#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nn1 n ASP 4 N 0.00 1.40 -4.00 3.54 5.68 -1.26 -4.88 116.55 117.03 2nn1 n ASP 4 Ca 0.00 -1.78 -0.08 0.00 -0.50 0.00 0.00 54.79 52.43 2nn1 n ASP 4 Cb 0.00 -0.12 -0.10 0.00 -1.14 0.00 0.00 41.12 39.76 2nn1 n ASP 4 CO 0.00 0.00 0.00 -1.66 -1.33 0.00 0.00 177.20 174.21 2nn1 s TRP 5 N -1.75 0.34 0.00 2.11 1.48 -1.26 -4.92 118.94 114.94 2nn1 s TRP 5 Ca 0.27 -0.76 0.00 0.00 -1.06 0.00 0.00 56.10 54.55 2nn1 s TRP 5 Cb 0.14 -0.25 0.00 0.00 -1.16 0.00 0.00 33.47 32.20 2nn1 s TRP 5 CO 0.21 -0.36 0.00 0.41 -4.06 0.00 0.00 176.95 173.15 2nn1 n GLY 6 N 0.56 2.69 0.00 3.67 0.00 -0.17 -5.02 105.19 106.93 2nn1 n GLY 6 Ca -0.17 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2nn1 n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2nn1 n TYR 7 N 0.00 0.00 -1.69 1.61 4.01 -1.26 -3.94 117.16 115.89 2nn1 n TYR 7 Ca 0.00 -0.29 -0.30 0.00 -0.16 0.00 0.00 57.90 57.15 2nn1 n TYR 7 Cb 0.00 -0.03 0.21 0.00 -0.31 0.00 0.00 39.34 39.21 2nn1 n TYR 7 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2nn1 s ASP 8 N -0.58 2.35 0.15 7.72 1.01 -1.26 -4.65 116.67 121.40 2nn1 s ASP 8 Ca 0.00 0.32 -0.17 0.00 0.71 0.00 0.00 52.55 53.41 2nn1 s ASP 8 Cb 0.00 -0.37 0.00 0.00 1.01 0.00 0.00 42.92 43.56 2nn1 s ASP 8 CO 0.00 -3.21 1.80 -0.78 0.21 0.00 0.00 175.17 173.18 2nn1 h ASP 9 N -1.97 0.37 0.85 0.27 1.82 -1.97 0.15 116.42 115.94 2nn1 h ASP 9 Ca -0.44 -0.00 -0.23 0.00 -0.39 0.00 0.00 57.03 55.96 2nn1 h ASP 9 Cb 1.24 -0.09 -0.03 0.00 0.68 0.00 0.00 39.33 41.14 2nn1 h ASP 9 CO 0.34 0.27 -1.16 0.11 -1.61 0.00 0.00 179.24 177.19 2nn1 h LYS 10 N 0.45 0.04 -0.24 0.28 1.57 -2.00 -3.35 116.57 113.32 2nn1 h LYS 10 Ca 0.13 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2nn1 h LYS 10 Cb -0.03 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2nn1 h LYS 10 CO -0.04 0.96 0.00 0.27 -0.57 0.00 0.00 179.45 180.06 2nn1 n ASN 11 N -3.33 2.97 -3.92 0.86 6.94 -1.23 -4.84 115.26 112.71 2nn1 n ASN 11 Ca -0.04 -2.33 -0.30 0.00 -0.02 0.00 0.00 54.58 51.89 2nn1 n ASN 11 Cb 0.97 -0.28 0.22 0.00 -2.36 0.00 0.00 39.78 38.32 2nn1 n ASN 11 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2nn1 s GLY 12 N -1.36 1.71 0.29 4.83 0.00 0.51 -1.00 107.32 112.31 2nn1 s GLY 12 Ca 0.25 -1.15 0.01 0.00 0.00 0.00 0.00 44.72 43.83 2nn1 s GLY 12 CO 0.11 -0.31 1.62 -2.55 0.00 0.00 0.00 173.10 171.98 2nn1 h PRO 13 N -2.10 0.13 0.00 2.90 0.11 -1.83 0.21 132.00 131.43 2nn1 h PRO 13 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2nn1 h PRO 13 Cb 1.25 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2nn1 h PRO 13 CO 0.34 0.09 0.00 0.93 -0.21 0.00 0.00 178.00 179.15 2nn1 h GLU 14 N 0.14 0.00 -0.01 1.05 5.08 -1.92 -2.76 114.58 116.15 2nn1 h GLU 14 Ca 0.55 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.91 2nn1 h GLU 14 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2nn1 h GLU 14 CO -0.72 0.00 -0.30 1.04 -1.00 0.00 0.00 179.01 178.03 2nn1 n GLN 15 N -2.78 2.10 -0.11 2.33 1.13 0.69 -4.68 117.38 116.07 2nn1 n GLN 15 Ca -0.01 -0.58 0.13 0.00 -1.94 0.00 0.00 57.00 54.60 2nn1 n GLN 15 Cb 0.14 -1.14 0.51 0.00 0.11 0.00 0.00 30.24 29.86 2nn1 n GLN 15 CO 0.00 0.00 0.00 -1.49 -1.44 0.00 0.00 177.06 174.13 2nn1 h TRP 16 N 1.17 0.44 -0.06 1.08 6.55 -1.12 -2.58 115.95 121.43 2nn1 h TRP 16 Ca 0.00 0.01 0.02 0.00 0.95 0.00 0.00 58.89 59.87 2nn1 h TRP 16 Cb 0.40 -0.14 -0.00 0.00 -0.86 0.00 0.00 29.16 28.56 2nn1 h TRP 16 CO 0.00 0.19 0.11 0.66 -1.05 0.00 0.00 178.44 178.35 2nn1 h SER 17 N 0.40 0.00 -0.58 -3.49 4.64 -1.80 0.27 113.55 112.99 2nn1 h SER 17 Ca 0.31 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.58 2nn1 h SER 17 Cb 0.66 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.73 2nn1 h SER 17 CO -0.09 0.00 0.19 0.11 -0.87 0.00 0.00 176.83 176.17 2nn1 h LYS 18 N 0.00 0.89 0.00 4.77 1.57 -1.83 -2.97 116.57 119.00 2nn1 h LYS 18 Ca 0.03 -0.19 -0.28 0.00 -1.87 0.00 0.00 60.65 58.34 2nn1 h LYS 18 Cb 0.25 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 2nn1 h LYS 18 CO -0.00 0.80 -2.13 1.28 -0.57 0.00 0.00 179.45 178.83 2nn1 n LEU 19 N -4.43 0.22 -3.74 2.94 4.77 -0.79 -4.73 117.00 111.24 2nn1 n LEU 19 Ca 0.03 0.10 -0.29 0.00 -0.03 0.00 0.00 56.01 55.82 2nn1 n LEU 19 Cb 0.20 0.33 -0.12 0.00 -2.33 0.00 0.00 43.42 41.50 2nn1 n LEU 19 CO 0.40 0.37 -0.20 -0.31 -1.33 0.00 0.00 177.39 176.32 2nn1 s TYR 20 N -2.70 2.36 0.57 -1.77 1.51 0.90 -4.99 117.35 113.23 2nn1 s TYR 20 Ca -0.08 -2.71 0.30 0.00 -1.01 0.00 0.00 57.07 53.57 2nn1 s TYR 20 Cb 0.08 -2.05 1.44 0.00 -0.11 0.00 0.00 41.96 41.32 2nn1 s TYR 20 CO 0.84 -0.73 1.83 -1.35 -1.11 0.00 0.00 175.55 175.03 2nn1 h PRO 21 N 6.24 0.00 0.00 -1.71 0.11 -1.75 -0.80 132.00 134.09 2nn1 h PRO 21 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 2nn1 h PRO 21 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2nn1 h PRO 21 CO 0.54 0.00 0.00 0.97 -0.21 0.00 0.00 178.00 179.30 2nn1 h ILE 22 N 0.00 0.00 -0.30 4.15 6.09 -1.92 -2.66 117.51 122.87 2nn1 h ILE 22 Ca 0.34 -0.15 0.09 0.00 -1.37 0.00 0.00 64.86 63.77 2nn1 h ILE 22 Cb 1.61 0.83 -0.01 0.00 0.47 0.00 0.00 36.82 39.71 2nn1 h ILE 22 CO -0.00 0.00 0.33 0.00 -3.07 0.00 0.00 178.15 175.40 2nn1 h ALA 23 N 2.11 1.98 -0.64 0.18 0.00 -1.47 0.40 119.26 121.83 2nn1 h ALA 23 Ca 0.00 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 2nn1 h ALA 23 Cb 0.20 0.02 -0.16 0.00 0.00 0.00 0.00 17.79 17.86 2nn1 h ALA 23 CO 0.00 -0.48 0.24 0.09 0.00 0.00 0.00 179.25 179.10 2nn1 n ASN 24 N -3.78 3.75 -3.02 0.00 5.03 -1.00 -4.94 115.26 111.29 2nn1 n ASN 24 Ca 0.05 -3.46 -0.15 0.00 0.87 0.00 0.00 54.58 51.88 2nn1 n ASN 24 Cb 0.48 -0.72 0.12 0.00 -1.02 0.00 0.00 39.78 38.64 2nn1 n ASN 24 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2nn1 n GLY 25 N -0.75 -1.99 0.45 7.41 0.00 0.14 -5.00 105.19 105.46 2nn1 n GLY 25 Ca 0.42 -1.58 0.12 0.00 0.00 0.00 0.00 46.02 44.98 2nn1 n GLY 25 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2nn1 n ASN 26 N -3.72 1.68 -2.48 1.61 3.02 -1.26 -4.33 115.26 109.79 2nn1 n ASN 26 Ca 0.08 -1.33 -0.14 0.00 -0.03 0.00 0.00 54.58 53.16 2nn1 n ASN 26 Cb 0.30 0.23 0.03 0.00 -0.61 0.00 0.00 39.78 39.73 2nn1 n ASN 26 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2nn1 n ASN 27 N -0.09 3.20 -4.84 6.41 3.02 -1.26 -4.68 115.26 117.02 2nn1 n ASN 27 Ca 0.12 -3.00 -0.34 0.00 -0.03 0.00 0.00 54.58 51.33 2nn1 n ASN 27 Cb 0.42 -0.44 -0.06 0.00 -0.61 0.00 0.00 39.78 39.09 2nn1 n ASN 27 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2nn1 s GLN 28 N -3.57 4.05 0.20 3.52 -1.52 -1.26 -2.27 119.66 118.80 2nn1 s GLN 28 Ca 0.39 0.67 0.09 0.00 -1.95 0.00 0.00 55.36 54.55 2nn1 s GLN 28 Cb 0.39 -2.60 -0.04 0.00 -0.22 0.00 0.00 33.01 30.53 2nn1 s GLN 28 CO -0.03 0.26 -0.17 -1.12 -0.25 0.00 0.00 175.29 173.98 2nn1 s SER 29 N -2.08 2.73 0.99 5.90 0.01 -1.26 -4.67 113.70 115.31 2nn1 s SER 29 Ca 0.49 -0.96 -0.16 0.00 1.31 0.00 0.00 55.95 56.64 2nn1 s SER 29 Cb -0.12 -0.16 0.22 0.00 0.21 0.00 0.00 66.02 66.17 2nn1 s SER 29 CO 0.19 -0.09 1.33 -0.81 0.41 0.00 0.00 173.24 174.26 2nn1 n PRO 30 N -0.13 -1.25 -4.13 12.44 -0.04 -1.26 -4.50 135.00 136.13 2nn1 n PRO 30 Ca -0.10 -2.12 -0.10 0.00 -0.04 0.00 0.00 63.50 61.15 2nn1 n PRO 30 Cb 0.59 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.61 2nn1 n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2nn1 s VAL 31 N -3.89 0.10 -0.16 0.52 -7.23 -1.26 0.21 120.40 108.69 2nn1 s VAL 31 Ca 0.76 -1.87 -0.19 0.00 -1.81 0.00 0.00 61.98 58.87 2nn1 s VAL 31 Cb -0.02 -2.01 -0.04 0.00 0.56 0.00 0.00 36.38 34.87 2nn1 s VAL 31 CO 0.53 -0.47 0.52 -0.62 -0.31 0.00 0.00 175.10 174.75 2nn1 s ASP 32 N -3.04 6.65 -0.42 4.85 2.15 -1.26 -3.02 116.67 122.59 2nn1 s ASP 32 Ca 0.23 0.78 -0.20 0.00 0.43 0.00 0.00 52.55 53.79 2nn1 s ASP 32 Cb 0.07 -2.30 0.02 0.00 -0.30 0.00 0.00 42.92 40.41 2nn1 s ASP 32 CO 0.01 -0.11 0.59 -0.63 -0.17 0.00 0.00 175.17 174.87 2nn1 s ILE 33 N 1.18 4.90 -0.50 4.11 1.01 0.81 -4.92 121.20 127.79 2nn1 s ILE 33 Ca 0.26 0.11 -0.19 0.00 0.00 0.00 0.00 60.65 60.84 2nn1 s ILE 33 Cb -0.15 -4.14 0.06 0.00 0.01 0.00 0.00 42.46 38.24 2nn1 s ILE 33 CO 0.10 -0.50 0.60 -0.54 0.00 0.00 0.00 174.94 174.61 2nn1 s LYS 34 N 2.65 3.11 0.55 2.79 1.02 -1.26 -0.31 119.74 128.29 2nn1 s LYS 34 Ca 0.21 -0.94 0.25 0.00 0.02 0.00 0.00 55.97 55.50 2nn1 s LYS 34 Cb -0.15 -4.10 1.46 0.00 -0.52 0.00 0.00 37.83 34.51 2nn1 s LYS 34 CO 0.17 -1.21 2.04 1.79 -0.92 0.00 0.00 175.35 177.23 2nn1 h THR 35 N 5.85 0.68 0.00 2.17 1.35 -1.96 -0.05 112.91 120.95 2nn1 h THR 35 Ca -0.28 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 2nn1 h THR 35 Cb 1.10 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 2nn1 h THR 35 CO 0.96 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 174.69 2nn1 n SER 36 N -4.20 0.63 -0.41 5.36 3.41 -1.26 -3.05 113.62 114.10 2nn1 n SER 36 Ca 0.05 0.62 0.05 0.00 -0.26 0.00 0.00 58.87 59.33 2nn1 n SER 36 Cb 0.45 -0.77 0.06 0.00 -0.26 0.00 0.00 64.21 63.69 2nn1 n SER 36 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2nn1 n GLU 37 N -2.16 1.03 -2.71 4.33 1.02 -0.05 -5.02 120.64 117.09 2nn1 n GLU 37 Ca 0.03 -1.31 -0.36 0.00 -0.02 0.00 0.00 57.16 55.50 2nn1 n GLU 37 Cb 0.28 -1.19 -0.06 0.00 -0.02 0.00 0.00 31.44 30.46 2nn1 n GLU 37 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2nn1 s THR 38 N -0.83 4.08 -0.32 2.62 -4.23 -1.11 -4.71 115.64 111.15 2nn1 s THR 38 Ca 0.13 1.59 -0.10 0.00 -1.18 0.00 0.00 61.69 62.14 2nn1 s THR 38 Cb 0.08 -3.82 -0.01 0.00 1.34 0.00 0.00 72.50 70.10 2nn1 s THR 38 CO 0.12 0.01 0.16 -0.54 -0.54 0.00 0.00 174.62 173.83 2nn1 s LYS 39 N -2.42 3.31 -0.66 3.99 1.02 -0.31 -4.88 119.74 119.79 2nn1 s LYS 39 Ca 0.55 -0.74 -0.27 0.00 0.02 0.00 0.00 55.97 55.53 2nn1 s LYS 39 Cb -0.18 -3.58 -0.00 0.00 -0.52 0.00 0.00 37.83 33.54 2nn1 s LYS 39 CO 0.23 -0.44 1.67 -1.58 -0.92 0.00 0.00 175.35 174.31 2nn1 s HIS 40 N 1.61 1.87 0.07 3.18 5.65 -1.26 -1.14 115.29 125.27 2nn1 s HIS 40 Ca 0.04 0.50 -0.20 0.00 0.25 0.00 0.00 55.06 55.65 2nn1 s HIS 40 Cb -0.17 -4.27 -0.07 0.00 -1.18 0.00 0.00 32.58 26.89 2nn1 s HIS 40 CO 0.06 -2.22 0.60 0.34 -0.65 0.00 0.00 174.74 172.87 2nn1 s ASP 41 N 6.66 7.10 0.00 9.88 2.15 -0.97 -4.93 116.67 136.57 2nn1 s ASP 41 Ca 0.57 1.30 0.23 0.00 0.43 0.00 0.00 52.55 55.07 2nn1 s ASP 41 Cb -0.11 -2.38 0.06 0.00 -0.30 0.00 0.00 42.92 40.19 2nn1 s ASP 41 CO 0.18 0.24 1.10 0.35 -0.17 0.00 0.00 175.17 176.87 2nn1 n THR 42 N 1.87 0.00 1.61 1.71 -2.24 -1.26 -3.98 114.28 111.99 2nn1 n THR 42 Ca -0.09 -0.04 0.15 0.00 -2.27 0.00 0.00 64.05 61.80 2nn1 n THR 42 Cb 0.50 0.78 0.66 0.00 -2.10 0.00 0.00 70.33 70.18 2nn1 n THR 42 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2nn1 n SER 43 N -1.28 0.81 -4.64 3.42 3.41 -1.26 -4.81 113.62 109.27 2nn1 n SER 43 Ca 0.05 -1.12 -0.42 0.00 -0.26 0.00 0.00 58.87 57.12 2nn1 n SER 43 Cb 0.35 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.25 2nn1 n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2nn1 s LEU 44 N -2.13 4.06 0.58 1.04 1.43 -1.26 -4.91 118.68 117.49 2nn1 s LEU 44 Ca 0.38 0.98 -0.05 0.00 -1.03 0.00 0.00 54.13 54.42 2nn1 s LEU 44 Cb 0.21 -3.28 0.01 0.00 0.03 0.00 0.00 46.19 43.16 2nn1 s LEU 44 CO 0.39 -0.64 0.88 -0.54 0.23 0.00 0.00 176.35 176.66 2nn1 s LYS 45 N 3.09 2.87 0.66 1.70 1.02 -0.94 -4.92 119.74 123.22 2nn1 s LYS 45 Ca 0.38 -0.11 -0.16 0.00 0.02 0.00 0.00 55.97 56.09 2nn1 s LYS 45 Cb -0.14 -2.31 0.00 0.00 -0.52 0.00 0.00 37.83 34.86 2nn1 s LYS 45 CO 0.10 -0.69 1.18 -2.14 -0.92 0.00 0.00 175.35 172.88 2nn1 s PRO 46 N -4.95 2.61 0.23 -1.68 0.02 -1.26 -1.64 135.00 128.33 2nn1 s PRO 46 Ca 0.54 1.68 -0.30 0.00 0.02 0.00 0.00 61.00 62.94 2nn1 s PRO 46 Cb -0.10 -1.90 -0.09 0.00 0.02 0.00 0.00 34.50 32.43 2nn1 s PRO 46 CO 0.44 -1.45 1.02 0.42 -0.33 0.00 0.00 177.00 177.10 2nn1 s ILE 47 N -1.95 3.90 -0.15 2.83 -1.09 -1.26 -1.74 121.20 121.74 2nn1 s ILE 47 Ca 0.73 1.82 -0.01 0.00 -2.23 0.00 0.00 60.65 60.96 2nn1 s ILE 47 Cb -0.27 -4.16 0.04 0.00 -1.58 0.00 0.00 42.46 36.49 2nn1 s ILE 47 CO 0.40 0.40 -0.04 -0.55 -1.23 0.00 0.00 174.94 173.91 2nn1 s SER 48 N -0.77 2.59 -0.05 3.58 0.15 0.70 -4.92 113.70 114.98 2nn1 s SER 48 Ca 0.44 -0.55 0.05 0.00 0.70 0.00 0.00 55.95 56.59 2nn1 s SER 48 Cb -0.28 -0.82 -0.02 0.00 -1.71 0.00 0.00 66.02 63.19 2nn1 s SER 48 CO 0.35 -0.18 -0.20 0.68 1.20 0.00 0.00 173.24 175.09 2nn1 s VAL 49 N 1.70 2.57 -0.31 4.45 -7.23 -1.26 -0.35 120.40 119.97 2nn1 s VAL 49 Ca 0.02 -0.90 -0.02 0.00 -1.81 0.00 0.00 61.98 59.27 2nn1 s VAL 49 Cb -0.15 -1.97 0.12 0.00 0.56 0.00 0.00 36.38 34.95 2nn1 s VAL 49 CO -0.08 0.58 0.20 -0.55 -0.31 0.00 0.00 175.10 174.95 2nn1 s SER 50 N -0.50 2.80 -0.02 4.85 0.15 -0.57 -5.03 113.70 115.38 2nn1 s SER 50 Ca 0.06 -1.39 0.01 0.00 0.70 0.00 0.00 55.95 55.34 2nn1 s SER 50 Cb -0.11 -0.09 -0.04 0.00 -1.71 0.00 0.00 66.02 64.07 2nn1 s SER 50 CO 0.01 -0.39 -0.01 -0.31 1.20 0.00 0.00 173.24 173.75 2nn1 s TYR 51 N 1.88 3.07 -0.30 3.44 2.02 -1.26 -1.34 117.35 124.86 2nn1 s TYR 51 Ca 0.12 0.09 -0.11 0.00 -0.37 0.00 0.00 57.07 56.79 2nn1 s TYR 51 Cb -0.17 -1.68 -0.03 0.00 -0.40 0.00 0.00 41.96 39.68 2nn1 s TYR 51 CO -0.25 0.45 0.19 1.21 -1.57 0.00 0.00 175.55 175.58 2nn1 s ASN 52 N -1.42 5.85 0.62 2.29 3.84 -1.19 -4.95 114.94 119.97 2nn1 s ASN 52 Ca 0.18 -0.25 0.31 0.00 0.21 0.00 0.00 52.86 53.31 2nn1 s ASN 52 Cb -0.11 -2.08 1.72 0.00 -0.55 0.00 0.00 41.25 40.22 2nn1 s ASN 52 CO 0.09 -0.13 2.05 1.55 -2.79 0.00 0.00 177.10 177.86 2nn1 h PRO 53 N 8.39 0.00 0.00 0.43 0.13 -1.94 -0.69 132.00 138.31 2nn1 h PRO 53 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2nn1 h PRO 53 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2nn1 h PRO 53 CO 0.59 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.36 2nn1 n ALA 54 N -2.18 1.61 0.69 -0.56 0.00 -1.26 -2.12 120.51 116.69 2nn1 n ALA 54 Ca 0.01 0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.65 2nn1 n ALA 54 Cb 0.37 -1.35 0.42 0.00 0.00 0.00 0.00 19.45 18.89 2nn1 n ALA 54 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2nn1 n THR 55 N -2.11 0.46 -1.74 0.00 -2.24 -0.27 -4.81 114.28 103.57 2nn1 n THR 55 Ca 0.02 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 2nn1 n THR 55 Cb 0.20 -0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 67.91 2nn1 n THR 55 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nn1 n ALA 56 N -1.74 2.43 0.08 6.98 0.00 -1.04 0.19 120.51 127.41 2nn1 n ALA 56 Ca 0.06 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2nn1 n ALA 56 Cb 0.41 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.42 2nn1 n ALA 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2nn1 n LYS 57 N 1.89 0.00 -3.73 0.00 4.81 -0.06 -4.44 118.16 116.63 2nn1 n LYS 57 Ca 0.08 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.39 2nn1 n LYS 57 Cb 0.37 -0.34 -0.08 0.00 0.02 0.00 0.00 35.03 35.00 2nn1 n LYS 57 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2nn1 s GLU 58 N -2.00 0.76 -0.10 1.64 2.12 -1.02 -1.40 118.70 118.71 2nn1 s GLU 58 Ca 0.00 -0.28 0.02 0.00 0.36 0.00 0.00 54.97 55.07 2nn1 s GLU 58 Cb 0.00 0.34 -0.01 0.00 0.26 0.00 0.00 34.13 34.71 2nn1 s GLU 58 CO 0.00 -0.23 -0.16 -1.50 -0.54 0.00 0.00 175.26 172.83 2nn1 s ILE 59 N -1.84 2.79 -0.01 -3.70 2.07 -0.17 0.16 121.20 120.51 2nn1 s ILE 59 Ca -0.10 -0.77 0.03 0.00 -1.41 0.00 0.00 60.65 58.40 2nn1 s ILE 59 Cb -0.03 -2.13 -0.00 0.00 0.13 0.00 0.00 42.46 40.43 2nn1 s ILE 59 CO 0.01 0.55 -0.09 -0.63 -1.91 0.00 0.00 174.94 172.87 2nn1 s ILE 60 N 0.08 0.76 -0.35 2.00 1.01 0.69 -1.47 121.20 123.91 2nn1 s ILE 60 Ca -0.07 -0.39 -0.22 0.00 0.00 0.00 0.00 60.65 59.97 2nn1 s ILE 60 Cb -0.15 -0.64 0.00 0.00 0.01 0.00 0.00 42.46 41.68 2nn1 s ILE 60 CO 0.05 0.22 0.71 0.21 0.00 0.00 0.00 174.94 176.13 2nn1 s ASN 61 N -0.11 6.50 -0.30 3.58 3.84 -0.43 -0.76 114.94 127.26 2nn1 s ASN 61 Ca 0.02 0.29 0.11 0.00 0.21 0.00 0.00 52.86 53.48 2nn1 s ASN 61 Cb -0.05 -2.36 0.69 0.00 -0.55 0.00 0.00 41.25 38.98 2nn1 s ASN 61 CO -0.00 -0.64 1.72 1.33 -2.79 0.00 0.00 177.10 176.71 2nn1 n VAL 62 N 5.65 2.81 0.00 -5.21 0.24 0.23 -1.23 118.33 120.82 2nn1 n VAL 62 Ca 0.01 -1.80 0.00 0.00 -2.04 0.00 0.00 64.34 60.50 2nn1 n VAL 62 Cb 0.48 -0.34 0.00 0.00 -1.47 0.00 0.00 33.84 32.51 2nn1 n VAL 62 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2nn1 n GLY 63 N -0.32 1.84 0.09 7.63 0.00 -1.26 -4.40 105.19 108.77 2nn1 n GLY 63 Ca 0.37 -0.19 0.10 0.00 0.00 0.00 0.00 46.02 46.31 2nn1 n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2nn1 n HIS 64 N 0.00 0.00 -3.20 1.61 1.44 -1.26 -4.22 115.22 109.58 2nn1 n HIS 64 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2nn1 n HIS 64 Cb 0.00 -0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.10 2nn1 n HIS 64 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2nn1 n SER 65 N -1.24 0.00 -3.98 4.39 2.88 -1.26 -4.76 113.62 109.66 2nn1 n SER 65 Ca 0.05 -0.67 -0.12 0.00 -1.33 0.00 0.00 58.87 56.81 2nn1 n SER 65 Cb 0.35 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.69 2nn1 n SER 65 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2nn1 s PHE 66 N -4.33 0.36 0.06 0.66 -0.12 -1.26 -0.60 117.98 112.75 2nn1 s PHE 66 Ca 0.00 -0.34 0.08 0.00 -0.05 0.00 0.00 56.93 56.61 2nn1 s PHE 66 Cb 0.00 -0.23 -0.03 0.00 -0.63 0.00 0.00 43.02 42.13 2nn1 s PHE 66 CO 0.00 -0.09 -0.21 -1.01 -0.05 0.00 0.00 175.22 173.86 2nn1 s HIS 67 N -0.93 1.82 -0.29 3.49 3.76 0.06 -4.43 115.29 118.77 2nn1 s HIS 67 Ca -0.08 -0.39 -0.02 0.00 -0.15 0.00 0.00 55.06 54.42 2nn1 s HIS 67 Cb -0.07 -1.06 0.04 0.00 1.11 0.00 0.00 32.58 32.60 2nn1 s HIS 67 CO -0.00 0.13 -0.01 0.08 -0.85 0.00 0.00 174.74 174.08 2nn1 s VAL 68 N -0.90 3.04 0.13 -0.90 1.01 -0.79 -0.22 120.40 121.77 2nn1 s VAL 68 Ca 0.07 -1.24 -0.00 0.00 0.00 0.00 0.00 61.98 60.81 2nn1 s VAL 68 Cb -0.09 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 2nn1 s VAL 68 CO 0.02 -0.01 0.29 0.20 0.00 0.00 0.00 175.10 175.61 2nn1 s ASN 69 N 1.29 6.38 0.17 3.32 0.01 0.12 -1.91 114.94 124.33 2nn1 s ASN 69 Ca -0.03 0.32 0.10 0.00 -0.71 0.00 0.00 52.86 52.54 2nn1 s ASN 69 Cb -0.19 -1.98 -0.04 0.00 0.41 0.00 0.00 41.25 39.45 2nn1 s ASN 69 CO -0.02 0.08 -0.21 -0.36 -1.51 0.00 0.00 177.10 175.08 2nn1 s PHE 70 N -1.67 2.00 0.20 2.20 0.40 -0.38 -0.88 117.98 119.86 2nn1 s PHE 70 Ca 0.37 -0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 55.97 2nn1 s PHE 70 Cb -0.12 -1.00 -0.08 0.00 0.51 0.00 0.00 43.02 42.33 2nn1 s PHE 70 CO 0.28 0.39 1.24 -1.21 0.70 0.00 0.00 175.22 176.61 2nn1 s GLU 71 N -2.69 4.45 -0.32 0.44 2.02 0.13 -4.80 118.70 117.93 2nn1 s GLU 71 Ca 0.17 1.96 0.13 0.00 0.02 0.00 0.00 54.97 57.25 2nn1 s GLU 71 Cb -0.07 -3.21 0.46 0.00 0.10 0.00 0.00 34.13 31.42 2nn1 s GLU 71 CO 0.08 -0.14 1.09 -0.40 0.02 0.00 0.00 175.26 175.92 2nn1 n ASP 72 N 2.37 3.16 0.03 -0.19 5.75 -1.26 -4.80 116.55 121.61 2nn1 n ASP 72 Ca 0.04 -3.03 0.12 0.00 -0.01 0.00 0.00 54.79 51.91 2nn1 n ASP 72 Cb 0.44 -0.45 0.22 0.00 -1.03 0.00 0.00 41.12 40.30 2nn1 n ASP 72 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2nn1 n ASN 73 N -0.48 0.58 -1.98 -1.12 0.23 -1.26 -4.96 115.26 106.27 2nn1 n ASN 73 Ca 0.25 -0.04 -0.06 0.00 -0.53 0.00 0.00 54.58 54.19 2nn1 n ASN 73 Cb 0.82 0.21 -0.01 0.00 -2.08 0.00 0.00 39.78 38.72 2nn1 n ASN 73 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2nn1 n ASP 74 N -1.81 -0.85 -2.12 0.53 5.68 -1.26 -5.07 116.55 111.66 2nn1 n ASP 74 Ca 0.04 -1.91 -0.26 0.00 -0.50 0.00 0.00 54.79 52.16 2nn1 n ASP 74 Cb 0.39 1.50 0.06 0.00 -1.14 0.00 0.00 41.12 41.93 2nn1 n ASP 74 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2nn1 n ASN 75 N -1.67 7.01 0.18 -1.12 3.02 -1.26 -4.51 115.26 116.92 2nn1 n ASN 75 Ca -0.01 -3.45 0.04 0.00 -0.03 0.00 0.00 54.58 51.12 2nn1 n ASN 75 Cb 0.30 -1.01 0.35 0.00 -0.61 0.00 0.00 39.78 38.81 2nn1 n ASN 75 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2nn1 h ARG 76 N 1.72 0.00 -4.08 3.52 3.08 -1.94 -3.39 114.38 113.29 2nn1 h ARG 76 Ca 0.46 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.93 2nn1 h ARG 76 Cb 0.92 0.00 -0.39 0.00 0.08 0.00 0.00 29.97 30.58 2nn1 h ARG 76 CO 1.20 0.40 -0.78 -1.12 -1.07 0.00 0.00 179.97 178.61 2nn1 s SER 77 N -6.69 3.61 0.06 7.04 0.01 -1.26 -3.19 113.70 113.29 2nn1 s SER 77 Ca -0.02 -1.13 -0.00 0.00 1.31 0.00 0.00 55.95 56.12 2nn1 s SER 77 Cb 0.13 -1.00 -0.04 0.00 0.21 0.00 0.00 66.02 65.32 2nn1 s SER 77 CO 0.71 -0.27 -0.04 0.68 0.41 0.00 0.00 173.24 174.73 2nn1 s VAL 78 N 1.53 0.33 -0.07 3.43 -7.23 -0.45 -1.53 120.40 116.41 2nn1 s VAL 78 Ca -0.03 -1.84 0.04 0.00 -1.81 0.00 0.00 61.98 58.33 2nn1 s VAL 78 Cb -0.18 -1.58 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 2nn1 s VAL 78 CO -0.08 -0.95 -0.18 -0.22 -0.31 0.00 0.00 175.10 173.36 2nn1 s LEU 79 N -2.95 2.47 0.25 1.32 2.96 0.68 -1.51 118.68 121.90 2nn1 s LEU 79 Ca 0.09 -0.35 -0.04 0.00 -0.22 0.00 0.00 54.13 53.60 2nn1 s LEU 79 Cb 0.07 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.24 2nn1 s LEU 79 CO -0.08 0.26 0.31 -0.54 -1.32 0.00 0.00 176.35 174.98 2nn1 s LYS 80 N -0.21 1.48 1.95 1.98 1.02 0.53 -1.22 119.74 125.26 2nn1 s LYS 80 Ca -0.01 -1.56 0.00 0.00 0.02 0.00 0.00 55.97 54.43 2nn1 s LYS 80 Cb -0.13 0.37 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 2nn1 s LYS 80 CO 0.03 -0.56 0.00 0.41 -0.92 0.00 0.00 175.35 174.31 2nn1 n GLY 81 N -0.38 -0.78 7.00 -3.33 0.00 -1.26 -0.21 105.19 106.22 2nn1 n GLY 81 Ca 0.01 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.66 2nn1 n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nn1 n GLY 82 N 0.00 3.43 0.88 -0.02 0.00 -0.65 -1.12 105.19 107.72 2nn1 n GLY 82 Ca 0.00 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.06 2nn1 n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2nn1 n PRO 83 N 14.00 2.14 -3.58 1.61 -0.04 -1.26 -2.22 135.00 145.64 2nn1 n PRO 83 Ca 0.00 -1.74 -0.32 0.00 -0.04 0.00 0.00 63.50 61.40 2nn1 n PRO 83 Cb 0.00 -1.43 -0.05 0.00 -0.04 0.00 0.00 33.50 31.98 2nn1 n PRO 83 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2nn1 s PHE 84 N -1.52 3.49 -0.03 0.54 0.08 -0.27 -4.96 117.98 115.31 2nn1 s PHE 84 Ca 0.35 0.70 0.06 0.00 0.12 0.00 0.00 56.93 58.16 2nn1 s PHE 84 Cb 0.19 -2.11 -0.09 0.00 -0.57 0.00 0.00 43.02 40.44 2nn1 s PHE 84 CO 0.27 0.41 0.09 -1.13 -0.10 0.00 0.00 175.22 174.76 2nn1 n SER 85 N 0.22 3.56 -4.94 1.36 3.41 -1.26 -4.32 113.62 111.65 2nn1 n SER 85 Ca -0.03 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.33 2nn1 n SER 85 Cb 0.52 1.02 -0.02 0.00 -0.26 0.00 0.00 64.21 65.47 2nn1 n SER 85 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2nn1 s ASP 86 N -3.13 6.34 -0.04 4.04 1.01 -1.26 -5.02 116.67 118.61 2nn1 s ASP 86 Ca -0.03 0.31 -0.22 0.00 0.71 0.00 0.00 52.55 53.33 2nn1 s ASP 86 Cb 0.03 -1.97 -0.05 0.00 1.01 0.00 0.00 42.92 41.95 2nn1 s ASP 86 CO 0.25 -0.10 0.64 -0.55 0.21 0.00 0.00 175.17 175.62 2nn1 s SER 87 N -3.58 6.97 -0.13 0.27 0.15 -1.26 -4.79 113.70 111.32 2nn1 s SER 87 Ca 0.37 1.16 -0.04 0.00 0.70 0.00 0.00 55.95 58.14 2nn1 s SER 87 Cb -0.10 -2.38 -0.03 0.00 -1.71 0.00 0.00 66.02 61.79 2nn1 s SER 87 CO 0.31 -0.00 -0.00 -0.31 1.20 0.00 0.00 173.24 174.43 2nn1 s TYR 88 N 0.29 3.13 -0.18 3.44 1.51 -0.35 -3.54 117.35 121.65 2nn1 s TYR 88 Ca 0.34 -0.01 -0.17 0.00 -1.01 0.00 0.00 57.07 56.21 2nn1 s TYR 88 Cb -0.18 -1.91 -0.04 0.00 -0.11 0.00 0.00 41.96 39.72 2nn1 s TYR 88 CO 0.17 0.22 0.45 0.50 -1.11 0.00 0.00 175.55 175.78 2nn1 s ARG 89 N -0.15 4.22 0.35 -0.62 3.52 0.12 -0.23 118.95 126.15 2nn1 s ARG 89 Ca 0.05 0.32 -0.29 0.00 -0.13 0.00 0.00 55.73 55.68 2nn1 s ARG 89 Cb -0.13 -3.52 -0.11 0.00 -1.56 0.00 0.00 34.95 29.64 2nn1 s ARG 89 CO 0.02 -0.02 1.43 -1.17 -0.81 0.00 0.00 175.30 174.76 2nn1 s LEU 90 N 1.23 4.36 0.00 -0.88 2.96 -0.58 -0.83 118.68 124.94 2nn1 s LEU 90 Ca 0.22 2.90 0.00 0.00 -0.22 0.00 0.00 54.13 57.03 2nn1 s LEU 90 Cb -0.15 -3.66 0.00 0.00 0.50 0.00 0.00 46.19 42.88 2nn1 s LEU 90 CO 0.09 -0.76 0.00 2.22 -1.32 0.00 0.00 176.35 176.58 2nn1 n PHE 91 N 0.86 0.00 -3.55 5.38 -1.74 -0.52 -4.65 117.46 113.23 2nn1 n PHE 91 Ca 0.02 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.84 2nn1 n PHE 91 Cb 0.40 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.38 2nn1 n PHE 91 CO 0.00 0.00 0.00 -1.14 -0.56 0.00 0.00 176.76 175.06 2nn1 s GLN 92 N -0.10 0.55 -0.01 3.97 0.74 -1.19 -1.25 119.66 122.37 2nn1 s GLN 92 Ca 0.00 -0.17 -0.07 0.00 0.05 0.00 0.00 55.36 55.17 2nn1 s GLN 92 Cb 0.00 0.25 0.00 0.00 1.10 0.00 0.00 33.01 34.36 2nn1 s GLN 92 CO 0.00 -0.23 0.13 -0.59 -0.55 0.00 0.00 175.29 174.05 2nn1 s PHE 93 N -2.60 0.02 0.39 1.67 -0.12 -0.80 -0.18 117.98 116.35 2nn1 s PHE 93 Ca 0.07 -0.06 -0.14 0.00 -0.05 0.00 0.00 56.93 56.75 2nn1 s PHE 93 Cb -0.01 -0.04 0.05 0.00 -0.63 0.00 0.00 43.02 42.39 2nn1 s PHE 93 CO -0.06 -0.25 0.75 -3.38 -0.05 0.00 0.00 175.22 172.23 2nn1 s HIS 94 N -1.13 0.27 0.31 3.49 -3.43 -0.28 -1.88 115.29 112.64 2nn1 s HIS 94 Ca -0.12 -0.90 0.04 0.00 -0.80 0.00 0.00 55.06 53.28 2nn1 s HIS 94 Cb -0.07 0.72 -0.06 0.00 -1.43 0.00 0.00 32.58 31.74 2nn1 s HIS 94 CO 0.01 -1.54 0.05 -0.06 -2.00 0.00 0.00 174.74 171.21 2nn1 s PHE 95 N -2.31 1.91 0.01 0.38 0.40 -1.26 -0.74 117.98 116.37 2nn1 s PHE 95 Ca 0.18 -0.95 0.02 0.00 -0.60 0.00 0.00 56.93 55.57 2nn1 s PHE 95 Cb -0.04 -1.22 -0.01 0.00 0.51 0.00 0.00 43.02 42.25 2nn1 s PHE 95 CO 0.13 -0.00 -0.06 -1.01 0.70 0.00 0.00 175.22 174.98 2nn1 s HIS 96 N -3.32 0.55 0.26 0.36 3.76 -0.44 -4.85 115.29 111.62 2nn1 s HIS 96 Ca 0.36 -0.24 -0.09 0.00 -0.15 0.00 0.00 55.06 54.94 2nn1 s HIS 96 Cb 0.08 -0.34 -0.01 0.00 1.11 0.00 0.00 32.58 33.42 2nn1 s HIS 96 CO 0.15 -0.04 0.41 1.67 -0.85 0.00 0.00 174.74 176.08 2nn1 s TRP 97 N -0.60 0.64 0.51 1.40 -2.14 -1.19 -1.34 118.94 116.23 2nn1 s TRP 97 Ca -0.02 -0.95 0.03 0.00 2.66 0.00 0.00 56.10 57.81 2nn1 s TRP 97 Cb -0.05 0.00 -0.01 0.00 -3.10 0.00 0.00 33.47 30.32 2nn1 s TRP 97 CO 0.00 -0.95 0.10 0.20 -2.66 0.00 0.00 176.95 173.63 2nn1 s GLY 98 N -3.08 2.84 0.43 3.67 0.00 -1.23 -1.82 107.32 108.13 2nn1 s GLY 98 Ca 0.27 -0.70 0.13 0.00 0.00 0.00 0.00 44.72 44.42 2nn1 s GLY 98 CO 0.12 -2.13 1.98 1.76 0.00 0.00 0.00 173.10 174.83 2nn1 h SER 99 N 1.24 0.07 -5.57 1.64 0.02 -1.79 -3.42 113.55 105.73 2nn1 h SER 99 Ca -0.42 -0.01 -0.28 0.00 -0.84 0.00 0.00 61.79 60.24 2nn1 h SER 99 Cb 1.31 -0.02 -0.15 0.00 0.14 0.00 0.00 62.40 63.68 2nn1 h SER 99 CO 0.71 0.23 -0.60 0.42 -1.14 0.00 0.00 176.83 176.44 2nn1 s THR 100 N -4.71 0.03 0.47 -2.27 -4.23 -1.26 -5.03 115.64 98.64 2nn1 s THR 100 Ca -0.04 -2.00 0.34 0.00 -1.18 0.00 0.00 61.69 58.81 2nn1 s THR 100 Cb 0.16 -2.51 0.37 0.00 1.34 0.00 0.00 72.50 71.86 2nn1 s THR 100 CO 0.71 0.00 2.18 0.78 -0.54 0.00 0.00 174.62 177.75 2nn1 h ASN 101 N 2.55 0.00 -0.22 3.99 2.35 -1.91 -2.93 115.58 119.40 2nn1 h ASN 101 Ca -0.35 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.47 2nn1 h ASN 101 Cb 1.25 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.61 2nn1 h ASN 101 CO 0.51 0.05 0.20 -0.33 -1.65 0.00 0.00 177.43 176.21 2nn1 h GLU 102 N 0.00 0.00 -4.12 0.81 4.39 -1.94 -3.35 114.58 110.37 2nn1 h GLU 102 Ca -0.00 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.46 2nn1 h GLU 102 Cb 0.21 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 28.76 2nn1 h GLU 102 CO 0.01 0.00 -0.24 -3.38 -1.16 0.00 0.00 179.01 174.24 2nn1 s HIS 103 N -4.81 0.97 0.00 4.33 -3.43 -1.11 -4.68 115.29 106.57 2nn1 s HIS 103 Ca -0.05 -1.21 0.00 0.00 -0.80 0.00 0.00 55.06 53.00 2nn1 s HIS 103 Cb 0.17 -0.11 0.00 0.00 -1.43 0.00 0.00 32.58 31.20 2nn1 s HIS 103 CO 0.61 -1.04 0.00 0.41 -2.00 0.00 0.00 174.74 172.72 2nn1 n GLY 104 N -0.50 1.86 3.77 -1.38 0.00 -0.80 -3.54 105.19 104.61 2nn1 n GLY 104 Ca 0.01 -0.17 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 2nn1 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nn1 s SER 105 N 0.00 4.00 -0.25 1.61 1.04 -0.54 -3.16 113.70 116.39 2nn1 s SER 105 Ca 0.00 1.30 -0.15 0.00 0.48 0.00 0.00 55.95 57.58 2nn1 s SER 105 Cb 0.00 -1.99 -0.10 0.00 0.10 0.00 0.00 66.02 64.03 2nn1 s SER 105 CO 0.00 -2.28 -0.36 -0.62 0.98 0.00 0.00 173.24 170.96 2nn1 n GLU 106 N -3.63 0.57 -2.17 4.02 1.02 -1.26 -4.80 120.64 114.39 2nn1 n GLU 106 Ca 0.07 0.25 -0.32 0.00 -0.02 0.00 0.00 57.16 57.14 2nn1 n GLU 106 Cb 0.56 -1.47 -0.01 0.00 -0.02 0.00 0.00 31.44 30.50 2nn1 n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2nn1 s HIS 107 N -2.60 3.35 0.08 -0.32 3.76 -1.26 -4.46 115.29 113.83 2nn1 s HIS 107 Ca -0.36 1.44 0.03 0.00 -0.15 0.00 0.00 55.06 56.02 2nn1 s HIS 107 Cb 0.12 -2.83 -0.03 0.00 1.11 0.00 0.00 32.58 30.95 2nn1 s HIS 107 CO 0.47 -0.65 -0.10 0.95 -0.85 0.00 0.00 174.74 174.56 2nn1 s THR 108 N -2.71 0.82 -0.19 1.30 -4.23 -1.17 -4.69 115.64 104.78 2nn1 s THR 108 Ca 0.59 -1.45 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 2nn1 s THR 108 Cb -0.12 -1.12 0.03 0.00 1.34 0.00 0.00 72.50 72.63 2nn1 s THR 108 CO 0.38 -0.48 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.13 2nn1 s VAL 109 N -2.06 1.93 -1.51 2.29 1.01 -1.05 -0.13 120.40 120.88 2nn1 s VAL 109 Ca 0.00 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 2nn1 s VAL 109 Cb -0.05 -1.84 0.07 0.00 0.00 0.00 0.00 36.38 34.56 2nn1 s VAL 109 CO 0.00 0.37 0.95 0.47 0.00 0.00 0.00 175.10 176.89 2nn1 n ASP 110 N 4.63 -4.33 0.00 3.32 8.00 0.58 -1.20 116.55 127.55 2nn1 n ASP 110 Ca -0.18 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.53 2nn1 n ASP 110 Cb 0.48 -3.90 0.00 0.00 -0.02 0.00 0.00 41.12 37.68 2nn1 n ASP 110 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nn1 n GLY 111 N -1.69 2.35 3.70 0.44 0.00 -1.26 -5.00 105.19 103.73 2nn1 n GLY 111 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2nn1 n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nn1 s VAL 112 N -3.14 4.85 -0.15 1.61 1.01 -0.34 -5.03 120.40 119.21 2nn1 s VAL 112 Ca 0.00 1.99 -0.09 0.00 0.00 0.00 0.00 61.98 63.88 2nn1 s VAL 112 Cb 0.00 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2nn1 s VAL 112 CO 0.00 0.10 0.15 -0.54 0.00 0.00 0.00 175.10 174.82 2nn1 s LYS 113 N 1.42 3.79 0.52 2.72 1.02 -1.26 -2.52 119.74 125.43 2nn1 s LYS 113 Ca 0.49 -0.13 0.08 0.00 0.02 0.00 0.00 55.97 56.43 2nn1 s LYS 113 Cb -0.20 -3.29 0.05 0.00 -0.52 0.00 0.00 37.83 33.87 2nn1 s LYS 113 CO 0.23 0.56 0.62 0.71 -0.92 0.00 0.00 175.35 176.55 2nn1 s TYR 114 N -0.41 1.83 0.10 3.18 1.51 -1.26 -4.79 117.35 117.50 2nn1 s TYR 114 Ca 0.13 -0.68 0.12 0.00 -1.01 0.00 0.00 57.07 55.63 2nn1 s TYR 114 Cb -0.12 -2.16 0.15 0.00 -0.11 0.00 0.00 41.96 39.72 2nn1 s TYR 114 CO 0.02 -0.76 1.48 0.77 -1.11 0.00 0.00 175.55 175.94 2nn1 h SER 115 N 0.48 0.00 -5.14 2.29 0.02 -1.49 -1.25 113.55 108.46 2nn1 h SER 115 Ca -0.34 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 60.68 2nn1 h SER 115 Cb 1.29 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.80 2nn1 h SER 115 CO 0.47 0.68 0.36 0.00 -1.14 0.00 0.00 176.83 177.21 2nn1 s ALA 116 N -3.13 -1.18 -0.10 3.77 0.00 -1.09 -3.76 121.76 116.27 2nn1 s ALA 116 Ca 0.01 -0.42 -0.09 0.00 0.00 0.00 0.00 51.96 51.46 2nn1 s ALA 116 Cb 0.10 0.73 0.03 0.00 0.00 0.00 0.00 23.12 23.98 2nn1 s ALA 116 CO 0.76 -1.02 0.26 -2.00 0.00 0.00 0.00 175.76 173.76 2nn1 s GLU 117 N -2.81 0.29 -0.16 0.00 2.12 -0.45 -0.85 118.70 116.85 2nn1 s GLU 117 Ca 0.15 0.37 -0.07 0.00 0.36 0.00 0.00 54.97 55.79 2nn1 s GLU 117 Cb -0.04 0.13 -0.04 0.00 0.26 0.00 0.00 34.13 34.43 2nn1 s GLU 117 CO 0.08 -0.05 0.07 -1.17 -0.54 0.00 0.00 175.26 173.65 2nn1 s LEU 118 N 0.22 3.90 -0.14 2.70 2.96 -0.23 -1.32 118.68 126.77 2nn1 s LEU 118 Ca -0.01 0.16 0.02 0.00 -0.22 0.00 0.00 54.13 54.09 2nn1 s LEU 118 Cb -0.02 -1.97 0.01 0.00 0.50 0.00 0.00 46.19 44.71 2nn1 s LEU 118 CO -0.00 0.25 -0.19 -1.00 -1.32 0.00 0.00 176.35 174.08 2nn1 s HIS 119 N -0.06 2.46 -0.27 5.38 3.76 0.08 -1.24 115.29 125.40 2nn1 s HIS 119 Ca 0.07 -1.26 -0.01 0.00 -0.15 0.00 0.00 55.06 53.71 2nn1 s HIS 119 Cb -0.12 -1.71 0.04 0.00 1.11 0.00 0.00 32.58 31.90 2nn1 s HIS 119 CO 0.01 -0.60 -0.04 0.08 -0.85 0.00 0.00 174.74 173.33 2nn1 s VAL 120 N 0.97 2.81 -0.03 -0.90 1.01 -0.56 -1.13 120.40 122.57 2nn1 s VAL 120 Ca -0.05 -1.26 -0.03 0.00 0.00 0.00 0.00 61.98 60.65 2nn1 s VAL 120 Cb -0.15 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2nn1 s VAL 120 CO -0.04 0.04 0.13 0.00 0.00 0.00 0.00 175.10 175.24 2nn1 s ALA 121 N 1.26 3.80 0.04 5.51 0.00 0.75 -1.02 121.76 132.10 2nn1 s ALA 121 Ca -0.03 -0.77 -0.00 0.00 0.00 0.00 0.00 51.96 51.15 2nn1 s ALA 121 Cb -0.18 -1.79 -0.03 0.00 0.00 0.00 0.00 23.12 21.12 2nn1 s ALA 121 CO -0.03 0.70 -0.03 -1.01 0.00 0.00 0.00 175.76 175.38 2nn1 s HIS 122 N -1.21 0.40 0.10 0.00 3.76 0.25 -1.44 115.29 117.16 2nn1 s HIS 122 Ca 0.23 -0.78 0.09 0.00 -0.15 0.00 0.00 55.06 54.44 2nn1 s HIS 122 Cb -0.12 -0.29 -0.04 0.00 1.11 0.00 0.00 32.58 33.24 2nn1 s HIS 122 CO 0.14 -0.27 -0.22 1.67 -0.85 0.00 0.00 174.74 175.20 2nn1 s TRP 123 N -2.63 1.92 -0.82 1.40 1.48 -0.01 -1.25 118.94 119.03 2nn1 s TRP 123 Ca -0.05 -0.41 -0.25 0.00 -1.06 0.00 0.00 56.10 54.34 2nn1 s TRP 123 Cb -0.01 -1.06 -0.04 0.00 -1.16 0.00 0.00 33.47 31.19 2nn1 s TRP 123 CO -0.05 0.23 1.95 1.21 -4.06 0.00 0.00 176.95 176.22 2nn1 s ASN 124 N -1.86 5.11 0.00 -2.66 3.84 0.13 -0.71 114.94 118.79 2nn1 s ASN 124 Ca 0.08 -0.37 0.29 0.00 0.21 0.00 0.00 52.86 53.07 2nn1 s ASN 124 Cb -0.10 -2.55 1.27 0.00 -0.55 0.00 0.00 41.25 39.32 2nn1 s ASN 124 CO 0.04 -2.70 1.91 -1.54 -2.79 0.00 0.00 177.10 172.03 2nn1 n SER 125 N 13.89 0.14 0.08 -4.21 3.41 -1.23 -1.70 113.62 123.99 2nn1 n SER 125 Ca 0.35 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.86 2nn1 n SER 125 Cb 0.48 -0.27 -0.12 0.00 -0.26 0.00 0.00 64.21 64.04 2nn1 n SER 125 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nn1 h ALA 126 N 3.26 0.26 0.00 7.33 0.00 -1.87 -3.38 119.26 124.86 2nn1 h ALA 126 Ca 0.00 -0.88 -0.17 0.00 0.00 0.00 0.00 54.91 53.86 2nn1 h ALA 126 Cb 0.40 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2nn1 h ALA 126 CO 0.00 1.11 -1.75 1.63 0.00 0.00 0.00 179.25 180.23 2nn1 n LYS 127 N -3.45 1.71 -4.35 0.00 5.02 -1.22 -5.05 118.16 110.82 2nn1 n LYS 127 Ca -0.04 -0.03 -0.24 0.00 -2.02 0.00 0.00 58.31 55.98 2nn1 n LYS 127 Cb 0.96 -1.30 -0.09 0.00 -0.02 0.00 0.00 35.03 34.59 2nn1 n LYS 127 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2nn1 s TYR 128 N -2.41 2.53 -0.66 2.13 2.02 -0.69 -5.06 117.35 115.21 2nn1 s TYR 128 Ca -0.06 -0.41 0.22 0.00 -0.37 0.00 0.00 57.07 56.45 2nn1 s TYR 128 Cb 0.04 -1.42 -0.12 0.00 -0.40 0.00 0.00 41.96 40.06 2nn1 s TYR 128 CO 0.49 0.51 0.88 0.43 -1.57 0.00 0.00 175.55 176.29 2nn1 n SER 129 N -0.92 0.63 -3.81 2.29 7.64 -1.26 -4.41 113.62 113.78 2nn1 n SER 129 Ca -0.04 -0.48 -0.08 0.00 1.01 0.00 0.00 58.87 59.28 2nn1 n SER 129 Cb 0.62 1.11 -0.02 0.00 -1.01 0.00 0.00 64.21 64.91 2nn1 n SER 129 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2nn1 s SER 130 N -3.65 -0.29 0.17 6.43 1.04 -1.26 -5.03 113.70 111.12 2nn1 s SER 130 Ca 0.03 -0.54 -0.11 0.00 0.48 0.00 0.00 55.95 55.81 2nn1 s SER 130 Cb 0.15 0.71 0.06 0.00 0.10 0.00 0.00 66.02 67.04 2nn1 s SER 130 CO 0.85 -1.30 1.66 0.25 0.98 0.00 0.00 173.24 175.68 2nn1 h LEU 131 N 2.01 0.95 -0.88 2.42 5.85 -1.96 -1.36 115.31 122.33 2nn1 h LEU 131 Ca -0.21 -0.26 0.09 0.00 0.84 0.00 0.00 57.88 58.33 2nn1 h LEU 131 Cb 1.26 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.96 2nn1 h LEU 131 CO 0.25 0.97 0.53 0.00 -0.34 0.00 0.00 178.44 179.86 2nn1 h ALA 132 N 1.01 1.26 -0.00 1.25 0.00 -2.00 0.34 119.26 121.12 2nn1 h ALA 132 Ca 0.18 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2nn1 h ALA 132 Cb 0.43 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2nn1 h ALA 132 CO 0.01 0.20 -0.02 1.49 0.00 0.00 0.00 179.25 180.94 2nn1 h GLU 133 N 0.91 0.02 -0.33 0.00 4.81 -1.91 -3.33 114.58 114.75 2nn1 h GLU 133 Ca 0.41 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.59 2nn1 h GLU 133 Cb 0.32 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 2nn1 h GLU 133 CO -0.23 0.68 0.03 0.00 -0.73 0.00 0.00 179.01 178.76 2nn1 h ALA 134 N 0.34 1.43 -1.15 2.92 0.00 -0.93 -3.28 119.26 118.58 2nn1 h ALA 134 Ca -0.00 -0.18 0.32 0.00 0.00 0.00 0.00 54.91 55.06 2nn1 h ALA 134 Cb 0.68 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 2nn1 h ALA 134 CO 0.00 0.40 0.79 0.00 0.00 0.00 0.00 179.25 180.45 2nn1 h ALA 135 N 1.55 2.78 -0.38 0.00 0.00 -0.43 -0.85 119.26 121.92 2nn1 h ALA 135 Ca 0.11 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2nn1 h ALA 135 Cb 0.27 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2nn1 h ALA 135 CO 0.00 -1.16 0.00 -1.13 0.00 0.00 0.00 179.25 176.96 2nn1 n SER 136 N -4.38 3.16 -4.82 0.00 3.41 -1.24 -4.63 113.62 105.13 2nn1 n SER 136 Ca 0.26 -1.92 -0.38 0.00 -0.26 0.00 0.00 58.87 56.57 2nn1 n SER 136 Cb 1.13 -0.25 -0.06 0.00 -0.26 0.00 0.00 64.21 64.77 2nn1 n SER 136 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2nn1 s LYS 137 N -1.16 4.08 0.42 4.33 -0.14 -0.32 -4.87 119.74 122.08 2nn1 s LYS 137 Ca 0.32 0.59 0.18 0.00 -1.36 0.00 0.00 55.97 55.70 2nn1 s LYS 137 Cb 0.18 -3.24 1.09 0.00 -1.68 0.00 0.00 37.83 34.18 2nn1 s LYS 137 CO 0.24 0.65 1.84 0.00 -0.76 0.00 0.00 175.35 177.32 2nn1 h ALA 138 N 4.67 2.22 -0.24 5.17 0.00 -1.85 0.52 119.26 129.74 2nn1 h ALA 138 Ca -0.50 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 2nn1 h ALA 138 Cb 1.22 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 2nn1 h ALA 138 CO 0.63 -0.52 -0.02 -0.40 0.00 0.00 0.00 179.25 178.94 2nn1 n ASP 139 N -4.52 3.33 0.06 0.00 5.75 -1.26 -4.35 116.55 115.56 2nn1 n ASP 139 Ca 0.20 -3.21 -0.15 0.00 -0.01 0.00 0.00 54.79 51.63 2nn1 n ASP 139 Cb 0.73 -0.55 -0.05 0.00 -1.03 0.00 0.00 41.12 40.21 2nn1 n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 2nn1 h GLY 140 N 1.35 0.53 -3.22 6.12 0.00 -0.95 -3.42 103.07 103.47 2nn1 h GLY 140 Ca 0.05 -0.91 -0.65 0.00 0.00 0.00 0.00 47.33 45.82 2nn1 h GLY 140 CO 0.23 0.81 -0.82 1.08 0.00 0.00 0.00 176.54 177.83 2nn1 s LEU 141 N -7.82 2.43 -0.05 3.11 1.43 0.03 0.17 118.68 117.97 2nn1 s LEU 141 Ca -0.07 -0.86 -0.01 0.00 -1.03 0.00 0.00 54.13 52.16 2nn1 s LEU 141 Cb 0.08 -1.16 0.03 0.00 0.03 0.00 0.00 46.19 45.17 2nn1 s LEU 141 CO 0.88 0.12 0.01 0.00 0.23 0.00 0.00 176.35 177.58 2nn1 s ALA 142 N -1.66 0.53 -0.08 4.21 0.00 -0.38 -1.28 121.76 123.10 2nn1 s ALA 142 Ca 0.20 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 52.18 2nn1 s ALA 142 Cb -0.08 -0.61 0.01 0.00 0.00 0.00 0.00 23.12 22.44 2nn1 s ALA 142 CO 0.10 -0.36 -0.14 0.08 0.00 0.00 0.00 175.76 175.44 2nn1 s VAL 143 N 1.75 1.32 -0.11 0.00 1.01 -1.08 -0.58 120.40 122.70 2nn1 s VAL 143 Ca 0.01 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 61.24 2nn1 s VAL 143 Cb -0.13 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 2nn1 s VAL 143 CO -0.04 0.40 0.47 -0.63 0.00 0.00 0.00 175.10 175.31 2nn1 s ILE 144 N 0.71 5.17 -0.11 2.22 1.01 -0.19 -1.26 121.20 128.75 2nn1 s ILE 144 Ca -0.13 0.95 0.01 0.00 0.00 0.00 0.00 60.65 61.48 2nn1 s ILE 144 Cb -0.16 -3.81 -0.01 0.00 0.01 0.00 0.00 42.46 38.48 2nn1 s ILE 144 CO 0.03 0.34 -0.15 -0.83 0.00 0.00 0.00 174.94 174.34 2nn1 s GLY 145 N 0.50 1.51 -0.13 6.18 0.00 0.19 -1.49 107.32 114.08 2nn1 s GLY 145 Ca 0.26 -0.91 0.01 0.00 0.00 0.00 0.00 44.72 44.07 2nn1 s GLY 145 CO 0.11 -0.30 -0.14 0.14 0.00 0.00 0.00 173.10 172.90 2nn1 s VAL 146 N 0.18 1.49 0.17 1.40 1.01 -0.37 -1.20 120.40 123.07 2nn1 s VAL 146 Ca -0.08 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 60.99 2nn1 s VAL 146 Cb -0.15 -1.39 -0.07 0.00 0.00 0.00 0.00 36.38 34.76 2nn1 s VAL 146 CO 0.05 0.44 1.07 -0.76 0.00 0.00 0.00 175.10 175.91 2nn1 s LEU 147 N 1.27 4.50 -0.28 3.92 1.43 -1.26 -1.07 118.68 127.19 2nn1 s LEU 147 Ca -0.00 2.05 -0.05 0.00 -1.03 0.00 0.00 54.13 55.09 2nn1 s LEU 147 Cb -0.14 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.49 2nn1 s LEU 147 CO -0.06 -0.18 0.03 -0.04 0.23 0.00 0.00 176.35 176.33 2nn1 s MET 148 N -0.39 3.02 -0.23 1.70 -1.94 -0.03 -1.49 119.30 119.94 2nn1 s MET 148 Ca 0.48 -0.88 -0.14 0.00 -1.71 0.00 0.00 55.69 53.44 2nn1 s MET 148 Cb -0.28 -3.24 -0.04 0.00 2.01 0.00 0.00 34.83 33.28 2nn1 s MET 148 CO 0.34 -0.42 0.31 0.21 -0.01 0.00 0.00 175.02 175.46 2nn1 s LYS 149 N 1.44 4.09 0.24 2.03 2.20 -0.17 -1.79 119.74 127.78 2nn1 s LYS 149 Ca 0.02 0.00 -0.31 0.00 -0.36 0.00 0.00 55.97 55.32 2nn1 s LYS 149 Cb -0.17 -3.58 -0.12 0.00 -1.51 0.00 0.00 37.83 32.46 2nn1 s LYS 149 CO 0.00 -0.08 1.68 0.54 -0.36 0.00 0.00 175.35 177.13 2nn1 s VAL 150 N 1.47 2.03 0.00 4.02 0.11 -1.26 -2.81 120.40 123.96 2nn1 s VAL 150 Ca 0.14 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.21 2nn1 s VAL 150 Cb -0.15 -3.01 0.00 0.00 -1.53 0.00 0.00 36.38 31.69 2nn1 s VAL 150 CO 0.08 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.46 2nn1 n GLY 151 N 3.38 -0.46 3.76 6.54 0.00 0.34 -4.88 105.19 113.88 2nn1 n GLY 151 Ca 0.13 0.39 -0.37 0.00 0.00 0.00 0.00 46.02 46.17 2nn1 n GLY 151 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nn1 s GLU 152 N 0.00 3.53 0.45 1.61 2.02 -1.26 -3.90 118.70 121.15 2nn1 s GLU 152 Ca 0.00 1.93 -0.25 0.00 0.02 0.00 0.00 54.97 56.67 2nn1 s GLU 152 Cb 0.00 -2.35 -0.09 0.00 0.10 0.00 0.00 34.13 31.80 2nn1 s GLU 152 CO 0.00 -0.78 1.36 0.00 0.02 0.00 0.00 175.26 175.86 2nn1 n ALA 153 N -0.69 1.72 -2.88 5.21 0.00 -1.26 -3.17 120.51 119.43 2nn1 n ALA 153 Ca 0.08 0.24 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 2nn1 n ALA 153 Cb 0.47 -2.34 -0.10 0.00 0.00 0.00 0.00 19.45 17.48 2nn1 n ALA 153 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2nn1 s ASN 154 N -0.53 5.91 0.54 0.00 3.84 -1.26 -4.85 114.94 118.58 2nn1 s ASN 154 Ca 0.62 -1.21 0.21 0.00 0.21 0.00 0.00 52.86 52.69 2nn1 s ASN 154 Cb -0.47 -2.09 1.45 0.00 -0.55 0.00 0.00 41.25 39.59 2nn1 s ASN 154 CO 0.57 -0.52 2.17 1.55 -2.79 0.00 0.00 177.10 178.09 2nn1 h PRO 155 N 8.56 0.00 0.00 0.43 0.13 -1.94 -2.37 132.00 136.82 2nn1 h PRO 155 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2nn1 h PRO 155 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2nn1 h PRO 155 CO 0.77 0.02 0.00 1.63 -0.23 0.00 0.00 178.00 180.19 2nn1 n LYS 156 N -4.25 0.06 0.00 0.86 5.02 -1.26 -1.67 118.16 116.91 2nn1 n LYS 156 Ca -0.03 0.37 0.12 0.00 -2.02 0.00 0.00 58.31 56.75 2nn1 n LYS 156 Cb 0.10 -1.62 0.24 0.00 -0.02 0.00 0.00 35.03 33.73 2nn1 n LYS 156 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2nn1 n LEU 157 N -1.73 0.74 -0.21 -0.35 4.77 -0.89 -4.57 117.00 114.77 2nn1 n LEU 157 Ca 0.02 -0.14 -0.02 0.00 -0.03 0.00 0.00 56.01 55.84 2nn1 n LEU 157 Cb 0.14 -0.18 0.05 0.00 -2.33 0.00 0.00 43.42 41.10 2nn1 n LEU 157 CO 0.12 0.16 0.72 -0.61 -1.33 0.00 0.00 177.39 176.45 2nn1 h GLN 158 N 0.41 -0.04 -0.74 3.23 5.75 -1.47 -0.46 115.11 121.80 2nn1 h GLN 158 Ca 0.00 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.47 2nn1 h GLN 158 Cb 0.51 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 2nn1 h GLN 158 CO 0.00 -0.03 0.34 -0.22 -2.65 0.00 0.00 178.83 176.27 2nn1 h LYS 159 N -0.04 1.08 0.07 1.69 3.64 -1.82 -0.30 116.57 120.89 2nn1 h LYS 159 Ca 0.29 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2nn1 h LYS 159 Cb 0.48 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2nn1 h LYS 159 CO -0.65 0.85 -0.04 0.28 -2.27 0.00 0.00 179.45 177.63 2nn1 h VAL 160 N 1.04 1.04 -0.76 2.00 2.07 -1.69 -2.68 116.25 117.28 2nn1 h VAL 160 Ca 0.25 -0.40 0.04 0.00 0.82 0.00 0.00 66.70 67.41 2nn1 h VAL 160 Cb 0.15 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.17 2nn1 h VAL 160 CO -0.03 0.10 0.48 -0.07 0.02 0.00 0.00 177.57 178.07 2nn1 h LEU 161 N -0.28 0.78 -1.78 2.57 3.38 -0.93 -1.80 115.31 117.26 2nn1 h LEU 161 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2nn1 h LEU 161 Cb 0.24 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2nn1 h LEU 161 CO 0.02 0.53 0.00 0.44 0.09 0.00 0.00 178.44 179.52 2nn1 h ASP 162 N 0.92 0.00 1.54 -0.43 3.32 -1.00 -2.84 116.42 117.93 2nn1 h ASP 162 Ca 0.31 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.36 2nn1 h ASP 162 Cb 0.04 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 2nn1 h ASP 162 CO -0.12 0.00 -0.46 0.00 -1.72 0.00 0.00 179.24 176.94 2nn1 h ALA 163 N 2.02 0.77 -0.64 3.45 0.00 -0.97 -3.36 119.26 120.54 2nn1 h ALA 163 Ca 0.00 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.96 2nn1 h ALA 163 Cb 0.35 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 2nn1 h ALA 163 CO 0.00 0.02 0.42 -0.07 0.00 0.00 0.00 179.25 179.62 2nn1 h LEU 164 N 0.00 0.56 -0.74 0.00 3.38 -1.42 -2.20 115.31 114.88 2nn1 h LEU 164 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2nn1 h LEU 164 Cb 1.01 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2nn1 h LEU 164 CO 0.00 0.37 0.00 0.00 0.09 0.00 0.00 178.44 178.90 2nn1 n GLN 165 N -4.48 0.07 0.00 1.13 -0.00 -1.26 -1.18 117.38 111.67 2nn1 n GLN 165 Ca 0.09 0.57 0.11 0.00 -0.00 0.00 0.00 57.00 57.76 2nn1 n GLN 165 Cb 0.23 -1.74 -0.01 0.00 -0.00 0.00 0.00 30.24 28.72 2nn1 n GLN 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2nn1 n ALA 166 N -1.65 3.94 -2.64 2.61 0.00 -0.83 -4.38 120.51 117.57 2nn1 n ALA 166 Ca -0.01 -0.61 -0.08 0.00 0.00 0.00 0.00 53.44 52.75 2nn1 n ALA 166 Cb 0.02 -0.82 0.04 0.00 0.00 0.00 0.00 19.45 18.69 2nn1 n ALA 166 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2nn1 n ILE 167 N -0.61 1.46 -0.20 0.00 -5.35 -0.32 -4.64 119.36 109.70 2nn1 n ILE 167 Ca 0.08 -3.31 0.02 0.00 -0.27 0.00 0.00 62.75 59.27 2nn1 n ILE 167 Cb 0.41 0.57 0.28 0.00 -1.74 0.00 0.00 39.64 39.16 2nn1 n ILE 167 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 2nn1 h LYS 168 N 2.66 0.91 -6.27 6.28 1.79 -1.72 -3.42 116.57 116.80 2nn1 h LYS 168 Ca -0.02 -0.05 -0.57 0.00 -2.18 0.00 0.00 60.65 57.82 2nn1 h LYS 168 Cb 1.25 -0.20 -0.10 0.00 -1.58 0.00 0.00 32.23 31.60 2nn1 h LYS 168 CO 0.41 0.60 -0.65 0.95 -1.08 0.00 0.00 179.45 179.68 2nn1 s THR 169 N -5.80 3.59 -0.01 -0.16 -4.23 -1.26 -0.36 115.64 107.42 2nn1 s THR 169 Ca -0.11 -1.70 -0.37 0.00 -1.18 0.00 0.00 61.69 58.33 2nn1 s THR 169 Cb 0.18 -2.88 -0.16 0.00 1.34 0.00 0.00 72.50 70.99 2nn1 s THR 169 CO 0.78 -0.27 1.48 1.17 -0.54 0.00 0.00 174.62 177.24 2nn1 n LYS 170 N -0.60 1.25 0.00 3.99 4.81 -0.13 -1.90 118.16 125.58 2nn1 n LYS 170 Ca -0.08 0.45 0.00 0.00 -0.87 0.00 0.00 58.31 57.81 2nn1 n LYS 170 Cb 0.57 -2.12 0.00 0.00 0.02 0.00 0.00 35.03 33.50 2nn1 n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2nn1 n GLY 171 N 3.07 3.15 3.77 3.14 0.00 -0.37 -4.66 105.19 113.29 2nn1 n GLY 171 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 2nn1 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nn1 s LYS 172 N -0.39 3.82 0.04 1.61 1.02 -0.80 -4.77 119.74 120.28 2nn1 s LYS 172 Ca 0.00 2.13 -0.08 0.00 0.02 0.00 0.00 55.97 58.04 2nn1 s LYS 172 Cb 0.00 -2.64 -0.00 0.00 -0.52 0.00 0.00 37.83 34.67 2nn1 s LYS 172 CO 0.00 -0.61 0.17 -0.98 -0.92 0.00 0.00 175.35 173.01 2nn1 s ARG 173 N -2.40 0.68 0.05 1.68 1.70 -1.26 -1.32 118.95 118.08 2nn1 s ARG 173 Ca 0.60 -0.69 -0.18 0.00 -0.47 0.00 0.00 55.73 54.98 2nn1 s ARG 173 Cb -0.37 0.28 0.04 0.00 -0.57 0.00 0.00 34.95 34.32 2nn1 s ARG 173 CO 0.47 -0.19 0.41 0.00 -1.08 0.00 0.00 175.30 174.91 2nn1 s ALA 174 N -2.70 -1.01 0.38 7.88 0.00 -0.54 -4.97 121.76 120.80 2nn1 s ALA 174 Ca -0.04 0.30 -0.28 0.00 0.00 0.00 0.00 51.96 51.94 2nn1 s ALA 174 Cb -0.01 0.36 -0.11 0.00 0.00 0.00 0.00 23.12 23.37 2nn1 s ALA 174 CO -0.05 -0.46 1.46 -2.14 0.00 0.00 0.00 175.76 174.57 2nn1 s PRO 175 N -2.52 4.10 -0.30 0.00 0.02 -1.26 -1.00 135.00 134.04 2nn1 s PRO 175 Ca -0.05 2.51 -0.03 0.00 0.02 0.00 0.00 61.00 63.45 2nn1 s PRO 175 Cb -0.01 -2.95 0.11 0.00 0.02 0.00 0.00 34.50 31.67 2nn1 s PRO 175 CO -0.03 -0.52 0.16 0.12 -0.33 0.00 0.00 177.00 176.40 2nn1 s PHE 176 N -1.13 0.28 0.40 6.54 5.36 -0.49 -4.71 117.98 124.23 2nn1 s PHE 176 Ca 0.53 -0.89 0.06 0.00 -0.96 0.00 0.00 56.93 55.67 2nn1 s PHE 176 Cb -0.45 -0.85 -0.07 0.00 -0.34 0.00 0.00 43.02 41.31 2nn1 s PHE 176 CO 0.61 -0.84 0.02 0.95 -1.46 0.00 0.00 175.22 174.50 2nn1 s THR 177 N 2.00 1.78 -1.11 0.12 -4.23 -1.26 -1.89 115.64 111.04 2nn1 s THR 177 Ca 0.10 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.43 2nn1 s THR 177 Cb -0.17 -2.89 -0.02 0.00 1.34 0.00 0.00 72.50 70.76 2nn1 s THR 177 CO -0.32 0.00 0.82 -3.20 -0.54 0.00 0.00 174.62 171.38 2nn1 n ASN 178 N -0.95 -5.63 -3.78 3.99 5.15 -1.13 -4.99 115.26 107.92 2nn1 n ASN 178 Ca -0.06 -0.95 -0.14 0.00 -0.60 0.00 0.00 54.58 52.83 2nn1 n ASN 178 Cb 0.67 -3.74 -0.15 0.00 -0.53 0.00 0.00 39.78 36.03 2nn1 n ASN 178 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 2nn1 s PHE 179 N -3.44 -0.06 -0.36 1.20 5.36 -0.90 -4.97 117.98 114.81 2nn1 s PHE 179 Ca 0.47 0.25 -0.07 0.00 -0.96 0.00 0.00 56.93 56.62 2nn1 s PHE 179 Cb -0.15 -0.12 0.05 0.00 -0.34 0.00 0.00 43.02 42.47 2nn1 s PHE 179 CO 0.84 -0.10 0.15 0.34 -1.46 0.00 0.00 175.22 174.99 2nn1 s ASP 180 N 0.84 5.40 0.00 6.13 -1.08 -1.26 -4.33 116.67 122.37 2nn1 s ASP 180 Ca -0.07 -1.30 0.10 0.00 -0.52 0.00 0.00 52.55 50.76 2nn1 s ASP 180 Cb -0.09 -1.90 0.46 0.00 -1.46 0.00 0.00 42.92 39.93 2nn1 s ASP 180 CO -0.03 -0.40 1.24 -0.81 0.52 0.00 0.00 175.17 175.69 2nn1 n PRO 181 N 4.82 0.08 0.19 4.34 -0.04 -1.26 -2.30 135.00 140.84 2nn1 n PRO 181 Ca -0.11 0.25 0.14 0.00 -0.04 0.00 0.00 63.50 63.74 2nn1 n PRO 181 Cb 0.44 -1.50 0.61 0.00 -0.04 0.00 0.00 33.50 33.01 2nn1 n PRO 181 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2nn1 h SER 182 N 0.00 0.00 0.69 3.54 4.64 -1.95 -1.72 113.55 118.74 2nn1 h SER 182 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nn1 h SER 182 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2nn1 h SER 182 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 2nn1 n THR 183 N -2.56 0.60 0.71 2.95 -2.24 -0.97 -2.64 114.28 110.12 2nn1 n THR 183 Ca 0.01 0.15 0.11 0.00 -2.27 0.00 0.00 64.05 62.05 2nn1 n THR 183 Cb 0.23 -0.80 -0.01 0.00 -2.10 0.00 0.00 70.33 67.64 2nn1 n THR 183 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2nn1 n LEU 184 N -1.50 0.66 -4.81 3.22 4.77 -0.65 -4.92 117.00 113.78 2nn1 n LEU 184 Ca 0.05 -0.17 -0.33 0.00 -0.03 0.00 0.00 56.01 55.53 2nn1 n LEU 184 Cb 0.24 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 2nn1 n LEU 184 CO 0.19 0.12 0.71 -0.76 -1.33 0.00 0.00 177.39 176.32 2nn1 s LEU 185 N -3.56 3.61 0.81 2.23 1.43 -1.08 -4.97 118.68 117.15 2nn1 s LEU 185 Ca 0.05 1.81 -0.11 0.00 -1.03 0.00 0.00 54.13 54.85 2nn1 s LEU 185 Cb 0.15 -4.54 0.08 0.00 0.03 0.00 0.00 46.19 41.91 2nn1 s LEU 185 CO 0.82 -0.98 1.09 -2.16 0.23 0.00 0.00 176.35 175.35 2nn1 s PRO 186 N -3.84 1.97 0.31 1.29 0.04 -1.26 -4.93 135.00 128.57 2nn1 s PRO 186 Ca 0.64 1.10 0.01 0.00 0.04 0.00 0.00 61.00 62.79 2nn1 s PRO 186 Cb -0.15 -1.87 0.55 0.00 0.04 0.00 0.00 34.50 33.06 2nn1 s PRO 186 CO 0.31 -1.83 1.91 0.66 0.04 0.00 0.00 177.00 178.10 2nn1 h SER 187 N -1.26 0.89 -2.98 6.66 4.64 -1.95 -3.40 113.55 116.14 2nn1 h SER 187 Ca -0.45 0.01 -0.66 0.00 -0.47 0.00 0.00 61.79 60.22 2nn1 h SER 187 Cb 1.24 -0.18 -0.11 0.00 -0.31 0.00 0.00 62.40 63.04 2nn1 h SER 187 CO 0.52 0.57 -0.54 -0.55 -0.87 0.00 0.00 176.83 175.96 2nn1 s SER 188 N -6.02 5.90 -0.33 4.97 0.15 -1.26 -5.01 113.70 112.09 2nn1 s SER 188 Ca -0.11 0.30 0.09 0.00 0.70 0.00 0.00 55.95 56.92 2nn1 s SER 188 Cb 0.20 -1.86 0.62 0.00 -1.71 0.00 0.00 66.02 63.26 2nn1 s SER 188 CO 0.80 0.35 1.68 0.18 1.20 0.00 0.00 173.24 177.45 2nn1 n LEU 189 N 2.33 5.34 -4.76 3.45 4.77 -1.26 -4.65 117.00 122.21 2nn1 n LEU 189 Ca -0.19 -3.50 -0.39 0.00 -0.03 0.00 0.00 56.01 51.90 2nn1 n LEU 189 Cb 0.54 -0.71 0.02 0.00 -2.33 0.00 0.00 43.42 40.94 2nn1 n LEU 189 CO 0.31 1.01 1.00 -1.81 -1.33 0.00 0.00 177.39 176.57 2nn1 s ASP 190 N -1.74 5.78 0.28 -1.43 1.01 -1.26 -4.66 116.67 114.65 2nn1 s ASP 190 Ca 0.51 2.76 -0.06 0.00 0.71 0.00 0.00 52.55 56.46 2nn1 s ASP 190 Cb 0.43 -2.64 -0.01 0.00 1.01 0.00 0.00 42.92 41.71 2nn1 s ASP 190 CO 0.08 -1.23 0.41 0.72 0.21 0.00 0.00 175.17 175.36 2nn1 s PHE 191 N -1.28 0.79 0.11 4.23 -0.71 -1.26 -1.50 117.98 118.36 2nn1 s PHE 191 Ca 0.64 -1.08 0.10 0.00 -1.04 0.00 0.00 56.93 55.55 2nn1 s PHE 191 Cb -0.40 -0.06 -0.04 0.00 -1.21 0.00 0.00 43.02 41.31 2nn1 s PHE 191 CO 0.50 -0.98 -0.25 -1.58 -1.34 0.00 0.00 175.22 171.56 2nn1 s TRP 192 N -3.66 2.17 -0.01 3.49 0.51 -0.07 -0.96 118.94 120.42 2nn1 s TRP 192 Ca 0.29 -0.39 -0.03 0.00 -2.12 0.00 0.00 56.10 53.84 2nn1 s TRP 192 Cb 0.01 -1.20 -0.00 0.00 -0.81 0.00 0.00 33.47 31.47 2nn1 s TRP 192 CO 0.14 0.27 0.07 -0.08 -0.51 0.00 0.00 176.95 176.84 2nn1 s THR 193 N -1.04 0.06 0.05 2.01 -1.32 -0.06 -0.79 115.64 114.55 2nn1 s THR 193 Ca 0.12 -0.48 -0.27 0.00 -1.21 0.00 0.00 61.69 59.84 2nn1 s THR 193 Cb -0.10 -0.26 0.07 0.00 -1.51 0.00 0.00 72.50 70.71 2nn1 s THR 193 CO 0.05 -0.27 0.67 -0.72 -2.21 0.00 0.00 174.62 172.14 2nn1 s TYR 194 N -0.84 -0.58 -0.10 9.09 1.13 -1.19 -1.13 117.35 123.73 2nn1 s TYR 194 Ca -0.09 0.68 -0.29 0.00 -1.41 0.00 0.00 57.07 55.96 2nn1 s TYR 194 Cb -0.06 0.49 -0.01 0.00 -1.10 0.00 0.00 41.96 41.28 2nn1 s TYR 194 CO 0.00 -0.71 0.98 -1.25 -2.51 0.00 0.00 175.55 172.06 2nn1 s PRO 195 N -2.50 4.42 0.00 -3.49 0.04 -1.26 -1.58 135.00 130.63 2nn1 s PRO 195 Ca -0.04 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2nn1 s PRO 195 Cb -0.01 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 31.00 2nn1 s PRO 195 CO -0.02 -0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.14 2nn1 n GLY 196 N 3.11 5.31 3.11 0.56 0.00 0.13 -4.81 105.19 112.61 2nn1 n GLY 196 Ca 0.08 -0.91 -0.15 0.00 0.00 0.00 0.00 46.02 45.03 2nn1 n GLY 196 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2nn1 n SER 197 N 0.00 -1.05 -4.77 1.61 3.41 -0.96 -2.55 113.62 109.30 2nn1 n SER 197 Ca 0.00 -2.89 -0.36 0.00 -0.26 0.00 0.00 58.87 55.36 2nn1 n SER 197 Cb 0.00 2.09 -0.01 0.00 -0.26 0.00 0.00 64.21 66.03 2nn1 n SER 197 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2nn1 s LEU 198 N 0.00 3.97 0.00 1.04 1.43 -0.47 -4.46 118.68 120.19 2nn1 s LEU 198 Ca 0.31 2.23 0.18 0.00 -1.03 0.00 0.00 54.13 55.82 2nn1 s LEU 198 Cb 0.00 -4.32 0.66 0.00 0.03 0.00 0.00 46.19 42.56 2nn1 s LEU 198 CO 0.22 -0.92 1.48 0.35 0.23 0.00 0.00 176.35 177.71 2nn1 n THR 199 N -0.62 0.25 -3.73 5.49 -2.24 -1.26 -4.51 114.28 107.65 2nn1 n THR 199 Ca 0.08 -0.34 -0.10 0.00 -2.27 0.00 0.00 64.05 61.43 2nn1 n THR 199 Cb 0.49 0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.94 2nn1 n THR 199 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2nn1 s HIS 200 N -1.75 -0.05 0.25 4.78 0.00 -1.26 -4.70 115.29 112.56 2nn1 s HIS 200 Ca 0.29 -0.29 -0.28 0.00 -3.00 0.00 0.00 55.06 51.78 2nn1 s HIS 200 Cb 0.15 0.21 -0.15 0.00 -4.00 0.00 0.00 32.58 28.78 2nn1 s HIS 200 CO 0.23 -0.74 0.73 -2.30 -1.00 0.00 0.00 174.74 171.66 2nn1 n PRO 201 N -0.23 0.62 0.00 -0.38 -0.02 -1.26 -0.79 135.00 132.93 2nn1 n PRO 201 Ca -0.13 0.22 0.07 0.00 -2.02 0.00 0.00 63.50 61.64 2nn1 n PRO 201 Cb 0.63 -1.39 0.44 0.00 -0.02 0.00 0.00 33.50 33.16 2nn1 n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2nn1 n PRO 202 N 0.86 0.54 -2.31 0.52 -0.04 -1.26 -5.00 135.00 128.31 2nn1 n PRO 202 Ca 0.14 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.43 2nn1 n PRO 202 Cb 0.29 -1.43 -0.02 0.00 -0.04 0.00 0.00 33.50 32.31 2nn1 n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2nn1 n LEU 203 N -0.93 -1.51 -4.72 1.53 4.77 0.03 -4.92 117.00 111.25 2nn1 n LEU 203 Ca 0.11 0.13 -0.43 0.00 -0.03 0.00 0.00 56.01 55.79 2nn1 n LEU 203 Cb 0.05 -2.54 -0.02 0.00 -2.33 0.00 0.00 43.42 38.59 2nn1 n LEU 203 CO 0.08 -0.26 1.13 -1.22 -1.33 0.00 0.00 177.39 175.79 2nn1 n TYR 204 N -3.51 2.62 -2.26 -1.77 4.01 -1.26 -4.36 117.16 110.63 2nn1 n TYR 204 Ca -0.19 0.36 -0.42 0.00 -0.16 0.00 0.00 57.90 57.49 2nn1 n TYR 204 Cb 0.64 -2.53 0.00 0.00 -0.31 0.00 0.00 39.34 37.14 2nn1 n TYR 204 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2nn1 n GLU 205 N 1.69 3.56 -0.12 -0.72 1.02 -1.26 -1.37 120.64 123.43 2nn1 n GLU 205 Ca 0.08 -3.42 0.03 0.00 -0.02 0.00 0.00 57.16 53.82 2nn1 n GLU 205 Cb 0.36 -2.96 0.04 0.00 -0.02 0.00 0.00 31.44 28.86 2nn1 n GLU 205 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2nn1 n SER 206 N 4.05 1.24 -4.47 1.62 3.41 -1.16 -4.42 113.62 113.88 2nn1 n SER 206 Ca 0.41 -2.08 -0.33 0.00 -0.26 0.00 0.00 58.87 56.61 2nn1 n SER 206 Cb 0.36 -0.16 -0.13 0.00 -0.26 0.00 0.00 64.21 64.03 2nn1 n SER 206 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2nn1 s VAL 207 N -1.09 3.70 -0.40 -3.33 1.01 -1.06 -0.79 120.40 118.44 2nn1 s VAL 207 Ca 0.09 -0.43 -0.15 0.00 0.00 0.00 0.00 61.98 61.49 2nn1 s VAL 207 Cb 0.08 -2.60 0.02 0.00 0.00 0.00 0.00 36.38 33.87 2nn1 s VAL 207 CO 0.01 0.51 0.33 -0.89 0.00 0.00 0.00 175.10 175.05 2nn1 s THR 208 N 0.30 5.22 0.29 3.92 2.01 -0.40 0.18 115.64 127.16 2nn1 s THR 208 Ca -0.05 -0.54 -0.22 0.00 0.31 0.00 0.00 61.69 61.19 2nn1 s THR 208 Cb -0.14 -3.93 -0.09 0.00 0.01 0.00 0.00 72.50 68.34 2nn1 s THR 208 CO 0.04 -0.30 0.83 0.26 -0.69 0.00 0.00 174.62 174.75 2nn1 s TRP 209 N 1.79 3.61 -0.30 4.92 0.52 -0.62 -2.65 118.94 126.21 2nn1 s TRP 209 Ca 0.07 1.55 0.00 0.00 0.02 0.00 0.00 56.10 57.74 2nn1 s TRP 209 Cb -0.18 -2.75 0.10 0.00 -1.15 0.00 0.00 33.47 29.48 2nn1 s TRP 209 CO 0.11 0.22 0.08 0.42 0.02 0.00 0.00 176.95 177.80 2nn1 s ILE 210 N -1.66 1.17 -0.28 2.03 -1.09 -0.39 -3.20 121.20 117.78 2nn1 s ILE 210 Ca 0.49 -1.52 -0.10 0.00 -2.23 0.00 0.00 60.65 57.28 2nn1 s ILE 210 Cb -0.16 -1.84 -0.04 0.00 -1.58 0.00 0.00 42.46 38.84 2nn1 s ILE 210 CO 0.21 -0.60 0.15 -0.63 -1.23 0.00 0.00 174.94 172.84 2nn1 s ILE 211 N 1.48 4.95 0.33 2.92 -1.09 0.03 0.56 121.20 130.37 2nn1 s ILE 211 Ca 0.08 -0.00 -0.28 0.00 -2.23 0.00 0.00 60.65 58.22 2nn1 s ILE 211 Cb -0.18 -3.37 -0.09 0.00 -1.58 0.00 0.00 42.46 37.24 2nn1 s ILE 211 CO -0.20 0.25 1.17 0.00 -1.23 0.00 0.00 174.94 174.93 2nn1 h LYS 213 N 3.36 0.72 -6.46 0.00 3.64 -1.59 -3.43 116.57 112.81 2nn1 h LYS 213 Ca -0.48 -0.52 -0.53 0.00 -1.27 0.00 0.00 60.65 57.86 2nn1 h LYS 213 Cb 1.22 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 33.09 2nn1 h LYS 213 CO 0.65 1.14 0.21 -2.00 -2.27 0.00 0.00 179.45 177.18 2nn1 s GLU 214 N -3.93 4.58 0.55 1.90 2.12 -1.26 -5.04 118.70 117.62 2nn1 s GLU 214 Ca -0.11 1.19 0.01 0.00 0.36 0.00 0.00 54.97 56.41 2nn1 s GLU 214 Cb 0.08 -3.32 0.03 0.00 0.26 0.00 0.00 34.13 31.18 2nn1 s GLU 214 CO 0.87 0.41 0.78 -1.54 -0.54 0.00 0.00 175.26 175.24 2nn1 s SER 215 N -0.58 5.32 0.27 -1.70 1.04 -1.26 -4.61 113.70 112.17 2nn1 s SER 215 Ca 0.39 0.06 0.10 0.00 0.48 0.00 0.00 55.95 56.98 2nn1 s SER 215 Cb -0.22 -0.98 -0.05 0.00 0.10 0.00 0.00 66.02 64.87 2nn1 s SER 215 CO 0.26 -1.12 -0.17 0.27 0.98 0.00 0.00 173.24 173.47 2nn1 s ILE 216 N -2.77 2.20 0.43 -1.02 -4.36 -0.55 -4.85 121.20 110.28 2nn1 s ILE 216 Ca 0.56 -2.32 0.02 0.00 -0.26 0.00 0.00 60.65 58.65 2nn1 s ILE 216 Cb -0.10 -2.28 -0.00 0.00 1.25 0.00 0.00 42.46 41.33 2nn1 s ILE 216 CO 0.39 -0.43 0.63 -0.55 0.24 0.00 0.00 174.94 175.23 2nn1 s SER 217 N -3.46 5.84 -0.28 4.36 0.15 -1.26 -1.00 113.70 118.04 2nn1 s SER 217 Ca 0.28 0.18 -0.24 0.00 0.70 0.00 0.00 55.95 56.87 2nn1 s SER 217 Cb -0.03 -1.45 0.09 0.00 -1.71 0.00 0.00 66.02 62.93 2nn1 s SER 217 CO 0.13 -0.66 0.83 0.54 1.20 0.00 0.00 173.24 175.27 2nn1 s VAL 218 N -2.49 0.00 0.53 4.45 0.11 -1.12 -4.43 120.40 117.45 2nn1 s VAL 218 Ca 0.48 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.50 2nn1 s VAL 218 Cb -0.10 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.76 2nn1 s VAL 218 CO 0.37 0.00 0.80 -0.94 -3.33 0.00 0.00 175.10 171.99 2nn1 s SER 219 N 0.43 5.67 0.33 3.54 1.04 -1.23 -0.50 113.70 122.97 2nn1 s SER 219 Ca 0.00 0.49 0.01 0.00 0.48 0.00 0.00 55.95 56.93 2nn1 s SER 219 Cb -0.05 -1.58 0.57 0.00 0.10 0.00 0.00 66.02 65.06 2nn1 s SER 219 CO -0.03 -0.92 1.97 0.28 0.98 0.00 0.00 173.24 175.53 2nn1 h SER 220 N 0.08 0.76 0.06 7.02 0.02 -1.94 -2.06 113.55 117.49 2nn1 h SER 220 Ca -0.45 -0.04 -0.15 0.00 -0.84 0.00 0.00 61.79 60.30 2nn1 h SER 220 Cb 1.26 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 2nn1 h SER 220 CO 0.59 0.59 -0.52 -0.33 -1.14 0.00 0.00 176.83 176.01 2nn1 h GLU 221 N 0.88 0.51 -0.54 3.45 3.07 -1.95 -1.90 114.58 118.10 2nn1 h GLU 221 Ca 0.23 -0.31 -0.12 0.00 -0.50 0.00 0.00 59.36 58.66 2nn1 h GLU 221 Cb -0.03 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 2nn1 h GLU 221 CO -0.04 0.91 -0.12 1.96 -1.40 0.00 0.00 179.01 180.32 2nn1 h GLN 222 N 0.40 1.03 -0.41 2.33 4.20 -1.82 -2.25 115.11 118.59 2nn1 h GLN 222 Ca 0.01 -0.38 -0.06 0.00 0.06 0.00 0.00 58.65 58.28 2nn1 h GLN 222 Cb 1.05 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.75 2nn1 h GLN 222 CO 0.10 1.07 0.00 -0.07 -0.67 0.00 0.00 178.83 179.26 2nn1 h LEU 223 N 0.91 0.63 -1.55 1.46 3.38 -1.29 -1.58 115.31 117.27 2nn1 h LEU 223 Ca 0.14 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2nn1 h LEU 223 Cb 0.69 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2nn1 h LEU 223 CO 0.05 0.70 0.19 0.00 0.09 0.00 0.00 178.44 179.47 2nn1 h ALA 224 N 1.38 1.66 -0.65 1.53 0.00 -0.85 -1.80 119.26 120.52 2nn1 h ALA 224 Ca 0.13 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2nn1 h ALA 224 Cb 0.39 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2nn1 h ALA 224 CO 0.01 0.29 0.17 1.96 0.00 0.00 0.00 179.25 181.68 2nn1 h GLN 225 N 0.50 1.01 -0.37 0.00 4.20 -0.72 -0.63 115.11 119.10 2nn1 h GLN 225 Ca 0.13 -0.22 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 2nn1 h GLN 225 Cb 0.03 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 2nn1 h GLN 225 CO -0.02 0.89 0.07 0.74 -0.67 0.00 0.00 178.83 179.84 2nn1 h PHE 226 N 0.97 0.63 0.00 2.96 0.04 -1.22 -2.67 116.94 117.65 2nn1 h PHE 226 Ca 0.21 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.89 2nn1 h PHE 226 Cb 0.33 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.30 2nn1 h PHE 226 CO 0.02 0.64 0.00 0.54 -0.60 0.00 0.00 178.31 178.91 2nn1 n ARG 227 N -4.57 0.10 0.00 1.51 1.74 -0.84 -2.23 116.66 112.36 2nn1 n ARG 227 Ca -0.01 0.31 0.14 0.00 -0.77 0.00 0.00 57.85 57.51 2nn1 n ARG 227 Cb 0.22 -1.67 0.50 0.00 -1.02 0.00 0.00 32.46 30.49 2nn1 n ARG 227 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2nn1 n SER 228 N -1.85 0.71 -4.78 0.55 3.41 -0.27 -3.45 113.62 107.94 2nn1 n SER 228 Ca 0.03 -0.70 -0.35 0.00 -0.26 0.00 0.00 58.87 57.59 2nn1 n SER 228 Cb 0.22 0.02 -0.00 0.00 -0.26 0.00 0.00 64.21 64.18 2nn1 n SER 228 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2nn1 s LEU 229 N -2.50 3.77 -0.08 1.04 1.43 -0.95 -4.85 118.68 116.55 2nn1 s LEU 229 Ca 0.26 2.14 -0.01 0.00 -1.03 0.00 0.00 54.13 55.49 2nn1 s LEU 229 Cb 0.20 -4.57 -0.03 0.00 0.03 0.00 0.00 46.19 41.81 2nn1 s LEU 229 CO 0.50 -1.14 -0.02 -0.76 0.23 0.00 0.00 176.35 175.16 2nn1 s LEU 230 N -3.73 3.47 0.02 1.79 1.43 0.51 -0.21 118.68 121.96 2nn1 s LEU 230 Ca 0.72 0.10 0.25 0.00 -1.03 0.00 0.00 54.13 54.16 2nn1 s LEU 230 Cb -0.23 -1.79 0.43 0.00 0.03 0.00 0.00 46.19 44.64 2nn1 s LEU 230 CO 0.26 0.37 1.36 -1.54 0.23 0.00 0.00 176.35 177.03 2nn1 n SER 231 N 2.19 0.55 -4.93 2.29 3.41 0.28 -3.28 113.62 114.12 2nn1 n SER 231 Ca -0.18 -0.23 -0.25 0.00 -0.26 0.00 0.00 58.87 57.94 2nn1 n SER 231 Cb 0.53 0.30 0.03 0.00 -0.26 0.00 0.00 64.21 64.82 2nn1 n SER 231 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2nn1 s ASN 232 N -3.20 5.48 0.39 4.04 4.22 -1.26 -4.47 114.94 120.14 2nn1 s ASN 232 Ca 0.10 0.52 -0.10 0.00 -2.14 0.00 0.00 52.86 51.24 2nn1 s ASN 232 Cb 0.17 -1.49 -0.06 0.00 1.28 0.00 0.00 41.25 41.15 2nn1 s ASN 232 CO 0.71 -1.09 0.73 0.68 -2.04 0.00 0.00 177.10 176.10 2nn1 s VAL 233 N -2.92 4.82 0.16 3.54 -7.23 -1.26 -0.95 120.40 116.55 2nn1 s VAL 233 Ca 0.54 0.53 -0.34 0.00 -1.81 0.00 0.00 61.98 60.91 2nn1 s VAL 233 Cb -0.10 -3.73 -0.15 0.00 0.56 0.00 0.00 36.38 32.95 2nn1 s VAL 233 CO 0.43 -0.49 1.28 1.21 -0.31 0.00 0.00 175.10 177.23 2nn1 n GLU 234 N -1.24 1.39 0.00 4.82 2.13 -1.26 -2.13 120.64 124.36 2nn1 n GLU 234 Ca 0.02 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.33 2nn1 n GLU 234 Cb 0.54 -2.08 0.00 0.00 0.27 0.00 0.00 31.44 30.17 2nn1 n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2nn1 n GLY 235 N 2.28 2.61 3.92 8.31 0.00 -1.26 -5.06 105.19 115.99 2nn1 n GLY 235 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 2nn1 n GLY 235 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2nn1 s ASP 236 N 0.67 4.67 0.28 1.61 1.01 -0.90 -4.99 116.67 119.01 2nn1 s ASP 236 Ca 0.00 0.53 -0.30 0.00 0.71 0.00 0.00 52.55 53.49 2nn1 s ASP 236 Cb 0.00 -1.11 -0.11 0.00 1.01 0.00 0.00 42.92 42.70 2nn1 s ASP 236 CO 0.00 -1.72 1.60 0.20 0.21 0.00 0.00 175.17 175.46 2nn1 s ASN 237 N -4.55 6.39 0.27 0.27 0.01 -1.26 -4.89 114.94 111.18 2nn1 s ASN 237 Ca 0.61 2.92 -0.30 0.00 -0.71 0.00 0.00 52.86 55.38 2nn1 s ASN 237 Cb -0.11 -2.63 -0.11 0.00 0.41 0.00 0.00 41.25 38.82 2nn1 s ASN 237 CO 0.46 -0.91 1.56 0.00 -1.51 0.00 0.00 177.10 176.71 2nn1 s ALA 238 N 0.18 3.73 -0.38 0.60 0.00 -1.26 -4.80 121.76 119.83 2nn1 s ALA 238 Ca 0.65 1.50 0.01 0.00 0.00 0.00 0.00 51.96 54.12 2nn1 s ALA 238 Cb -0.48 -3.63 0.12 0.00 0.00 0.00 0.00 23.12 19.14 2nn1 s ALA 238 CO 0.45 -0.91 0.17 0.08 0.00 0.00 0.00 175.76 175.55 2nn1 s VAL 239 N 0.13 1.16 0.46 0.00 1.01 -1.26 -5.02 120.40 116.87 2nn1 s VAL 239 Ca 0.63 -2.04 -0.24 0.00 0.00 0.00 0.00 61.98 60.33 2nn1 s VAL 239 Cb -0.46 -1.84 -0.09 0.00 0.00 0.00 0.00 36.38 33.99 2nn1 s VAL 239 CO 0.45 -0.80 1.20 -2.65 0.00 0.00 0.00 175.10 173.29 2nn1 n PRO 240 N 4.11 1.68 -2.54 2.72 -0.02 -1.26 -0.56 135.00 139.13 2nn1 n PRO 240 Ca 0.04 0.60 -0.43 0.00 -2.02 0.00 0.00 63.50 61.70 2nn1 n PRO 240 Cb 0.38 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 2nn1 n PRO 240 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2nn1 n MET 241 N -0.19 3.19 -0.28 -0.52 2.81 0.70 -4.71 117.12 118.12 2nn1 n MET 241 Ca 0.08 -3.29 -0.06 0.00 -1.81 0.00 0.00 57.70 52.63 2nn1 n MET 241 Cb 0.41 -3.41 0.06 0.00 -0.71 0.00 0.00 33.22 29.56 2nn1 n MET 241 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 2nn1 h GLN 242 N 7.33 1.14 -3.05 0.03 4.20 -1.88 -3.38 115.11 119.51 2nn1 h GLN 242 Ca 0.44 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.93 2nn1 h GLN 242 Cb 0.84 -0.19 -0.12 0.00 0.30 0.00 0.00 27.48 28.32 2nn1 h GLN 242 CO 1.48 0.93 0.17 -3.38 -0.67 0.00 0.00 178.83 177.36 2nn1 s HIS 243 N -5.56 -0.48 -0.08 2.96 -3.43 -1.26 -3.08 115.29 104.36 2nn1 s HIS 243 Ca -0.12 0.25 0.04 0.00 -0.80 0.00 0.00 55.06 54.43 2nn1 s HIS 243 Cb 0.15 0.52 0.11 0.00 -1.43 0.00 0.00 32.58 31.94 2nn1 s HIS 243 CO 0.83 -0.84 1.13 0.27 -2.00 0.00 0.00 174.74 174.13 2nn1 n ASN 244 N -0.36 -1.00 -4.67 7.38 0.23 -0.76 -4.87 115.26 111.21 2nn1 n ASN 244 Ca -0.16 -2.05 -0.35 0.00 -0.53 0.00 0.00 54.58 51.49 2nn1 n ASN 244 Cb 0.65 0.36 -0.09 0.00 -2.08 0.00 0.00 39.78 38.61 2nn1 n ASN 244 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2nn1 s ASN 245 N -1.10 5.51 0.18 0.53 6.03 -1.23 -4.68 114.94 120.17 2nn1 s ASN 245 Ca 0.04 0.14 -0.15 0.00 -1.03 0.00 0.00 52.86 51.86 2nn1 s ASN 245 Cb 0.12 -1.79 -0.07 0.00 -3.03 0.00 0.00 41.25 36.48 2nn1 s ASN 245 CO -0.04 0.28 0.59 -0.60 -2.03 0.00 0.00 177.10 175.30 2nn1 s ARG 246 N -0.27 4.00 0.75 3.55 3.52 -1.26 -5.04 118.95 124.21 2nn1 s ARG 246 Ca 0.07 0.53 -0.13 0.00 -0.13 0.00 0.00 55.73 56.08 2nn1 s ARG 246 Cb -0.12 -2.86 0.05 0.00 -1.56 0.00 0.00 34.95 30.46 2nn1 s ARG 246 CO 0.02 0.43 1.14 -2.14 -0.81 0.00 0.00 175.30 173.94 2nn1 s PRO 247 N -2.12 2.15 0.47 5.12 0.02 -1.26 -4.73 135.00 134.65 2nn1 s PRO 247 Ca 0.41 1.49 -0.23 0.00 0.02 0.00 0.00 61.00 62.69 2nn1 s PRO 247 Cb -0.15 -1.86 -0.07 0.00 0.02 0.00 0.00 34.50 32.44 2nn1 s PRO 247 CO 0.20 -1.77 1.18 0.95 -0.33 0.00 0.00 177.00 177.22 2nn1 s THR 248 N -2.41 3.02 0.31 0.99 -4.23 -1.26 -4.38 115.64 107.69 2nn1 s THR 248 Ca 0.68 0.76 0.08 0.00 -1.18 0.00 0.00 61.69 62.03 2nn1 s THR 248 Cb -0.23 -3.39 -0.04 0.00 1.34 0.00 0.00 72.50 70.19 2nn1 s THR 248 CO 0.49 -0.01 0.15 -1.10 -0.54 0.00 0.00 174.62 173.60 2nn1 s GLN 249 N -2.73 2.52 0.27 3.99 -1.52 0.13 -4.93 119.66 117.39 2nn1 s GLN 249 Ca 0.64 -1.39 -0.30 0.00 -1.95 0.00 0.00 55.36 52.37 2nn1 s GLN 249 Cb -0.29 -2.30 -0.11 0.00 -0.22 0.00 0.00 33.01 30.09 2nn1 s GLN 249 CO 0.36 0.21 1.52 -2.14 -0.25 0.00 0.00 175.29 174.99 2nn1 s PRO 250 N -3.84 4.19 0.47 2.91 0.02 -1.26 -4.51 135.00 132.98 2nn1 s PRO 250 Ca 0.36 2.45 0.20 0.00 0.02 0.00 0.00 61.00 64.03 2nn1 s PRO 250 Cb -0.05 -3.07 1.16 0.00 0.02 0.00 0.00 34.50 32.57 2nn1 s PRO 250 CO 0.23 -0.54 2.00 -0.07 -0.33 0.00 0.00 177.00 178.29 2nn1 h LEU 251 N 5.01 0.00 -1.28 -5.54 3.38 -1.93 -3.44 115.31 111.51 2nn1 h LEU 251 Ca -0.46 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.02 2nn1 h LEU 251 Cb 1.22 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.91 2nn1 h LEU 251 CO 0.79 0.19 -0.80 0.29 0.09 0.00 0.00 178.44 178.99 2nn1 n LYS 252 N -3.94 -4.63 -0.30 1.13 4.76 -1.26 -1.47 118.16 112.44 2nn1 n LYS 252 Ca -0.02 0.53 0.00 0.00 -2.87 0.00 0.00 58.31 55.95 2nn1 n LYS 252 Cb 0.27 -5.22 0.00 0.00 -1.84 0.00 0.00 35.03 28.25 2nn1 n LYS 252 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2nn1 n GLY 253 N -1.66 1.85 3.75 0.72 0.00 -1.26 -5.03 105.19 103.56 2nn1 n GLY 253 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 2nn1 n GLY 253 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nn1 s ARG 254 N -0.20 2.79 -0.15 1.61 0.52 -0.55 -5.02 118.95 117.96 2nn1 s ARG 254 Ca 0.00 1.75 -0.02 0.00 -0.52 0.00 0.00 55.73 56.94 2nn1 s ARG 254 Cb 0.00 -1.91 -0.02 0.00 0.52 0.00 0.00 34.95 33.54 2nn1 s ARG 254 CO 0.00 -1.33 -0.08 0.99 0.02 0.00 0.00 175.30 174.90 2nn1 s THR 255 N -1.77 3.51 -0.25 0.02 2.01 -1.26 -4.98 115.64 112.92 2nn1 s THR 255 Ca 0.75 -0.49 -0.18 0.00 0.31 0.00 0.00 61.69 62.08 2nn1 s THR 255 Cb -0.29 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.68 2nn1 s THR 255 CO 0.36 0.50 0.52 -0.69 -0.69 0.00 0.00 174.62 174.63 2nn1 s VAL 256 N 0.44 5.07 0.13 3.82 1.01 -1.26 -4.67 120.40 124.93 2nn1 s VAL 256 Ca -0.06 0.91 -0.05 0.00 0.00 0.00 0.00 61.98 62.78 2nn1 s VAL 256 Cb -0.15 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 2nn1 s VAL 256 CO 0.04 0.10 0.36 -0.13 0.00 0.00 0.00 175.10 175.46 2nn1 s ARG 257 N 2.22 3.61 -0.03 2.72 0.52 -0.28 -1.16 118.95 126.55 2nn1 s ARG 257 Ca 0.22 -0.10 0.06 0.00 -0.52 0.00 0.00 55.73 55.38 2nn1 s ARG 257 Cb -0.16 -2.88 -0.02 0.00 0.52 0.00 0.00 34.95 32.41 2nn1 s ARG 257 CO 0.09 0.49 -0.20 0.00 0.02 0.00 0.00 175.30 175.70 2nn1 s ALA 258 N -1.62 2.43 -1.82 2.13 0.00 -0.29 -0.88 121.76 121.72 2nn1 s ALA 258 Ca 0.39 -1.06 0.28 0.00 0.00 0.00 0.00 51.96 51.57 2nn1 s ALA 258 Cb -0.12 -0.76 1.00 0.00 0.00 0.00 0.00 23.12 23.24 2nn1 s ALA 258 CO 0.24 0.55 1.72 -1.13 0.00 0.00 0.00 175.76 177.14 2nn1 n SER 259 N 2.30 0.85 0.00 0.00 3.41 -0.14 -2.28 113.62 117.76 2nn1 n SER 259 Ca -0.17 -0.85 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 2nn1 n SER 259 Cb 0.52 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 2nn1 n SER 259 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10