#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nn1 s TRP 5 N 0.00 0.29 0.00 -0.67 1.48 -1.26 -4.95 118.94 113.83 2nn1 s TRP 5 Ca 0.00 -0.70 0.00 0.00 -1.06 0.00 0.00 56.10 54.34 2nn1 s TRP 5 Cb 0.00 -0.20 0.00 0.00 -1.16 0.00 0.00 33.47 32.11 2nn1 s TRP 5 CO 0.00 -0.41 0.00 0.41 -4.06 0.00 0.00 176.95 172.89 2nn1 n GLY 6 N 0.38 2.96 0.00 3.67 0.00 0.19 -5.02 105.19 107.38 2nn1 n GLY 6 Ca -0.17 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.76 117.16 116.08 2nn1 n TYR 7 Ca 0.00 -0.10 -0.17 0.00 -0.16 0.00 0.00 57.90 57.47 2nn1 n TYR 7 Cb 0.00 -0.01 0.11 0.00 -0.31 0.00 0.00 39.34 39.13 2nn1 n TYR 7 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2nn1 n ASP 8 N -0.10 0.17 -0.13 7.72 8.00 -1.26 -4.63 116.55 126.33 2nn1 n ASP 8 Ca 0.00 -1.34 -0.10 0.00 0.71 0.00 0.00 54.79 54.06 2nn1 n ASP 8 Cb 0.07 -0.57 -0.02 0.00 -0.02 0.00 0.00 41.12 40.59 2nn1 n ASP 8 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2nn1 h ASP 9 N -0.93 0.56 0.30 -2.24 3.45 -1.96 0.28 116.42 115.88 2nn1 h ASP 9 Ca -0.24 -0.23 -0.11 0.00 0.43 0.00 0.00 57.03 56.87 2nn1 h ASP 9 Cb 0.70 -0.15 -0.01 0.00 -0.56 0.00 0.00 39.33 39.31 2nn1 h ASP 9 CO 0.18 0.65 -0.45 0.07 -1.57 0.00 0.00 179.24 178.12 2nn1 h LYS 10 N 0.45 0.19 0.00 3.56 2.10 -2.00 -3.33 116.57 117.54 2nn1 h LYS 10 Ca 0.12 -0.10 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 2nn1 h LYS 10 Cb 0.31 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.64 2nn1 h LYS 10 CO 0.00 0.60 -0.18 0.27 -2.00 0.00 0.00 179.45 178.14 2nn1 n ASN 11 N -4.00 1.31 -3.80 7.07 2.04 -1.23 -4.97 115.26 111.68 2nn1 n ASN 11 Ca -0.02 -2.45 -0.30 0.00 -0.44 0.00 0.00 54.58 51.37 2nn1 n ASN 11 Cb 0.50 -0.28 0.23 0.00 -2.53 0.00 0.00 39.78 37.70 2nn1 n ASN 11 CO 0.00 0.00 0.00 -0.83 -0.44 0.00 0.00 177.26 175.99 2nn1 s GLY 12 N -1.83 1.71 0.38 4.83 0.00 0.98 -0.63 107.32 112.76 2nn1 s GLY 12 Ca 0.15 -1.21 0.19 0.00 0.00 0.00 0.00 44.72 43.86 2nn1 s GLY 12 CO 0.01 -0.32 1.68 -2.55 0.00 0.00 0.00 173.10 171.92 2nn1 h PRO 13 N -2.22 0.28 0.00 2.90 0.11 -1.82 -1.09 132.00 130.16 2nn1 h PRO 13 Ca -0.43 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 2nn1 h PRO 13 Cb 1.25 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2nn1 h PRO 13 CO 0.30 0.19 -0.04 0.93 -0.21 0.00 0.00 178.00 179.16 2nn1 h GLU 14 N 0.29 0.00 0.00 1.05 4.39 -1.92 -2.99 114.58 115.39 2nn1 h GLU 14 Ca 0.72 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.42 2nn1 h GLU 14 Cb 1.85 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.50 2nn1 h GLU 14 CO -0.49 0.04 -0.02 0.00 -1.16 0.00 0.00 179.01 177.38 2nn1 n GLN 15 N -3.56 2.00 0.25 2.33 -0.00 -0.43 -4.69 117.38 113.29 2nn1 n GLN 15 Ca -0.02 -1.86 0.07 0.00 -0.00 0.00 0.00 57.00 55.19 2nn1 n GLN 15 Cb 0.15 -1.15 0.61 0.00 -0.00 0.00 0.00 30.24 29.85 2nn1 n GLN 15 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.06 175.57 2nn1 h TRP 16 N 0.00 0.00 -0.02 2.61 6.55 -1.36 -2.35 115.95 121.38 2nn1 h TRP 16 Ca 0.00 0.00 0.01 0.00 0.95 0.00 0.00 58.89 59.85 2nn1 h TRP 16 Cb 0.77 -0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.07 2nn1 h TRP 16 CO 0.00 0.04 0.07 0.66 -1.05 0.00 0.00 178.44 178.16 2nn1 h SER 17 N 0.00 0.00 -0.27 -3.49 4.64 -1.81 0.17 113.55 112.80 2nn1 h SER 17 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2nn1 h SER 17 Cb 0.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2nn1 h SER 17 CO 0.00 0.00 0.13 0.11 -0.87 0.00 0.00 176.83 176.21 2nn1 h LYS 18 N 0.00 0.38 0.00 4.77 1.57 -1.79 -2.73 116.57 118.77 2nn1 h LYS 18 Ca 0.01 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 2nn1 h LYS 18 Cb 0.15 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 2nn1 h LYS 18 CO -0.00 0.37 -1.70 1.28 -0.57 0.00 0.00 179.45 178.83 2nn1 n LEU 19 N -4.81 0.40 -3.64 2.94 4.77 -0.96 -4.68 117.00 111.02 2nn1 n LEU 19 Ca -0.02 0.17 -0.28 0.00 -0.03 0.00 0.00 56.01 55.84 2nn1 n LEU 19 Cb 0.10 0.09 -0.11 0.00 -2.33 0.00 0.00 43.42 41.16 2nn1 n LEU 19 CO 0.35 0.08 -0.20 -0.31 -1.33 0.00 0.00 177.39 175.98 2nn1 s TYR 20 N -3.17 2.15 0.55 -1.77 1.51 0.55 -4.99 117.35 112.19 2nn1 s TYR 20 Ca -0.05 -2.69 0.35 0.00 -1.01 0.00 0.00 57.07 53.66 2nn1 s TYR 20 Cb 0.10 -1.76 1.52 0.00 -0.11 0.00 0.00 41.96 41.72 2nn1 s TYR 20 CO 0.85 -0.72 1.81 -1.35 -1.11 0.00 0.00 175.55 175.03 2nn1 h PRO 21 N 5.81 0.00 0.00 -1.71 0.11 -1.71 -0.13 132.00 134.37 2nn1 h PRO 21 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2nn1 h PRO 21 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2nn1 h PRO 21 CO 0.52 0.00 0.00 1.51 -0.21 0.00 0.00 178.00 179.82 2nn1 n ILE 22 N -4.12 1.11 0.21 4.15 0.13 -1.26 -2.22 119.36 117.35 2nn1 n ILE 22 Ca 0.23 0.57 0.17 0.00 -1.10 0.00 0.00 62.75 62.62 2nn1 n ILE 22 Cb 1.17 -1.55 0.83 0.00 -0.84 0.00 0.00 39.64 39.25 2nn1 n ILE 22 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2nn1 h ALA 23 N 2.08 1.80 -0.55 1.51 0.00 -1.35 0.22 119.26 122.97 2nn1 h ALA 23 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2nn1 h ALA 23 Cb 0.09 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2nn1 h ALA 23 CO 0.00 -0.28 0.02 0.09 0.00 0.00 0.00 179.25 179.08 2nn1 n ASN 24 N -3.82 5.50 -3.54 0.00 5.03 -0.94 -4.95 115.26 112.54 2nn1 n ASN 24 Ca 0.01 -2.97 -0.29 0.00 0.87 0.00 0.00 54.58 52.20 2nn1 n ASN 24 Cb 0.31 -0.68 0.25 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 0.44 -2.77 0.45 7.41 0.00 0.78 -4.99 105.19 106.51 2nn1 n GLY 25 Ca 0.28 -1.49 0.13 0.00 0.00 0.00 0.00 46.02 44.94 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 -4.85 1.61 -2.52 1.61 3.02 -1.26 -4.26 115.26 108.60 2nn1 n ASN 26 Ca 0.15 -1.31 -0.12 0.00 -0.03 0.00 0.00 54.58 53.26 2nn1 n ASN 26 Cb 0.58 0.16 0.03 0.00 -0.61 0.00 0.00 39.78 39.95 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 -0.07 2.93 -4.84 6.41 3.02 -1.26 -4.71 115.26 116.74 2nn1 n ASN 27 Ca 0.13 -2.88 -0.33 0.00 -0.03 0.00 0.00 54.58 51.48 2nn1 n ASN 27 Cb 0.41 -0.45 -0.06 0.00 -0.61 0.00 0.00 39.78 39.07 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 -3.58 4.07 0.20 3.52 -1.52 -1.26 -2.31 119.66 118.77 2nn1 s GLN 28 Ca 0.37 0.78 0.08 0.00 -1.95 0.00 0.00 55.36 54.63 2nn1 s GLN 28 Cb 0.38 -2.40 -0.05 0.00 -0.22 0.00 0.00 33.01 30.72 2nn1 s GLN 28 CO -0.02 0.13 -0.16 -1.12 -0.25 0.00 0.00 175.29 173.87 2nn1 s SER 29 N -2.22 2.66 0.99 5.90 0.01 -1.26 -4.67 113.70 115.11 2nn1 s SER 29 Ca 0.55 -0.98 -0.16 0.00 1.31 0.00 0.00 55.95 56.67 2nn1 s SER 29 Cb -0.10 -0.15 0.22 0.00 0.21 0.00 0.00 66.02 66.20 2nn1 s SER 29 CO 0.17 -0.12 1.31 -0.81 0.41 0.00 0.00 173.24 174.19 2nn1 n PRO 30 N -0.23 -1.26 -4.15 12.44 -0.04 -1.26 -4.50 135.00 136.00 2nn1 n PRO 30 Ca -0.09 -2.05 -0.10 0.00 -0.04 0.00 0.00 63.50 61.22 2nn1 n PRO 30 Cb 0.60 -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 -3.86 0.16 0.07 0.52 -7.23 -1.26 0.29 120.40 109.08 2nn1 s VAL 31 Ca 0.75 -1.90 -0.18 0.00 -1.81 0.00 0.00 61.98 58.83 2nn1 s VAL 31 Cb -0.02 -1.97 -0.07 0.00 0.56 0.00 0.00 36.38 34.89 2nn1 s VAL 31 CO 0.52 -0.55 0.55 -0.62 -0.31 0.00 0.00 175.10 174.69 2nn1 s ASP 32 N -3.04 7.02 -0.40 4.85 2.15 -1.26 -3.05 116.67 122.94 2nn1 s ASP 32 Ca 0.21 1.22 -0.12 0.00 0.43 0.00 0.00 52.55 54.29 2nn1 s ASP 32 Cb 0.07 -2.34 0.04 0.00 -0.30 0.00 0.00 42.92 40.39 2nn1 s ASP 32 CO 0.00 0.27 0.26 -0.63 -0.17 0.00 0.00 175.17 174.90 2nn1 s ILE 33 N -1.13 4.71 -0.56 4.11 1.01 0.10 -4.94 121.20 124.51 2nn1 s ILE 33 Ca 0.29 -0.95 -0.22 0.00 0.00 0.00 0.00 60.65 59.76 2nn1 s ILE 33 Cb -0.19 -3.70 0.05 0.00 0.01 0.00 0.00 42.46 38.64 2nn1 s ILE 33 CO 0.18 -0.34 0.84 -0.54 0.00 0.00 0.00 174.94 175.08 2nn1 s LYS 34 N 1.56 3.22 0.39 2.79 -0.14 -1.26 -0.13 119.74 126.17 2nn1 s LYS 34 Ca 0.03 -0.58 0.12 0.00 -1.36 0.00 0.00 55.97 54.17 2nn1 s LYS 34 Cb -0.20 -4.10 0.92 0.00 -1.68 0.00 0.00 37.83 32.76 2nn1 s LYS 34 CO 0.06 -1.46 1.90 1.79 -0.76 0.00 0.00 175.35 176.88 2nn1 h THR 35 N 5.96 0.83 0.00 2.17 1.35 -1.95 0.35 112.91 121.63 2nn1 h THR 35 Ca -0.27 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 2nn1 h THR 35 Cb 1.08 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.72 2nn1 h THR 35 CO 1.07 0.10 0.00 0.77 -0.25 0.00 0.00 175.52 177.21 2nn1 h SER 36 N 0.57 0.00 -0.01 5.36 4.64 -2.03 -2.87 113.55 119.21 2nn1 h SER 36 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 2nn1 h SER 36 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 2nn1 h SER 36 CO -0.15 0.00 -0.24 -0.62 -0.87 0.00 0.00 176.83 174.95 2nn1 n GLU 37 N -2.59 1.59 -2.23 4.77 -0.58 0.09 -5.00 120.64 116.69 2nn1 n GLU 37 Ca 0.01 -1.00 -0.34 0.00 -0.42 0.00 0.00 57.16 55.41 2nn1 n GLU 37 Cb 0.21 -1.28 -0.00 0.00 -0.57 0.00 0.00 31.44 29.79 2nn1 n GLU 37 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2nn1 s THR 38 N -1.74 3.60 -0.11 2.62 -4.23 -1.07 -4.72 115.64 109.99 2nn1 s THR 38 Ca 0.15 0.89 0.03 0.00 -1.18 0.00 0.00 61.69 61.57 2nn1 s THR 38 Cb 0.13 -3.35 -0.00 0.00 1.34 0.00 0.00 72.50 70.61 2nn1 s THR 38 CO 0.35 -0.32 -0.20 -0.54 -0.54 0.00 0.00 174.62 173.36 2nn1 s LYS 39 N -3.61 3.15 -0.09 3.99 -0.14 -0.62 -4.91 119.74 117.51 2nn1 s LYS 39 Ca 0.67 -0.82 -0.30 0.00 -1.36 0.00 0.00 55.97 54.17 2nn1 s LYS 39 Cb -0.18 -2.41 -0.02 0.00 -1.68 0.00 0.00 37.83 33.53 2nn1 s LYS 39 CO 0.29 0.17 1.08 -1.58 -0.76 0.00 0.00 175.35 174.55 2nn1 s HIS 40 N 0.39 3.39 -0.26 3.18 5.65 -1.26 -0.99 115.29 125.39 2nn1 s HIS 40 Ca -0.16 1.45 -0.04 0.00 0.25 0.00 0.00 55.06 56.56 2nn1 s HIS 40 Cb -0.17 -3.28 0.01 0.00 -1.18 0.00 0.00 32.58 27.96 2nn1 s HIS 40 CO 0.07 -0.63 0.01 0.34 -0.65 0.00 0.00 174.74 173.88 2nn1 s ASP 41 N 1.24 4.70 0.29 9.88 -1.08 -1.09 -4.93 116.67 125.67 2nn1 s ASP 41 Ca 0.51 -0.71 0.24 0.00 -0.52 0.00 0.00 52.55 52.08 2nn1 s ASP 41 Cb -0.21 -1.78 1.04 0.00 -1.46 0.00 0.00 42.92 40.51 2nn1 s ASP 41 CO 0.19 -0.14 1.73 0.71 0.52 0.00 0.00 175.17 178.18 2nn1 h THR 42 N 5.93 0.00 -0.00 1.71 1.35 -1.95 -2.62 112.91 117.33 2nn1 h THR 42 Ca -0.34 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2nn1 h THR 42 Cb 1.13 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 2nn1 h THR 42 CO 0.59 0.00 -0.04 -1.54 -0.25 0.00 0.00 175.52 174.28 2nn1 n SER 43 N -2.30 0.35 -4.60 5.36 3.41 -1.26 -4.77 113.62 109.81 2nn1 n SER 43 Ca 0.02 -0.72 -0.43 0.00 -0.26 0.00 0.00 58.87 57.48 2nn1 n SER 43 Cb 0.21 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.05 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 -2.30 3.84 0.63 1.04 1.43 -0.99 -4.85 118.68 117.48 2nn1 s LEU 44 Ca 0.36 0.47 -0.09 0.00 -1.03 0.00 0.00 54.13 53.83 2nn1 s LEU 44 Cb 0.21 -3.40 -0.01 0.00 0.03 0.00 0.00 46.19 43.02 2nn1 s LEU 44 CO 0.43 -1.07 1.00 -0.54 0.23 0.00 0.00 176.35 176.39 2nn1 s LYS 45 N 3.97 3.20 0.64 1.70 1.02 -0.91 -4.88 119.74 124.48 2nn1 s LYS 45 Ca 0.43 0.43 -0.18 0.00 0.02 0.00 0.00 55.97 56.67 2nn1 s LYS 45 Cb -0.09 -2.14 -0.01 0.00 -0.52 0.00 0.00 37.83 35.07 2nn1 s LYS 45 CO 0.26 -0.71 1.22 -2.14 -0.92 0.00 0.00 175.35 173.06 2nn1 s PRO 46 N -5.15 2.68 0.18 -1.68 0.02 -1.26 -1.10 135.00 128.69 2nn1 s PRO 46 Ca 0.55 1.85 -0.30 0.00 0.02 0.00 0.00 61.00 63.12 2nn1 s PRO 46 Cb -0.11 -1.89 -0.08 0.00 0.02 0.00 0.00 34.50 32.45 2nn1 s PRO 46 CO 0.50 -1.44 1.02 0.42 -0.33 0.00 0.00 177.00 177.17 2nn1 s ILE 47 N -1.66 4.07 -0.18 2.83 -1.09 -1.26 -2.20 121.20 121.70 2nn1 s ILE 47 Ca 0.78 1.87 0.01 0.00 -2.23 0.00 0.00 60.65 61.07 2nn1 s ILE 47 Cb -0.31 -4.19 0.04 0.00 -1.58 0.00 0.00 42.46 36.41 2nn1 s ILE 47 CO 0.38 0.36 -0.10 -0.55 -1.23 0.00 0.00 174.94 173.79 2nn1 s SER 48 N -0.44 3.18 -0.19 3.58 0.15 0.34 -4.94 113.70 115.38 2nn1 s SER 48 Ca 0.46 -0.78 -0.01 0.00 0.70 0.00 0.00 55.95 56.32 2nn1 s SER 48 Cb -0.27 -1.18 0.01 0.00 -1.71 0.00 0.00 66.02 62.87 2nn1 s SER 48 CO 0.33 -0.13 -0.14 0.68 1.20 0.00 0.00 173.24 175.18 2nn1 s VAL 49 N 1.44 2.56 -0.45 4.45 -7.23 -1.26 -1.18 120.40 118.73 2nn1 s VAL 49 Ca 0.00 -0.77 0.02 0.00 -1.81 0.00 0.00 61.98 59.42 2nn1 s VAL 49 Cb -0.15 -2.11 0.14 0.00 0.56 0.00 0.00 36.38 34.81 2nn1 s VAL 49 CO -0.09 0.50 0.25 -0.94 -0.31 0.00 0.00 175.10 174.51 2nn1 s SER 50 N 1.28 3.68 0.07 4.85 1.04 -0.92 -5.05 113.70 118.64 2nn1 s SER 50 Ca 0.04 -2.70 -0.04 0.00 0.48 0.00 0.00 55.95 53.73 2nn1 s SER 50 Cb -0.14 -1.08 -0.05 0.00 0.10 0.00 0.00 66.02 64.85 2nn1 s SER 50 CO -0.08 -0.26 0.28 -0.31 0.98 0.00 0.00 173.24 173.86 2nn1 s TYR 51 N 0.25 3.52 -0.34 5.02 2.02 -1.26 -2.38 117.35 124.18 2nn1 s TYR 51 Ca 0.18 0.46 -0.11 0.00 -0.37 0.00 0.00 57.07 57.23 2nn1 s TYR 51 Cb -0.23 -1.92 -0.00 0.00 -0.40 0.00 0.00 41.96 39.41 2nn1 s TYR 51 CO -0.01 0.55 0.21 1.21 -1.57 0.00 0.00 175.55 175.94 2nn1 s ASN 52 N -2.20 5.81 0.59 2.29 3.84 -1.25 -4.96 114.94 119.06 2nn1 s ASN 52 Ca 0.34 -0.60 0.27 0.00 0.21 0.00 0.00 52.86 53.08 2nn1 s ASN 52 Cb -0.13 -2.07 1.48 0.00 -0.55 0.00 0.00 41.25 39.98 2nn1 s ASN 52 CO 0.23 -0.26 1.81 1.55 -2.79 0.00 0.00 177.10 177.63 2nn1 h PRO 53 N 8.44 0.00 0.00 0.43 0.13 -1.96 -0.47 132.00 138.57 2nn1 h PRO 53 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2nn1 h PRO 53 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2nn1 h PRO 53 CO 0.64 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.41 2nn1 n ALA 54 N -1.83 2.28 0.82 -0.56 0.00 -1.26 -1.70 120.51 118.27 2nn1 n ALA 54 Ca -0.02 -0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.44 2nn1 n ALA 54 Cb 0.34 -1.43 0.34 0.00 0.00 0.00 0.00 19.45 18.70 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 -1.38 0.19 -1.73 0.00 -2.24 -0.18 -4.83 114.28 104.09 2nn1 n THR 55 Ca 0.10 -0.12 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 2nn1 n THR 55 Cb 0.26 -0.16 -0.02 0.00 -2.10 0.00 0.00 70.33 68.30 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 -1.63 2.53 0.06 6.98 0.00 -1.18 -0.06 120.51 127.21 2nn1 n ALA 56 Ca 0.05 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2nn1 n ALA 56 Cb 0.38 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.36 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 2.58 0.00 -3.81 0.00 4.81 -0.40 -4.42 118.16 116.92 2nn1 n LYS 57 Ca 0.11 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.42 2nn1 n LYS 57 Cb 0.36 -0.28 -0.10 0.00 0.02 0.00 0.00 35.03 35.03 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 -1.79 0.50 -0.09 1.64 2.12 -0.90 -0.92 118.70 119.25 2nn1 s GLU 58 Ca 0.00 -0.13 -0.00 0.00 0.36 0.00 0.00 54.97 55.20 2nn1 s GLU 58 Cb 0.00 0.22 -0.03 0.00 0.26 0.00 0.00 34.13 34.58 2nn1 s GLU 58 CO 0.00 -0.12 -0.06 -1.50 -0.54 0.00 0.00 175.26 173.04 2nn1 s ILE 59 N -0.96 3.73 -0.03 -3.70 2.07 -0.02 -0.11 121.20 122.17 2nn1 s ILE 59 Ca -0.10 -0.45 -0.04 0.00 -1.41 0.00 0.00 60.65 58.65 2nn1 s ILE 59 Cb -0.05 -2.55 0.01 0.00 0.13 0.00 0.00 42.46 39.99 2nn1 s ILE 59 CO 0.02 0.57 0.10 -0.51 -1.91 0.00 0.00 174.94 173.21 2nn1 s ILE 60 N -0.47 0.01 -0.35 2.00 2.07 0.10 -0.90 121.20 123.66 2nn1 s ILE 60 Ca 0.07 -0.05 -0.23 0.00 -1.41 0.00 0.00 60.65 59.03 2nn1 s ILE 60 Cb -0.12 -0.16 0.01 0.00 0.13 0.00 0.00 42.46 42.31 2nn1 s ILE 60 CO 0.02 -0.03 0.76 0.21 -1.91 0.00 0.00 174.94 173.99 2nn1 s ASN 61 N -0.04 6.55 -0.29 4.50 3.84 -0.29 -0.75 114.94 128.46 2nn1 s ASN 61 Ca -0.01 0.38 0.11 0.00 0.21 0.00 0.00 52.86 53.55 2nn1 s ASN 61 Cb -0.01 -2.39 0.72 0.00 -0.55 0.00 0.00 41.25 39.02 2nn1 s ASN 61 CO 0.00 -0.68 1.73 1.33 -2.79 0.00 0.00 177.10 176.69 2nn1 n VAL 62 N 5.70 2.82 0.00 -5.21 0.24 -0.12 -1.03 118.33 120.73 2nn1 n VAL 62 Ca 0.02 -1.71 0.00 0.00 -2.04 0.00 0.00 64.34 60.61 2nn1 n VAL 62 Cb 0.48 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.52 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 -0.14 1.79 0.01 7.63 0.00 -1.26 -4.41 105.19 108.81 2nn1 n GLY 63 Ca 0.36 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.33 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 0.04 -3.15 1.61 1.44 -1.26 -4.13 115.22 109.77 2nn1 n HIS 64 Ca 0.00 0.01 0.00 0.00 -2.01 0.00 0.00 57.72 55.72 2nn1 n HIS 64 Cb 0.00 -0.15 0.00 0.00 0.12 0.00 0.00 29.99 29.96 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 -1.61 0.00 -4.01 4.39 2.88 -1.26 -4.74 113.62 109.26 2nn1 n SER 65 Ca 0.04 -0.69 -0.13 0.00 -1.33 0.00 0.00 58.87 56.75 2nn1 n SER 65 Cb 0.36 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.70 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 -4.81 0.51 0.08 0.66 -0.12 -1.26 -0.94 117.98 112.10 2nn1 s PHE 66 Ca 0.00 -0.39 0.08 0.00 -0.05 0.00 0.00 56.93 56.56 2nn1 s PHE 66 Cb 0.00 -0.32 -0.03 0.00 -0.63 0.00 0.00 43.02 42.04 2nn1 s PHE 66 CO 0.00 -0.08 -0.20 -1.01 -0.05 0.00 0.00 175.22 173.87 2nn1 s HIS 67 N -1.06 1.76 -0.29 3.49 3.76 0.07 -4.43 115.29 118.58 2nn1 s HIS 67 Ca -0.08 -0.41 -0.01 0.00 -0.15 0.00 0.00 55.06 54.41 2nn1 s HIS 67 Cb -0.08 -0.99 0.05 0.00 1.11 0.00 0.00 32.58 32.67 2nn1 s HIS 67 CO 0.00 0.17 -0.02 0.08 -0.85 0.00 0.00 174.74 174.12 2nn1 s VAL 68 N -1.06 2.87 0.09 -0.90 1.01 -0.70 -0.72 120.40 120.99 2nn1 s VAL 68 Ca 0.06 -1.39 -0.01 0.00 0.00 0.00 0.00 61.98 60.64 2nn1 s VAL 68 Cb -0.10 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 2nn1 s VAL 68 CO 0.03 -0.07 0.26 0.20 0.00 0.00 0.00 175.10 175.53 2nn1 s ASN 69 N 1.24 6.39 0.19 3.32 0.01 0.84 -1.79 114.94 125.14 2nn1 s ASN 69 Ca -0.05 0.35 0.11 0.00 -0.71 0.00 0.00 52.86 52.56 2nn1 s ASN 69 Cb -0.20 -1.99 -0.04 0.00 0.41 0.00 0.00 41.25 39.43 2nn1 s ASN 69 CO -0.02 0.13 -0.23 -0.36 -1.51 0.00 0.00 177.10 175.11 2nn1 s PHE 70 N -1.57 2.23 0.10 2.20 0.40 -0.63 -1.27 117.98 119.44 2nn1 s PHE 70 Ca 0.37 -0.37 -0.31 0.00 -0.60 0.00 0.00 56.93 56.01 2nn1 s PHE 70 Cb -0.13 -1.10 -0.08 0.00 0.51 0.00 0.00 43.02 42.23 2nn1 s PHE 70 CO 0.27 0.48 1.44 -1.21 0.70 0.00 0.00 175.22 176.91 2nn1 s GLU 71 N -2.71 4.29 -0.28 0.44 2.02 0.91 -4.79 118.70 118.58 2nn1 s GLU 71 Ca 0.20 2.12 0.12 0.00 0.02 0.00 0.00 54.97 57.44 2nn1 s GLU 71 Cb -0.08 -3.33 0.48 0.00 0.10 0.00 0.00 34.13 31.31 2nn1 s GLU 71 CO 0.09 -0.51 1.16 -0.40 0.02 0.00 0.00 175.26 175.62 2nn1 n ASP 72 N 4.36 3.80 0.08 -0.19 5.75 -1.26 -4.76 116.55 124.33 2nn1 n ASP 72 Ca 0.13 -3.17 0.12 0.00 -0.01 0.00 0.00 54.79 51.86 2nn1 n ASP 72 Cb 0.42 -0.39 0.17 0.00 -1.03 0.00 0.00 41.12 40.29 2nn1 n ASP 72 CO 0.00 0.00 0.00 -1.13 -0.11 0.00 0.00 177.20 175.96 2nn1 h ASN 73 N 2.32 0.00 -5.76 -1.12 -0.73 -1.95 -3.48 115.58 104.86 2nn1 h ASN 73 Ca 0.20 -0.15 -0.39 0.00 1.87 0.00 0.00 56.30 57.83 2nn1 h ASN 73 Cb 1.45 0.00 -0.12 0.00 0.27 0.00 0.00 38.32 39.92 2nn1 h ASN 73 CO 0.56 0.08 -0.42 1.51 -0.37 0.00 0.00 177.43 178.79 2nn1 s ASP 74 N -4.53 1.31 -0.48 1.15 1.47 -1.26 -5.07 116.67 109.25 2nn1 s ASP 74 Ca 0.06 -1.64 -0.01 0.00 1.18 0.00 0.00 52.55 52.13 2nn1 s ASP 74 Cb 0.12 0.57 0.32 0.00 -0.34 0.00 0.00 42.92 43.60 2nn1 s ASP 74 CO 0.72 -1.11 2.03 0.59 0.68 0.00 0.00 175.17 178.08 2nn1 n ASN 75 N -1.38 7.06 0.11 2.11 3.02 -1.26 -4.54 115.26 120.38 2nn1 n ASN 75 Ca 0.05 -3.40 -0.01 0.00 -0.03 0.00 0.00 54.58 51.19 2nn1 n ASN 75 Cb 0.62 -1.02 0.27 0.00 -0.61 0.00 0.00 39.78 39.04 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 0.20 -4.86 3.52 3.08 -1.94 -3.40 114.38 112.71 2nn1 h ARG 76 Ca 0.44 -0.08 -0.66 0.00 0.07 0.00 0.00 59.98 59.75 2nn1 h ARG 76 Cb 0.86 -0.01 -0.36 0.00 0.08 0.00 0.00 29.97 30.54 2nn1 h ARG 76 CO 1.15 0.54 -0.82 -1.12 -1.07 0.00 0.00 179.97 178.65 2nn1 s SER 77 N -6.88 3.72 0.05 7.04 0.01 -1.26 -3.83 113.70 112.54 2nn1 s SER 77 Ca -0.04 -1.01 -0.03 0.00 1.31 0.00 0.00 55.95 56.18 2nn1 s SER 77 Cb 0.14 -1.44 -0.03 0.00 0.21 0.00 0.00 66.02 64.90 2nn1 s SER 77 CO 0.76 -0.11 0.03 0.68 0.41 0.00 0.00 173.24 175.00 2nn1 s VAL 78 N 1.24 0.19 -0.08 3.43 -7.23 -1.00 -1.87 120.40 115.08 2nn1 s VAL 78 Ca -0.02 -1.56 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 2nn1 s VAL 78 Cb -0.17 -1.34 -0.02 0.00 0.56 0.00 0.00 36.38 35.41 2nn1 s VAL 78 CO -0.09 -0.86 -0.11 -0.22 -0.31 0.00 0.00 175.10 173.52 2nn1 s LEU 79 N -2.73 2.91 0.23 1.32 2.96 0.61 -2.17 118.68 121.80 2nn1 s LEU 79 Ca 0.04 -0.17 -0.08 0.00 -0.22 0.00 0.00 54.13 53.70 2nn1 s LEU 79 Cb 0.05 -1.63 -0.02 0.00 0.50 0.00 0.00 46.19 45.10 2nn1 s LEU 79 CO -0.09 0.29 0.35 -1.59 -1.32 0.00 0.00 176.35 173.99 2nn1 s LYS 80 N -0.40 1.40 1.20 1.98 -2.85 -0.33 -0.43 119.74 120.32 2nn1 s LYS 80 Ca 0.05 -1.38 0.00 0.00 -1.00 0.00 0.00 55.97 53.64 2nn1 s LYS 80 Cb -0.12 0.40 0.00 0.00 -2.06 0.00 0.00 37.83 36.04 2nn1 s LYS 80 CO 0.02 -0.54 0.00 0.41 0.10 0.00 0.00 175.35 175.34 2nn1 n GLY 81 N -0.33 -1.19 7.00 0.59 0.00 -1.26 -0.50 105.19 109.49 2nn1 n GLY 81 Ca -0.01 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.43 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 3.36 0.45 -0.02 0.00 -0.26 -1.23 105.19 107.49 2nn1 n GLY 82 Ca 0.00 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.05 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 1.60 -3.65 1.61 -0.04 -1.26 -2.13 135.00 145.14 2nn1 n PRO 83 Ca 0.00 -0.90 -0.33 0.00 -0.04 0.00 0.00 63.50 62.23 2nn1 n PRO 83 Cb 0.00 -1.39 -0.05 0.00 -0.04 0.00 0.00 33.50 32.02 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 -1.85 3.52 -0.24 0.54 0.08 -0.36 -4.98 117.98 114.69 2nn1 s PHE 84 Ca 0.33 0.64 0.16 0.00 0.12 0.00 0.00 56.93 58.18 2nn1 s PHE 84 Cb 0.17 -2.06 -0.23 0.00 -0.57 0.00 0.00 43.02 40.33 2nn1 s PHE 84 CO 0.26 0.48 0.45 -1.13 -0.10 0.00 0.00 175.22 175.19 2nn1 n SER 85 N 0.49 1.12 -4.41 1.36 3.41 -1.26 -4.28 113.62 110.05 2nn1 n SER 85 Ca -0.05 -0.26 -0.20 0.00 -0.26 0.00 0.00 58.87 58.09 2nn1 n SER 85 Cb 0.52 1.52 -0.10 0.00 -0.26 0.00 0.00 64.21 65.89 2nn1 n SER 85 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2nn1 s ASP 86 N -3.46 2.52 0.37 4.04 -4.77 -1.26 -5.01 116.67 109.10 2nn1 s ASP 86 Ca -0.02 -1.21 -0.20 0.00 -3.30 0.00 0.00 52.55 47.81 2nn1 s ASP 86 Cb 0.11 -0.12 -0.10 0.00 -1.09 0.00 0.00 42.92 41.72 2nn1 s ASP 86 CO 0.67 -0.41 0.88 -0.44 0.70 0.00 0.00 175.17 176.57 2nn1 s SER 87 N -3.42 6.96 -0.06 2.11 0.01 -1.26 -4.75 113.70 113.30 2nn1 s SER 87 Ca 0.30 1.58 0.04 0.00 1.31 0.00 0.00 55.95 59.18 2nn1 s SER 87 Cb 0.05 -2.49 -0.02 0.00 0.21 0.00 0.00 66.02 63.76 2nn1 s SER 87 CO 0.11 -0.25 -0.18 -0.31 0.41 0.00 0.00 173.24 173.03 2nn1 s TYR 88 N -2.00 2.61 -0.14 2.43 1.51 0.43 -4.05 117.35 118.13 2nn1 s TYR 88 Ca 0.57 -0.36 -0.21 0.00 -1.01 0.00 0.00 57.07 56.06 2nn1 s TYR 88 Cb -0.11 -1.63 -0.03 0.00 -0.11 0.00 0.00 41.96 40.07 2nn1 s TYR 88 CO 0.16 0.03 0.60 0.50 -1.11 0.00 0.00 175.55 175.73 2nn1 s ARG 89 N -0.47 4.30 0.24 -0.62 3.52 0.75 -0.29 118.95 126.39 2nn1 s ARG 89 Ca 0.06 0.63 -0.30 0.00 -0.13 0.00 0.00 55.73 55.98 2nn1 s ARG 89 Cb -0.12 -3.51 -0.10 0.00 -1.56 0.00 0.00 34.95 29.67 2nn1 s ARG 89 CO 0.01 -0.06 1.43 -1.17 -0.81 0.00 0.00 175.30 174.71 2nn1 s LEU 90 N 1.29 4.39 0.00 -0.88 2.96 -0.78 -0.55 118.68 125.11 2nn1 s LEU 90 Ca 0.30 2.64 0.00 0.00 -0.22 0.00 0.00 54.13 56.85 2nn1 s LEU 90 Cb -0.16 -3.62 0.00 0.00 0.50 0.00 0.00 46.19 42.91 2nn1 s LEU 90 CO 0.12 -0.69 0.00 2.22 -1.32 0.00 0.00 176.35 176.68 2nn1 n PHE 91 N 2.39 0.00 -3.60 5.38 -1.74 -0.66 -4.63 117.46 114.60 2nn1 n PHE 91 Ca 0.07 0.00 -0.04 0.00 -0.56 0.00 0.00 57.45 56.91 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 -0.23 0.30 -0.02 3.97 0.74 -1.19 -1.60 119.66 121.63 2nn1 s GLN 92 Ca 0.00 -0.11 -0.11 0.00 0.05 0.00 0.00 55.36 55.19 2nn1 s GLN 92 Cb 0.00 0.14 0.02 0.00 1.10 0.00 0.00 33.01 34.26 2nn1 s GLN 92 CO 0.00 -0.13 0.24 -0.59 -0.55 0.00 0.00 175.29 174.25 2nn1 s PHE 93 N -2.41 -0.11 0.39 1.67 -0.12 -0.74 -0.31 117.98 116.35 2nn1 s PHE 93 Ca 0.09 0.18 -0.14 0.00 -0.05 0.00 0.00 56.93 57.02 2nn1 s PHE 93 Cb -0.01 0.04 0.06 0.00 -0.63 0.00 0.00 43.02 42.48 2nn1 s PHE 93 CO -0.05 -0.31 0.77 -2.39 -0.05 0.00 0.00 175.22 173.19 2nn1 n HIS 94 N 1.61 -2.32 -4.43 3.49 1.44 -0.24 -1.71 115.22 113.05 2nn1 n HIS 94 Ca -0.21 -1.87 -0.21 0.00 -2.01 0.00 0.00 57.72 53.42 2nn1 n HIS 94 Cb 0.56 0.90 -0.11 0.00 0.12 0.00 0.00 29.99 31.47 2nn1 n HIS 94 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2nn1 s PHE 95 N -2.26 1.91 -0.01 -1.40 0.40 -1.26 -0.70 117.98 114.67 2nn1 s PHE 95 Ca 0.16 -0.95 0.02 0.00 -0.60 0.00 0.00 56.93 55.57 2nn1 s PHE 95 Cb -0.05 -1.22 -0.00 0.00 0.51 0.00 0.00 43.02 42.26 2nn1 s PHE 95 CO 0.12 0.01 -0.07 -1.01 0.70 0.00 0.00 175.22 174.97 2nn1 s HIS 96 N -3.31 0.61 0.23 0.36 3.76 -0.19 -4.85 115.29 111.90 2nn1 s HIS 96 Ca 0.35 -0.12 -0.08 0.00 -0.15 0.00 0.00 55.06 55.07 2nn1 s HIS 96 Cb 0.08 -0.40 -0.02 0.00 1.11 0.00 0.00 32.58 33.35 2nn1 s HIS 96 CO 0.15 -0.01 0.32 1.67 -0.85 0.00 0.00 174.74 176.01 2nn1 s TRP 97 N -0.13 0.72 0.52 1.40 -2.14 -1.19 -1.18 118.94 116.94 2nn1 s TRP 97 Ca 0.02 -1.02 0.01 0.00 2.66 0.00 0.00 56.10 57.78 2nn1 s TRP 97 Cb -0.03 -0.14 0.00 0.00 -3.10 0.00 0.00 33.47 30.20 2nn1 s TRP 97 CO -0.00 -0.84 0.06 0.20 -2.66 0.00 0.00 176.95 173.71 2nn1 s GLY 98 N -3.08 2.97 0.38 3.67 0.00 -1.20 -1.24 107.32 108.82 2nn1 s GLY 98 Ca 0.30 -0.36 0.08 0.00 0.00 0.00 0.00 44.72 44.74 2nn1 s GLY 98 CO 0.10 -2.17 1.93 1.76 0.00 0.00 0.00 173.10 174.72 2nn1 h SER 99 N 1.23 0.32 -2.91 1.64 0.02 -1.73 -3.42 113.55 108.69 2nn1 h SER 99 Ca -0.43 -0.05 -0.54 0.00 -0.84 0.00 0.00 61.79 59.93 2nn1 h SER 99 Cb 1.32 -0.08 -0.13 0.00 0.14 0.00 0.00 62.40 63.64 2nn1 h SER 99 CO 0.71 0.42 -0.55 0.42 -1.14 0.00 0.00 176.83 176.69 2nn1 s THR 100 N -4.88 0.89 -0.65 -2.27 -4.23 -1.26 -5.03 115.64 98.21 2nn1 s THR 100 Ca -0.06 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.70 2nn1 s THR 100 Cb 0.16 -2.51 0.28 0.00 1.34 0.00 0.00 72.50 71.77 2nn1 s THR 100 CO 0.74 0.00 1.76 0.78 -0.54 0.00 0.00 174.62 177.36 2nn1 h ASN 101 N 1.88 0.00 0.98 3.99 2.35 -1.91 -3.21 115.58 119.66 2nn1 h ASN 101 Ca -0.38 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.37 2nn1 h ASN 101 Cb 1.27 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.64 2nn1 h ASN 101 CO 0.64 0.00 0.00 -0.33 -1.65 0.00 0.00 177.43 176.09 2nn1 h GLU 102 N 0.00 0.00 -2.55 0.81 3.07 -1.92 -3.36 114.58 110.63 2nn1 h GLU 102 Ca 0.00 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.77 2nn1 h GLU 102 Cb 0.66 0.00 -0.21 0.00 -0.84 0.00 0.00 28.75 28.36 2nn1 h GLU 102 CO 0.00 0.00 -0.10 -3.38 -1.40 0.00 0.00 179.01 174.13 2nn1 s HIS 103 N -3.30 -0.47 0.00 4.33 -3.43 -1.21 -4.73 115.29 106.48 2nn1 s HIS 103 Ca 0.06 0.97 0.00 0.00 -0.80 0.00 0.00 55.06 55.29 2nn1 s HIS 103 Cb 0.10 0.21 0.00 0.00 -1.43 0.00 0.00 32.58 31.46 2nn1 s HIS 103 CO 0.47 -0.39 0.00 0.41 -2.00 0.00 0.00 174.74 173.23 2nn1 n GLY 104 N 1.89 0.04 3.81 -1.38 0.00 -0.35 -3.23 105.19 105.97 2nn1 n GLY 104 Ca -0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.55 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 4.19 -0.22 1.61 1.04 -0.57 -3.14 113.70 116.60 2nn1 s SER 105 Ca 0.00 1.11 -0.14 0.00 0.48 0.00 0.00 55.95 57.39 2nn1 s SER 105 Cb 0.00 -1.76 -0.09 0.00 0.10 0.00 0.00 66.02 64.27 2nn1 s SER 105 CO 0.00 -2.14 -0.33 -0.62 0.98 0.00 0.00 173.24 171.13 2nn1 n GLU 106 N -3.52 0.52 -2.27 4.02 1.02 -1.26 -4.81 120.64 114.34 2nn1 n GLU 106 Ca 0.07 0.22 -0.32 0.00 -0.02 0.00 0.00 57.16 57.11 2nn1 n GLU 106 Cb 0.58 -1.39 -0.02 0.00 -0.02 0.00 0.00 31.44 30.59 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 -2.63 3.27 0.12 -0.32 3.76 -1.26 -4.47 115.29 113.77 2nn1 s HIS 107 Ca -0.32 1.49 0.05 0.00 -0.15 0.00 0.00 55.06 56.12 2nn1 s HIS 107 Cb 0.10 -2.88 -0.04 0.00 1.11 0.00 0.00 32.58 30.87 2nn1 s HIS 107 CO 0.43 -0.65 -0.11 0.95 -0.85 0.00 0.00 174.74 174.51 2nn1 s THR 108 N -2.54 1.15 -0.21 1.30 -4.23 -1.17 -4.62 115.64 105.31 2nn1 s THR 108 Ca 0.61 -1.82 0.01 0.00 -1.18 0.00 0.00 61.69 59.31 2nn1 s THR 108 Cb -0.12 -1.59 0.04 0.00 1.34 0.00 0.00 72.50 72.17 2nn1 s THR 108 CO 0.33 -0.59 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.01 2nn1 s VAL 109 N -2.68 1.83 -1.46 2.29 1.01 -0.93 0.00 120.40 120.46 2nn1 s VAL 109 Ca 0.11 -1.13 -0.10 0.00 0.00 0.00 0.00 61.98 60.86 2nn1 s VAL 109 Cb -0.01 -1.86 0.05 0.00 0.00 0.00 0.00 36.38 34.55 2nn1 s VAL 109 CO 0.01 0.20 0.91 0.47 0.00 0.00 0.00 175.10 176.68 2nn1 n ASP 110 N 4.62 -5.40 0.00 3.32 8.00 0.82 -1.64 116.55 126.26 2nn1 n ASP 110 Ca -0.16 -0.57 0.00 0.00 0.71 0.00 0.00 54.79 54.78 2nn1 n ASP 110 Cb 0.46 -4.31 0.00 0.00 -0.02 0.00 0.00 41.12 37.25 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 -1.68 2.49 3.68 0.44 0.00 -1.26 -5.01 105.19 103.85 2nn1 n GLY 111 Ca -0.00 0.00 -0.41 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 -2.75 4.90 -0.08 1.61 1.01 -0.65 -5.04 120.40 119.39 2nn1 s VAL 112 Ca 0.00 1.68 -0.07 0.00 0.00 0.00 0.00 61.98 63.58 2nn1 s VAL 112 Cb 0.00 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2nn1 s VAL 112 CO 0.00 0.07 0.19 -0.75 0.00 0.00 0.00 175.10 174.61 2nn1 s LYS 113 N 1.83 3.51 0.66 2.72 2.20 -1.26 -2.19 119.74 127.21 2nn1 s LYS 113 Ca 0.40 -0.08 0.05 0.00 -0.36 0.00 0.00 55.97 55.98 2nn1 s LYS 113 Cb -0.17 -3.17 0.12 0.00 -1.51 0.00 0.00 37.83 33.09 2nn1 s LYS 113 CO 0.15 0.75 0.91 0.71 -0.36 0.00 0.00 175.35 177.51 2nn1 s TYR 114 N -1.09 1.27 0.21 4.03 1.51 -1.26 -4.78 117.35 117.23 2nn1 s TYR 114 Ca 0.18 -0.59 0.07 0.00 -1.01 0.00 0.00 57.07 55.73 2nn1 s TYR 114 Cb -0.13 -2.55 0.12 0.00 -0.11 0.00 0.00 41.96 39.29 2nn1 s TYR 114 CO 0.08 -1.51 1.47 0.77 -1.11 0.00 0.00 175.55 175.24 2nn1 h SER 115 N -0.20 0.09 -5.14 2.29 0.02 -1.52 -0.64 113.55 108.45 2nn1 h SER 115 Ca -0.31 -0.07 0.04 0.00 -0.84 0.00 0.00 61.79 60.61 2nn1 h SER 115 Cb 1.28 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 2nn1 h SER 115 CO 0.39 0.83 0.38 0.00 -1.14 0.00 0.00 176.83 177.29 2nn1 s ALA 116 N -3.31 -1.03 -0.16 3.77 0.00 -1.03 -3.56 121.76 116.44 2nn1 s ALA 116 Ca -0.01 -0.62 -0.14 0.00 0.00 0.00 0.00 51.96 51.18 2nn1 s ALA 116 Cb 0.11 0.70 0.04 0.00 0.00 0.00 0.00 23.12 23.98 2nn1 s ALA 116 CO 0.80 -1.01 0.41 -2.00 0.00 0.00 0.00 175.76 173.96 2nn1 s GLU 117 N -2.23 0.48 -0.12 0.00 2.12 -0.33 -1.25 118.70 117.37 2nn1 s GLU 117 Ca 0.18 0.58 -0.06 0.00 0.36 0.00 0.00 54.97 56.03 2nn1 s GLU 117 Cb -0.04 0.23 -0.04 0.00 0.26 0.00 0.00 34.13 34.54 2nn1 s GLU 117 CO 0.09 -0.06 0.09 -1.17 -0.54 0.00 0.00 175.26 173.68 2nn1 s LEU 118 N 0.26 4.11 -0.10 2.70 2.96 0.08 -1.03 118.68 127.66 2nn1 s LEU 118 Ca -0.00 0.33 0.01 0.00 -0.22 0.00 0.00 54.13 54.26 2nn1 s LEU 118 Cb -0.03 -1.99 0.02 0.00 0.50 0.00 0.00 46.19 44.68 2nn1 s LEU 118 CO 0.00 0.37 -0.13 -1.00 -1.32 0.00 0.00 176.35 174.27 2nn1 s HIS 119 N -0.79 1.75 -0.29 5.38 3.76 0.12 -1.14 115.29 124.07 2nn1 s HIS 119 Ca 0.13 -0.79 0.01 0.00 -0.15 0.00 0.00 55.06 54.26 2nn1 s HIS 119 Cb -0.12 -1.29 0.06 0.00 1.11 0.00 0.00 32.58 32.34 2nn1 s HIS 119 CO 0.03 -0.43 -0.03 0.08 -0.85 0.00 0.00 174.74 173.54 2nn1 s VAL 120 N 1.03 2.59 0.03 -0.90 1.01 -0.48 -1.08 120.40 122.59 2nn1 s VAL 120 Ca -0.07 -1.62 -0.06 0.00 0.00 0.00 0.00 61.98 60.23 2nn1 s VAL 120 Cb -0.15 -2.56 -0.05 0.00 0.00 0.00 0.00 36.38 33.63 2nn1 s VAL 120 CO -0.01 -0.15 0.29 0.00 0.00 0.00 0.00 175.10 175.22 2nn1 s ALA 121 N 1.15 3.84 0.05 5.51 0.00 0.58 -0.91 121.76 131.98 2nn1 s ALA 121 Ca -0.05 -0.57 -0.02 0.00 0.00 0.00 0.00 51.96 51.32 2nn1 s ALA 121 Cb -0.20 -2.07 -0.03 0.00 0.00 0.00 0.00 23.12 20.82 2nn1 s ALA 121 CO -0.04 0.66 -0.00 -1.01 0.00 0.00 0.00 175.76 175.37 2nn1 s HIS 122 N -1.35 0.42 0.10 0.00 3.76 0.43 -1.66 115.29 116.99 2nn1 s HIS 122 Ca 0.30 -0.89 0.07 0.00 -0.15 0.00 0.00 55.06 54.38 2nn1 s HIS 122 Cb -0.13 -0.31 -0.03 0.00 1.11 0.00 0.00 32.58 33.21 2nn1 s HIS 122 CO 0.18 -0.36 -0.18 1.67 -0.85 0.00 0.00 174.74 175.20 2nn1 s TRP 123 N -3.38 1.55 -0.83 1.40 1.48 0.29 -1.30 118.94 118.14 2nn1 s TRP 123 Ca 0.02 -0.45 -0.25 0.00 -1.06 0.00 0.00 56.10 54.36 2nn1 s TRP 123 Cb 0.04 -0.85 -0.03 0.00 -1.16 0.00 0.00 33.47 31.47 2nn1 s TRP 123 CO -0.08 0.16 1.88 1.21 -4.06 0.00 0.00 176.95 176.06 2nn1 s ASN 124 N -1.97 5.27 0.00 -2.66 3.84 0.81 -0.17 114.94 120.05 2nn1 s ASN 124 Ca 0.05 -0.47 0.29 0.00 0.21 0.00 0.00 52.86 52.94 2nn1 s ASN 124 Cb -0.09 -2.55 1.33 0.00 -0.55 0.00 0.00 41.25 39.39 2nn1 s ASN 124 CO 0.04 -2.57 1.93 -1.54 -2.79 0.00 0.00 177.10 172.17 2nn1 n SER 125 N 13.29 0.34 0.04 -4.21 3.41 -1.26 -1.88 113.62 123.36 2nn1 n SER 125 Ca 0.34 -0.50 -0.11 0.00 -0.26 0.00 0.00 58.87 58.34 2nn1 n SER 125 Cb 0.48 -0.12 -0.13 0.00 -0.26 0.00 0.00 64.21 64.18 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 3.59 0.41 0.00 7.33 0.00 -1.87 -3.38 119.26 125.33 2nn1 h ALA 126 Ca 0.00 -1.11 -0.16 0.00 0.00 0.00 0.00 54.91 53.64 2nn1 h ALA 126 Cb 0.32 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2nn1 h ALA 126 CO 0.00 1.27 -1.89 1.17 0.00 0.00 0.00 179.25 179.81 2nn1 n LYS 127 N -3.33 1.20 -4.49 0.00 4.81 -1.23 -5.03 118.16 110.09 2nn1 n LYS 127 Ca -0.10 -0.06 -0.24 0.00 -0.87 0.00 0.00 58.31 57.04 2nn1 n LYS 127 Cb 1.01 -1.37 -0.10 0.00 0.02 0.00 0.00 35.03 34.58 2nn1 n LYS 127 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2nn1 s TYR 128 N -2.63 2.23 -1.07 5.64 2.02 -0.79 -5.06 117.35 117.69 2nn1 s TYR 128 Ca -0.07 -0.50 0.20 0.00 -0.37 0.00 0.00 57.07 56.33 2nn1 s TYR 128 Cb 0.06 -1.18 -0.19 0.00 -0.40 0.00 0.00 41.96 40.26 2nn1 s TYR 128 CO 0.61 0.54 0.87 0.43 -1.57 0.00 0.00 175.55 176.43 2nn1 n SER 129 N -0.67 1.08 -3.67 2.29 7.64 -1.26 -4.33 113.62 114.69 2nn1 n SER 129 Ca -0.05 -1.04 -0.09 0.00 1.01 0.00 0.00 58.87 58.69 2nn1 n SER 129 Cb 0.62 0.93 -0.02 0.00 -1.01 0.00 0.00 64.21 64.73 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 -2.80 -0.37 0.19 6.43 1.04 -1.26 -5.03 113.70 111.90 2nn1 s SER 130 Ca 0.09 -0.36 -0.09 0.00 0.48 0.00 0.00 55.95 56.07 2nn1 s SER 130 Cb 0.15 0.64 0.10 0.00 0.10 0.00 0.00 66.02 67.02 2nn1 s SER 130 CO 0.78 -1.14 1.70 0.25 0.98 0.00 0.00 173.24 175.80 2nn1 h LEU 131 N 2.05 1.06 -1.12 2.42 5.85 -1.95 -1.16 115.31 122.46 2nn1 h LEU 131 Ca -0.27 -0.25 0.06 0.00 0.84 0.00 0.00 57.88 58.27 2nn1 h LEU 131 Cb 1.27 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.96 2nn1 h LEU 131 CO 0.32 1.03 0.60 0.00 -0.34 0.00 0.00 178.44 180.06 2nn1 h ALA 132 N 1.06 1.49 0.09 1.25 0.00 -2.00 0.26 119.26 121.41 2nn1 h ALA 132 Ca 0.21 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.88 2nn1 h ALA 132 Cb 0.41 -0.28 0.02 0.00 0.00 0.00 0.00 17.79 17.94 2nn1 h ALA 132 CO 0.01 0.37 -0.88 1.49 0.00 0.00 0.00 179.25 180.25 2nn1 h GLU 133 N 1.06 0.44 -0.01 0.00 4.81 -1.90 -3.36 114.58 115.62 2nn1 h GLU 133 Ca 0.40 -0.59 -0.14 0.00 -0.13 0.00 0.00 59.36 58.90 2nn1 h GLU 133 Cb 0.19 0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 2nn1 h GLU 133 CO -0.15 1.24 -0.66 0.00 -0.73 0.00 0.00 179.01 178.70 2nn1 h ALA 134 N 0.23 0.88 -0.80 2.92 0.00 -0.89 -3.34 119.26 118.25 2nn1 h ALA 134 Ca -0.13 -0.60 0.23 0.00 0.00 0.00 0.00 54.91 54.41 2nn1 h ALA 134 Cb 1.61 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.27 2nn1 h ALA 134 CO 0.17 0.82 0.61 0.00 0.00 0.00 0.00 179.25 180.84 2nn1 h ALA 135 N 1.29 2.72 -0.29 0.00 0.00 -0.63 -1.63 119.26 120.72 2nn1 h ALA 135 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2nn1 h ALA 135 Cb 1.18 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2nn1 h ALA 135 CO 0.09 -1.02 0.00 -1.13 0.00 0.00 0.00 179.25 177.19 2nn1 n SER 136 N -4.17 3.05 -4.84 0.00 3.41 -1.25 -4.64 113.62 105.18 2nn1 n SER 136 Ca 0.16 -1.89 -0.38 0.00 -0.26 0.00 0.00 58.87 56.51 2nn1 n SER 136 Cb 0.90 -0.19 -0.06 0.00 -0.26 0.00 0.00 64.21 64.60 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 -1.30 3.81 0.33 4.33 -0.14 -0.61 -4.86 119.74 121.30 2nn1 s LYS 137 Ca 0.30 0.26 0.10 0.00 -1.36 0.00 0.00 55.97 55.28 2nn1 s LYS 137 Cb 0.18 -3.22 0.88 0.00 -1.68 0.00 0.00 37.83 33.99 2nn1 s LYS 137 CO 0.25 0.69 1.76 0.00 -0.76 0.00 0.00 175.35 177.29 2nn1 h ALA 138 N 4.87 1.84 -0.52 5.17 0.00 -1.85 0.17 119.26 128.95 2nn1 h ALA 138 Ca -0.52 0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.32 2nn1 h ALA 138 Cb 1.22 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 2nn1 h ALA 138 CO 0.61 -0.27 0.13 -0.40 0.00 0.00 0.00 179.25 179.33 2nn1 n ASP 139 N -4.78 3.88 0.12 0.00 5.75 -1.26 -4.28 116.55 115.98 2nn1 n ASP 139 Ca 0.25 -3.33 -0.20 0.00 -0.01 0.00 0.00 54.79 51.49 2nn1 n ASP 139 Cb 0.71 -0.67 -0.15 0.00 -1.03 0.00 0.00 41.12 39.98 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 1.87 0.46 -2.75 6.12 0.00 -0.70 -3.42 103.07 104.65 2nn1 h GLY 140 Ca 0.20 -1.18 -0.61 0.00 0.00 0.00 0.00 47.33 45.74 2nn1 h GLY 140 CO 0.53 1.03 -0.79 1.08 0.00 0.00 0.00 176.54 178.39 2nn1 s LEU 141 N -7.36 2.51 -0.04 3.11 1.43 0.19 -0.14 118.68 118.37 2nn1 s LEU 141 Ca -0.06 -0.94 -0.02 0.00 -1.03 0.00 0.00 54.13 52.07 2nn1 s LEU 141 Cb 0.06 -1.08 0.03 0.00 0.03 0.00 0.00 46.19 45.22 2nn1 s LEU 141 CO 0.91 0.06 0.07 0.00 0.23 0.00 0.00 176.35 177.63 2nn1 s ALA 142 N -2.12 0.14 -0.07 4.21 0.00 -0.42 -1.18 121.76 122.31 2nn1 s ALA 142 Ca 0.24 0.27 0.03 0.00 0.00 0.00 0.00 51.96 52.50 2nn1 s ALA 142 Cb -0.06 -0.60 0.01 0.00 0.00 0.00 0.00 23.12 22.46 2nn1 s ALA 142 CO 0.12 -0.45 -0.16 0.08 0.00 0.00 0.00 175.76 175.34 2nn1 s VAL 143 N 2.04 1.46 -0.14 0.00 1.01 -1.03 -0.43 120.40 123.31 2nn1 s VAL 143 Ca 0.03 -0.68 -0.16 0.00 0.00 0.00 0.00 61.98 61.17 2nn1 s VAL 143 Cb -0.12 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 2nn1 s VAL 143 CO -0.03 0.43 0.38 -0.63 0.00 0.00 0.00 175.10 175.24 2nn1 s ILE 144 N 0.49 5.25 -0.09 2.22 1.01 -0.09 -1.22 121.20 128.77 2nn1 s ILE 144 Ca -0.15 0.74 0.01 0.00 0.00 0.00 0.00 60.65 61.26 2nn1 s ILE 144 Cb -0.16 -3.72 -0.02 0.00 0.01 0.00 0.00 42.46 38.57 2nn1 s ILE 144 CO 0.05 0.36 -0.13 -0.83 0.00 0.00 0.00 174.94 174.39 2nn1 s GLY 145 N 0.55 1.55 -0.12 6.18 0.00 0.14 -1.38 107.32 114.24 2nn1 s GLY 145 Ca 0.21 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 44.00 2nn1 s GLY 145 CO 0.07 -0.47 -0.10 0.14 0.00 0.00 0.00 173.10 172.73 2nn1 s VAL 146 N -0.20 1.21 0.22 1.40 1.01 -0.29 -1.44 120.40 122.31 2nn1 s VAL 146 Ca 0.01 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 2nn1 s VAL 146 Cb -0.13 -1.19 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 2nn1 s VAL 146 CO 0.03 0.40 1.10 -0.76 0.00 0.00 0.00 175.10 175.87 2nn1 s LEU 147 N 1.55 4.51 -0.21 3.92 1.43 -1.26 -0.74 118.68 127.88 2nn1 s LEU 147 Ca 0.03 2.16 -0.03 0.00 -1.03 0.00 0.00 54.13 55.26 2nn1 s LEU 147 Cb -0.13 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.48 2nn1 s LEU 147 CO -0.08 -0.19 -0.07 -0.04 0.23 0.00 0.00 176.35 176.20 2nn1 s MET 148 N -0.76 3.31 -0.22 1.70 -1.94 -0.38 -1.50 119.30 119.50 2nn1 s MET 148 Ca 0.48 -0.66 -0.09 0.00 -1.71 0.00 0.00 55.69 53.70 2nn1 s MET 148 Cb -0.30 -2.92 -0.05 0.00 2.01 0.00 0.00 34.83 33.57 2nn1 s MET 148 CO 0.37 -0.19 0.13 0.21 -0.01 0.00 0.00 175.02 175.53 2nn1 s LYS 149 N 1.42 4.04 0.30 2.03 2.20 0.02 -1.89 119.74 127.86 2nn1 s LYS 149 Ca 0.05 -0.29 -0.30 0.00 -0.36 0.00 0.00 55.97 55.07 2nn1 s LYS 149 Cb -0.14 -3.43 -0.11 0.00 -1.51 0.00 0.00 37.83 32.64 2nn1 s LYS 149 CO -0.05 0.13 1.52 0.54 -0.36 0.00 0.00 175.35 177.12 2nn1 s VAL 150 N 0.83 2.27 0.00 4.02 0.11 -1.26 -2.62 120.40 123.76 2nn1 s VAL 150 Ca 0.06 0.24 0.00 0.00 -2.93 0.00 0.00 61.98 59.35 2nn1 s VAL 150 Cb -0.13 -3.15 0.00 0.00 -1.53 0.00 0.00 36.38 31.57 2nn1 s VAL 150 CO 0.02 0.04 0.00 0.61 -3.33 0.00 0.00 175.10 172.45 2nn1 n GLY 151 N 1.80 -0.35 3.78 6.54 0.00 0.56 -4.86 105.19 112.66 2nn1 n GLY 151 Ca 0.06 0.38 -0.35 0.00 0.00 0.00 0.00 46.02 46.11 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 3.47 0.37 1.61 2.02 -1.26 -4.03 118.70 120.88 2nn1 s GLU 152 Ca 0.00 1.55 -0.28 0.00 0.02 0.00 0.00 54.97 56.26 2nn1 s GLU 152 Cb 0.00 -2.03 -0.11 0.00 0.10 0.00 0.00 34.13 32.09 2nn1 s GLU 152 CO 0.00 -0.74 1.49 0.00 0.02 0.00 0.00 175.26 176.03 2nn1 s ALA 153 N -1.82 3.58 -0.46 5.21 0.00 -1.26 -3.10 121.76 123.92 2nn1 s ALA 153 Ca 0.71 1.58 -0.15 0.00 0.00 0.00 0.00 51.96 54.10 2nn1 s ALA 153 Cb -0.22 -3.61 0.06 0.00 0.00 0.00 0.00 23.12 19.35 2nn1 s ALA 153 CO 0.25 -1.06 0.37 1.21 0.00 0.00 0.00 175.76 176.54 2nn1 s ASN 154 N -0.11 6.14 0.62 0.00 3.84 -1.26 -4.86 114.94 119.31 2nn1 s ASN 154 Ca 0.53 -1.22 0.38 0.00 0.21 0.00 0.00 52.86 52.76 2nn1 s ASN 154 Cb -0.47 -2.18 2.07 0.00 -0.55 0.00 0.00 41.25 40.12 2nn1 s ASN 154 CO 0.63 -0.60 2.27 1.55 -2.79 0.00 0.00 177.10 178.16 2nn1 h PRO 155 N 8.73 0.00 0.00 0.43 0.13 -1.94 -2.35 132.00 137.00 2nn1 h PRO 155 Ca -0.28 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2nn1 h PRO 155 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 2nn1 h PRO 155 CO 0.84 0.02 -0.02 0.87 -0.23 0.00 0.00 178.00 179.48 2nn1 h LYS 156 N 0.00 0.00 0.00 0.86 1.79 -1.92 -2.27 116.57 115.03 2nn1 h LYS 156 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2nn1 h LYS 156 Cb 0.09 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.74 2nn1 h LYS 156 CO 0.00 0.02 -0.23 1.28 -1.08 0.00 0.00 179.45 179.44 2nn1 n LEU 157 N -3.16 0.28 -0.28 2.94 4.77 -0.88 -4.51 117.00 116.16 2nn1 n LEU 157 Ca -0.01 0.30 -0.08 0.00 -0.03 0.00 0.00 56.01 56.19 2nn1 n LEU 157 Cb 0.22 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 40.86 2nn1 n LEU 157 CO 0.25 0.03 0.49 -0.61 -1.33 0.00 0.00 177.39 176.22 2nn1 h GLN 158 N 0.00 -0.03 -0.55 3.23 5.75 -1.56 -0.36 115.11 121.58 2nn1 h GLN 158 Ca 0.00 0.00 0.09 0.00 -0.15 0.00 0.00 58.65 58.59 2nn1 h GLN 158 Cb 0.53 0.01 -0.07 0.00 1.07 0.00 0.00 27.48 29.02 2nn1 h GLN 158 CO 0.00 -0.02 0.16 -0.22 -2.65 0.00 0.00 178.83 176.10 2nn1 h LYS 159 N -0.04 0.31 -0.09 1.69 3.64 -1.83 0.46 116.57 120.71 2nn1 h LYS 159 Ca 0.11 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2nn1 h LYS 159 Cb 0.31 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2nn1 h LYS 159 CO -0.64 0.20 0.05 0.28 -2.27 0.00 0.00 179.45 177.07 2nn1 h VAL 160 N 0.32 1.08 -0.57 2.00 2.07 -1.69 -2.38 116.25 117.08 2nn1 h VAL 160 Ca 0.28 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.55 2nn1 h VAL 160 Cb 0.36 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 2nn1 h VAL 160 CO -0.32 0.07 0.21 -0.07 0.02 0.00 0.00 177.57 177.48 2nn1 h LEU 161 N 0.06 0.76 -1.20 2.57 3.38 -0.58 -2.28 115.31 118.02 2nn1 h LEU 161 Ca 0.03 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 2nn1 h LEU 161 Cb 0.07 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2nn1 h LEU 161 CO -0.01 0.70 -0.34 0.44 0.09 0.00 0.00 178.44 179.33 2nn1 h ASP 162 N 0.82 0.00 1.52 -0.43 3.32 -0.79 -2.96 116.42 117.90 2nn1 h ASP 162 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 2nn1 h ASP 162 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2nn1 h ASP 162 CO -0.01 0.34 0.00 0.00 -1.72 0.00 0.00 179.24 177.84 2nn1 h ALA 163 N 1.66 1.00 -0.09 3.45 0.00 -0.88 -3.33 119.26 121.08 2nn1 h ALA 163 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2nn1 h ALA 163 Cb 0.73 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2nn1 h ALA 163 CO 0.04 0.00 0.01 -0.07 0.00 0.00 0.00 179.25 179.23 2nn1 h LEU 164 N 0.00 0.10 -1.99 0.00 3.38 -1.42 -2.52 115.31 112.86 2nn1 h LEU 164 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2nn1 h LEU 164 Cb 0.76 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2nn1 h LEU 164 CO 0.00 0.12 0.00 0.06 0.09 0.00 0.00 178.44 178.71 2nn1 h GLN 165 N 0.12 0.00 -0.01 1.13 -0.00 -1.78 -1.87 115.11 112.70 2nn1 h GLN 165 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.68 2nn1 h GLN 165 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.55 2nn1 h GLN 165 CO -0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 178.83 178.40 2nn1 n ALA 166 N -1.96 3.44 -2.64 0.06 0.00 -0.95 -4.26 120.51 114.19 2nn1 n ALA 166 Ca -0.01 -0.44 -0.10 0.00 0.00 0.00 0.00 53.44 52.89 2nn1 n ALA 166 Cb 0.13 -1.05 0.03 0.00 0.00 0.00 0.00 19.45 18.56 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 -0.89 1.37 -0.24 0.00 -5.35 -0.71 -4.64 119.36 108.90 2nn1 n ILE 167 Ca 0.09 -3.36 -0.01 0.00 -0.27 0.00 0.00 62.75 59.21 2nn1 n ILE 167 Cb 0.36 0.45 0.20 0.00 -1.74 0.00 0.00 39.64 38.91 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 2.77 1.04 -6.26 6.28 1.79 -1.72 -3.41 116.57 117.06 2nn1 h LYS 168 Ca -0.02 -0.09 -0.57 0.00 -2.18 0.00 0.00 60.65 57.79 2nn1 h LYS 168 Cb 1.20 -0.22 -0.09 0.00 -1.58 0.00 0.00 32.23 31.53 2nn1 h LYS 168 CO 0.48 0.72 -0.63 0.95 -1.08 0.00 0.00 179.45 179.90 2nn1 s THR 169 N -5.80 3.78 0.10 -0.16 -4.23 -1.26 -0.60 115.64 107.46 2nn1 s THR 169 Ca -0.11 -1.58 -0.35 0.00 -1.18 0.00 0.00 61.69 58.46 2nn1 s THR 169 Cb 0.17 -2.97 -0.15 0.00 1.34 0.00 0.00 72.50 70.89 2nn1 s THR 169 CO 0.79 -0.25 1.51 1.17 -0.54 0.00 0.00 174.62 177.30 2nn1 n LYS 170 N -0.59 1.70 0.00 3.99 4.81 -0.21 -2.00 118.16 125.86 2nn1 n LYS 170 Ca -0.08 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 57.97 2nn1 n LYS 170 Cb 0.57 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.29 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 3.14 3.32 3.77 3.14 0.00 -0.20 -4.61 105.19 113.76 2nn1 n GLY 171 Ca 0.18 0.00 -0.37 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 -0.66 3.91 0.06 1.61 1.02 -0.85 -4.80 119.74 120.04 2nn1 s LYS 172 Ca 0.00 1.74 -0.08 0.00 0.02 0.00 0.00 55.97 57.65 2nn1 s LYS 172 Cb 0.00 -2.50 -0.00 0.00 -0.52 0.00 0.00 37.83 34.80 2nn1 s LYS 172 CO 0.00 -0.41 0.17 -0.98 -0.92 0.00 0.00 175.35 173.20 2nn1 s ARG 173 N -2.55 0.75 0.04 1.68 1.70 -1.26 -1.14 118.95 118.17 2nn1 s ARG 173 Ca 0.61 -0.84 -0.16 0.00 -0.47 0.00 0.00 55.73 54.87 2nn1 s ARG 173 Cb -0.28 0.30 0.03 0.00 -0.57 0.00 0.00 34.95 34.43 2nn1 s ARG 173 CO 0.34 -0.22 0.36 0.00 -1.08 0.00 0.00 175.30 174.70 2nn1 s ALA 174 N -3.30 -0.85 0.45 7.88 0.00 -0.07 -4.95 121.76 120.92 2nn1 s ALA 174 Ca 0.01 0.16 -0.25 0.00 0.00 0.00 0.00 51.96 51.88 2nn1 s ALA 174 Cb 0.02 0.33 -0.08 0.00 0.00 0.00 0.00 23.12 23.40 2nn1 s ALA 174 CO -0.08 -0.44 1.36 -2.14 0.00 0.00 0.00 175.76 174.46 2nn1 s PRO 175 N -2.51 3.68 -0.27 0.00 0.02 -1.26 -0.84 135.00 133.82 2nn1 s PRO 175 Ca -0.05 2.25 -0.03 0.00 0.02 0.00 0.00 61.00 63.19 2nn1 s PRO 175 Cb -0.01 -2.60 0.11 0.00 0.02 0.00 0.00 34.50 32.02 2nn1 s PRO 175 CO -0.03 -0.76 0.19 0.12 -0.33 0.00 0.00 177.00 176.20 2nn1 s PHE 176 N -1.26 -0.02 0.39 6.54 5.36 -0.10 -4.67 117.98 124.21 2nn1 s PHE 176 Ca 0.62 -0.50 0.07 0.00 -0.96 0.00 0.00 56.93 56.16 2nn1 s PHE 176 Cb -0.40 -0.68 -0.08 0.00 -0.34 0.00 0.00 43.02 41.52 2nn1 s PHE 176 CO 0.51 -0.82 0.01 0.95 -1.46 0.00 0.00 175.22 174.41 2nn1 s THR 177 N 2.22 1.85 -0.86 0.12 -4.23 -1.26 -1.62 115.64 111.86 2nn1 s THR 177 Ca 0.09 -2.02 -0.05 0.00 -1.18 0.00 0.00 61.69 58.53 2nn1 s THR 177 Cb -0.15 -2.93 -0.00 0.00 1.34 0.00 0.00 72.50 70.76 2nn1 s THR 177 CO -0.32 -0.02 0.67 -3.20 -0.54 0.00 0.00 174.62 171.22 2nn1 n ASN 178 N -0.90 -5.92 -3.72 3.99 5.15 -1.12 -4.99 115.26 107.75 2nn1 n ASN 178 Ca -0.04 -0.68 -0.12 0.00 -0.60 0.00 0.00 54.58 53.13 2nn1 n ASN 178 Cb 0.67 -3.21 -0.13 0.00 -0.53 0.00 0.00 39.78 36.57 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 -3.09 -0.38 -0.42 1.20 5.36 -0.69 -4.99 117.98 114.97 2nn1 s PHE 179 Ca 0.10 0.88 -0.11 0.00 -0.96 0.00 0.00 56.93 56.85 2nn1 s PHE 179 Cb -0.04 0.08 0.06 0.00 -0.34 0.00 0.00 43.02 42.78 2nn1 s PHE 179 CO 0.84 -0.26 0.27 0.34 -1.46 0.00 0.00 175.22 174.95 2nn1 s ASP 180 N 1.37 5.74 0.21 6.13 -1.08 -1.26 -4.44 116.67 123.34 2nn1 s ASP 180 Ca -0.09 -1.35 0.18 0.00 -0.52 0.00 0.00 52.55 50.77 2nn1 s ASP 180 Cb -0.10 -2.03 0.86 0.00 -1.46 0.00 0.00 42.92 40.19 2nn1 s ASP 180 CO -0.09 -0.52 1.54 -0.81 0.52 0.00 0.00 175.17 175.81 2nn1 n PRO 181 N 4.98 0.12 0.14 4.34 -0.04 -1.26 -2.03 135.00 141.25 2nn1 n PRO 181 Ca -0.11 0.51 0.11 0.00 -0.04 0.00 0.00 63.50 63.98 2nn1 n PRO 181 Cb 0.44 -1.81 0.51 0.00 -0.04 0.00 0.00 33.50 32.60 2nn1 n PRO 181 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2nn1 n SER 182 N -2.04 0.62 0.08 3.54 3.41 -1.26 -1.20 113.62 116.77 2nn1 n SER 182 Ca 0.00 0.69 0.10 0.00 -0.26 0.00 0.00 58.87 59.41 2nn1 n SER 182 Cb 0.10 -0.81 0.43 0.00 -0.26 0.00 0.00 64.21 63.67 2nn1 n SER 182 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2nn1 n THR 183 N -2.23 0.82 0.61 6.66 -2.24 -0.86 -2.28 114.28 114.77 2nn1 n THR 183 Ca 0.01 0.18 0.12 0.00 -2.27 0.00 0.00 64.05 62.09 2nn1 n THR 183 Cb 0.17 -1.03 0.09 0.00 -2.10 0.00 0.00 70.33 67.47 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 -1.96 0.64 -4.81 3.22 4.77 -0.34 -4.95 117.00 113.57 2nn1 n LEU 184 Ca 0.03 0.07 -0.32 0.00 -0.03 0.00 0.00 56.01 55.76 2nn1 n LEU 184 Cb 0.23 -0.14 0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2nn1 n LEU 184 CO 0.19 0.02 0.71 -0.76 -1.33 0.00 0.00 177.39 176.22 2nn1 s LEU 185 N -3.95 3.35 0.85 2.23 1.43 -0.97 -4.96 118.68 116.66 2nn1 s LEU 185 Ca 0.05 1.73 -0.11 0.00 -1.03 0.00 0.00 54.13 54.77 2nn1 s LEU 185 Cb 0.14 -4.52 0.10 0.00 0.03 0.00 0.00 46.19 41.94 2nn1 s LEU 185 CO 0.76 -1.27 1.09 -2.16 0.23 0.00 0.00 176.35 175.00 2nn1 s PRO 186 N -4.46 1.68 0.14 1.29 0.04 -1.26 -4.96 135.00 127.46 2nn1 s PRO 186 Ca 0.61 0.77 -0.18 0.00 0.04 0.00 0.00 61.00 62.24 2nn1 s PRO 186 Cb -0.15 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 2nn1 s PRO 186 CO 0.44 -1.94 1.76 1.03 0.04 0.00 0.00 177.00 178.33 2nn1 h SER 187 N -1.32 0.15 -3.16 6.66 0.87 -1.96 -3.41 113.55 111.38 2nn1 h SER 187 Ca -0.48 0.02 -0.59 0.00 -1.23 0.00 0.00 61.79 59.51 2nn1 h SER 187 Cb 1.27 -0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.18 2nn1 h SER 187 CO 0.56 0.12 -0.12 -0.55 -0.53 0.00 0.00 176.83 176.32 2nn1 s SER 188 N -5.35 6.91 -0.28 6.23 0.15 -1.26 -4.99 113.70 115.10 2nn1 s SER 188 Ca -0.13 1.08 0.11 0.00 0.70 0.00 0.00 55.95 57.71 2nn1 s SER 188 Cb 0.10 -2.31 0.58 0.00 -1.71 0.00 0.00 66.02 62.69 2nn1 s SER 188 CO 0.70 0.25 1.58 0.18 1.20 0.00 0.00 173.24 177.15 2nn1 n LEU 189 N 2.07 4.77 -4.76 3.45 4.77 -1.26 -4.66 117.00 121.38 2nn1 n LEU 189 Ca -0.11 -3.42 -0.39 0.00 -0.03 0.00 0.00 56.01 52.06 2nn1 n LEU 189 Cb 0.52 -0.66 0.03 0.00 -2.33 0.00 0.00 43.42 40.98 2nn1 n LEU 189 CO 0.40 0.97 1.04 -1.81 -1.33 0.00 0.00 177.39 176.66 2nn1 s ASP 190 N -1.91 5.51 0.26 -1.43 1.01 -1.26 -4.67 116.67 114.18 2nn1 s ASP 190 Ca 0.48 2.88 -0.10 0.00 0.71 0.00 0.00 52.55 56.51 2nn1 s ASP 190 Cb 0.40 -2.65 -0.01 0.00 1.01 0.00 0.00 42.92 41.68 2nn1 s ASP 190 CO 0.07 -1.42 0.45 0.72 0.21 0.00 0.00 175.17 175.19 2nn1 s PHE 191 N -1.24 0.54 0.18 4.23 -0.71 -1.26 -1.25 117.98 118.47 2nn1 s PHE 191 Ca 0.67 -0.88 0.11 0.00 -1.04 0.00 0.00 56.93 55.79 2nn1 s PHE 191 Cb -0.43 0.08 -0.04 0.00 -1.21 0.00 0.00 43.02 41.42 2nn1 s PHE 191 CO 0.53 -0.99 -0.24 -1.58 -1.34 0.00 0.00 175.22 171.60 2nn1 s TRP 192 N -3.85 2.32 -0.04 3.49 0.51 0.08 -1.01 118.94 120.45 2nn1 s TRP 192 Ca 0.25 -0.36 -0.10 0.00 -2.12 0.00 0.00 56.10 53.78 2nn1 s TRP 192 Cb 0.00 -1.18 0.02 0.00 -0.81 0.00 0.00 33.47 31.50 2nn1 s TRP 192 CO 0.11 0.46 0.22 -0.08 -0.51 0.00 0.00 176.95 177.15 2nn1 s THR 193 N -1.52 0.04 0.13 2.01 -1.32 0.19 -0.67 115.64 114.50 2nn1 s THR 193 Ca 0.19 -0.37 -0.23 0.00 -1.21 0.00 0.00 61.69 60.08 2nn1 s THR 193 Cb -0.08 -0.44 0.07 0.00 -1.51 0.00 0.00 72.50 70.53 2nn1 s THR 193 CO 0.09 -0.20 0.58 -0.72 -2.21 0.00 0.00 174.62 172.16 2nn1 s TYR 194 N -0.78 -0.51 -0.13 9.09 1.13 -1.18 -0.98 117.35 123.99 2nn1 s TYR 194 Ca -0.09 0.37 -0.26 0.00 -1.41 0.00 0.00 57.07 55.69 2nn1 s TYR 194 Cb -0.05 0.50 -0.02 0.00 -1.10 0.00 0.00 41.96 41.30 2nn1 s TYR 194 CO 0.02 -0.80 0.83 -1.25 -2.51 0.00 0.00 175.55 171.84 2nn1 s PRO 195 N -3.43 4.35 0.00 -3.49 0.04 -1.26 -1.64 135.00 129.57 2nn1 s PRO 195 Ca -0.00 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.09 2nn1 s PRO 195 Cb -0.01 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.99 2nn1 s PRO 195 CO -0.10 -0.23 0.00 0.41 0.04 0.00 0.00 177.00 177.12 2nn1 n GLY 196 N 3.33 5.21 3.09 0.56 0.00 0.15 -4.82 105.19 112.70 2nn1 n GLY 196 Ca 0.04 -0.98 -0.18 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.77 -4.78 1.61 3.41 -0.98 -2.25 113.62 109.86 2nn1 n SER 197 Ca 0.00 -3.05 -0.37 0.00 -0.26 0.00 0.00 58.87 55.19 2nn1 n SER 197 Cb 0.00 1.73 -0.03 0.00 -0.26 0.00 0.00 64.21 65.65 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 4.11 0.00 1.04 1.43 -0.58 -4.47 118.68 120.21 2nn1 s LEU 198 Ca 0.37 2.17 0.25 0.00 -1.03 0.00 0.00 54.13 55.88 2nn1 s LEU 198 Cb 0.01 -4.18 1.20 0.00 0.03 0.00 0.00 46.19 43.26 2nn1 s LEU 198 CO 0.26 -0.65 1.81 0.35 0.23 0.00 0.00 176.35 178.34 2nn1 n THR 199 N -0.18 0.05 -3.85 5.49 -2.24 -1.26 -4.48 114.28 107.81 2nn1 n THR 199 Ca 0.06 -0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.59 2nn1 n THR 199 Cb 0.49 0.04 -0.06 0.00 -2.10 0.00 0.00 70.33 68.70 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 -1.95 0.16 0.32 4.78 0.00 -1.26 -4.70 115.29 112.64 2nn1 s HIS 200 Ca 0.37 -0.54 -0.25 0.00 -3.00 0.00 0.00 55.06 51.64 2nn1 s HIS 200 Cb 0.18 0.04 -0.14 0.00 -4.00 0.00 0.00 32.58 28.66 2nn1 s HIS 200 CO 0.30 -0.68 0.65 -2.30 -1.00 0.00 0.00 174.74 171.71 2nn1 n PRO 201 N -0.18 0.62 0.00 -0.38 -0.02 -1.26 -1.08 135.00 132.70 2nn1 n PRO 201 Ca -0.12 0.22 0.06 0.00 -2.02 0.00 0.00 63.50 61.64 2nn1 n PRO 201 Cb 0.63 -1.44 0.34 0.00 -0.02 0.00 0.00 33.50 33.00 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 0.78 0.32 -1.94 0.52 -0.04 -1.26 -5.01 135.00 128.36 2nn1 n PRO 202 Ca 0.13 0.05 -0.18 0.00 -0.04 0.00 0.00 63.50 63.46 2nn1 n PRO 202 Cb 0.33 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.25 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 -1.08 -1.47 -4.66 1.53 4.77 -0.24 -4.92 117.00 110.93 2nn1 n LEU 203 Ca 0.08 0.26 -0.45 0.00 -0.03 0.00 0.00 56.01 55.87 2nn1 n LEU 203 Cb 0.05 -2.59 -0.03 0.00 -2.33 0.00 0.00 43.42 38.53 2nn1 n LEU 203 CO 0.07 -0.58 0.99 -1.22 -1.33 0.00 0.00 177.39 175.32 2nn1 n TYR 204 N -2.94 2.09 -2.16 -1.77 4.01 -1.26 -4.36 117.16 110.77 2nn1 n TYR 204 Ca -0.19 0.46 -0.41 0.00 -0.16 0.00 0.00 57.90 57.59 2nn1 n TYR 204 Cb 0.62 -2.44 -0.00 0.00 -0.31 0.00 0.00 39.34 37.21 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 1.99 3.98 -0.02 -0.72 1.02 -1.26 -1.52 120.64 124.11 2nn1 n GLU 205 Ca 0.12 -3.44 0.01 0.00 -0.02 0.00 0.00 57.16 53.83 2nn1 n GLU 205 Cb 0.31 -2.81 0.01 0.00 -0.02 0.00 0.00 31.44 28.93 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 3.07 1.77 -4.56 1.62 3.41 -1.17 -4.40 113.62 113.36 2nn1 n SER 206 Ca 0.50 -2.00 -0.34 0.00 -0.26 0.00 0.00 58.87 56.77 2nn1 n SER 206 Cb 0.31 -0.05 -0.11 0.00 -0.26 0.00 0.00 64.21 64.10 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 -1.06 4.19 -0.41 -3.33 1.01 -0.96 -0.64 120.40 119.20 2nn1 s VAL 207 Ca 0.03 -0.26 -0.16 0.00 0.00 0.00 0.00 61.98 61.60 2nn1 s VAL 207 Cb 0.03 -2.84 0.02 0.00 0.00 0.00 0.00 36.38 33.59 2nn1 s VAL 207 CO 0.00 0.50 0.33 -0.89 0.00 0.00 0.00 175.10 175.05 2nn1 s THR 208 N 0.16 5.22 0.20 3.92 2.01 -0.33 0.30 115.64 127.13 2nn1 s THR 208 Ca 0.00 -0.59 -0.25 0.00 0.31 0.00 0.00 61.69 61.17 2nn1 s THR 208 Cb -0.13 -3.96 -0.08 0.00 0.01 0.00 0.00 72.50 68.34 2nn1 s THR 208 CO 0.02 -0.34 0.80 0.26 -0.69 0.00 0.00 174.62 174.67 2nn1 s TRP 209 N 1.79 3.84 -0.29 4.92 0.52 -0.65 -2.48 118.94 126.58 2nn1 s TRP 209 Ca 0.07 1.63 0.01 0.00 0.02 0.00 0.00 56.10 57.82 2nn1 s TRP 209 Cb -0.19 -2.78 0.09 0.00 -1.15 0.00 0.00 33.47 29.45 2nn1 s TRP 209 CO 0.11 0.44 0.04 0.42 0.02 0.00 0.00 176.95 177.98 2nn1 s ILE 210 N -1.28 1.42 -0.28 2.03 -1.09 -0.36 -3.10 121.20 118.54 2nn1 s ILE 210 Ca 0.39 -1.58 -0.10 0.00 -2.23 0.00 0.00 60.65 57.13 2nn1 s ILE 210 Cb -0.22 -1.96 -0.03 0.00 -1.58 0.00 0.00 42.46 38.67 2nn1 s ILE 210 CO 0.25 -0.49 0.15 -0.63 -1.23 0.00 0.00 174.94 173.00 2nn1 s ILE 211 N 1.37 4.91 0.30 2.92 -1.09 0.15 0.25 121.20 130.01 2nn1 s ILE 211 Ca 0.06 -0.05 -0.29 0.00 -2.23 0.00 0.00 60.65 58.14 2nn1 s ILE 211 Cb -0.18 -3.37 -0.10 0.00 -1.58 0.00 0.00 42.46 37.23 2nn1 s ILE 211 CO -0.15 0.23 1.25 0.00 -1.23 0.00 0.00 174.94 175.04 2nn1 h LYS 213 N 3.80 0.43 -6.23 0.00 3.64 -1.50 -3.44 116.57 113.27 2nn1 h LYS 213 Ca -0.48 -0.28 -0.57 0.00 -1.27 0.00 0.00 60.65 58.05 2nn1 h LYS 213 Cb 1.22 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 33.03 2nn1 h LYS 213 CO 0.68 0.88 -0.10 -1.21 -2.27 0.00 0.00 179.45 177.43 2nn1 s GLU 214 N -3.90 4.03 0.45 1.90 0.41 -1.26 -5.05 118.70 115.28 2nn1 s GLU 214 Ca -0.06 0.54 0.07 0.00 -0.41 0.00 0.00 54.97 55.11 2nn1 s GLU 214 Cb 0.12 -3.08 0.02 0.00 -1.78 0.00 0.00 34.13 29.40 2nn1 s GLU 214 CO 0.82 0.57 0.61 -1.54 -0.49 0.00 0.00 175.26 175.24 2nn1 s SER 215 N -1.41 5.56 0.26 -0.19 1.04 -1.26 -4.58 113.70 113.12 2nn1 s SER 215 Ca 0.32 -0.40 0.09 0.00 0.48 0.00 0.00 55.95 56.45 2nn1 s SER 215 Cb -0.17 -0.62 -0.05 0.00 0.10 0.00 0.00 66.02 65.28 2nn1 s SER 215 CO 0.18 -0.86 -0.14 0.27 0.98 0.00 0.00 173.24 173.67 2nn1 s ILE 216 N -2.43 2.05 0.50 -1.02 -4.36 -0.56 -4.83 121.20 110.55 2nn1 s ILE 216 Ca 0.56 -2.27 0.02 0.00 -0.26 0.00 0.00 60.65 58.70 2nn1 s ILE 216 Cb -0.10 -2.29 0.02 0.00 1.25 0.00 0.00 42.46 41.35 2nn1 s ILE 216 CO 0.34 -0.42 0.72 -0.55 0.24 0.00 0.00 174.94 175.27 2nn1 s SER 217 N -3.45 5.49 -0.25 4.36 0.15 -1.26 -0.79 113.70 117.95 2nn1 s SER 217 Ca 0.28 0.04 -0.26 0.00 0.70 0.00 0.00 55.95 56.70 2nn1 s SER 217 Cb -0.01 -1.06 0.10 0.00 -1.71 0.00 0.00 66.02 63.34 2nn1 s SER 217 CO 0.12 -0.96 0.91 0.54 1.20 0.00 0.00 173.24 175.05 2nn1 s VAL 218 N -2.65 0.00 0.43 4.45 0.11 -1.08 -4.45 120.40 117.22 2nn1 s VAL 218 Ca 0.54 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.59 2nn1 s VAL 218 Cb -0.10 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.74 2nn1 s VAL 218 CO 0.38 0.00 0.66 -0.94 -3.33 0.00 0.00 175.10 171.87 2nn1 s SER 219 N 0.01 5.97 0.37 3.54 1.04 -1.23 -0.32 113.70 123.09 2nn1 s SER 219 Ca 0.01 0.40 0.04 0.00 0.48 0.00 0.00 55.95 56.88 2nn1 s SER 219 Cb -0.04 -1.73 0.71 0.00 0.10 0.00 0.00 66.02 65.06 2nn1 s SER 219 CO -0.02 -0.61 2.02 0.77 0.98 0.00 0.00 173.24 176.38 2nn1 h SER 220 N 0.44 0.65 0.37 7.02 4.64 -1.94 -1.48 113.55 123.25 2nn1 h SER 220 Ca -0.47 -0.01 -0.17 0.00 -0.47 0.00 0.00 61.79 60.67 2nn1 h SER 220 Cb 1.24 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 2nn1 h SER 220 CO 0.59 0.46 -0.69 -0.33 -0.87 0.00 0.00 176.83 175.99 2nn1 h GLU 221 N 0.76 0.29 -0.32 4.77 3.07 -1.95 -2.12 114.58 119.08 2nn1 h GLU 221 Ca 0.22 -0.23 -0.13 0.00 -0.50 0.00 0.00 59.36 58.72 2nn1 h GLU 221 Cb -0.05 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2nn1 h GLU 221 CO -0.05 0.87 -0.34 1.96 -1.40 0.00 0.00 179.01 180.05 2nn1 h GLN 222 N 0.20 0.70 -0.48 2.33 4.20 -1.76 -2.30 115.11 118.00 2nn1 h GLN 222 Ca -0.02 -0.33 -0.09 0.00 0.06 0.00 0.00 58.65 58.27 2nn1 h GLN 222 Cb 1.25 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.00 2nn1 h GLN 222 CO 0.11 0.94 -0.06 -0.07 -0.67 0.00 0.00 178.83 179.08 2nn1 h LEU 223 N 0.59 0.82 -1.70 1.46 3.38 -1.21 -2.16 115.31 116.49 2nn1 h LEU 223 Ca 0.06 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2nn1 h LEU 223 Cb 0.86 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2nn1 h LEU 223 CO 0.07 0.92 0.17 0.00 0.09 0.00 0.00 178.44 179.70 2nn1 h ALA 224 N 1.16 1.78 -0.69 1.53 0.00 -1.04 -1.13 119.26 120.87 2nn1 h ALA 224 Ca 0.14 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2nn1 h ALA 224 Cb 0.55 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2nn1 h ALA 224 CO 0.03 0.20 0.15 1.96 0.00 0.00 0.00 179.25 181.59 2nn1 h GLN 225 N 0.38 1.11 -0.31 0.00 4.20 -0.84 -0.76 115.11 118.88 2nn1 h GLN 225 Ca 0.10 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 2nn1 h GLN 225 Cb -0.02 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 2nn1 h GLN 225 CO -0.02 0.98 0.17 0.74 -0.67 0.00 0.00 178.83 180.03 2nn1 h PHE 226 N 1.05 0.43 0.00 2.96 0.04 -1.08 -2.35 116.94 117.99 2nn1 h PHE 226 Ca 0.22 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.97 2nn1 h PHE 226 Cb 0.38 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.40 2nn1 h PHE 226 CO 0.03 0.35 0.00 0.54 -0.60 0.00 0.00 178.31 178.63 2nn1 n ARG 227 N -4.80 0.03 0.00 1.51 1.74 -0.87 -2.15 116.66 112.12 2nn1 n ARG 227 Ca -0.01 0.26 0.13 0.00 -0.77 0.00 0.00 57.85 57.46 2nn1 n ARG 227 Cb 0.08 -1.56 0.45 0.00 -1.02 0.00 0.00 32.46 30.41 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 -1.62 0.24 -4.76 0.55 3.41 -0.32 -3.30 113.62 107.81 2nn1 n SER 228 Ca 0.04 0.17 -0.36 0.00 -0.26 0.00 0.00 58.87 58.46 2nn1 n SER 228 Cb 0.19 -0.17 0.02 0.00 -0.26 0.00 0.00 64.21 63.99 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 -3.04 3.72 -0.07 1.04 1.43 -0.92 -4.83 118.68 116.02 2nn1 s LEU 229 Ca 0.13 2.28 -0.01 0.00 -1.03 0.00 0.00 54.13 55.50 2nn1 s LEU 229 Cb 0.18 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.79 2nn1 s LEU 229 CO 0.61 -1.39 -0.02 -0.76 0.23 0.00 0.00 176.35 175.02 2nn1 s LEU 230 N -3.90 3.43 0.05 1.79 1.43 0.23 -0.34 118.68 121.37 2nn1 s LEU 230 Ca 0.75 0.07 0.25 0.00 -1.03 0.00 0.00 54.13 54.17 2nn1 s LEU 230 Cb -0.27 -1.79 0.42 0.00 0.03 0.00 0.00 46.19 44.58 2nn1 s LEU 230 CO 0.30 0.37 1.36 -1.54 0.23 0.00 0.00 176.35 177.06 2nn1 n SER 231 N 2.11 0.57 -4.92 2.29 3.41 -0.28 -3.40 113.62 113.41 2nn1 n SER 231 Ca -0.18 -0.08 -0.26 0.00 -0.26 0.00 0.00 58.87 58.08 2nn1 n SER 231 Cb 0.53 0.25 0.04 0.00 -0.26 0.00 0.00 64.21 64.76 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 -3.55 5.50 0.42 4.04 4.22 -1.26 -4.51 114.94 119.79 2nn1 s ASN 232 Ca 0.09 0.65 -0.09 0.00 -2.14 0.00 0.00 52.86 51.37 2nn1 s ASN 232 Cb 0.16 -1.60 -0.06 0.00 1.28 0.00 0.00 41.25 41.03 2nn1 s ASN 232 CO 0.71 -1.12 0.76 0.68 -2.04 0.00 0.00 177.10 176.09 2nn1 s VAL 233 N -3.00 4.84 0.25 3.54 -7.23 -1.26 -1.04 120.40 116.50 2nn1 s VAL 233 Ca 0.55 0.46 -0.30 0.00 -1.81 0.00 0.00 61.98 60.87 2nn1 s VAL 233 Cb -0.11 -3.77 -0.14 0.00 0.56 0.00 0.00 36.38 32.93 2nn1 s VAL 233 CO 0.45 -0.60 1.24 1.21 -0.31 0.00 0.00 175.10 177.09 2nn1 n GLU 234 N -1.53 1.70 0.00 4.82 2.13 -1.26 -2.43 120.64 124.07 2nn1 n GLU 234 Ca 0.02 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.44 2nn1 n GLU 234 Cb 0.54 -2.14 0.00 0.00 0.27 0.00 0.00 31.44 30.11 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 1.67 3.10 3.76 8.31 0.00 -1.26 -5.05 105.19 115.71 2nn1 n GLY 235 Ca 0.11 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.93 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 0.00 3.82 0.35 1.61 1.11 -1.02 -4.95 116.67 117.60 2nn1 s ASP 236 Ca 0.00 1.33 -0.28 0.00 0.18 0.00 0.00 52.55 53.78 2nn1 s ASP 236 Cb 0.00 -2.02 -0.11 0.00 1.07 0.00 0.00 42.92 41.86 2nn1 s ASP 236 CO 0.00 -2.40 1.45 0.21 1.18 0.00 0.00 175.17 175.62 2nn1 s ASN 237 N -3.69 6.45 0.28 0.27 2.47 -1.26 -4.90 114.94 114.56 2nn1 s ASN 237 Ca 0.63 2.95 -0.30 0.00 0.42 0.00 0.00 52.86 56.55 2nn1 s ASN 237 Cb -0.16 -2.66 -0.11 0.00 -1.45 0.00 0.00 41.25 36.87 2nn1 s ASN 237 CO 0.55 -0.80 1.57 0.00 -3.72 0.00 0.00 177.10 174.70 2nn1 s ALA 238 N -0.98 3.73 -0.30 1.71 0.00 -1.26 -4.82 121.76 119.84 2nn1 s ALA 238 Ca 0.53 1.52 -0.02 0.00 0.00 0.00 0.00 51.96 53.99 2nn1 s ALA 238 Cb -0.45 -3.63 0.10 0.00 0.00 0.00 0.00 23.12 19.14 2nn1 s ALA 238 CO 0.59 -0.93 0.11 0.08 0.00 0.00 0.00 175.76 175.61 2nn1 s VAL 239 N 0.05 0.47 0.46 0.00 1.01 -1.26 -5.05 120.40 116.09 2nn1 s VAL 239 Ca 0.63 -1.10 -0.24 0.00 0.00 0.00 0.00 61.98 61.27 2nn1 s VAL 239 Cb -0.47 -1.36 -0.09 0.00 0.00 0.00 0.00 36.38 34.47 2nn1 s VAL 239 CO 0.46 -0.68 1.15 -2.65 0.00 0.00 0.00 175.10 173.38 2nn1 n PRO 240 N 5.02 1.56 -2.52 2.72 -0.02 -1.26 -1.12 135.00 139.38 2nn1 n PRO 240 Ca -0.04 0.56 -0.43 0.00 -2.02 0.00 0.00 63.50 61.57 2nn1 n PRO 240 Cb 0.42 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 2nn1 n PRO 240 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 2nn1 n MET 241 N -0.21 3.23 -0.15 -0.52 1.56 0.54 -4.71 117.12 116.87 2nn1 n MET 241 Ca 0.09 -3.35 -0.05 0.00 -0.27 0.00 0.00 57.70 54.12 2nn1 n MET 241 Cb 0.41 -3.29 0.04 0.00 2.15 0.00 0.00 33.22 32.53 2nn1 n MET 241 CO 0.00 0.00 0.00 1.96 -0.73 0.00 0.00 175.97 177.20 2nn1 h GLN 242 N 7.02 0.49 -2.81 2.12 1.08 -1.87 -3.38 115.11 117.76 2nn1 h GLN 242 Ca 0.43 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.59 2nn1 h GLN 242 Cb 0.81 -0.11 -0.13 0.00 -0.05 0.00 0.00 27.48 28.00 2nn1 h GLN 242 CO 1.49 0.32 0.24 -3.38 -0.95 0.00 0.00 178.83 176.55 2nn1 s HIS 243 N -6.14 -0.53 -0.18 2.96 -3.43 -1.26 -3.26 115.29 103.45 2nn1 s HIS 243 Ca -0.13 0.41 0.10 0.00 -0.80 0.00 0.00 55.06 54.64 2nn1 s HIS 243 Cb 0.13 0.54 0.26 0.00 -1.43 0.00 0.00 32.58 32.08 2nn1 s HIS 243 CO 0.73 -0.79 1.28 0.27 -2.00 0.00 0.00 174.74 174.23 2nn1 n ASN 244 N -0.21 -0.86 -4.60 7.38 0.23 -0.38 -4.85 115.26 111.97 2nn1 n ASN 244 Ca -0.16 -2.10 -0.34 0.00 -0.53 0.00 0.00 54.58 51.44 2nn1 n ASN 244 Cb 0.64 0.37 -0.10 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 -1.37 5.27 0.22 0.53 6.03 -1.23 -4.68 114.94 119.70 2nn1 s ASN 245 Ca 0.09 0.03 -0.18 0.00 -1.03 0.00 0.00 52.86 51.77 2nn1 s ASN 245 Cb 0.26 -1.81 -0.08 0.00 -3.03 0.00 0.00 41.25 36.59 2nn1 s ASN 245 CO -0.08 0.22 0.68 -0.60 -2.03 0.00 0.00 177.10 175.29 2nn1 s ARG 246 N 0.10 4.14 0.71 3.55 3.52 -1.26 -5.03 118.95 124.68 2nn1 s ARG 246 Ca 0.02 0.74 -0.14 0.00 -0.13 0.00 0.00 55.73 56.22 2nn1 s ARG 246 Cb -0.13 -2.83 0.03 0.00 -1.56 0.00 0.00 34.95 30.46 2nn1 s ARG 246 CO 0.02 0.39 1.14 -2.14 -0.81 0.00 0.00 175.30 173.89 2nn1 s PRO 247 N -2.11 2.40 0.48 5.12 0.02 -1.26 -4.71 135.00 134.94 2nn1 s PRO 247 Ca 0.43 1.49 -0.23 0.00 0.02 0.00 0.00 61.00 62.71 2nn1 s PRO 247 Cb -0.15 -1.89 -0.07 0.00 0.02 0.00 0.00 34.50 32.41 2nn1 s PRO 247 CO 0.20 -1.58 1.30 0.95 -0.33 0.00 0.00 177.00 177.54 2nn1 s THR 248 N -2.31 2.49 0.20 0.99 -4.23 -1.26 -4.37 115.64 107.15 2nn1 s THR 248 Ca 0.69 0.38 0.07 0.00 -1.18 0.00 0.00 61.69 61.65 2nn1 s THR 248 Cb -0.23 -3.20 -0.04 0.00 1.34 0.00 0.00 72.50 70.37 2nn1 s THR 248 CO 0.45 0.01 0.05 -1.10 -0.54 0.00 0.00 174.62 173.49 2nn1 s GLN 249 N -2.67 2.52 0.26 3.99 -1.52 0.14 -4.94 119.66 117.44 2nn1 s GLN 249 Ca 0.65 -1.14 -0.31 0.00 -1.95 0.00 0.00 55.36 52.62 2nn1 s GLN 249 Cb -0.37 -2.38 -0.12 0.00 -0.22 0.00 0.00 33.01 29.92 2nn1 s GLN 249 CO 0.45 0.43 1.59 -0.35 -0.25 0.00 0.00 175.29 177.16 2nn1 n PRO 250 N -0.48 2.57 0.23 2.91 -0.04 -1.26 -4.58 135.00 134.34 2nn1 n PRO 250 Ca -0.08 0.92 0.08 0.00 -0.04 0.00 0.00 63.50 64.37 2nn1 n PRO 250 Cb 0.56 -2.69 0.56 0.00 -0.04 0.00 0.00 33.50 31.89 2nn1 n PRO 250 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2nn1 h LEU 251 N 5.22 0.00 -2.05 1.53 5.85 -1.93 -3.44 115.31 120.49 2nn1 h LEU 251 Ca -0.46 0.00 -0.57 0.00 0.84 0.00 0.00 57.88 57.70 2nn1 h LEU 251 Cb 1.23 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 42.12 2nn1 h LEU 251 CO 0.83 0.20 -0.94 0.29 -0.34 0.00 0.00 178.44 178.48 2nn1 n LYS 252 N -3.96 -1.94 -0.12 1.25 5.02 -1.26 -1.53 118.16 115.63 2nn1 n LYS 252 Ca -0.02 0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2nn1 n LYS 252 Cb 0.28 -3.97 0.00 0.00 -0.02 0.00 0.00 35.03 31.32 2nn1 n LYS 252 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2nn1 n GLY 253 N -2.31 1.78 3.75 0.72 0.00 -1.26 -5.02 105.19 102.84 2nn1 n GLY 253 Ca -0.32 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.34 2.47 -0.12 1.61 0.52 -0.58 -5.03 118.95 117.48 2nn1 s ARG 254 Ca 0.00 1.46 -0.01 0.00 -0.52 0.00 0.00 55.73 56.66 2nn1 s ARG 254 Cb 0.00 -1.90 -0.02 0.00 0.52 0.00 0.00 34.95 33.54 2nn1 s ARG 254 CO 0.00 -1.52 -0.09 0.99 0.02 0.00 0.00 175.30 174.70 2nn1 s THR 255 N -2.34 3.43 -0.33 0.02 2.01 -1.26 -5.01 115.64 112.16 2nn1 s THR 255 Ca 0.68 -0.54 -0.14 0.00 0.31 0.00 0.00 61.69 62.00 2nn1 s THR 255 Cb -0.22 -2.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.82 2nn1 s THR 255 CO 0.45 0.53 0.31 -0.69 -0.69 0.00 0.00 174.62 174.53 2nn1 s VAL 256 N 0.08 5.22 0.12 3.82 1.01 -1.26 -4.62 120.40 124.77 2nn1 s VAL 256 Ca -0.03 0.05 -0.08 0.00 0.00 0.00 0.00 61.98 61.92 2nn1 s VAL 256 Cb -0.14 -3.75 -0.06 0.00 0.00 0.00 0.00 36.38 32.43 2nn1 s VAL 256 CO 0.04 -0.00 0.42 -0.13 0.00 0.00 0.00 175.10 175.42 2nn1 s ARG 257 N 1.92 3.73 0.01 2.72 0.52 -0.15 -1.59 118.95 126.10 2nn1 s ARG 257 Ca 0.10 0.12 0.05 0.00 -0.52 0.00 0.00 55.73 55.48 2nn1 s ARG 257 Cb -0.17 -2.90 -0.03 0.00 0.52 0.00 0.00 34.95 32.38 2nn1 s ARG 257 CO 0.11 0.49 -0.15 0.00 0.02 0.00 0.00 175.30 175.77 2nn1 s ALA 258 N -1.54 2.69 -0.88 2.13 0.00 -0.16 -0.64 121.76 123.36 2nn1 s ALA 258 Ca 0.38 -1.09 0.25 0.00 0.00 0.00 0.00 51.96 51.49 2nn1 s ALA 258 Cb -0.13 -0.88 0.49 0.00 0.00 0.00 0.00 23.12 22.61 2nn1 s ALA 258 CO 0.21 0.58 1.41 -1.13 0.00 0.00 0.00 175.76 176.82 2nn1 n SER 259 N 1.79 0.53 0.00 0.00 3.41 -0.18 -2.68 113.62 116.49 2nn1 n SER 259 Ca -0.16 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 2nn1 n SER 259 Cb 0.52 0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.66 2nn1 n SER 259 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10