#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nu9 s VAL 2 N 0.00 5.23 0.00 1.39 1.01 -1.26 -4.90 120.40 121.87 1nu9 s VAL 2 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1nu9 s VAL 2 Cb 0.00 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.73 1nu9 s VAL 2 CO 0.00 0.23 0.00 0.35 0.00 0.00 0.00 175.10 175.68 1nu9 n THR 3 N 4.75 0.00 -3.90 3.92 -2.24 -1.26 -5.12 114.28 110.43 1nu9 n THR 3 Ca -0.10 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.47 1nu9 n THR 3 Cb 0.51 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.70 1nu9 n THR 3 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1nu9 s LYS 4 N -0.87 3.06 -0.23 -0.78 1.02 -1.26 -5.10 119.74 115.57 1nu9 s LYS 4 Ca 0.00 -1.02 -0.06 0.00 0.02 0.00 0.00 55.97 54.91 1nu9 s LYS 4 Cb 0.00 -2.68 -0.03 0.00 -0.52 0.00 0.00 37.83 34.60 1nu9 s LYS 4 CO 0.00 0.29 0.04 0.34 -0.92 0.00 0.00 175.35 175.10 1nu9 s ASP 5 N -3.97 4.99 -0.02 2.83 3.68 -1.26 -4.96 116.67 117.96 1nu9 s ASP 5 Ca 0.37 -0.21 0.14 0.00 2.13 0.00 0.00 52.55 54.98 1nu9 s ASP 5 Cb -0.08 -1.88 0.42 0.00 -1.45 0.00 0.00 42.92 39.93 1nu9 s ASP 5 CO 0.27 -0.00 1.35 -1.22 0.13 0.00 0.00 175.17 175.70 1nu9 n TYR 6 N 4.70 0.67 0.31 -5.34 4.02 -1.26 -4.66 117.16 115.61 1nu9 n TYR 6 Ca -0.17 -0.53 0.19 0.00 -0.01 0.00 0.00 57.90 57.38 1nu9 n TYR 6 Cb 0.51 -0.05 1.04 0.00 -0.02 0.00 0.00 39.34 40.82 1nu9 n TYR 6 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1nu9 h SER 7 N 2.62 0.00 -0.27 7.72 4.64 -1.93 -2.40 113.55 123.93 1nu9 h SER 7 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1nu9 h SER 7 Cb 0.88 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.94 1nu9 h SER 7 CO 0.03 0.01 -0.01 0.29 -0.87 0.00 0.00 176.83 176.28 1nu9 n LYS 8 N -3.49 2.51 0.00 4.77 4.76 -1.26 -4.60 118.16 120.84 1nu9 n LYS 8 Ca -0.03 -2.91 0.10 0.00 -2.87 0.00 0.00 58.31 52.60 1nu9 n LYS 8 Cb 0.09 -1.82 0.04 0.00 -1.84 0.00 0.00 35.03 31.50 1nu9 n LYS 8 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1nu9 n GLU 9 N -0.75 1.68 -2.76 1.97 4.07 -0.90 -4.98 120.64 118.96 1nu9 n GLU 9 Ca 0.25 -1.35 -0.35 0.00 -0.06 0.00 0.00 57.16 55.65 1nu9 n GLU 9 Cb 0.92 -1.40 -0.06 0.00 -0.06 0.00 0.00 31.44 30.84 1nu9 n GLU 9 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1nu9 s SER 10 N -1.98 7.01 0.00 4.31 0.15 -1.26 -4.64 113.70 117.30 1nu9 s SER 10 Ca 0.21 1.79 0.22 0.00 0.70 0.00 0.00 55.95 58.86 1nu9 s SER 10 Cb 0.17 -2.56 0.53 0.00 -1.71 0.00 0.00 66.02 62.44 1nu9 s SER 10 CO 0.38 -0.31 1.44 0.54 1.20 0.00 0.00 173.24 176.49 1nu9 n ARG 11 N -0.22 2.27 -2.54 5.44 5.12 -1.26 -4.93 116.66 120.54 1nu9 n ARG 11 Ca 0.05 -1.93 -0.41 0.00 -1.93 0.00 0.00 57.85 53.64 1nu9 n ARG 11 Cb 0.52 -1.47 -0.04 0.00 -1.16 0.00 0.00 32.46 30.31 1nu9 n ARG 11 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1nu9 s VAL 12 N -1.53 3.86 0.10 1.55 1.01 -1.26 -4.97 120.40 119.16 1nu9 s VAL 12 Ca 0.37 1.65 -0.31 0.00 0.00 0.00 0.00 61.98 63.69 1nu9 s VAL 12 Cb 0.21 -4.05 -0.07 0.00 0.00 0.00 0.00 36.38 32.46 1nu9 s VAL 12 CO 0.29 0.31 1.31 0.20 0.00 0.00 0.00 175.10 177.21 1nu9 s ASN 13 N -0.29 6.93 0.60 3.32 0.01 -1.26 -4.89 114.94 119.36 1nu9 s ASN 13 Ca 0.48 2.21 0.28 0.00 -0.71 0.00 0.00 52.86 55.12 1nu9 s ASN 13 Cb -0.29 -2.59 1.30 0.00 0.41 0.00 0.00 41.25 40.08 1nu9 s ASN 13 CO 0.35 -0.57 1.71 1.05 -1.51 0.00 0.00 177.10 178.14 1nu9 h GLU 14 N 6.64 0.00 -0.00 -0.60 -0.00 -1.98 0.75 114.58 119.37 1nu9 h GLU 14 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.94 1nu9 h GLU 14 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.96 1nu9 h GLU 14 CO 0.83 0.00 -0.73 0.09 -0.00 0.00 0.00 179.01 179.20 1nu9 n ASN 15 N -3.46 1.05 -0.20 3.06 5.03 -1.26 -4.31 115.26 115.17 1nu9 n ASN 15 Ca 0.11 -0.89 0.14 0.00 0.87 0.00 0.00 54.58 54.81 1nu9 n ASN 15 Cb 0.89 0.66 0.46 0.00 -1.02 0.00 0.00 39.78 40.77 1nu9 n ASN 15 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1nu9 h SER 16 N 0.49 0.48 0.59 6.41 0.02 -1.22 -1.24 113.55 119.08 1nu9 h SER 16 Ca 0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1nu9 h SER 16 Cb 0.54 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1nu9 h SER 16 CO 0.00 0.25 0.00 2.29 -1.14 0.00 0.00 176.83 178.23 1nu9 n LYS 17 N -4.51 0.09 0.00 3.45 0.00 -1.26 -2.30 118.16 113.62 1nu9 n LYS 17 Ca 0.15 0.33 0.14 0.00 -0.00 0.00 0.00 58.31 58.93 1nu9 n LYS 17 Cb 0.51 -1.67 0.45 0.00 -0.00 0.00 0.00 35.03 34.33 1nu9 n LYS 17 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1nu9 n TYR 18 N -1.83 0.00 -0.42 5.58 4.02 -0.47 -4.88 117.16 119.16 1nu9 n TYR 18 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 1nu9 n TYR 18 Cb 0.19 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.48 1nu9 n TYR 18 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1nu9 n GLY 19 N 1.23 -2.43 3.69 2.72 0.00 -0.97 -4.95 105.19 104.47 1nu9 n GLY 19 Ca 0.17 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.33 1nu9 n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nu9 s THR 20 N -0.87 4.00 0.30 2.61 2.01 -1.26 -4.93 115.64 117.50 1nu9 s THR 20 Ca 0.00 1.35 -0.29 0.00 0.31 0.00 0.00 61.69 63.06 1nu9 s THR 20 Cb 0.00 -3.87 -0.10 0.00 0.01 0.00 0.00 72.50 68.54 1nu9 s THR 20 CO 0.00 -0.00 1.18 -0.76 -0.69 0.00 0.00 174.62 174.35 1nu9 s LEU 21 N 2.30 4.49 0.36 4.42 1.43 -1.26 -4.26 118.68 126.16 1nu9 s LEU 21 Ca 0.60 2.43 -0.26 0.00 -1.03 0.00 0.00 54.13 55.86 1nu9 s LEU 21 Cb -0.28 -3.65 -0.09 0.00 0.03 0.00 0.00 46.19 42.20 1nu9 s LEU 21 CO 0.24 -0.30 1.15 -0.63 0.23 0.00 0.00 176.35 177.03 1nu9 s ILE 22 N -1.17 3.28 0.37 -0.59 1.01 -0.09 -4.98 121.20 119.03 1nu9 s ILE 22 Ca 0.47 1.13 -0.28 0.00 0.00 0.00 0.00 60.65 61.97 1nu9 s ILE 22 Cb -0.35 -3.66 -0.11 0.00 0.01 0.00 0.00 42.46 38.35 1nu9 s ILE 22 CO 0.45 0.15 1.49 -0.44 0.00 0.00 0.00 174.94 176.59 1nu9 s SER 23 N -1.07 6.36 0.21 3.58 0.01 -1.26 -4.72 113.70 116.82 1nu9 s SER 23 Ca 0.53 3.03 -0.10 0.00 1.31 0.00 0.00 55.95 60.72 1nu9 s SER 23 Cb -0.31 -2.67 0.30 0.00 0.21 0.00 0.00 66.02 63.56 1nu9 s SER 23 CO 0.39 -0.86 1.66 -0.78 0.41 0.00 0.00 173.24 174.06 1nu9 h ASP 24 N 3.15 -0.26 -0.02 2.44 3.58 -1.94 0.14 116.42 123.51 1nu9 h ASP 24 Ca -0.50 0.15 0.01 0.00 0.42 0.00 0.00 57.03 57.10 1nu9 h ASP 24 Cb 1.24 0.27 -0.00 0.00 1.72 0.00 0.00 39.33 42.55 1nu9 h ASP 24 CO 0.65 -0.11 0.01 4.11 -2.88 0.00 0.00 179.24 181.03 1nu9 h TRP 25 N 0.13 0.00 0.00 0.28 5.08 -2.01 -1.18 115.95 118.24 1nu9 h TRP 25 Ca 0.33 0.00 -0.26 0.00 1.08 0.00 0.00 58.89 60.04 1nu9 h TRP 25 Cb 0.53 0.00 -0.05 0.00 -3.00 0.00 0.00 29.16 26.64 1nu9 h TRP 25 CO -0.36 0.00 -1.70 0.98 -1.28 0.00 0.00 178.44 176.08 1nu9 n TYR 26 N -4.34 0.88 -0.12 0.12 9.36 -0.43 -4.19 117.16 118.44 1nu9 n TYR 26 Ca -0.03 0.31 -0.05 0.00 3.32 0.00 0.00 57.90 61.46 1nu9 n TYR 26 Cb 0.11 -1.13 0.03 0.00 -0.63 0.00 0.00 39.34 37.72 1nu9 n TYR 26 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 1nu9 h LEU 27 N 0.00 0.07 -0.77 2.98 5.85 0.46 -2.68 115.31 121.22 1nu9 h LEU 27 Ca -0.27 0.06 0.17 0.00 0.84 0.00 0.00 57.88 58.68 1nu9 h LEU 27 Cb 1.90 0.07 -0.11 0.00 0.37 0.00 0.00 40.66 42.88 1nu9 h LEU 27 CO 0.06 0.08 0.22 0.11 -0.34 0.00 0.00 178.44 178.56 1nu9 h LYS 28 N 0.25 0.28 0.00 1.25 1.79 -1.63 0.15 116.57 118.67 1nu9 h LYS 28 Ca 0.19 -0.02 -0.09 0.00 -2.18 0.00 0.00 60.65 58.55 1nu9 h LYS 28 Cb 0.21 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 1nu9 h LYS 28 CO -0.23 0.19 -0.44 0.78 -1.08 0.00 0.00 179.45 178.67 1nu9 h GLY 29 N 0.29 0.00 1.71 3.86 0.00 -1.70 -2.05 103.07 105.19 1nu9 h GLY 29 Ca 0.44 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.59 1nu9 h GLY 29 CO -0.52 0.00 -0.79 3.21 0.00 0.00 0.00 176.54 178.44 1nu9 h ARG 30 N 0.00 0.27 -0.28 4.80 2.47 -0.58 -2.26 114.38 118.80 1nu9 h ARG 30 Ca -0.00 -0.25 -0.11 0.00 -1.26 0.00 0.00 59.98 58.35 1nu9 h ARG 30 Cb 0.90 0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 29.28 1nu9 h ARG 30 CO 0.06 0.93 -0.26 -0.07 0.56 0.00 0.00 179.97 181.19 1nu9 h LEU 31 N 0.17 0.72 -0.94 3.04 3.38 -0.91 -1.89 115.31 118.88 1nu9 h LEU 31 Ca -0.04 -0.46 0.01 0.00 0.09 0.00 0.00 57.88 57.48 1nu9 h LEU 31 Cb 1.38 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 1nu9 h LEU 31 CO 0.13 1.04 0.62 0.74 0.09 0.00 0.00 178.44 181.05 1nu9 h THR 32 N 0.42 1.25 -0.43 0.22 2.02 -1.38 -0.24 112.91 114.76 1nu9 h THR 32 Ca 0.05 -0.46 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 1nu9 h THR 32 Cb 0.82 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1nu9 h THR 32 CO 0.07 0.24 0.12 -1.28 0.37 0.00 0.00 175.52 175.03 1nu9 h SER 33 N 1.28 0.59 -0.24 4.18 0.87 -1.25 -1.10 113.55 117.88 1nu9 h SER 33 Ca 0.34 -0.08 -0.19 0.00 -1.23 0.00 0.00 61.79 60.63 1nu9 h SER 33 Cb -0.13 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.68 1nu9 h SER 33 CO -0.07 0.58 -0.58 -0.07 -0.53 0.00 0.00 176.83 176.15 1nu9 h LEU 34 N 0.63 0.95 -0.73 2.23 3.38 -0.38 -2.12 115.31 119.27 1nu9 h LEU 34 Ca 0.15 -0.53 0.04 0.00 0.09 0.00 0.00 57.88 57.63 1nu9 h LEU 34 Cb 0.22 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1nu9 h LEU 34 CO -0.01 1.32 0.45 -0.08 0.09 0.00 0.00 178.44 180.21 1nu9 h GLU 35 N 0.64 0.83 -0.58 1.13 4.81 -0.60 -1.87 114.58 118.95 1nu9 h GLU 35 Ca 0.00 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 1nu9 h GLU 35 Cb 1.19 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 1nu9 h GLU 35 CO 0.13 0.55 0.02 0.77 -0.73 0.00 0.00 179.01 179.75 1nu9 h SER 36 N 0.86 0.96 -0.79 1.04 0.02 -1.08 -1.54 113.55 113.02 1nu9 h SER 36 Ca 0.30 -0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 60.96 1nu9 h SER 36 Cb 0.07 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.31 1nu9 h SER 36 CO -0.13 1.00 0.32 1.56 -1.14 0.00 0.00 176.83 178.44 1nu9 h GLN 37 N 0.91 1.18 -0.37 3.45 4.20 -0.86 0.21 115.11 123.83 1nu9 h GLN 37 Ca 0.17 -0.21 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 1nu9 h GLN 37 Cb 0.50 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1nu9 h GLN 37 CO 0.02 0.95 0.05 0.74 -0.67 0.00 0.00 178.83 179.92 1nu9 h PHE 38 N 1.15 0.67 -0.51 2.96 -1.00 -0.98 -0.52 116.94 118.70 1nu9 h PHE 38 Ca 0.26 -0.10 -0.00 0.00 2.81 0.00 0.00 57.97 60.95 1nu9 h PHE 38 Cb 0.21 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 39.56 1nu9 h PHE 38 CO 0.02 0.68 0.32 0.82 -1.61 0.00 0.00 178.31 178.54 1nu9 h ILE 39 N 0.46 1.15 -0.72 -0.55 2.04 -0.96 -0.52 117.51 118.40 1nu9 h ILE 39 Ca 0.11 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.62 1nu9 h ILE 39 Cb 0.38 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1nu9 h ILE 39 CO 0.01 0.15 0.31 -1.13 0.00 0.00 0.00 178.15 177.49 1nu9 h ASN 40 N 0.69 0.97 -0.39 1.72 -1.24 -0.74 -0.60 115.58 115.98 1nu9 h ASN 40 Ca 0.18 -0.16 -0.09 0.00 0.71 0.00 0.00 56.30 56.95 1nu9 h ASN 40 Cb -0.03 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.76 1nu9 h ASN 40 CO -0.04 0.86 -0.09 0.00 -1.29 0.00 0.00 177.43 176.87 1nu9 h ALA 41 N 1.15 0.54 -0.33 1.57 0.00 -0.55 -1.90 119.26 119.74 1nu9 h ALA 41 Ca 0.24 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1nu9 h ALA 41 Cb 0.17 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1nu9 h ALA 41 CO -0.02 0.40 -0.11 -0.07 0.00 0.00 0.00 179.25 179.44 1nu9 h LEU 42 N 0.57 0.54 -0.63 0.00 3.38 -1.00 -2.26 115.31 115.91 1nu9 h LEU 42 Ca 0.10 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1nu9 h LEU 42 Cb 0.61 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1nu9 h LEU 42 CO 0.04 0.69 0.27 1.23 0.09 0.00 0.00 178.44 180.76 1nu9 h GLY 43 N 0.94 1.00 1.13 0.83 0.00 -0.80 -0.42 103.07 105.74 1nu9 h GLY 43 Ca 0.09 -0.53 -0.08 0.00 0.00 0.00 0.00 47.33 46.82 1nu9 h GLY 43 CO 0.03 0.50 0.11 -2.22 0.00 0.00 0.00 176.54 174.96 1nu9 h ILE 44 N 0.87 1.26 -0.20 2.60 2.04 -1.14 -2.40 117.51 120.54 1nu9 h ILE 44 Ca 0.21 -1.01 0.04 0.00 1.00 0.00 0.00 64.86 65.10 1nu9 h ILE 44 Cb 0.18 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 1nu9 h ILE 44 CO -0.02 0.38 -0.03 0.25 0.00 0.00 0.00 178.15 178.73 1nu9 h LEU 45 N 1.00 -0.13 0.00 1.44 7.12 -0.79 -2.55 115.31 121.40 1nu9 h LEU 45 Ca 0.20 0.05 0.00 0.00 0.13 0.00 0.00 57.88 58.26 1nu9 h LEU 45 Cb 0.42 0.10 0.00 0.00 -0.53 0.00 0.00 40.66 40.65 1nu9 h LEU 45 CO 0.01 -0.04 0.00 -0.62 -0.13 0.00 0.00 178.44 177.66 1nu9 n GLU 46 N -5.17 0.06 -1.62 1.25 -0.58 -0.23 -4.87 120.64 109.47 1nu9 n GLU 46 Ca -0.02 0.19 -0.56 0.00 -0.42 0.00 0.00 57.16 56.35 1nu9 n GLU 46 Cb 0.12 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 29.42 1nu9 n GLU 46 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1nu9 n THR 47 N -1.45 0.08 -0.29 2.62 -1.04 -0.93 -4.82 114.28 108.44 1nu9 n THR 47 Ca 0.05 -0.02 0.12 0.00 -2.04 0.00 0.00 64.05 62.17 1nu9 n THR 47 Cb 0.18 -0.76 0.29 0.00 -1.82 0.00 0.00 70.33 68.22 1nu9 n THR 47 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 1nu9 h TYR 48 N 5.06 0.47 -1.00 -1.42 3.20 -1.91 0.97 116.97 122.33 1nu9 h TYR 48 Ca -0.48 0.05 0.24 0.00 3.14 0.00 0.00 58.73 61.68 1nu9 h TYR 48 Cb 1.35 -0.07 -0.09 0.00 1.54 0.00 0.00 36.73 39.46 1nu9 h TYR 48 CO 0.65 -0.13 0.65 1.25 -1.64 0.00 0.00 178.16 178.93 1nu9 h HIS 49 N 0.29 0.67 -0.22 -3.82 2.76 -1.90 0.29 115.15 113.22 1nu9 h HIS 49 Ca 0.54 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.73 1nu9 h HIS 49 Cb 1.05 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.82 1nu9 h HIS 49 CO -0.21 0.10 0.00 0.66 -1.30 0.00 0.00 177.93 177.19 1nu9 n TYR 50 N -4.61 0.29 1.40 5.26 0.53 0.33 -4.05 117.16 116.31 1nu9 n TYR 50 Ca 0.23 -0.14 0.00 0.00 -1.02 0.00 0.00 57.90 56.97 1nu9 n TYR 50 Cb 0.80 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 39.11 1nu9 n TYR 50 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1nu9 n GLY 51 N 1.02 -0.06 3.88 2.72 0.00 0.09 -4.68 105.19 108.15 1nu9 n GLY 51 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1nu9 n GLY 51 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nu9 s GLU 52 N -1.63 3.78 0.37 1.61 2.56 -1.26 -5.00 118.70 119.14 1nu9 s GLU 52 Ca 0.00 0.34 0.04 0.00 0.00 0.00 0.00 54.97 55.35 1nu9 s GLU 52 Cb 0.00 -2.51 0.73 0.00 2.00 0.00 0.00 34.13 34.34 1nu9 s GLU 52 CO 0.00 0.13 2.02 0.87 -0.56 0.00 0.00 175.26 177.72 1nu9 h LYS 53 N 1.78 0.69 0.00 4.30 1.57 -1.97 -2.47 116.57 120.47 1nu9 h LYS 53 Ca -0.47 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 1nu9 h LYS 53 Cb 1.18 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.34 1nu9 h LYS 53 CO 0.66 0.47 0.00 0.39 -0.57 0.00 0.00 179.45 180.40 1nu9 n GLU 54 N -4.44 0.02 -0.01 3.15 4.71 -1.26 -1.72 120.64 121.09 1nu9 n GLU 54 Ca 0.05 0.43 0.12 0.00 -0.01 0.00 0.00 57.16 57.75 1nu9 n GLU 54 Cb 0.06 -1.56 0.13 0.00 -1.01 0.00 0.00 31.44 29.06 1nu9 n GLU 54 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1nu9 n TYR 55 N -1.61 0.03 -0.05 -0.32 4.02 -0.93 -4.66 117.16 113.64 1nu9 n TYR 55 Ca 0.01 -0.02 -0.12 0.00 -0.01 0.00 0.00 57.90 57.76 1nu9 n TYR 55 Cb 0.07 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.32 1nu9 n TYR 55 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1nu9 h LYS 56 N 4.58 -0.43 0.13 -0.72 3.64 -1.46 0.07 116.57 122.38 1nu9 h LYS 56 Ca 0.00 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1nu9 h LYS 56 Cb 0.98 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1nu9 h LYS 56 CO 0.00 -0.29 -0.06 -0.44 -2.27 0.00 0.00 179.45 176.39 1nu9 h ASP 57 N -0.45 -0.14 -0.98 4.20 3.32 -1.83 0.17 116.42 120.71 1nu9 h ASP 57 Ca 0.09 -0.08 0.19 0.00 0.02 0.00 0.00 57.03 57.25 1nu9 h ASP 57 Cb 0.62 0.04 -0.11 0.00 0.22 0.00 0.00 39.33 40.10 1nu9 h ASP 57 CO -0.48 -0.01 0.58 0.00 -1.72 0.00 0.00 179.24 177.61 1nu9 h ALA 58 N 0.60 1.61 -0.11 3.45 0.00 -1.82 0.25 119.26 123.23 1nu9 h ALA 58 Ca -0.02 0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.75 1nu9 h ALA 58 Cb 0.21 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.95 1nu9 h ALA 58 CO 0.03 -0.07 -0.82 0.87 0.00 0.00 0.00 179.25 179.25 1nu9 h LYS 59 N 0.72 0.71 -0.64 0.00 1.57 -0.56 -1.84 116.57 116.54 1nu9 h LYS 59 Ca 0.56 -0.62 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 1nu9 h LYS 59 Cb 0.88 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.30 1nu9 h LYS 59 CO -0.39 1.22 0.28 -0.44 -0.57 0.00 0.00 179.45 179.55 1nu9 h ASP 60 N 0.47 0.86 -0.18 0.86 3.45 0.88 0.11 116.42 122.86 1nu9 h ASP 60 Ca -0.06 -0.15 -0.00 0.00 0.43 0.00 0.00 57.03 57.24 1nu9 h ASP 60 Cb 1.45 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 39.99 1nu9 h ASP 60 CO 0.16 0.77 0.10 0.50 -1.57 0.00 0.00 179.24 179.20 1nu9 h LYS 61 N 0.89 0.25 -0.65 3.56 3.64 -0.56 -1.43 116.57 122.27 1nu9 h LYS 61 Ca 0.22 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.48 1nu9 h LYS 61 Cb 0.16 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1nu9 h LYS 61 CO -0.02 0.25 0.07 1.25 -2.27 0.00 0.00 179.45 178.73 1nu9 h LEU 62 N 0.19 1.06 -0.71 5.20 5.85 -1.02 -2.51 115.31 123.37 1nu9 h LEU 62 Ca 0.06 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1nu9 h LEU 62 Cb 0.07 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.78 1nu9 h LEU 62 CO -0.01 1.07 0.35 -0.03 -0.34 0.00 0.00 178.44 179.49 1nu9 h MET 63 N 1.02 1.01 -0.72 1.25 4.05 -0.85 -0.13 114.93 120.55 1nu9 h MET 63 Ca 0.19 -0.14 -0.03 0.00 -0.28 0.00 0.00 59.70 59.44 1nu9 h MET 63 Cb 0.48 -0.19 -0.03 0.00 -0.80 0.00 0.00 31.60 31.06 1nu9 h MET 63 CO 0.02 0.78 0.33 1.15 0.23 0.00 0.00 176.91 179.42 1nu9 h THR 64 N 0.98 1.24 -0.33 -0.77 2.02 -1.12 0.24 112.91 115.18 1nu9 h THR 64 Ca 0.24 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.69 1nu9 h THR 64 Cb 0.10 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1nu9 h THR 64 CO -0.03 0.29 0.05 0.03 0.37 0.00 0.00 175.52 176.23 1nu9 h ARG 65 N 1.02 0.54 -0.20 6.66 2.47 -1.00 0.41 114.38 124.28 1nu9 h ARG 65 Ca 0.25 -0.15 -0.02 0.00 -1.26 0.00 0.00 59.98 58.80 1nu9 h ARG 65 Cb 0.15 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.39 1nu9 h ARG 65 CO -0.03 0.63 0.06 0.82 0.56 0.00 0.00 179.97 182.01 1nu9 h ILE 66 N 0.38 1.19 0.00 2.04 2.04 -0.73 -1.76 117.51 120.67 1nu9 h ILE 66 Ca 0.10 -0.60 -0.07 0.00 1.00 0.00 0.00 64.86 65.29 1nu9 h ILE 66 Cb 0.35 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 1nu9 h ILE 66 CO 0.01 0.19 -0.35 -0.07 0.00 0.00 0.00 178.15 177.93 1nu9 h LEU 67 N 0.15 0.00 -0.33 1.44 3.38 -0.47 -0.79 115.31 118.68 1nu9 h LEU 67 Ca 0.06 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1nu9 h LEU 67 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1nu9 h LEU 67 CO -0.00 0.35 0.12 1.23 0.09 0.00 0.00 178.44 180.23 1nu9 h GLY 68 N 1.47 0.54 2.00 0.83 0.00 -0.59 0.49 103.07 107.80 1nu9 h GLY 68 Ca -0.00 -0.30 -0.12 0.00 0.00 0.00 0.00 47.33 46.91 1nu9 h GLY 68 CO 0.05 0.28 -0.57 0.83 0.00 0.00 0.00 176.54 177.13 1nu9 h GLU 69 N 0.38 0.00 -0.37 4.80 4.39 -0.92 -2.24 114.58 120.62 1nu9 h GLU 69 Ca 0.11 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.71 1nu9 h GLU 69 Cb 0.21 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 1nu9 h GLU 69 CO -0.01 0.57 -0.16 0.22 -1.16 0.00 0.00 179.01 178.47 1nu9 h ASP 70 N 0.00 0.79 -0.46 1.42 1.82 -0.76 -2.85 116.42 116.38 1nu9 h ASP 70 Ca -0.01 -0.40 -0.03 0.00 -0.39 0.00 0.00 57.03 56.21 1nu9 h ASP 70 Cb 1.16 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 40.93 1nu9 h ASP 70 CO 0.07 1.01 0.19 -0.61 -1.61 0.00 0.00 179.24 178.30 1nu9 h GLN 71 N 0.57 0.74 -0.09 0.28 5.75 0.13 -1.17 115.11 121.31 1nu9 h GLN 71 Ca 0.09 -0.11 0.03 0.00 -0.15 0.00 0.00 58.65 58.51 1nu9 h GLN 71 Cb 0.71 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 29.09 1nu9 h GLN 71 CO 0.05 0.62 -0.12 -0.92 -2.65 0.00 0.00 178.83 175.81 1nu9 h TYR 72 N 0.73 -0.30 -0.65 3.99 3.20 -1.18 0.88 116.97 123.63 1nu9 h TYR 72 Ca 0.17 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.97 1nu9 h TYR 72 Cb 0.17 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 1nu9 h TYR 72 CO 0.01 -0.18 0.06 -0.07 -1.64 0.00 0.00 178.16 176.34 1nu9 h LEU 73 N -0.16 1.07 -0.85 2.82 -0.00 -1.30 -1.91 115.31 114.98 1nu9 h LEU 73 Ca 0.07 -0.28 -0.02 0.00 -0.00 0.00 0.00 57.88 57.66 1nu9 h LEU 73 Cb 0.26 -0.29 -0.04 0.00 -0.00 0.00 0.00 40.66 40.60 1nu9 h LEU 73 CO -0.19 1.08 0.46 0.25 -0.00 0.00 0.00 178.44 180.04 1nu9 h LEU 74 N 1.02 1.06 -0.70 1.67 5.85 -0.83 -0.16 115.31 123.21 1nu9 h LEU 74 Ca 0.19 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.70 1nu9 h LEU 74 Cb 0.50 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 1nu9 h LEU 74 CO 0.02 0.86 -0.15 -0.33 -0.34 0.00 0.00 178.44 178.50 1nu9 h GLU 75 N 1.18 0.85 -0.67 1.25 5.08 -0.64 -1.61 114.58 120.02 1nu9 h GLU 75 Ca 0.30 -0.31 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1nu9 h GLU 75 Cb 0.04 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1nu9 h GLU 75 CO -0.05 0.94 0.23 0.00 -1.00 0.00 0.00 179.01 179.13 1nu9 h ARG 76 N 0.75 1.02 -0.36 2.33 2.47 -0.87 -0.50 114.38 119.22 1nu9 h ARG 76 Ca 0.12 -0.21 0.01 0.00 -1.26 0.00 0.00 59.98 58.63 1nu9 h ARG 76 Cb 0.66 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.81 1nu9 h ARG 76 CO 0.05 0.88 0.24 -0.22 0.56 0.00 0.00 179.97 181.47 1nu9 h LYS 77 N 0.96 0.47 -0.32 0.04 3.64 -0.81 0.18 116.57 120.73 1nu9 h LYS 77 Ca 0.22 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.58 1nu9 h LYS 77 Cb 0.27 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1nu9 h LYS 77 CO -0.01 0.31 0.20 0.87 -2.27 0.00 0.00 179.45 178.55 1nu9 h LYS 78 N 0.48 0.40 -0.18 1.90 1.57 -0.87 0.32 116.57 120.19 1nu9 h LYS 78 Ca 0.13 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1nu9 h LYS 78 Cb -0.05 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1nu9 h LYS 78 CO -0.03 0.26 0.08 0.28 -0.57 0.00 0.00 179.45 179.47 1nu9 h VAL 79 N 0.41 1.13 -0.17 0.50 2.07 -0.84 -2.53 116.25 116.83 1nu9 h VAL 79 Ca 0.12 -0.39 -0.06 0.00 0.82 0.00 0.00 66.70 67.19 1nu9 h VAL 79 Cb -0.02 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1nu9 h VAL 79 CO -0.04 0.13 -0.15 1.56 0.02 0.00 0.00 177.57 179.09 1nu9 h GLN 80 N 0.15 0.28 -0.49 1.57 4.20 -0.19 -2.63 115.11 117.99 1nu9 h GLN 80 Ca 0.06 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 1nu9 h GLN 80 Cb 0.13 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 1nu9 h GLN 80 CO -0.01 0.43 -0.06 -0.92 -0.67 0.00 0.00 178.83 177.61 1nu9 h TYR 81 N 0.26 0.94 -0.61 2.96 3.20 -0.15 0.40 116.97 123.97 1nu9 h TYR 81 Ca 0.05 -0.16 -0.01 0.00 3.14 0.00 0.00 58.73 61.75 1nu9 h TYR 81 Cb 0.42 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.42 1nu9 h TYR 81 CO 0.01 0.88 0.35 0.93 -1.64 0.00 0.00 178.16 178.69 1nu9 h GLU 82 N 0.79 0.84 -0.57 1.82 4.39 -1.10 -0.85 114.58 119.89 1nu9 h GLU 82 Ca 0.14 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.71 1nu9 h GLU 82 Cb 0.55 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1nu9 h GLU 82 CO 0.03 0.62 0.18 0.93 -1.16 0.00 0.00 179.01 179.61 1nu9 h GLU 83 N 0.82 0.88 -0.88 2.33 4.39 -1.21 -2.83 114.58 118.08 1nu9 h GLU 83 Ca 0.22 -0.19 0.03 0.00 0.34 0.00 0.00 59.36 59.76 1nu9 h GLU 83 Cb 0.02 -0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 28.49 1nu9 h GLU 83 CO -0.04 0.80 0.57 -0.92 -1.16 0.00 0.00 179.01 178.26 1nu9 h TYR 84 N 0.80 1.07 -0.56 4.33 3.20 -0.33 -1.13 116.97 124.35 1nu9 h TYR 84 Ca 0.18 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.05 1nu9 h TYR 84 Cb 0.28 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 38.17 1nu9 h TYR 84 CO 0.02 0.62 0.21 0.87 -1.64 0.00 0.00 178.16 178.24 1nu9 h LYS 85 N 1.12 0.84 -0.92 1.82 1.57 -0.97 0.31 116.57 120.34 1nu9 h LYS 85 Ca 0.35 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 1nu9 h LYS 85 Cb -0.00 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.13 1nu9 h LYS 85 CO -0.11 0.74 0.52 0.87 -0.57 0.00 0.00 179.45 180.90 1nu9 h LYS 86 N 0.77 1.27 -0.50 3.15 1.57 -1.22 -1.26 116.57 120.36 1nu9 h LYS 86 Ca 0.18 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 1nu9 h LYS 86 Cb 0.22 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1nu9 h LYS 86 CO -0.01 0.91 -0.10 1.25 -0.57 0.00 0.00 179.45 180.94 1nu9 h LEU 87 N 1.28 0.94 -1.16 2.94 5.85 -0.46 -1.99 115.31 122.72 1nu9 h LEU 87 Ca 0.33 -0.35 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 1nu9 h LEU 87 Cb -0.00 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.73 1nu9 h LEU 87 CO -0.06 1.07 0.49 0.22 -0.34 0.00 0.00 178.44 179.83 1nu9 h TYR 88 N 0.80 1.03 -0.43 1.25 3.20 0.02 0.35 116.97 123.18 1nu9 h TYR 88 Ca 0.13 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 1nu9 h TYR 88 Cb 0.65 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 1nu9 h TYR 88 CO 0.05 0.67 -0.09 -0.22 -1.64 0.00 0.00 178.16 176.93 1nu9 h LYS 89 N 1.09 0.82 -0.27 1.82 3.64 -0.96 -0.32 116.57 122.38 1nu9 h LYS 89 Ca 0.29 -0.31 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1nu9 h LYS 89 Cb -0.07 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 1nu9 h LYS 89 CO -0.06 0.93 0.13 -0.22 -2.27 0.00 0.00 179.45 177.97 1nu9 h LYS 90 N 0.64 0.39 -0.79 1.90 3.64 -0.81 -1.98 116.57 119.56 1nu9 h LYS 90 Ca 0.11 -0.06 0.15 0.00 -1.27 0.00 0.00 60.65 59.58 1nu9 h LYS 90 Cb 0.62 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.32 1nu9 h LYS 90 CO 0.04 0.38 0.52 -0.92 -2.27 0.00 0.00 179.45 177.20 1nu9 h TYR 91 N 0.31 0.57 -0.15 1.91 3.20 0.11 -1.64 116.97 121.27 1nu9 h TYR 91 Ca 0.09 0.02 -0.19 0.00 3.14 0.00 0.00 58.73 61.79 1nu9 h TYR 91 Cb 0.11 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.21 1nu9 h TYR 91 CO -0.02 0.21 -0.66 0.87 -1.64 0.00 0.00 178.16 176.92 1nu9 h LYS 92 N 0.48 0.59 0.00 1.82 1.79 -0.35 -1.69 116.57 119.20 1nu9 h LYS 92 Ca 0.39 -0.43 -0.05 0.00 -2.18 0.00 0.00 60.65 58.38 1nu9 h LYS 92 Cb 0.82 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.54 1nu9 h LYS 92 CO -0.14 1.05 -0.25 0.93 -1.08 0.00 0.00 179.45 179.96 1nu9 h GLU 93 N 0.42 0.00 0.00 3.15 5.08 -0.71 -2.02 114.58 120.51 1nu9 h GLU 93 Ca -0.02 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1nu9 h GLU 93 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1nu9 h GLU 93 CO 0.13 0.25 -0.90 0.93 -1.00 0.00 0.00 179.01 178.41 1nu9 h GLU 94 N 0.00 0.00 -2.05 2.33 5.08 -1.22 -3.39 114.58 115.33 1nu9 h GLU 94 Ca -0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.80 1nu9 h GLU 94 Cb 0.47 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.32 1nu9 h GLU 94 CO 0.03 0.15 -1.00 0.09 -1.00 0.00 0.00 179.01 177.28 1nu9 n ASN 95 N -2.87 1.23 0.04 1.42 4.13 -0.65 -4.97 115.26 113.58 1nu9 n ASN 95 Ca -0.02 -2.95 0.20 0.00 1.68 0.00 0.00 54.58 53.49 1nu9 n ASN 95 Cb 0.65 -0.64 0.72 0.00 -1.54 0.00 0.00 39.78 38.98 1nu9 n ASN 95 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 1nu9 h PRO 96 N 3.79 0.00 -0.08 3.52 0.11 -1.57 0.16 132.00 137.93 1nu9 h PRO 96 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1nu9 h PRO 96 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1nu9 h PRO 96 CO 0.56 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.60 1nu9 n THR 97 N -4.17 0.10 -2.53 -1.15 -2.24 -1.26 -4.86 114.28 98.17 1nu9 n THR 97 Ca 0.09 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.33 1nu9 n THR 97 Cb 0.59 -0.02 -0.04 0.00 -2.10 0.00 0.00 70.33 68.76 1nu9 n THR 97 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1nu9 s SER 98 N -1.38 7.32 0.00 3.42 0.15 0.57 -4.94 113.70 118.84 1nu9 s SER 98 Ca 0.22 2.15 0.17 0.00 0.70 0.00 0.00 55.95 59.19 1nu9 s SER 98 Cb 0.11 -2.61 0.18 0.00 -1.71 0.00 0.00 66.02 61.99 1nu9 s SER 98 CO 0.17 -0.14 1.08 0.29 1.20 0.00 0.00 173.24 175.85 1nu9 n LYS 99 N 1.74 1.55 -1.76 5.44 5.02 -1.26 -4.99 118.16 123.90 1nu9 n LYS 99 Ca 0.00 -1.62 -0.42 0.00 -2.02 0.00 0.00 58.31 54.25 1nu9 n LYS 99 Cb 0.46 -1.33 -0.02 0.00 -0.02 0.00 0.00 35.03 34.11 1nu9 n LYS 99 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1nu9 s VAL 100 N -1.34 2.05 0.03 -0.18 1.01 -1.26 -4.98 120.40 115.73 1nu9 s VAL 100 Ca 0.22 0.04 -0.09 0.00 0.00 0.00 0.00 61.98 62.15 1nu9 s VAL 100 Cb 0.15 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.45 1nu9 s VAL 100 CO 0.21 0.01 0.34 -0.54 0.00 0.00 0.00 175.10 175.12 1nu9 s LYS 101 N -0.09 3.71 0.07 2.72 -0.14 -1.26 -5.05 119.74 119.70 1nu9 s LYS 101 Ca 0.66 0.11 -0.31 0.00 -1.36 0.00 0.00 55.97 55.07 1nu9 s LYS 101 Cb -0.48 -3.07 -0.07 0.00 -1.68 0.00 0.00 37.83 32.53 1nu9 s LYS 101 CO 0.44 0.62 1.31 1.41 -0.76 0.00 0.00 175.35 178.37 1nu9 s MET 102 N -1.68 4.36 0.64 1.68 -2.45 -1.26 -4.98 119.30 115.61 1nu9 s MET 102 Ca 0.29 1.92 -0.17 0.00 -1.25 0.00 0.00 55.69 56.48 1nu9 s MET 102 Cb -0.14 -3.34 -0.01 0.00 1.25 0.00 0.00 34.83 32.59 1nu9 s MET 102 CO 0.16 -0.38 1.20 0.15 1.05 0.00 0.00 175.02 177.19 1nu9 s LYS 103 N 1.30 2.73 0.50 4.11 1.02 -1.26 -5.02 119.74 123.12 1nu9 s LYS 103 Ca 0.62 1.77 -0.04 0.00 0.02 0.00 0.00 55.97 58.34 1nu9 s LYS 103 Cb -0.33 -1.90 -0.01 0.00 -0.52 0.00 0.00 37.83 35.06 1nu9 s LYS 103 CO 0.29 -1.38 0.78 0.95 -0.92 0.00 0.00 175.35 175.08 1nu9 s THR 104 N -1.77 4.29 0.28 2.17 -4.23 -1.26 -4.84 115.64 110.27 1nu9 s THR 104 Ca 0.76 -0.06 0.01 0.00 -1.18 0.00 0.00 61.69 61.21 1nu9 s THR 104 Cb -0.29 -3.64 0.26 0.00 1.34 0.00 0.00 72.50 70.17 1nu9 s THR 104 CO 0.37 -0.59 1.78 0.15 -0.54 0.00 0.00 174.62 175.79 1nu9 h PHE 105 N 0.16 0.90 0.00 3.99 3.57 -1.95 1.00 116.94 124.61 1nu9 h PHE 105 Ca -0.46 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.04 1nu9 h PHE 105 Cb 1.23 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.70 1nu9 h PHE 105 CO 0.51 0.24 -0.15 -0.44 -2.23 0.00 0.00 178.31 176.24 1nu9 h ASP 106 N 0.72 0.00 0.57 0.41 3.45 -2.04 -2.89 116.42 116.65 1nu9 h ASP 106 Ca 0.50 0.00 -0.28 0.00 0.43 0.00 0.00 57.03 57.67 1nu9 h ASP 106 Cb 0.68 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.42 1nu9 h ASP 106 CO -0.35 0.15 -1.50 1.56 -1.57 0.00 0.00 179.24 177.53 1nu9 h GLN 107 N 0.00 0.10 -7.11 3.56 4.20 -1.46 -3.46 115.11 110.93 1nu9 h GLN 107 Ca -0.00 -0.17 -0.55 0.00 0.06 0.00 0.00 58.65 57.99 1nu9 h GLN 107 Cb 0.72 0.06 0.15 0.00 0.30 0.00 0.00 27.48 28.71 1nu9 h GLN 107 CO 0.02 0.86 0.49 -0.47 -0.67 0.00 0.00 178.83 179.06 1nu9 s TYR 108 N -2.63 2.15 0.07 2.96 5.04 0.18 -4.94 117.35 120.18 1nu9 s TYR 108 Ca -0.06 1.50 0.03 0.00 -2.44 0.00 0.00 57.07 56.10 1nu9 s TYR 108 Cb 0.08 -3.62 -0.03 0.00 0.35 0.00 0.00 41.96 38.74 1nu9 s TYR 108 CO 0.83 -2.72 -0.09 0.95 -1.34 0.00 0.00 175.55 173.18 1nu9 s THR 109 N -1.50 0.75 0.07 4.34 -4.23 -1.26 -4.97 115.64 108.84 1nu9 s THR 109 Ca 0.81 -1.40 -0.36 0.00 -1.18 0.00 0.00 61.69 59.56 1nu9 s THR 109 Cb -0.35 -1.04 -0.15 0.00 1.34 0.00 0.00 72.50 72.30 1nu9 s THR 109 CO 0.39 -0.49 1.48 -0.38 -0.54 0.00 0.00 174.62 175.08 1nu9 n ILE 110 N 0.96 0.06 -0.04 2.99 5.41 -1.26 -4.90 119.36 122.57 1nu9 n ILE 110 Ca -0.19 -0.01 0.02 0.00 1.00 0.00 0.00 62.75 63.57 1nu9 n ILE 110 Cb 0.56 -1.15 -0.14 0.00 -0.71 0.00 0.00 39.64 38.20 1nu9 n ILE 110 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1nu9 n GLU 111 N 3.27 0.80 -4.59 0.38 1.02 -1.26 -4.97 120.64 115.29 1nu9 n GLU 111 Ca 0.19 -0.11 -0.31 0.00 -0.02 0.00 0.00 57.16 56.91 1nu9 n GLU 111 Cb 0.22 -1.45 -0.17 0.00 -0.02 0.00 0.00 31.44 30.03 1nu9 n GLU 111 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1nu9 s ASP 112 N -4.55 2.85 -0.06 1.62 -0.00 -1.26 -4.91 116.67 110.36 1nu9 s ASP 112 Ca -0.08 -0.53 -0.23 0.00 -0.00 0.00 0.00 52.55 51.71 1nu9 s ASP 112 Cb 0.09 -1.30 0.05 0.00 -0.00 0.00 0.00 42.92 41.76 1nu9 s ASP 112 CO 0.76 0.05 0.52 -0.22 -0.00 0.00 0.00 175.17 176.28 1nu9 s LEU 113 N 0.88 0.01 0.26 1.23 2.96 -1.26 -5.03 118.68 117.73 1nu9 s LEU 113 Ca -0.07 0.52 0.10 0.00 -0.22 0.00 0.00 54.13 54.46 1nu9 s LEU 113 Cb -0.15 1.95 -0.04 0.00 0.50 0.00 0.00 46.19 48.44 1nu9 s LEU 113 CO -0.02 -0.49 -0.04 0.42 -1.32 0.00 0.00 176.35 174.90 1nu9 s THR 114 N -1.05 3.27 0.43 3.68 -4.23 -1.26 -0.91 115.64 115.57 1nu9 s THR 114 Ca -0.11 -1.97 0.12 0.00 -1.18 0.00 0.00 61.69 58.55 1nu9 s THR 114 Cb -0.03 -2.74 0.19 0.00 1.34 0.00 0.00 72.50 71.27 1nu9 s THR 114 CO 0.07 -0.36 1.99 0.24 -0.54 0.00 0.00 174.62 176.02 1nu9 h MET 115 N 2.03 0.17 -0.65 3.99 2.86 -1.93 -1.35 114.93 120.04 1nu9 h MET 115 Ca -0.44 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.17 1nu9 h MET 115 Cb 1.25 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.85 1nu9 h MET 115 CO 0.60 0.26 0.37 -0.09 1.06 0.00 0.00 176.91 179.11 1nu9 h ARG 116 N 0.16 0.90 -0.24 1.72 9.65 -1.91 0.46 114.38 125.12 1nu9 h ARG 116 Ca 0.04 -0.10 -0.02 0.00 -1.10 0.00 0.00 59.98 58.80 1nu9 h ARG 116 Cb 0.25 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 1nu9 h ARG 116 CO 0.01 0.66 0.06 0.93 2.80 0.00 0.00 179.97 184.44 1nu9 h GLU 117 N 0.89 0.39 -0.08 0.20 5.08 -1.51 -1.49 114.58 118.06 1nu9 h GLU 117 Ca 0.23 -0.09 0.03 0.00 -1.00 0.00 0.00 59.36 58.53 1nu9 h GLU 117 Cb 0.01 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1nu9 h GLU 117 CO -0.04 0.49 -0.12 -0.92 -1.00 0.00 0.00 179.01 177.41 1nu9 h TYR 118 N 0.22 -0.32 -0.85 4.33 3.20 -0.98 0.15 116.97 122.72 1nu9 h TYR 118 Ca 0.08 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 1nu9 h TYR 118 Cb 0.27 0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.65 1nu9 h TYR 118 CO 0.01 -0.19 0.42 -0.91 -1.64 0.00 0.00 178.16 175.85 1nu9 h ASN 119 N -0.17 1.11 -0.39 -2.11 -0.26 -0.87 -0.15 115.58 112.74 1nu9 h ASN 119 Ca 0.07 -0.13 -0.15 0.00 -0.56 0.00 0.00 56.30 55.53 1nu9 h ASN 119 Cb 0.27 -0.29 -0.01 0.00 -1.06 0.00 0.00 38.32 37.24 1nu9 h ASN 119 CO -0.18 0.93 -0.33 -0.33 -1.06 0.00 0.00 177.43 176.46 1nu9 h GLU 120 N 1.22 0.93 -0.32 0.81 5.08 -0.88 0.10 114.58 121.52 1nu9 h GLU 120 Ca 0.29 -0.45 -0.03 0.00 -1.00 0.00 0.00 59.36 58.17 1nu9 h GLU 120 Cb 0.11 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1nu9 h GLU 120 CO -0.04 1.11 0.07 -0.07 -1.00 0.00 0.00 179.01 179.09 1nu9 h LEU 121 N 0.77 0.49 -0.20 1.33 3.38 -0.77 0.10 115.31 120.41 1nu9 h LEU 121 Ca 0.08 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1nu9 h LEU 121 Cb 0.91 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1nu9 h LEU 121 CO 0.08 0.59 0.12 0.74 0.09 0.00 0.00 178.44 180.07 1nu9 h THR 122 N 0.35 1.08 -0.12 0.22 2.02 -0.88 -0.88 112.91 114.69 1nu9 h THR 122 Ca 0.10 -0.18 -0.11 0.00 0.77 0.00 0.00 66.41 66.99 1nu9 h THR 122 Cb 0.30 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 1nu9 h THR 122 CO 0.00 0.07 -0.41 -0.33 0.37 0.00 0.00 175.52 175.22 1nu9 h GLU 123 N 0.25 0.27 0.11 6.66 4.39 -0.72 -1.81 114.58 123.72 1nu9 h GLU 123 Ca 0.07 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 1nu9 h GLU 123 Cb 0.01 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1nu9 h GLU 123 CO -0.01 0.64 -0.05 1.03 -1.16 0.00 0.00 179.01 179.46 1nu9 h SER 124 N 0.22 -0.12 -0.81 1.42 0.87 -0.28 0.06 113.55 114.92 1nu9 h SER 124 Ca 0.02 -0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.40 1nu9 h SER 124 Cb 0.83 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.78 1nu9 h SER 124 CO 0.07 0.11 0.49 -0.07 -0.53 0.00 0.00 176.83 176.90 1nu9 h LEU 125 N -0.35 0.96 -0.32 2.23 3.38 -1.11 0.82 115.31 120.92 1nu9 h LEU 125 Ca -0.01 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.92 1nu9 h LEU 125 Cb 0.29 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1nu9 h LEU 125 CO 0.02 0.74 0.14 0.50 0.09 0.00 0.00 178.44 179.93 1nu9 h LYS 126 N 1.10 0.28 -0.41 1.13 3.64 -1.24 0.11 116.57 121.19 1nu9 h LYS 126 Ca 0.29 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.59 1nu9 h LYS 126 Cb -0.05 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1nu9 h LYS 126 CO -0.06 0.19 -0.02 1.03 -2.27 0.00 0.00 179.45 178.33 1nu9 h SER 127 N 0.29 0.64 -0.34 4.20 0.87 -0.58 -0.66 113.55 117.96 1nu9 h SER 127 Ca 0.14 -0.14 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 1nu9 h SER 127 Cb 0.08 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 1nu9 h SER 127 CO -0.12 0.72 -0.00 0.00 -0.53 0.00 0.00 176.83 176.90 1nu9 h ALA 128 N 1.36 0.46 -0.50 6.23 0.00 0.16 -1.48 119.26 125.49 1nu9 h ALA 128 Ca 0.13 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1nu9 h ALA 128 Cb 0.42 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1nu9 h ALA 128 CO 0.02 0.23 0.22 0.28 0.00 0.00 0.00 179.25 179.99 1nu9 h VAL 129 N 0.42 1.20 -0.59 0.00 2.07 -0.79 -1.71 116.25 116.85 1nu9 h VAL 129 Ca 0.10 -0.60 0.07 0.00 0.82 0.00 0.00 66.70 67.08 1nu9 h VAL 129 Cb 0.46 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.85 1nu9 h VAL 129 CO 0.02 0.23 0.28 0.50 0.02 0.00 0.00 177.57 178.62 1nu9 h LYS 130 N 0.66 0.51 -0.54 1.57 1.63 -0.92 0.68 116.57 120.16 1nu9 h LYS 130 Ca 0.17 -0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 59.86 1nu9 h LYS 130 Cb 0.16 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.65 1nu9 h LYS 130 CO -0.02 0.33 0.02 -0.44 -3.45 0.00 0.00 179.45 175.90 1nu9 h ASP 131 N 0.52 0.86 -0.63 4.20 3.32 -1.01 -1.03 116.42 122.65 1nu9 h ASP 131 Ca 0.28 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 1nu9 h ASP 131 Cb 0.24 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1nu9 h ASP 131 CO -0.22 0.91 0.39 0.15 -1.72 0.00 0.00 179.24 178.76 1nu9 h PHE 132 N 0.84 0.82 -0.32 4.55 3.57 -0.30 0.25 116.94 126.34 1nu9 h PHE 132 Ca 0.16 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 1nu9 h PHE 132 Cb 0.47 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1nu9 h PHE 132 CO 0.03 0.55 -0.13 0.93 -2.23 0.00 0.00 178.31 177.45 1nu9 h GLU 133 N 0.85 0.56 -0.28 1.11 5.08 -0.49 0.96 114.58 122.38 1nu9 h GLU 133 Ca 0.23 -0.17 -0.15 0.00 -1.00 0.00 0.00 59.36 58.26 1nu9 h GLU 133 Cb -0.04 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 1nu9 h GLU 133 CO -0.04 0.68 -0.43 -0.22 -1.00 0.00 0.00 179.01 178.00 1nu9 h LYS 134 N 0.51 0.78 -0.58 2.33 3.64 -0.46 -1.79 116.57 121.00 1nu9 h LYS 134 Ca 0.09 -0.47 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 1nu9 h LYS 134 Cb 0.53 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.37 1nu9 h LYS 134 CO 0.03 1.09 0.36 -0.44 -2.27 0.00 0.00 179.45 178.23 1nu9 h ASP 135 N 0.53 0.69 -0.53 4.20 3.45 -0.08 -1.77 116.42 122.91 1nu9 h ASP 135 Ca 0.03 -0.04 -0.00 0.00 0.43 0.00 0.00 57.03 57.44 1nu9 h ASP 135 Cb 1.02 -0.17 -0.03 0.00 -0.56 0.00 0.00 39.33 39.59 1nu9 h ASP 135 CO 0.10 0.53 0.32 0.58 -1.57 0.00 0.00 179.24 179.19 1nu9 h VAL 136 N 0.79 1.16 -0.73 -1.35 2.07 -0.76 -1.14 116.25 116.29 1nu9 h VAL 136 Ca 0.21 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.40 1nu9 h VAL 136 Cb -0.05 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 1nu9 h VAL 136 CO -0.04 0.16 0.48 -0.08 0.02 0.00 0.00 177.57 178.11 1nu9 h GLU 137 N 0.71 0.87 -0.15 1.57 4.81 -0.85 -0.12 114.58 121.41 1nu9 h GLU 137 Ca 0.19 -0.05 -0.20 0.00 -0.13 0.00 0.00 59.36 59.17 1nu9 h GLU 137 Cb -0.01 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 29.18 1nu9 h GLU 137 CO -0.04 0.57 -0.69 0.82 -0.73 0.00 0.00 179.01 178.95 1nu9 h ILE 138 N 0.89 1.30 -0.65 2.32 2.04 -0.89 -2.85 117.51 119.67 1nu9 h ILE 138 Ca 0.29 -1.91 0.02 0.00 1.00 0.00 0.00 64.86 64.26 1nu9 h ILE 138 Cb 0.05 2.02 -0.04 0.00 -0.74 0.00 0.00 36.82 38.11 1nu9 h ILE 138 CO -0.08 0.60 0.41 0.40 0.00 0.00 0.00 178.15 179.48 1nu9 h ILE 139 N 0.43 1.12 0.00 -0.67 2.04 -0.44 -2.66 117.51 117.33 1nu9 h ILE 139 Ca -0.04 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.53 1nu9 h ILE 139 Cb 1.32 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1nu9 h ILE 139 CO 0.14 0.15 0.00 -0.62 0.00 0.00 0.00 178.15 177.82 1nu9 n GLU 140 N -4.67 0.15 0.09 2.37 1.02 -0.13 -1.74 120.64 117.73 1nu9 n GLU 140 Ca 0.06 0.30 0.06 0.00 -0.02 0.00 0.00 57.16 57.56 1nu9 n GLU 140 Cb 0.06 -1.75 -0.02 0.00 -0.02 0.00 0.00 31.44 29.71 1nu9 n GLU 140 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1nu9 h ASN 141 N 0.00 0.00 0.29 1.62 2.35 -1.23 -3.33 115.58 115.28 1nu9 h ASN 141 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1nu9 h ASN 141 Cb 0.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 1nu9 h ASN 141 CO 0.00 0.27 -1.00 1.67 -1.65 0.00 0.00 177.43 176.71 1nu9 n GLN 142 N -2.84 0.19 -3.59 0.81 7.27 -0.98 -4.61 117.38 113.63 1nu9 n GLN 142 Ca -0.03 -0.02 -0.29 0.00 0.07 0.00 0.00 57.00 56.74 1nu9 n GLN 142 Cb 0.68 -1.55 -0.12 0.00 2.41 0.00 0.00 30.24 31.66 1nu9 n GLN 142 CO 0.00 0.00 0.00 -1.01 0.07 0.00 0.00 177.06 176.12 1nu9 s HIS 143 N -3.13 1.60 0.62 3.69 3.76 -0.71 -4.99 115.29 116.13 1nu9 s HIS 143 Ca 0.05 -2.29 0.32 0.00 -0.15 0.00 0.00 55.06 52.99 1nu9 s HIS 143 Cb 0.15 -1.47 1.78 0.00 1.11 0.00 0.00 32.58 34.15 1nu9 s HIS 143 CO 0.81 -0.78 2.09 0.45 -0.85 0.00 0.00 174.74 176.46 1nu9 h HIS 144 N 6.37 0.00 0.00 1.40 3.86 -1.82 0.55 115.15 125.52 1nu9 h HIS 144 Ca 0.10 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1nu9 h HIS 144 Cb 0.91 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.38 1nu9 h HIS 144 CO 0.44 0.00 0.00 -0.40 0.86 0.00 0.00 177.93 178.83 1nu9 n ASP 145 N -3.43 0.00 -0.00 2.45 3.85 -1.26 -2.69 116.55 115.47 1nu9 n ASP 145 Ca 0.00 0.21 0.09 0.00 -0.71 0.00 0.00 54.79 54.38 1nu9 n ASP 145 Cb 0.32 -0.38 -0.11 0.00 -1.35 0.00 0.00 41.12 39.61 1nu9 n ASP 145 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1nu9 n LEU 146 N -1.38 0.78 -4.72 -2.12 4.77 0.19 -1.53 117.00 112.99 1nu9 n LEU 146 Ca 0.08 -0.45 -0.42 0.00 -0.03 0.00 0.00 56.01 55.19 1nu9 n LEU 146 Cb 0.19 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 1nu9 n LEU 146 CO 0.17 0.20 1.32 -0.75 -1.33 0.00 0.00 177.39 176.99 1nu9 s LYS 147 N -2.80 4.15 0.61 3.23 2.47 -1.09 -4.87 119.74 121.44 1nu9 s LYS 147 Ca 0.06 2.53 -0.18 0.00 -1.56 0.00 0.00 55.97 56.81 1nu9 s LYS 147 Cb 0.14 -3.10 -0.03 0.00 -1.46 0.00 0.00 37.83 33.39 1nu9 s LYS 147 CO 0.76 -0.70 1.24 -1.25 0.16 0.00 0.00 175.35 175.56 1nu9 s PRO 148 N 1.05 2.82 0.63 4.03 0.04 -1.26 -4.50 135.00 137.80 1nu9 s PRO 148 Ca 0.72 1.92 -0.13 0.00 0.04 0.00 0.00 61.00 63.55 1nu9 s PRO 148 Cb -0.48 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 1nu9 s PRO 148 CO 0.33 -1.35 1.04 -0.06 0.04 0.00 0.00 177.00 177.00 1nu9 s PHE 149 N -1.52 3.26 0.84 0.56 0.08 0.12 -4.96 117.98 116.37 1nu9 s PHE 149 Ca 0.79 1.42 -0.12 0.00 0.12 0.00 0.00 56.93 59.15 1nu9 s PHE 149 Cb -0.33 -2.86 0.10 0.00 -0.57 0.00 0.00 43.02 39.36 1nu9 s PHE 149 CO 0.35 -0.95 1.10 0.95 -0.10 0.00 0.00 175.22 176.58 1nu9 s THR 150 N -2.89 2.85 0.26 0.64 -4.23 -1.26 -4.76 115.64 106.26 1nu9 s THR 150 Ca 0.59 0.28 -0.02 0.00 -1.18 0.00 0.00 61.69 61.35 1nu9 s THR 150 Cb -0.13 -2.90 0.25 0.00 1.34 0.00 0.00 72.50 71.06 1nu9 s THR 150 CO 0.47 -0.36 1.84 0.44 -0.54 0.00 0.00 174.62 176.47 1nu9 h ASP 151 N -1.31 0.88 -0.12 3.99 3.32 -1.99 -0.73 116.42 120.47 1nu9 h ASP 151 Ca -0.48 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 1nu9 h ASP 151 Cb 1.28 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.68 1nu9 h ASP 151 CO 0.57 0.51 0.03 -0.08 -1.72 0.00 0.00 179.24 178.56 1nu9 h GLU 152 N 0.98 0.19 -0.62 3.56 4.81 -2.00 -0.37 114.58 121.14 1nu9 h GLU 152 Ca 0.44 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.63 1nu9 h GLU 152 Cb 0.34 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 1nu9 h GLU 152 CO -0.23 0.35 0.40 0.52 -0.73 0.00 0.00 179.01 179.32 1nu9 h MET 153 N 0.01 0.83 -0.44 1.92 2.86 -1.78 -1.97 114.93 116.35 1nu9 h MET 153 Ca 0.04 -0.06 -0.13 0.00 -2.06 0.00 0.00 59.70 57.49 1nu9 h MET 153 Cb 0.24 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1nu9 h MET 153 CO -0.00 0.56 -0.24 1.49 1.06 0.00 0.00 176.91 179.78 1nu9 h GLU 154 N 0.85 0.91 -0.57 1.72 4.81 -0.94 -1.18 114.58 120.18 1nu9 h GLU 154 Ca 0.23 -0.39 -0.01 0.00 -0.13 0.00 0.00 59.36 59.05 1nu9 h GLU 154 Cb -0.07 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1nu9 h GLU 154 CO -0.05 1.04 0.31 1.49 -0.73 0.00 0.00 179.01 181.07 1nu9 h GLU 155 N 0.78 0.79 0.11 1.92 4.81 -0.48 0.18 114.58 122.70 1nu9 h GLU 155 Ca 0.10 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1nu9 h GLU 155 Cb 0.80 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.02 1nu9 h GLU 155 CO 0.07 0.61 -0.05 0.87 -0.73 0.00 0.00 179.01 179.78 1nu9 h LYS 156 N 0.76 -0.15 -0.40 1.92 1.57 -1.26 -1.54 116.57 117.48 1nu9 h LYS 156 Ca 0.20 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.04 1nu9 h LYS 156 Cb 0.05 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.35 1nu9 h LYS 156 CO -0.03 0.14 0.14 0.00 -0.57 0.00 0.00 179.45 179.14 1nu9 h ALA 157 N 0.41 0.47 -0.20 3.86 0.00 -1.09 -1.09 119.26 121.62 1nu9 h ALA 157 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1nu9 h ALA 157 Cb 0.36 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1nu9 h ALA 157 CO 0.03 -0.25 0.13 1.15 0.00 0.00 0.00 179.25 180.31 1nu9 h THR 158 N 0.30 1.06 -0.07 0.00 2.02 -0.58 -2.17 112.91 113.47 1nu9 h THR 158 Ca 0.18 -0.11 -0.17 0.00 0.77 0.00 0.00 66.41 67.07 1nu9 h THR 158 Cb 0.16 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1nu9 h THR 158 CO -0.18 0.06 -0.71 0.00 0.37 0.00 0.00 175.52 175.06 1nu9 h ALA 159 N 1.87 0.65 -0.52 6.16 0.00 -0.15 -0.71 119.26 126.57 1nu9 h ALA 159 Ca 0.07 -0.60 -0.12 0.00 0.00 0.00 0.00 54.91 54.26 1nu9 h ALA 159 Cb -0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1nu9 h ALA 159 CO -0.02 0.77 -0.15 0.00 0.00 0.00 0.00 179.25 179.86 1nu9 h ARG 160 N 0.24 1.01 -0.29 0.00 3.08 -0.92 -0.53 114.38 116.97 1nu9 h ARG 160 Ca -0.02 -0.39 -0.02 0.00 0.07 0.00 0.00 59.98 59.61 1nu9 h ARG 160 Cb 1.27 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.25 1nu9 h ARG 160 CO 0.12 1.08 0.11 0.28 -1.07 0.00 0.00 179.97 180.48 1nu9 h VAL 161 N 0.89 1.19 -0.25 2.04 2.07 -1.18 -1.86 116.25 119.15 1nu9 h VAL 161 Ca 0.13 -0.58 -0.10 0.00 0.82 0.00 0.00 66.70 66.97 1nu9 h VAL 161 Cb 0.72 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1nu9 h VAL 161 CO 0.06 0.20 -0.26 0.44 0.02 0.00 0.00 177.57 178.03 1nu9 h ASP 162 N 0.32 0.47 0.09 0.57 3.32 -1.01 -1.49 116.42 118.70 1nu9 h ASP 162 Ca 0.10 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 1nu9 h ASP 162 Cb 0.21 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1nu9 h ASP 162 CO -0.01 0.73 -0.04 -0.78 -1.72 0.00 0.00 179.24 177.42 1nu9 h ASP 163 N 0.42 -0.10 -0.35 6.45 -0.00 -0.85 0.09 116.42 122.08 1nu9 h ASP 163 Ca 0.06 -0.07 0.03 0.00 -0.00 0.00 0.00 57.03 57.05 1nu9 h ASP 163 Cb 0.67 0.03 -0.03 0.00 -0.00 0.00 0.00 39.33 40.00 1nu9 h ASP 163 CO 0.05 0.00 0.16 0.25 -0.00 0.00 0.00 179.24 179.70 1nu9 h LEU 164 N -0.20 0.22 -1.20 2.28 6.46 -1.17 -0.98 115.31 120.72 1nu9 h LEU 164 Ca -0.01 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 57.82 1nu9 h LEU 164 Cb 0.16 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.02 1nu9 h LEU 164 CO 0.02 0.17 0.56 0.00 -0.62 0.00 0.00 178.44 178.57 1nu9 h ALA 165 N 1.20 1.53 0.00 1.25 0.00 -1.05 -0.13 119.26 122.06 1nu9 h ALA 165 Ca 0.15 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1nu9 h ALA 165 Cb 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1nu9 h ALA 165 CO -0.12 0.36 -0.26 -0.91 0.00 0.00 0.00 179.25 178.32 1nu9 h ASN 166 N 1.00 0.00 -0.09 0.00 2.35 0.30 0.89 115.58 120.02 1nu9 h ASN 166 Ca 0.36 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.92 1nu9 h ASN 166 Cb 0.14 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.51 1nu9 h ASN 166 CO -0.12 0.26 -0.62 0.11 -1.65 0.00 0.00 177.43 175.41 1nu9 h LYS 167 N 0.00 0.70 -0.73 0.81 1.57 -0.10 -0.73 116.57 118.10 1nu9 h LYS 167 Ca -0.00 -0.48 -0.03 0.00 -1.87 0.00 0.00 60.65 58.26 1nu9 h LYS 167 Cb 0.54 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.89 1nu9 h LYS 167 CO 0.03 1.11 0.33 0.00 -0.57 0.00 0.00 179.45 180.35 1nu9 h ALA 168 N 0.78 0.94 -0.11 3.86 0.00 -0.23 -1.93 119.26 122.58 1nu9 h ALA 168 Ca -0.01 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1nu9 h ALA 168 Cb 1.21 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1nu9 h ALA 168 CO 0.12 0.53 -0.14 1.88 0.00 0.00 0.00 179.25 181.64 1nu9 h TYR 169 N 1.03 0.18 0.18 0.00 0.05 -0.65 -0.61 116.97 117.16 1nu9 h TYR 169 Ca 0.25 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 59.00 1nu9 h TYR 169 Cb 0.15 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 37.84 1nu9 h TYR 169 CO 0.01 0.32 -0.09 0.77 -1.05 0.00 0.00 178.16 178.12 1nu9 h SER 170 N 0.17 -0.21 -0.70 3.88 0.02 -0.67 0.64 113.55 116.67 1nu9 h SER 170 Ca 0.03 -0.13 0.09 0.00 -0.84 0.00 0.00 61.79 60.94 1nu9 h SER 170 Cb 0.36 0.05 -0.07 0.00 0.14 0.00 0.00 62.40 62.89 1nu9 h SER 170 CO 0.02 0.00 0.36 0.58 -1.14 0.00 0.00 176.83 176.65 1nu9 h VAL 171 N -0.42 0.87 -0.05 2.27 2.07 -0.98 0.65 116.25 120.66 1nu9 h VAL 171 Ca -0.03 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.31 1nu9 h VAL 171 Cb 0.33 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.26 1nu9 h VAL 171 CO 0.04 0.11 -0.12 0.22 0.02 0.00 0.00 177.57 177.84 1nu9 h TYR 172 N 0.62 -0.31 -0.14 1.57 3.20 -0.75 -2.24 116.97 118.91 1nu9 h TYR 172 Ca 0.34 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.21 1nu9 h TYR 172 Cb 0.34 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 1nu9 h TYR 172 CO -0.10 -0.19 0.01 0.74 -1.64 0.00 0.00 178.16 176.98 1nu9 h PHE 173 N -0.19 0.20 0.00 -3.82 0.04 0.08 -1.28 116.94 111.97 1nu9 h PHE 173 Ca 0.06 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1nu9 h PHE 173 Cb 0.27 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.36 1nu9 h PHE 173 CO -0.21 0.21 0.00 0.00 -0.60 0.00 0.00 178.31 177.71 1nu9 n ALA 174 N -2.51 1.86 -0.35 2.45 0.00 0.13 -3.80 120.51 118.30 1nu9 n ALA 174 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1nu9 n ALA 174 Cb 0.15 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1nu9 n ALA 174 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1nu9 n PHE 175 N -2.19 0.00 0.30 0.00 3.01 -0.97 -4.75 117.46 112.86 1nu9 n PHE 175 Ca 0.03 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.64 1nu9 n PHE 175 Cb 0.29 0.00 0.67 0.00 -0.01 0.00 0.00 39.48 40.43 1nu9 n PHE 175 CO 0.00 0.00 0.00 -0.24 1.01 0.00 0.00 176.76 177.53 1nu9 h VAL 176 N 0.35 0.00 -0.28 -4.37 3.04 -1.34 -1.70 116.25 111.94 1nu9 h VAL 176 Ca 0.00 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 65.49 1nu9 h VAL 176 Cb 0.17 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 30.42 1nu9 h VAL 176 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.57 177.10 1nu9 n ARG 177 N -2.56 2.13 -3.05 4.17 1.74 -1.26 -4.79 116.66 113.03 1nu9 n ARG 177 Ca 0.00 -1.88 -0.44 0.00 -0.77 0.00 0.00 57.85 54.75 1nu9 n ARG 177 Cb 0.17 -1.32 -0.04 0.00 -1.02 0.00 0.00 32.46 30.26 1nu9 n ARG 177 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1nu9 s ASP 178 N -1.08 6.30 0.44 0.55 3.68 -0.64 -4.93 116.67 120.99 1nu9 s ASP 178 Ca 0.25 -1.57 0.30 0.00 2.13 0.00 0.00 52.55 53.67 1nu9 s ASP 178 Cb 0.14 -2.33 1.44 0.00 -1.45 0.00 0.00 42.92 40.73 1nu9 s ASP 178 CO 0.19 -1.12 1.61 0.71 0.13 0.00 0.00 175.17 176.69 1nu9 h THR 179 N 5.82 0.08 0.00 1.71 1.35 -1.89 0.31 112.91 120.30 1nu9 h THR 179 Ca -0.18 -0.02 -0.13 0.00 -0.55 0.00 0.00 66.41 65.52 1nu9 h THR 179 Cb 1.07 0.02 -0.02 0.00 -1.73 0.00 0.00 68.15 67.49 1nu9 h THR 179 CO 1.09 0.01 -0.62 -0.61 -0.25 0.00 0.00 175.52 175.14 1nu9 h GLN 180 N 0.06 0.00 0.00 4.72 4.15 -1.92 -3.35 115.11 118.77 1nu9 h GLN 180 Ca 0.84 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.26 1nu9 h GLN 180 Cb 2.65 0.00 0.00 0.00 0.21 0.00 0.00 27.48 30.34 1nu9 h GLN 180 CO -0.44 0.62 0.00 0.72 -1.93 0.00 0.00 178.83 177.80 1nu9 n HIS 181 N -3.68 0.00 -0.02 3.99 8.25 0.87 -4.85 115.22 119.79 1nu9 n HIS 181 Ca -0.01 -0.40 -0.14 0.00 -0.26 0.00 0.00 57.72 56.91 1nu9 n HIS 181 Cb 0.64 -0.04 -0.09 0.00 1.12 0.00 0.00 29.99 31.62 1nu9 n HIS 181 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1nu9 h LYS 182 N 0.00 -0.53 -0.79 -0.41 3.64 -0.97 -1.98 116.57 115.53 1nu9 h LYS 182 Ca 0.00 0.04 0.16 0.00 -1.27 0.00 0.00 60.65 59.57 1nu9 h LYS 182 Cb 0.43 0.12 -0.10 0.00 -0.41 0.00 0.00 32.23 32.27 1nu9 h LYS 182 CO 0.00 -0.35 0.33 1.15 -2.27 0.00 0.00 179.45 178.31 1nu9 h THR 183 N -0.55 0.63 0.00 1.00 2.02 -1.88 0.36 112.91 114.49 1nu9 h THR 183 Ca 0.05 -0.16 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 1nu9 h THR 183 Cb 0.67 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1nu9 h THR 183 CO -0.44 0.08 -0.25 -0.33 0.37 0.00 0.00 175.52 174.96 1nu9 h GLU 184 N 0.45 0.00 -0.03 6.66 3.07 -1.83 -1.25 114.58 121.66 1nu9 h GLU 184 Ca 0.44 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 59.20 1nu9 h GLU 184 Cb 0.70 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.62 1nu9 h GLU 184 CO -0.42 0.25 -0.40 0.00 -1.40 0.00 0.00 179.01 177.03 1nu9 h ALA 185 N 1.75 0.09 -0.92 3.43 0.00 0.27 -1.79 119.26 122.09 1nu9 h ALA 185 Ca -0.00 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1nu9 h ALA 185 Cb 0.44 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1nu9 h ALA 185 CO 0.03 0.22 0.55 -0.07 0.00 0.00 0.00 179.25 179.99 1nu9 h LEU 186 N -0.23 1.11 -0.53 0.00 3.38 -0.35 -1.17 115.31 117.52 1nu9 h LEU 186 Ca -0.04 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 1nu9 h LEU 186 Cb 1.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1nu9 h LEU 186 CO 0.08 0.85 -0.44 -0.33 0.09 0.00 0.00 178.44 178.69 1nu9 h GLU 187 N 1.27 0.69 -0.35 1.13 5.08 -1.26 -1.40 114.58 119.74 1nu9 h GLU 187 Ca 0.33 -0.38 0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1nu9 h GLU 187 Cb -0.05 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1nu9 h GLU 187 CO -0.06 0.99 0.15 1.25 -1.00 0.00 0.00 179.01 180.35 1nu9 h LEU 188 N 0.56 0.21 -0.29 1.33 5.85 -0.70 0.23 115.31 122.50 1nu9 h LEU 188 Ca 0.04 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1nu9 h LEU 188 Cb 0.99 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.99 1nu9 h LEU 188 CO 0.09 0.16 0.12 0.50 -0.34 0.00 0.00 178.44 178.97 1nu9 h LYS 189 N 0.32 0.43 -0.63 1.25 3.64 -1.04 -1.43 116.57 119.11 1nu9 h LYS 189 Ca 0.15 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1nu9 h LYS 189 Cb 0.09 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 1nu9 h LYS 189 CO -0.13 0.44 0.25 0.00 -2.27 0.00 0.00 179.45 177.75 1nu9 h ALA 190 N 0.97 1.26 -0.01 5.00 0.00 -0.81 -0.48 119.26 125.19 1nu9 h ALA 190 Ca 0.10 -0.16 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1nu9 h ALA 190 Cb 0.17 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1nu9 h ALA 190 CO -0.01 0.54 -0.74 0.87 0.00 0.00 0.00 179.25 179.91 1nu9 h LYS 191 N 0.90 0.06 -0.26 0.00 1.57 -0.39 -0.98 116.57 117.48 1nu9 h LYS 191 Ca 0.21 -0.06 -0.16 0.00 -1.87 0.00 0.00 60.65 58.78 1nu9 h LYS 191 Cb 0.17 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1nu9 h LYS 191 CO -0.02 0.77 -0.47 0.28 -0.57 0.00 0.00 179.45 179.44 1nu9 h VAL 192 N 0.04 1.29 -0.63 0.50 2.07 -0.90 -2.58 116.25 116.05 1nu9 h VAL 192 Ca -0.01 -1.67 -0.01 0.00 0.82 0.00 0.00 66.70 65.82 1nu9 h VAL 192 Cb 1.31 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.76 1nu9 h VAL 192 CO 0.10 0.54 0.34 0.44 0.02 0.00 0.00 177.57 179.01 1nu9 h ASP 193 N 0.52 0.80 0.10 0.57 3.32 -0.96 -2.62 116.42 118.15 1nu9 h ASP 193 Ca 0.01 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 1nu9 h ASP 193 Cb 1.08 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.42 1nu9 h ASP 193 CO 0.11 0.67 -0.06 0.25 -1.72 0.00 0.00 179.24 178.48 1nu9 h LEU 194 N 0.86 -0.16 -1.26 1.55 7.12 -1.10 -1.52 115.31 120.81 1nu9 h LEU 194 Ca 0.22 0.01 -0.06 0.00 0.13 0.00 0.00 57.88 58.19 1nu9 h LEU 194 Cb 0.05 0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.22 1nu9 h LEU 194 CO -0.03 -0.10 -0.27 -0.37 -0.13 0.00 0.00 178.44 177.53 1nu9 h VAL 195 N -0.16 0.76 0.13 1.05 -1.51 -1.42 -3.03 116.25 112.06 1nu9 h VAL 195 Ca -0.01 -1.14 -0.28 0.00 -1.23 0.00 0.00 66.70 64.04 1nu9 h VAL 195 Cb 0.14 1.71 0.01 0.00 -2.13 0.00 0.00 31.29 31.02 1nu9 h VAL 195 CO 0.01 0.27 -1.24 -0.07 -1.23 0.00 0.00 177.57 175.30 1nu9 h LEU 196 N 0.00 0.49 0.00 4.19 4.07 -1.27 -3.46 115.31 119.34 1nu9 h LEU 196 Ca -0.00 -0.51 0.00 0.00 0.08 0.00 0.00 57.88 57.45 1nu9 h LEU 196 Cb 0.69 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.27 1nu9 h LEU 196 CO 0.04 1.39 0.00 0.61 -1.08 0.00 0.00 178.44 179.39 1nu9 n GLY 197 N 1.49 -3.88 3.74 0.83 0.00 -0.59 -1.33 105.19 105.45 1nu9 n GLY 197 Ca -0.09 -2.14 -0.38 0.00 0.00 0.00 0.00 46.02 43.41 1nu9 n GLY 197 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nu9 s ASP 198 N -0.12 5.05 0.26 1.61 1.01 -1.26 -4.76 116.67 118.46 1nu9 s ASP 198 Ca 0.00 2.67 -0.03 0.00 0.71 0.00 0.00 52.55 55.90 1nu9 s ASP 198 Cb 0.00 -2.63 0.31 0.00 1.01 0.00 0.00 42.92 41.62 1nu9 s ASP 198 CO 0.00 -1.71 1.79 -0.33 0.21 0.00 0.00 175.17 175.13 1nu9 h GLU 199 N 1.10 0.91 0.00 8.23 5.08 -1.94 -1.07 114.58 126.89 1nu9 h GLU 199 Ca -0.51 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 57.63 1nu9 h GLU 199 Cb 1.31 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1nu9 h GLU 199 CO 0.56 0.83 -0.11 0.38 -1.00 0.00 0.00 179.01 179.66 1nu9 h ASP 200 N 0.87 0.00 -1.03 1.42 2.03 -2.01 -3.37 116.42 114.33 1nu9 h ASP 200 Ca 0.19 0.00 -0.40 0.00 -0.73 0.00 0.00 57.03 56.09 1nu9 h ASP 200 Cb 0.33 0.00 -0.27 0.00 -0.83 0.00 0.00 39.33 38.56 1nu9 h ASP 200 CO 0.00 0.11 -0.81 2.29 -1.03 0.00 0.00 179.24 179.81 1nu9 n LYS 201 N -3.21 0.74 -1.22 4.15 2.85 -0.99 -5.14 118.16 115.34 1nu9 n LYS 201 Ca 0.01 -2.50 -0.31 0.00 -1.05 0.00 0.00 58.31 54.46 1nu9 n LYS 201 Cb 0.42 -1.34 0.10 0.00 -0.65 0.00 0.00 35.03 33.56 1nu9 n LYS 201 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1nu9 s PRO 202 N -0.27 2.09 0.06 -1.58 0.04 -0.44 -4.06 135.00 130.85 1nu9 s PRO 202 Ca 0.34 1.16 -0.31 0.00 0.04 0.00 0.00 61.00 62.23 1nu9 s PRO 202 Cb 0.20 -1.88 -0.08 0.00 0.04 0.00 0.00 34.50 32.78 1nu9 s PRO 202 CO -0.18 -1.76 1.54 -1.01 0.04 0.00 0.00 177.00 175.64 1nu9 s HIS 203 N -2.89 2.70 0.45 0.56 3.76 -0.45 -4.95 115.29 114.47 1nu9 s HIS 203 Ca 0.62 0.57 -0.23 0.00 -0.15 0.00 0.00 55.06 55.86 1nu9 s HIS 203 Cb -0.18 -3.84 -0.08 0.00 1.11 0.00 0.00 32.58 29.60 1nu9 s HIS 203 CO 0.56 -3.24 1.16 1.03 -0.85 0.00 0.00 174.74 173.40 1nu9 s ARG 204 N 2.27 3.83 -1.14 1.40 0.52 -1.26 -4.91 118.95 119.65 1nu9 s ARG 204 Ca 0.69 1.76 -0.09 0.00 -0.52 0.00 0.00 55.73 57.57 1nu9 s ARG 204 Cb -0.37 -2.45 0.26 0.00 0.52 0.00 0.00 34.95 32.91 1nu9 s ARG 204 CO 0.30 -0.49 1.26 -0.89 0.02 0.00 0.00 175.30 175.50 1nu9 n ILE 205 N -0.39 4.59 1.22 1.52 2.08 -1.26 -4.80 119.36 122.31 1nu9 n ILE 205 Ca 0.07 -5.28 0.13 0.00 0.56 0.00 0.00 62.75 58.23 1nu9 n ILE 205 Cb 0.48 -2.50 0.39 0.00 -0.75 0.00 0.00 39.64 37.27 1nu9 n ILE 205 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 1nu9 n SER 206 N 3.19 0.82 -3.41 4.38 3.41 -1.26 -4.61 113.62 116.13 1nu9 n SER 206 Ca 0.28 -0.69 -0.10 0.00 -0.26 0.00 0.00 58.87 58.10 1nu9 n SER 206 Cb 0.39 0.11 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 1nu9 n SER 206 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1nu9 s ASN 207 N -2.60 0.11 0.36 4.04 2.20 -1.26 0.15 114.94 117.93 1nu9 s ASN 207 Ca 0.22 -1.05 0.04 0.00 -0.94 0.00 0.00 52.86 51.13 1nu9 s ASN 207 Cb 0.19 0.73 0.67 0.00 -2.00 0.00 0.00 41.25 40.84 1nu9 s ASN 207 CO 0.55 -1.43 1.97 -0.33 -2.94 0.00 0.00 177.10 174.92 1nu9 h GLU 208 N 2.07 0.66 -0.06 3.55 5.08 -1.76 -1.93 114.58 122.19 1nu9 h GLU 208 Ca -0.27 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.00 1nu9 h GLU 208 Cb 1.25 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 1nu9 h GLU 208 CO 0.35 0.51 -0.03 -0.09 -1.00 0.00 0.00 179.01 178.75 1nu9 h ARG 209 N 0.66 0.13 -0.46 2.33 9.65 -1.65 -0.98 114.38 124.05 1nu9 h ARG 209 Ca 0.17 -0.06 -0.04 0.00 -1.10 0.00 0.00 59.98 58.95 1nu9 h ARG 209 Cb 0.07 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.63 1nu9 h ARG 209 CO -0.02 0.51 0.11 0.82 2.80 0.00 0.00 179.97 184.18 1nu9 h ILE 210 N -0.26 1.20 0.26 1.20 2.04 -1.80 0.02 117.51 120.17 1nu9 h ILE 210 Ca 0.01 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 1nu9 h ILE 210 Cb 0.47 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1nu9 h ILE 210 CO 0.01 0.27 -0.12 -0.08 0.00 0.00 0.00 178.15 178.23 1nu9 h GLU 211 N 0.68 -0.33 -0.90 2.37 4.81 -1.23 0.50 114.58 120.47 1nu9 h GLU 211 Ca 0.15 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.39 1nu9 h GLU 211 Cb 0.26 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 1nu9 h GLU 211 CO -0.00 -0.11 0.52 -0.22 -0.73 0.00 0.00 179.01 178.47 1nu9 h LYS 212 N -0.51 1.24 0.04 1.92 3.64 -0.95 -2.03 116.57 119.93 1nu9 h LYS 212 Ca -0.04 -0.13 -0.23 0.00 -1.27 0.00 0.00 60.65 58.99 1nu9 h LYS 212 Cb 0.38 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1nu9 h LYS 212 CO 0.06 0.89 -1.02 0.93 -2.27 0.00 0.00 179.45 178.04 1nu9 h GLU 213 N 1.25 0.24 -0.31 1.90 4.39 -0.93 -1.94 114.58 119.18 1nu9 h GLU 213 Ca 0.32 -0.32 -0.13 0.00 0.34 0.00 0.00 59.36 59.58 1nu9 h GLU 213 Cb -0.01 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 1nu9 h GLU 213 CO -0.06 1.07 -0.33 1.98 -1.16 0.00 0.00 179.01 180.51 1nu9 h MET 214 N 0.11 0.69 -0.14 2.33 4.05 -0.82 0.15 114.93 121.30 1nu9 h MET 214 Ca -0.08 -0.32 -0.03 0.00 -0.28 0.00 0.00 59.70 58.99 1nu9 h MET 214 Cb 1.70 -0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 32.48 1nu9 h MET 214 CO 0.16 0.93 -0.04 0.82 0.23 0.00 0.00 176.91 179.01 1nu9 h ILE 215 N 0.58 1.30 -0.61 1.77 1.08 -1.38 -0.19 117.51 120.06 1nu9 h ILE 215 Ca 0.06 -1.02 -0.04 0.00 -0.39 0.00 0.00 64.86 63.48 1nu9 h ILE 215 Cb 0.85 1.68 -0.03 0.00 -3.07 0.00 0.00 36.82 36.26 1nu9 h ILE 215 CO 0.07 0.30 0.22 0.11 -0.69 0.00 0.00 178.15 178.16 1nu9 h LYS 216 N -0.04 0.90 0.26 2.37 1.57 -1.17 -0.17 116.57 120.29 1nu9 h LYS 216 Ca 0.03 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1nu9 h LYS 216 Cb 0.48 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1nu9 h LYS 216 CO 0.02 0.75 -0.12 -0.44 -0.57 0.00 0.00 179.45 179.09 1nu9 h ASP 217 N 0.88 -0.29 -0.75 0.86 3.45 -0.56 0.10 116.42 120.12 1nu9 h ASP 217 Ca 0.21 -0.13 0.09 0.00 0.43 0.00 0.00 57.03 57.62 1nu9 h ASP 217 Cb 0.21 0.08 -0.07 0.00 -0.56 0.00 0.00 39.33 38.98 1nu9 h ASP 217 CO -0.01 -0.04 0.41 -0.07 -1.57 0.00 0.00 179.24 177.96 1nu9 h LEU 218 N -0.55 0.58 -0.38 1.55 3.38 -0.84 0.28 115.31 119.34 1nu9 h LEU 218 Ca -0.04 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1nu9 h LEU 218 Cb 0.40 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1nu9 h LEU 218 CO 0.06 0.34 0.11 -0.33 0.09 0.00 0.00 178.44 178.71 1nu9 h GLU 219 N 0.71 0.60 -0.54 1.13 5.08 -0.86 -2.09 114.58 118.60 1nu9 h GLU 219 Ca 0.36 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1nu9 h GLU 219 Cb 0.32 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 1nu9 h GLU 219 CO -0.24 0.61 0.25 0.66 -1.00 0.00 0.00 179.01 179.29 1nu9 h SER 220 N 0.47 0.69 -0.05 1.42 4.64 0.28 -0.88 113.55 120.11 1nu9 h SER 220 Ca 0.12 -0.07 -0.11 0.00 -0.47 0.00 0.00 61.79 61.26 1nu9 h SER 220 Cb 0.27 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 1nu9 h SER 220 CO -0.00 0.60 -0.30 0.40 -0.87 0.00 0.00 176.83 176.66 1nu9 h ILE 221 N 0.77 1.28 -0.19 0.95 2.04 -0.09 -0.30 117.51 121.97 1nu9 h ILE 221 Ca 0.19 -1.38 -0.13 0.00 1.00 0.00 0.00 64.86 64.54 1nu9 h ILE 221 Cb 0.10 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1nu9 h ILE 221 CO -0.02 0.44 -0.39 0.40 0.00 0.00 0.00 178.15 178.58 1nu9 h ILE 222 N 0.45 1.33 -0.17 -0.67 2.04 -0.94 -2.86 117.51 116.69 1nu9 h ILE 222 Ca 0.06 -1.63 -0.06 0.00 1.00 0.00 0.00 64.86 64.23 1nu9 h ILE 222 Cb 0.75 1.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 1nu9 h ILE 222 CO 0.06 0.50 -0.18 -0.33 0.00 0.00 0.00 178.15 178.20 1nu9 h GLU 223 N 0.27 0.28 -0.58 2.37 5.08 -1.04 -2.28 114.58 118.69 1nu9 h GLU 223 Ca 0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1nu9 h GLU 223 Cb 0.99 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 1nu9 h GLU 223 CO 0.09 0.46 0.37 -0.44 -1.00 0.00 0.00 179.01 178.49 1nu9 h ASP 224 N 0.26 0.67 -0.32 1.42 3.45 -0.89 0.54 116.42 121.56 1nu9 h ASP 224 Ca 0.05 -0.03 0.05 0.00 0.43 0.00 0.00 57.03 57.52 1nu9 h ASP 224 Cb 0.47 -0.17 -0.04 0.00 -0.56 0.00 0.00 39.33 39.03 1nu9 h ASP 224 CO 0.03 0.51 0.05 0.15 -1.57 0.00 0.00 179.24 178.41 1nu9 h PHE 225 N 0.78 0.08 -0.32 4.55 3.57 -1.19 -0.85 116.94 123.56 1nu9 h PHE 225 Ca 0.21 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.61 1nu9 h PHE 225 Cb -0.06 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 1nu9 h PHE 225 CO -0.03 0.00 -0.30 0.74 -2.23 0.00 0.00 178.31 176.50 1nu9 h PHE 226 N 0.16 0.78 -0.28 0.41 -1.00 -1.26 -1.86 116.94 113.89 1nu9 h PHE 226 Ca 0.15 -0.20 -0.01 0.00 2.81 0.00 0.00 57.97 60.73 1nu9 h PHE 226 Cb 0.17 -0.18 -0.01 0.00 3.61 0.00 0.00 35.95 39.54 1nu9 h PHE 226 CO -0.19 0.90 0.15 0.82 -1.61 0.00 0.00 178.31 178.38 1nu9 h ILE 227 N 0.58 1.12 -0.05 -0.55 1.08 -0.50 -1.21 117.51 117.98 1nu9 h ILE 227 Ca 0.07 -0.33 -0.19 0.00 -0.39 0.00 0.00 64.86 64.02 1nu9 h ILE 227 Cb 0.80 0.84 -0.00 0.00 -3.07 0.00 0.00 36.82 35.38 1nu9 h ILE 227 CO 0.07 0.12 -0.78 -0.33 -0.69 0.00 0.00 178.15 176.54 1nu9 h GLU 228 N 0.33 0.37 0.00 2.37 5.08 -1.12 -3.21 114.58 118.40 1nu9 h GLU 228 Ca 0.10 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1nu9 h GLU 228 Cb 0.06 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1nu9 h GLU 228 CO -0.02 0.98 -0.42 1.79 -1.00 0.00 0.00 179.01 180.35 1nu9 h THR 229 N 0.24 0.00 0.00 1.13 1.35 -1.37 -3.47 112.91 110.78 1nu9 h THR 229 Ca -0.04 -0.90 0.00 0.00 -0.55 0.00 0.00 66.41 64.92 1nu9 h THR 229 Cb 1.37 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 69.47 1nu9 h THR 229 CO 0.13 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.01 1nu9 n GLY 230 N 1.17 0.71 3.91 5.82 0.00 -0.50 -5.05 105.19 111.24 1nu9 n GLY 230 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1nu9 n GLY 230 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nu9 s LEU 231 N 0.00 3.58 -0.02 0.99 1.43 -0.93 -5.01 118.68 118.72 1nu9 s LEU 231 Ca 0.00 0.94 -0.12 0.00 -1.03 0.00 0.00 54.13 53.92 1nu9 s LEU 231 Cb 0.00 -3.89 -0.05 0.00 0.03 0.00 0.00 46.19 42.28 1nu9 s LEU 231 CO 0.00 -0.63 0.33 0.20 0.23 0.00 0.00 176.35 176.48 1nu9 s ASN 232 N -4.12 6.66 -0.29 2.29 0.02 -1.26 -4.51 114.94 113.72 1nu9 s ASN 232 Ca 0.48 0.79 -0.27 0.00 -1.02 0.00 0.00 52.86 52.84 1nu9 s ASN 232 Cb -0.10 -2.18 0.01 0.00 0.02 0.00 0.00 41.25 38.99 1nu9 s ASN 232 CO 0.45 0.32 0.98 -0.75 0.02 0.00 0.00 177.10 178.13 1nu9 s LYS 233 N -1.22 4.09 0.54 -0.60 2.20 -1.26 -4.67 119.74 118.82 1nu9 s LYS 233 Ca 0.23 1.01 -0.19 0.00 -0.36 0.00 0.00 55.97 56.66 1nu9 s LYS 233 Cb -0.15 -3.71 -0.06 0.00 -1.51 0.00 0.00 37.83 32.41 1nu9 s LYS 233 CO 0.12 -0.76 1.10 -1.25 -0.36 0.00 0.00 175.35 174.20 1nu9 s PRO 234 N 3.33 3.42 0.32 4.03 0.04 -1.26 -4.79 135.00 140.08 1nu9 s PRO 234 Ca 0.41 1.51 0.26 0.00 0.04 0.00 0.00 61.00 63.22 1nu9 s PRO 234 Cb -0.13 -2.02 0.90 0.00 0.04 0.00 0.00 34.50 33.29 1nu9 s PRO 234 CO 0.12 -0.77 1.77 -0.44 0.04 0.00 0.00 177.00 177.71 1nu9 h ASP 235 N 1.15 0.00 -3.24 6.66 3.45 -1.96 -3.42 116.42 119.06 1nu9 h ASP 235 Ca -0.49 0.00 -0.50 0.00 0.43 0.00 0.00 57.03 56.47 1nu9 h ASP 235 Cb 1.25 0.00 -0.37 0.00 -0.56 0.00 0.00 39.33 39.65 1nu9 h ASP 235 CO 0.57 0.00 -0.79 0.20 -1.57 0.00 0.00 179.24 177.65 1nu9 s ASN 236 N -4.85 1.92 -0.06 6.45 0.01 -1.26 -5.11 114.94 112.03 1nu9 s ASN 236 Ca 0.06 -0.24 0.01 0.00 -0.71 0.00 0.00 52.86 51.98 1nu9 s ASN 236 Cb 0.10 -0.72 0.02 0.00 0.41 0.00 0.00 41.25 41.06 1nu9 s ASN 236 CO 0.52 -0.12 -0.07 -0.63 -1.51 0.00 0.00 177.10 175.29 1nu9 s ILE 237 N 1.61 0.81 0.01 0.60 1.01 -1.26 -4.95 121.20 119.02 1nu9 s ILE 237 Ca 0.02 -0.25 -0.30 0.00 0.00 0.00 0.00 60.65 60.11 1nu9 s ILE 237 Cb -0.13 -0.80 -0.06 0.00 0.01 0.00 0.00 42.46 41.48 1nu9 s ILE 237 CO -0.06 0.30 1.40 -0.89 0.00 0.00 0.00 174.94 175.69 1nu9 s THR 238 N 1.04 3.67 0.25 2.92 2.01 -1.26 -4.92 115.64 119.35 1nu9 s THR 238 Ca -0.08 1.07 -0.30 0.00 0.31 0.00 0.00 61.69 62.68 1nu9 s THR 238 Cb -0.14 -3.69 -0.11 0.00 0.01 0.00 0.00 72.50 68.57 1nu9 s THR 238 CO -0.00 0.01 1.53 -0.44 -0.69 0.00 0.00 174.62 175.02 1nu9 s SER 239 N 1.82 6.53 0.33 3.53 0.01 -1.26 -4.69 113.70 119.97 1nu9 s SER 239 Ca 0.64 2.77 -0.29 0.00 1.31 0.00 0.00 55.95 60.38 1nu9 s SER 239 Cb -0.32 -2.62 -0.10 0.00 0.21 0.00 0.00 66.02 63.18 1nu9 s SER 239 CO 0.27 -0.81 1.40 -0.47 0.41 0.00 0.00 173.24 174.03 1nu9 s TYR 240 N 0.26 2.90 -0.19 2.43 5.04 -0.35 -4.90 117.35 122.55 1nu9 s TYR 240 Ca 0.63 1.24 -0.05 0.00 -2.44 0.00 0.00 57.07 56.46 1nu9 s TYR 240 Cb -0.45 -3.82 0.07 0.00 0.35 0.00 0.00 41.96 38.11 1nu9 s TYR 240 CO 0.42 -2.42 0.09 0.34 -1.34 0.00 0.00 175.55 172.65 1nu9 s ASP 241 N -0.17 2.56 0.27 4.32 3.68 -1.26 -4.84 116.67 121.22 1nu9 s ASP 241 Ca 0.53 -0.73 0.01 0.00 2.13 0.00 0.00 52.55 54.48 1nu9 s ASP 241 Cb -0.42 -0.28 0.63 0.00 -1.45 0.00 0.00 42.92 41.40 1nu9 s ASP 241 CO 0.54 -0.36 1.69 -1.28 0.13 0.00 0.00 175.17 175.89 1nu9 h SER 242 N 8.41 0.21 0.36 -0.34 0.87 -1.94 0.71 113.55 121.82 1nu9 h SER 242 Ca -0.16 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1nu9 h SER 242 Cb 1.13 0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 63.25 1nu9 h SER 242 CO 0.32 -0.02 -0.05 0.77 -0.53 0.00 0.00 176.83 177.32 1nu9 h SER 243 N 0.35 0.00 0.00 6.23 4.64 -1.98 -1.82 113.55 120.97 1nu9 h SER 243 Ca 0.51 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.58 1nu9 h SER 243 Cb 0.93 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.97 1nu9 h SER 243 CO -0.53 0.05 -1.94 0.29 -0.87 0.00 0.00 176.83 173.83 1nu9 n LYS 244 N -3.36 1.36 -0.04 4.77 5.02 0.26 -4.79 118.16 121.38 1nu9 n LYS 244 Ca -0.02 0.03 0.02 0.00 -2.02 0.00 0.00 58.31 56.32 1nu9 n LYS 244 Cb 0.19 -1.35 0.04 0.00 -0.02 0.00 0.00 35.03 33.89 1nu9 n LYS 244 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1nu9 n HIS 245 N -2.66 0.10 -1.66 2.13 8.25 0.22 -4.31 115.22 117.29 1nu9 n HIS 245 Ca -0.25 -0.31 -0.51 0.00 -0.26 0.00 0.00 57.72 56.39 1nu9 n HIS 245 Cb 0.90 -0.03 -0.06 0.00 1.12 0.00 0.00 29.99 31.93 1nu9 n HIS 245 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1nu9 n HIS 246 N -0.01 2.05 0.25 4.41 -0.00 -0.69 -3.78 115.22 117.44 1nu9 n HIS 246 Ca 0.03 0.35 0.15 0.00 0.46 0.00 0.00 57.72 58.71 1nu9 n HIS 246 Cb 0.23 -2.50 0.76 0.00 -0.12 0.00 0.00 29.99 28.36 1nu9 n HIS 246 CO 0.00 0.00 0.00 0.10 0.46 0.00 0.00 176.34 176.90 1nu9 h TYR 247 N 6.79 0.00 0.00 1.57 -0.00 -1.91 0.42 116.97 123.85 1nu9 h TYR 247 Ca -0.47 0.00 -0.21 0.00 -0.00 0.00 0.00 58.73 58.05 1nu9 h TYR 247 Cb 1.29 0.00 -0.04 0.00 -0.00 0.00 0.00 36.73 37.99 1nu9 h TYR 247 CO 0.72 0.00 -1.78 1.17 -0.00 0.00 0.00 178.16 178.27 1nu9 n LYS 248 N -2.53 0.97 0.12 0.10 3.00 -1.26 -4.08 118.16 114.48 1nu9 n LYS 248 Ca -0.01 0.05 0.12 0.00 -0.00 0.00 0.00 58.31 58.47 1nu9 n LYS 248 Cb 0.08 -1.28 0.10 0.00 0.00 0.00 0.00 35.03 33.93 1nu9 n LYS 248 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 1nu9 h ASN 249 N 0.00 0.00 -1.36 3.14 2.35 -1.91 -3.39 115.58 114.41 1nu9 h ASN 249 Ca -0.31 -0.05 -0.40 0.00 -0.55 0.00 0.00 56.30 54.99 1nu9 h ASN 249 Cb 1.55 0.00 -0.33 0.00 0.05 0.00 0.00 38.32 39.59 1nu9 h ASN 249 CO -0.03 0.02 -0.98 1.41 -1.65 0.00 0.00 177.43 176.21 1nu9 n HIS 250 N -2.64 -0.63 -0.22 1.19 8.25 0.15 -4.94 115.22 116.38 1nu9 n HIS 250 Ca 0.02 -3.26 -0.04 0.00 -0.26 0.00 0.00 57.72 54.17 1nu9 n HIS 250 Cb 0.52 0.18 0.01 0.00 1.12 0.00 0.00 29.99 31.81 1nu9 n HIS 250 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1nu9 h SER 251 N 2.97 -1.16 0.11 0.41 0.02 -1.70 0.35 113.55 114.55 1nu9 h SER 251 Ca 0.02 0.23 0.02 0.00 -0.84 0.00 0.00 61.79 61.23 1nu9 h SER 251 Cb 1.03 0.59 -0.05 0.00 0.14 0.00 0.00 62.40 64.11 1nu9 h SER 251 CO 0.39 -0.30 -0.44 -0.33 -1.14 0.00 0.00 176.83 175.01 1nu9 h GLU 252 N -0.14 -0.64 -0.98 3.45 5.08 -1.92 0.97 114.58 120.40 1nu9 h GLU 252 Ca 0.25 0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.75 1nu9 h GLU 252 Cb 0.55 0.15 -0.08 0.00 0.50 0.00 0.00 28.75 29.88 1nu9 h GLU 252 CO -0.71 -0.43 0.63 0.78 -1.00 0.00 0.00 179.01 178.28 1nu9 h GLY 253 N -0.67 1.54 0.61 -3.84 0.00 -1.40 -0.41 103.07 98.90 1nu9 h GLY 253 Ca 0.02 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 1nu9 h GLY 253 CO -0.26 0.23 -0.47 -2.75 0.00 0.00 0.00 176.54 173.28 1nu9 h PHE 254 N 1.04 -1.28 -0.99 5.60 3.57 0.64 -1.08 116.94 124.43 1nu9 h PHE 254 Ca 0.46 -0.00 0.14 0.00 3.53 0.00 0.00 57.97 62.10 1nu9 h PHE 254 Cb 0.37 0.48 -0.09 0.00 2.79 0.00 0.00 35.95 39.50 1nu9 h PHE 254 CO -0.00 -0.66 0.62 0.93 -2.23 0.00 0.00 178.31 176.96 1nu9 h GLU 255 N -1.04 0.86 -0.19 1.11 4.39 -0.21 0.11 114.58 119.61 1nu9 h GLU 255 Ca -0.08 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.49 1nu9 h GLU 255 Cb 0.87 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 1nu9 h GLU 255 CO 0.02 0.57 -0.21 0.00 -1.16 0.00 0.00 179.01 178.23 1nu9 h ALA 256 N 1.58 1.30 -0.22 3.43 0.00 -0.85 0.40 119.26 124.90 1nu9 h ALA 256 Ca 0.51 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 55.01 1nu9 h ALA 256 Cb 0.63 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1nu9 h ALA 256 CO -0.28 0.47 -0.37 1.25 0.00 0.00 0.00 179.25 180.32 1nu9 h LEU 257 N 0.30 0.70 0.32 0.00 6.46 0.51 -1.66 115.31 121.94 1nu9 h LEU 257 Ca 0.05 -0.53 -0.02 0.00 -0.12 0.00 0.00 57.88 57.27 1nu9 h LEU 257 Cb 0.54 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 40.27 1nu9 h LEU 257 CO 0.04 1.10 -0.15 0.58 -0.62 0.00 0.00 178.44 179.38 1nu9 h VAL 258 N 0.33 0.71 -0.28 1.05 2.07 -1.03 -0.59 116.25 118.51 1nu9 h VAL 258 Ca 0.02 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.36 1nu9 h VAL 258 Cb 0.96 0.84 -0.06 0.00 -1.52 0.00 0.00 31.29 31.50 1nu9 h VAL 258 CO 0.08 0.05 -0.14 0.50 0.02 0.00 0.00 177.57 178.09 1nu9 h LYS 259 N -0.55 -0.09 -0.76 1.57 3.64 -0.96 0.18 116.57 119.59 1nu9 h LYS 259 Ca -0.04 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1nu9 h LYS 259 Cb 0.41 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.21 1nu9 h LYS 259 CO 0.07 -0.06 0.44 1.49 -2.27 0.00 0.00 179.45 179.12 1nu9 h GLU 260 N -0.10 1.04 -0.11 1.90 4.81 -1.21 -0.95 114.58 119.96 1nu9 h GLU 260 Ca 0.15 -0.10 -0.05 0.00 -0.13 0.00 0.00 59.36 59.23 1nu9 h GLU 260 Cb 0.32 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 1nu9 h GLU 260 CO -0.34 0.74 -0.11 1.15 -0.73 0.00 0.00 179.01 179.72 1nu9 h THR 261 N 1.05 1.35 -0.64 0.32 2.02 -0.23 -1.16 112.91 115.63 1nu9 h THR 261 Ca 0.27 -1.26 0.04 0.00 0.77 0.00 0.00 66.41 66.23 1nu9 h THR 261 Cb -0.02 1.93 -0.05 0.00 -1.74 0.00 0.00 68.15 68.28 1nu9 h THR 261 CO -0.05 0.36 0.37 0.03 0.37 0.00 0.00 175.52 176.61 1nu9 h ARG 262 N -0.12 0.70 -0.63 6.66 3.08 -0.51 -0.82 114.38 122.74 1nu9 h ARG 262 Ca 0.02 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1nu9 h ARG 262 Cb 0.63 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1nu9 h ARG 262 CO 0.03 0.46 0.10 0.93 -1.07 0.00 0.00 179.97 180.42 1nu9 h GLU 263 N 0.72 1.04 -0.91 0.04 5.08 -1.11 -1.08 114.58 118.35 1nu9 h GLU 263 Ca 0.27 -0.28 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1nu9 h GLU 263 Cb 0.09 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 1nu9 h GLU 263 CO -0.13 0.97 0.60 0.00 -1.00 0.00 0.00 179.01 179.44 1nu9 h ALA 264 N 1.03 1.18 0.19 3.43 0.00 -0.55 0.14 119.26 124.68 1nu9 h ALA 264 Ca 0.19 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1nu9 h ALA 264 Cb 0.44 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1nu9 h ALA 264 CO 0.01 0.50 -0.09 0.28 0.00 0.00 0.00 179.25 179.95 1nu9 h VAL 265 N 1.19 0.88 -0.82 0.00 2.07 -0.56 -1.44 116.25 117.57 1nu9 h VAL 265 Ca 0.35 -0.32 0.13 0.00 0.82 0.00 0.00 66.70 67.68 1nu9 h VAL 265 Cb -0.06 1.07 -0.09 0.00 -1.52 0.00 0.00 31.29 30.69 1nu9 h VAL 265 CO -0.10 0.07 0.42 0.74 0.02 0.00 0.00 177.57 178.73 1nu9 h THR 266 N -0.41 0.77 0.00 2.57 2.02 -0.88 -0.58 112.91 116.40 1nu9 h THR 266 Ca -0.03 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1nu9 h THR 266 Cb 0.32 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1nu9 h THR 266 CO 0.04 0.12 0.00 0.59 0.37 0.00 0.00 175.52 176.64 1nu9 n ASN 267 N -4.86 0.00 -4.78 4.18 3.02 0.01 -4.88 115.26 107.94 1nu9 n ASN 267 Ca 0.15 -0.08 -0.37 0.00 -0.03 0.00 0.00 54.58 54.26 1nu9 n ASN 267 Cb 0.38 -0.29 -0.06 0.00 -0.61 0.00 0.00 39.78 39.19 1nu9 n ASN 267 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nu9 s ALA 268 N -2.59 3.21 0.51 5.41 0.00 -0.23 -5.06 121.76 123.01 1nu9 s ALA 268 Ca 0.25 0.50 0.04 0.00 0.00 0.00 0.00 51.96 52.75 1nu9 s ALA 268 Cb 0.18 -3.16 0.09 0.00 0.00 0.00 0.00 23.12 20.22 1nu9 s ALA 268 CO 0.42 0.18 0.65 0.27 0.00 0.00 0.00 175.76 177.28 1nu9 n ASN 269 N 0.50 1.35 -1.95 0.00 2.04 -1.26 -4.78 115.26 111.16 1nu9 n ASN 269 Ca 0.02 -2.03 0.03 0.00 -0.44 0.00 0.00 54.58 52.16 1nu9 n ASN 269 Cb 0.50 -0.38 0.38 0.00 -2.53 0.00 0.00 39.78 37.75 1nu9 n ASN 269 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 1nu9 n ASP 270 N -2.67 5.50 -0.03 0.53 3.85 -1.26 -4.47 116.55 118.01 1nu9 n ASP 270 Ca 0.12 -3.03 0.02 0.00 -0.71 0.00 0.00 54.79 51.20 1nu9 n ASP 270 Cb 0.44 -0.71 0.37 0.00 -1.35 0.00 0.00 41.12 39.87 1nu9 n ASP 270 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 1nu9 h SER 271 N 3.61 0.53 -0.61 -1.12 0.02 -1.95 -2.87 113.55 111.15 1nu9 h SER 271 Ca 0.09 -0.04 0.15 0.00 -0.84 0.00 0.00 61.79 61.15 1nu9 h SER 271 Cb 2.11 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 64.49 1nu9 h SER 271 CO 0.58 0.44 0.43 4.11 -1.14 0.00 0.00 176.83 181.25 1nu9 h TRP 272 N 0.60 0.15 -0.79 3.45 5.08 -1.89 -2.36 115.95 120.19 1nu9 h TRP 272 Ca 0.15 0.00 0.17 0.00 1.08 0.00 0.00 58.89 60.30 1nu9 h TRP 272 Cb 0.04 -0.05 -0.05 0.00 -3.00 0.00 0.00 29.16 26.10 1nu9 h TRP 272 CO 0.00 0.06 0.53 0.87 -1.28 0.00 0.00 178.44 178.62 1nu9 h LYS 273 N 0.13 0.35 0.00 0.12 1.57 -1.87 0.24 116.57 117.11 1nu9 h LYS 273 Ca 0.29 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1nu9 h LYS 273 Cb 0.98 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1nu9 h LYS 273 CO -0.04 0.23 0.00 0.25 -0.57 0.00 0.00 179.45 179.33 1nu9 n THR 274 N -4.47 0.02 -1.16 -0.16 -2.24 -0.89 -3.62 114.28 101.76 1nu9 n THR 274 Ca 0.16 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.98 1nu9 n THR 274 Cb 0.60 -0.58 0.05 0.00 -2.10 0.00 0.00 70.33 68.31 1nu9 n THR 274 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1nu9 n LYS 275 N -1.03 1.01 -1.32 -0.78 5.02 0.84 -5.10 118.16 116.80 1nu9 n LYS 275 Ca 0.19 -1.63 -0.32 0.00 -2.02 0.00 0.00 58.31 54.54 1nu9 n LYS 275 Cb 0.11 -0.97 0.09 0.00 -0.02 0.00 0.00 35.03 34.24 1nu9 n LYS 275 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1nu9 s THR 276 N -1.28 2.86 0.01 -0.18 -4.23 -1.15 -4.95 115.64 106.71 1nu9 s THR 276 Ca 0.12 0.34 -0.25 0.00 -1.18 0.00 0.00 61.69 60.72 1nu9 s THR 276 Cb 0.11 -2.76 -0.19 0.00 1.34 0.00 0.00 72.50 71.00 1nu9 s THR 276 CO 0.01 -0.31 1.40 0.58 -0.54 0.00 0.00 174.62 175.76 1nu9 h VAL 277 N -0.79 1.26 -3.56 2.29 2.07 -1.92 -3.45 116.25 112.16 1nu9 h VAL 277 Ca -0.45 -0.81 -0.47 0.00 0.82 0.00 0.00 66.70 65.78 1nu9 h VAL 277 Cb 1.26 1.81 0.05 0.00 -1.52 0.00 0.00 31.29 32.89 1nu9 h VAL 277 CO 0.50 0.21 0.15 -0.54 0.02 0.00 0.00 177.57 177.91 1nu9 s LYS 278 N -4.80 2.89 -0.27 1.57 1.02 -1.26 -5.07 119.74 113.82 1nu9 s LYS 278 Ca -0.15 -0.08 -0.11 0.00 0.02 0.00 0.00 55.97 55.66 1nu9 s LYS 278 Cb 0.03 -2.30 -0.05 0.00 -0.52 0.00 0.00 37.83 35.00 1nu9 s LYS 278 CO 0.67 -0.69 0.17 0.21 -0.92 0.00 0.00 175.35 174.79 1nu9 s LYS 279 N -4.96 3.94 0.14 1.68 2.47 -1.26 -5.06 119.74 116.69 1nu9 s LYS 279 Ca 0.54 -0.33 0.04 0.00 -1.56 0.00 0.00 55.97 54.66 1nu9 s LYS 279 Cb -0.10 -3.61 -0.04 0.00 -1.46 0.00 0.00 37.83 32.62 1nu9 s LYS 279 CO 0.44 -0.14 0.14 0.71 0.16 0.00 0.00 175.35 176.66 1nu9 s TYR 280 N 1.63 3.20 0.00 4.03 1.51 -1.26 -5.22 117.35 121.25 1nu9 s TYR 280 Ca 0.07 0.02 0.00 0.00 -1.01 0.00 0.00 57.07 56.15 1nu9 s TYR 280 Cb -0.16 -1.56 0.00 0.00 -0.11 0.00 0.00 41.96 40.14 1nu9 s TYR 280 CO 0.09 0.52 0.00 0.41 -1.11 0.00 0.00 175.55 175.46