#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 4.86 0.00 1.39 1.01 -1.26 -4.91 120.40 121.49 1nu9 s VAL 2 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 61.98 61.99 1nu9 s VAL 2 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.11 1nu9 s VAL 2 CO 0.00 0.33 0.00 0.35 0.00 0.00 0.00 175.10 175.78 1nu9 n THR 3 N 4.68 0.00 -3.76 3.92 -2.24 -1.26 -5.11 114.28 110.51 1nu9 n THR 3 Ca -0.15 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.39 1nu9 n THR 3 Cb 0.52 -0.36 -0.02 0.00 -2.10 0.00 0.00 70.33 68.36 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 -1.37 3.47 -0.34 -0.78 1.02 -1.26 -5.07 119.74 115.41 1nu9 s LYS 4 Ca 0.00 -0.55 -0.09 0.00 0.02 0.00 0.00 55.97 55.35 1nu9 s LYS 4 Cb 0.00 -2.83 0.02 0.00 -0.52 0.00 0.00 37.83 34.49 1nu9 s LYS 4 CO 0.00 0.37 0.15 0.34 -0.92 0.00 0.00 175.35 175.28 1nu9 s ASP 5 N -3.73 5.48 -0.09 2.83 3.68 -1.26 -4.95 116.67 118.64 1nu9 s ASP 5 Ca 0.36 -0.85 0.18 0.00 2.13 0.00 0.00 52.55 54.38 1nu9 s ASP 5 Cb -0.10 -1.96 0.64 0.00 -1.45 0.00 0.00 42.92 40.05 1nu9 s ASP 5 CO 0.31 -0.29 1.55 -1.22 0.13 0.00 0.00 175.17 175.65 1nu9 n TYR 6 N 4.93 1.22 0.37 -5.34 4.02 -1.26 -4.65 117.16 116.45 1nu9 n TYR 6 Ca -0.13 -0.60 0.05 0.00 -0.01 0.00 0.00 57.90 57.21 1nu9 n TYR 6 Cb 0.47 -0.19 0.23 0.00 -0.02 0.00 0.00 39.34 39.83 1nu9 n TYR 6 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1nu9 n SER 7 N 0.96 0.00 -0.82 7.72 3.41 -1.26 -2.62 113.62 121.02 1nu9 n SER 7 Ca 0.23 0.48 0.05 0.00 -0.26 0.00 0.00 58.87 59.37 1nu9 n SER 7 Cb 0.79 -0.49 0.13 0.00 -0.26 0.00 0.00 64.21 64.38 1nu9 n SER 7 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1nu9 n LYS 8 N -1.49 0.95 -0.17 4.33 5.02 -1.26 -4.67 118.16 120.87 1nu9 n LYS 8 Ca 0.03 -2.67 0.09 0.00 -2.02 0.00 0.00 58.31 53.74 1nu9 n LYS 8 Cb 0.12 -1.02 0.18 0.00 -0.02 0.00 0.00 35.03 34.29 1nu9 n LYS 8 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1nu9 n GLU 9 N -0.57 2.28 -3.42 1.97 4.07 -1.08 -4.98 120.64 118.91 1nu9 n GLU 9 Ca 0.13 -2.07 -0.36 0.00 -0.06 0.00 0.00 57.16 54.80 1nu9 n GLU 9 Cb 0.83 -1.41 -0.06 0.00 -0.06 0.00 0.00 31.44 30.75 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 -1.21 6.82 -0.02 4.31 0.15 -1.26 -4.61 113.70 117.88 1nu9 s SER 10 Ca 0.31 1.02 0.14 0.00 0.70 0.00 0.00 55.95 58.13 1nu9 s SER 10 Cb 0.18 -2.27 0.44 0.00 -1.71 0.00 0.00 66.02 62.66 1nu9 s SER 10 CO 0.25 0.18 1.36 0.54 1.20 0.00 0.00 173.24 176.77 1nu9 n ARG 11 N 1.13 2.27 -2.72 5.44 5.12 -1.26 -4.92 116.66 121.72 1nu9 n ARG 11 Ca -0.08 -1.79 -0.41 0.00 -1.93 0.00 0.00 57.85 53.64 1nu9 n ARG 11 Cb 0.52 -1.44 -0.04 0.00 -1.16 0.00 0.00 32.46 30.33 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 -1.42 4.47 0.08 1.55 1.01 -1.26 -4.96 120.40 119.87 1nu9 s VAL 12 Ca 0.33 2.06 -0.31 0.00 0.00 0.00 0.00 61.98 64.06 1nu9 s VAL 12 Cb 0.18 -4.31 -0.07 0.00 0.00 0.00 0.00 36.38 32.17 1nu9 s VAL 12 CO 0.21 0.32 1.45 0.20 0.00 0.00 0.00 175.10 177.28 1nu9 s ASN 13 N -0.02 6.78 0.24 3.32 0.01 -1.26 -4.91 114.94 119.11 1nu9 s ASN 13 Ca 0.47 2.31 0.07 0.00 -0.71 0.00 0.00 52.86 55.00 1nu9 s ASN 13 Cb -0.24 -2.58 0.72 0.00 0.41 0.00 0.00 41.25 39.57 1nu9 s ASN 13 CO 0.30 -0.72 1.14 1.21 -1.51 0.00 0.00 177.10 177.52 1nu9 n GLU 14 N 4.61 -0.05 0.02 -0.60 4.07 -1.26 -0.15 120.64 127.29 1nu9 n GLU 14 Ca 0.13 1.05 0.12 0.00 -0.06 0.00 0.00 57.16 58.41 1nu9 n GLU 14 Cb 0.42 -1.76 0.29 0.00 -0.06 0.00 0.00 31.44 30.33 1nu9 n GLU 14 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1nu9 n ASN 15 N -4.86 0.50 -0.15 4.31 5.03 -1.26 -4.28 115.26 114.55 1nu9 n ASN 15 Ca 0.21 0.01 0.16 0.00 0.87 0.00 0.00 54.58 55.83 1nu9 n ASN 15 Cb 0.71 0.07 0.52 0.00 -1.02 0.00 0.00 39.78 40.05 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 0.00 0.37 0.89 6.41 0.02 -0.92 -1.90 113.55 118.41 1nu9 h SER 16 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1nu9 h SER 16 Cb 0.59 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.08 1nu9 h SER 16 CO 0.00 0.19 0.00 2.29 -1.14 0.00 0.00 176.83 178.17 1nu9 n LYS 17 N -4.47 0.22 -0.11 3.45 0.00 -1.26 -2.67 118.16 113.32 1nu9 n LYS 17 Ca 0.14 0.40 0.11 0.00 -0.00 0.00 0.00 58.31 58.96 1nu9 n LYS 17 Cb 0.53 -1.88 0.31 0.00 -0.00 0.00 0.00 35.03 33.98 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 -2.29 0.29 0.00 5.58 4.02 -0.71 -4.83 117.16 119.21 1nu9 n TYR 18 Ca 0.03 -0.14 0.00 0.00 -0.01 0.00 0.00 57.90 57.77 1nu9 n TYR 18 Cb 0.27 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.59 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 1.28 -0.77 3.67 2.72 0.00 -1.09 -4.95 105.19 106.05 1nu9 n GLY 19 Ca 0.17 -1.40 -0.43 0.00 0.00 0.00 0.00 46.02 44.36 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 0.00 4.64 0.37 2.61 2.01 -1.26 -4.98 115.64 119.03 1nu9 s THR 20 Ca 0.00 1.96 -0.26 0.00 0.31 0.00 0.00 61.69 63.70 1nu9 s THR 20 Cb 0.00 -4.27 -0.09 0.00 0.01 0.00 0.00 72.50 68.16 1nu9 s THR 20 CO 0.00 -0.13 1.14 -0.76 -0.69 0.00 0.00 174.62 174.18 1nu9 s LEU 21 N 2.96 4.27 0.19 4.42 1.43 -1.26 -4.28 118.68 126.41 1nu9 s LEU 21 Ca 0.47 2.30 -0.16 0.00 -1.03 0.00 0.00 54.13 55.70 1nu9 s LEU 21 Cb -0.17 -3.95 -0.08 0.00 0.03 0.00 0.00 46.19 42.03 1nu9 s LEU 21 CO 0.10 -0.53 0.63 0.27 0.23 0.00 0.00 176.35 177.04 1nu9 s ILE 22 N -1.39 4.74 0.15 -0.59 -4.36 -0.49 -4.99 121.20 114.27 1nu9 s ILE 22 Ca 0.54 0.99 -0.33 0.00 -0.26 0.00 0.00 60.65 61.59 1nu9 s ILE 22 Cb -0.30 -3.77 -0.16 0.00 1.25 0.00 0.00 42.46 39.48 1nu9 s ILE 22 CO 0.38 0.18 1.11 -1.20 0.24 0.00 0.00 174.94 175.66 1nu9 n SER 23 N 0.64 1.03 -0.29 4.36 7.64 -1.26 -4.64 113.62 121.09 1nu9 n SER 23 Ca -0.03 1.14 0.12 0.00 1.01 0.00 0.00 58.87 61.11 1nu9 n SER 23 Cb 0.52 -1.17 0.28 0.00 -1.01 0.00 0.00 64.21 62.83 1nu9 n SER 23 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1nu9 h ASP 24 N 3.20 0.25 -0.44 6.43 3.58 -1.95 0.09 116.42 127.59 1nu9 h ASP 24 Ca -0.43 0.15 -0.03 0.00 0.42 0.00 0.00 57.03 57.15 1nu9 h ASP 24 Cb 1.36 0.15 -0.02 0.00 1.72 0.00 0.00 39.33 42.54 1nu9 h ASP 24 CO 0.69 -0.01 0.20 4.11 -2.88 0.00 0.00 179.24 181.34 1nu9 h TRP 25 N 0.37 0.69 0.00 0.28 5.08 -2.02 -2.02 115.95 118.33 1nu9 h TRP 25 Ca 0.53 -0.03 -0.16 0.00 1.08 0.00 0.00 58.89 60.31 1nu9 h TRP 25 Cb 0.99 -0.22 -0.02 0.00 -3.00 0.00 0.00 29.16 26.91 1nu9 h TRP 25 CO -0.17 0.54 -0.86 -0.92 -1.28 0.00 0.00 178.44 175.75 1nu9 h TYR 26 N 0.69 0.00 0.02 0.12 3.20 -1.56 -3.35 116.97 116.09 1nu9 h TYR 26 Ca 0.17 0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.06 1nu9 h TYR 26 Cb 0.13 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 1nu9 h TYR 26 CO 0.01 0.70 -0.17 1.25 -1.64 0.00 0.00 178.16 178.31 1nu9 h LEU 27 N 0.00 -0.48 -0.93 2.82 6.46 -0.30 -2.45 115.31 120.43 1nu9 h LEU 27 Ca -0.05 0.07 0.21 0.00 -0.12 0.00 0.00 57.88 58.00 1nu9 h LEU 27 Cb 1.57 0.20 -0.12 0.00 -0.73 0.00 0.00 40.66 41.58 1nu9 h LEU 27 CO 0.08 -0.23 0.48 0.11 -0.62 0.00 0.00 178.44 178.26 1nu9 h LYS 28 N -0.29 0.51 -0.14 1.25 1.57 -1.62 0.16 116.57 118.01 1nu9 h LYS 28 Ca 0.05 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 1nu9 h LYS 28 Cb 0.34 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1nu9 h LYS 28 CO -0.14 0.33 -0.50 0.78 -0.57 0.00 0.00 179.45 179.35 1nu9 h GLY 29 N 0.52 0.41 1.64 3.86 0.00 -1.63 -2.32 103.07 105.54 1nu9 h GLY 29 Ca 0.57 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 1nu9 h GLY 29 CO -0.47 0.40 -0.43 3.21 0.00 0.00 0.00 176.54 179.25 1nu9 h ARG 30 N 0.30 0.40 -0.25 4.80 2.47 -0.41 -2.13 114.38 119.55 1nu9 h ARG 30 Ca 0.01 -0.21 -0.13 0.00 -1.26 0.00 0.00 59.98 58.40 1nu9 h ARG 30 Cb 0.98 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.29 1nu9 h ARG 30 CO 0.08 0.76 -0.38 -0.07 0.56 0.00 0.00 179.97 180.92 1nu9 h LEU 31 N 0.33 0.61 -0.67 3.04 3.38 -0.92 -1.86 115.31 119.23 1nu9 h LEU 31 Ca 0.03 -0.26 -0.13 0.00 0.09 0.00 0.00 57.88 57.60 1nu9 h LEU 31 Cb 0.89 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1nu9 h LEU 31 CO 0.07 0.93 -0.40 0.74 0.09 0.00 0.00 178.44 179.87 1nu9 h THR 32 N 0.48 1.30 -0.24 0.22 2.02 -1.31 -0.52 112.91 114.86 1nu9 h THR 32 Ca 0.05 -1.57 -0.00 0.00 0.77 0.00 0.00 66.41 65.65 1nu9 h THR 32 Cb 0.88 1.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.83 1nu9 h THR 32 CO 0.08 0.50 0.15 -1.28 0.37 0.00 0.00 175.52 175.33 1nu9 h SER 33 N 0.47 0.29 -0.18 4.18 0.87 -1.14 -0.75 113.55 117.30 1nu9 h SER 33 Ca 0.04 -0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.57 1nu9 h SER 33 Cb 0.91 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 1nu9 h SER 33 CO 0.08 0.25 0.05 -0.07 -0.53 0.00 0.00 176.83 176.61 1nu9 h LEU 34 N 0.30 0.04 -0.75 2.23 3.38 -0.99 -0.50 115.31 119.03 1nu9 h LEU 34 Ca 0.09 0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.19 1nu9 h LEU 34 Cb 0.02 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 1nu9 h LEU 34 CO -0.02 0.05 0.36 -0.08 0.09 0.00 0.00 178.44 178.85 1nu9 h GLU 35 N 0.13 0.56 -0.67 1.13 4.81 -0.82 -1.08 114.58 118.63 1nu9 h GLU 35 Ca 0.08 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.22 1nu9 h GLU 35 Cb 0.06 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1nu9 h GLU 35 CO -0.09 0.37 0.20 0.77 -0.73 0.00 0.00 179.01 179.53 1nu9 h SER 36 N 0.58 0.97 -0.36 1.04 0.02 -0.28 -1.76 113.55 113.76 1nu9 h SER 36 Ca 0.39 -0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 61.13 1nu9 h SER 36 Cb 0.47 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 1nu9 h SER 36 CO -0.31 0.91 0.12 1.56 -1.14 0.00 0.00 176.83 177.96 1nu9 h GLN 37 N 1.00 0.55 -0.67 3.45 4.20 0.10 -0.90 115.11 122.85 1nu9 h GLN 37 Ca 0.22 -0.12 0.03 0.00 0.06 0.00 0.00 58.65 58.84 1nu9 h GLN 37 Cb 0.30 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.95 1nu9 h GLN 37 CO -0.01 0.57 0.41 0.74 -0.67 0.00 0.00 178.83 179.88 1nu9 h PHE 38 N 0.43 0.77 -0.35 2.96 -1.00 -1.12 0.13 116.94 118.77 1nu9 h PHE 38 Ca 0.12 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.92 1nu9 h PHE 38 Cb 0.24 -0.25 -0.02 0.00 3.61 0.00 0.00 35.95 39.54 1nu9 h PHE 38 CO 0.01 0.43 0.21 0.82 -1.61 0.00 0.00 178.31 178.17 1nu9 h ILE 39 N 0.81 1.12 -0.61 -0.55 2.04 -1.03 0.97 117.51 120.25 1nu9 h ILE 39 Ca 0.27 -0.28 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1nu9 h ILE 39 Cb 0.04 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 1nu9 h ILE 39 CO -0.11 0.12 0.24 -1.13 0.00 0.00 0.00 178.15 177.26 1nu9 h ASN 40 N 0.45 0.86 -0.15 1.72 -1.24 -0.71 -0.61 115.58 115.90 1nu9 h ASN 40 Ca 0.12 -0.18 -0.01 0.00 0.71 0.00 0.00 56.30 56.94 1nu9 h ASN 40 Cb 0.01 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 38.83 1nu9 h ASN 40 CO -0.02 0.80 0.05 0.00 -1.29 0.00 0.00 177.43 176.97 1nu9 h ALA 41 N 1.09 0.20 0.00 1.57 0.00 -0.25 -1.83 119.26 120.04 1nu9 h ALA 41 Ca 0.20 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1nu9 h ALA 41 Cb 0.22 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1nu9 h ALA 41 CO -0.02 -0.18 -0.12 -0.07 0.00 0.00 0.00 179.25 178.87 1nu9 h LEU 42 N 0.07 0.00 -0.69 0.00 3.38 -0.70 -2.36 115.31 115.01 1nu9 h LEU 42 Ca 0.05 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 1nu9 h LEU 42 Cb 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1nu9 h LEU 42 CO -0.00 0.12 -0.46 1.23 0.09 0.00 0.00 178.44 179.41 1nu9 h GLY 43 N 0.37 0.50 1.28 0.83 0.00 -0.43 -1.94 103.07 103.68 1nu9 h GLY 43 Ca -0.00 -0.52 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 1nu9 h GLY 43 CO 0.02 0.47 -0.23 -2.22 0.00 0.00 0.00 176.54 174.58 1nu9 h ILE 44 N 0.37 1.27 -0.44 2.60 2.04 -0.85 -2.60 117.51 119.90 1nu9 h ILE 44 Ca 0.02 -1.36 -0.00 0.00 1.00 0.00 0.00 64.86 64.52 1nu9 h ILE 44 Cb 0.96 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.21 1nu9 h ILE 44 CO 0.08 0.46 0.26 0.25 0.00 0.00 0.00 178.15 179.20 1nu9 h LEU 45 N 0.71 0.53 -0.28 1.44 5.85 -1.14 -2.64 115.31 119.79 1nu9 h LEU 45 Ca 0.10 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1nu9 h LEU 45 Cb 0.76 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1nu9 h LEU 45 CO 0.06 0.43 0.00 -0.62 -0.34 0.00 0.00 178.44 177.97 1nu9 n GLU 46 N -4.73 0.13 -1.53 1.25 -0.58 -0.76 -4.85 120.64 109.56 1nu9 n GLU 46 Ca 0.01 0.28 -0.57 0.00 -0.42 0.00 0.00 57.16 56.46 1nu9 n GLU 46 Cb 0.06 -1.71 -0.07 0.00 -0.57 0.00 0.00 31.44 29.14 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 -1.96 0.00 -0.26 2.62 -1.04 -0.99 -4.80 114.28 107.86 1nu9 n THR 47 Ca 0.04 -0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.12 1nu9 n THR 47 Cb 0.27 -0.29 0.21 0.00 -1.82 0.00 0.00 70.33 68.70 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 3.58 0.41 -1.01 -1.42 3.20 -1.91 -1.87 116.97 117.96 1nu9 h TYR 48 Ca -0.50 0.04 0.27 0.00 3.14 0.00 0.00 58.73 61.68 1nu9 h TYR 48 Cb 1.40 -0.06 -0.13 0.00 1.54 0.00 0.00 36.73 39.47 1nu9 h TYR 48 CO 0.58 -0.04 0.59 1.25 -1.64 0.00 0.00 178.16 178.91 1nu9 h HIS 49 N 0.34 0.99 -0.10 -3.82 2.76 -1.90 0.06 115.15 113.47 1nu9 h HIS 49 Ca 0.44 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.65 1nu9 h HIS 49 Cb 0.75 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 29.43 1nu9 h HIS 49 CO -0.21 0.00 0.00 0.66 -1.30 0.00 0.00 177.93 177.08 1nu9 n TYR 50 N -4.92 0.14 -0.25 5.26 0.53 -0.70 -4.25 117.16 112.96 1nu9 n TYR 50 Ca 0.28 -0.07 -0.06 0.00 -1.02 0.00 0.00 57.90 57.04 1nu9 n TYR 50 Cb 0.81 0.00 0.02 0.00 -1.03 0.00 0.00 39.34 39.14 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 0.75 2.90 3.67 2.72 0.00 0.01 -4.67 105.19 110.57 1nu9 n GLY 51 Ca 0.07 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.66 2.46 0.42 1.61 2.56 -1.26 -5.01 118.70 118.82 1nu9 s GLU 52 Ca 0.11 -0.92 0.14 0.00 0.00 0.00 0.00 54.97 54.31 1nu9 s GLU 52 Cb 0.09 -2.47 1.01 0.00 2.00 0.00 0.00 34.13 34.76 1nu9 s GLU 52 CO 0.01 0.52 1.92 0.87 -0.56 0.00 0.00 175.26 178.01 1nu9 h LYS 53 N 3.29 0.44 0.00 4.30 1.57 -1.98 -1.89 116.57 122.31 1nu9 h LYS 53 Ca -0.48 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1nu9 h LYS 53 Cb 1.17 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.38 1nu9 h LYS 53 CO 0.58 0.29 0.00 0.39 -0.57 0.00 0.00 179.45 180.15 1nu9 n GLU 54 N -4.49 0.07 0.00 3.15 4.71 -1.26 -1.80 120.64 121.02 1nu9 n GLU 54 Ca 0.14 0.46 0.10 0.00 -0.01 0.00 0.00 57.16 57.85 1nu9 n GLU 54 Cb 0.50 -1.67 0.07 0.00 -1.01 0.00 0.00 31.44 29.33 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 -1.81 0.00 -0.23 -0.32 4.02 -0.71 -4.66 117.16 113.46 1nu9 n TYR 55 Ca 0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.87 1nu9 n TYR 55 Cb 0.09 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.45 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 3.73 -0.09 -0.04 -0.72 1.63 -1.45 0.13 116.57 119.77 1nu9 h LYS 56 Ca 0.00 0.01 -0.17 0.00 -0.85 0.00 0.00 60.65 59.64 1nu9 h LYS 56 Cb 0.81 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.45 1nu9 h LYS 56 CO 0.00 -0.06 -0.73 -0.44 -3.45 0.00 0.00 179.45 174.77 1nu9 h ASP 57 N -0.09 0.28 -0.58 4.20 3.32 -1.83 -0.35 116.42 121.37 1nu9 h ASP 57 Ca 0.28 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 1nu9 h ASP 57 Cb 0.54 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 1nu9 h ASP 57 CO -0.72 0.91 0.11 0.00 -1.72 0.00 0.00 179.24 177.82 1nu9 h ALA 58 N 1.08 0.77 -0.17 3.45 0.00 -1.63 -1.66 119.26 121.10 1nu9 h ALA 58 Ca -0.02 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1nu9 h ALA 58 Cb 1.29 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1nu9 h ALA 58 CO 0.11 0.51 -0.06 0.87 0.00 0.00 0.00 179.25 180.69 1nu9 h LYS 59 N 0.86 0.34 -0.99 0.00 1.57 -0.61 -1.55 116.57 116.18 1nu9 h LYS 59 Ca 0.18 -0.14 0.08 0.00 -1.87 0.00 0.00 60.65 58.90 1nu9 h LYS 59 Cb 0.40 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.63 1nu9 h LYS 59 CO 0.01 0.63 0.63 -0.44 -0.57 0.00 0.00 179.45 179.71 1nu9 h ASP 60 N 0.03 1.00 -0.23 0.86 3.45 -1.01 0.33 116.42 120.85 1nu9 h ASP 60 Ca 0.04 0.02 -0.02 0.00 0.43 0.00 0.00 57.03 57.50 1nu9 h ASP 60 Cb 0.52 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 39.08 1nu9 h ASP 60 CO 0.02 0.62 0.09 0.50 -1.57 0.00 0.00 179.24 178.89 1nu9 h LYS 61 N 1.12 0.35 -0.44 3.56 3.64 -1.14 -0.25 116.57 123.42 1nu9 h LYS 61 Ca 0.44 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.66 1nu9 h LYS 61 Cb 0.23 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1nu9 h LYS 61 CO -0.19 0.41 -0.09 1.25 -2.27 0.00 0.00 179.45 178.56 1nu9 h LEU 62 N 0.22 0.84 -0.42 5.20 5.85 -0.32 -2.68 115.31 124.00 1nu9 h LEU 62 Ca 0.08 -0.35 0.04 0.00 0.84 0.00 0.00 57.88 58.48 1nu9 h LEU 62 Cb 0.20 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1nu9 h LEU 62 CO -0.01 1.00 0.19 -0.03 -0.34 0.00 0.00 178.44 179.26 1nu9 h MET 63 N 0.67 0.37 -0.32 1.25 4.05 -0.29 0.18 114.93 120.85 1nu9 h MET 63 Ca 0.11 -0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.54 1nu9 h MET 63 Cb 0.62 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.32 1nu9 h MET 63 CO 0.04 0.25 0.21 1.15 0.23 0.00 0.00 176.91 178.79 1nu9 h THR 64 N 0.38 1.01 -0.00 -0.77 2.02 -0.93 0.18 112.91 114.81 1nu9 h THR 64 Ca 0.19 -0.11 -0.16 0.00 0.77 0.00 0.00 66.41 67.10 1nu9 h THR 64 Cb 0.12 0.67 0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1nu9 h THR 64 CO -0.15 0.06 -0.61 0.03 0.37 0.00 0.00 175.52 175.22 1nu9 h ARG 65 N 0.31 0.41 -0.09 6.66 2.47 -0.83 -1.90 114.38 121.41 1nu9 h ARG 65 Ca 0.13 -0.44 -0.01 0.00 -1.26 0.00 0.00 59.98 58.40 1nu9 h ARG 65 Cb 0.13 0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 28.57 1nu9 h ARG 65 CO -0.03 1.11 0.02 0.82 0.56 0.00 0.00 179.97 182.45 1nu9 h ILE 66 N -0.10 1.20 -0.07 2.04 2.04 -0.44 -2.34 117.51 119.84 1nu9 h ILE 66 Ca -0.08 -0.63 -0.04 0.00 1.00 0.00 0.00 64.86 65.11 1nu9 h ILE 66 Cb 1.32 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.85 1nu9 h ILE 66 CO 0.12 0.18 -0.16 -0.07 0.00 0.00 0.00 178.15 178.22 1nu9 h LEU 67 N -0.08 0.11 -0.72 1.44 3.38 -0.76 -0.66 115.31 118.01 1nu9 h LEU 67 Ca 0.03 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1nu9 h LEU 67 Cb 0.26 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1nu9 h LEU 67 CO 0.00 0.28 -0.05 1.23 0.09 0.00 0.00 178.44 179.99 1nu9 h GLY 68 N 0.65 1.00 2.00 0.83 0.00 -1.16 0.19 103.07 106.59 1nu9 h GLY 68 Ca 0.02 -0.74 -0.19 0.00 0.00 0.00 0.00 47.33 46.42 1nu9 h GLY 68 CO 0.02 0.68 -0.92 0.83 0.00 0.00 0.00 176.54 177.16 1nu9 h GLU 69 N 0.85 0.00 -0.25 4.80 4.39 -0.79 -2.28 114.58 121.30 1nu9 h GLU 69 Ca 0.15 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 1nu9 h GLU 69 Cb 0.57 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.21 1nu9 h GLU 69 CO 0.03 0.92 0.13 0.22 -1.16 0.00 0.00 179.01 179.15 1nu9 h ASP 70 N 0.00 0.31 -0.67 1.42 1.82 -0.91 -2.01 116.42 116.38 1nu9 h ASP 70 Ca -0.01 -0.11 0.01 0.00 -0.39 0.00 0.00 57.03 56.54 1nu9 h ASP 70 Cb 1.66 -0.08 -0.03 0.00 0.68 0.00 0.00 39.33 41.56 1nu9 h ASP 70 CO 0.12 0.33 0.45 -0.61 -1.61 0.00 0.00 179.24 177.92 1nu9 h GLN 71 N 0.28 0.87 -0.30 0.28 5.75 -0.59 0.53 115.11 121.92 1nu9 h GLN 71 Ca 0.09 -0.05 0.03 0.00 -0.15 0.00 0.00 58.65 58.57 1nu9 h GLN 71 Cb 0.09 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 28.42 1nu9 h GLN 71 CO -0.01 0.57 0.10 -0.92 -2.65 0.00 0.00 178.83 175.92 1nu9 h TYR 72 N 0.89 0.18 -0.24 3.99 5.03 -0.77 0.12 116.97 126.17 1nu9 h TYR 72 Ca 0.25 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.54 1nu9 h TYR 72 Cb -0.07 -0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.16 1nu9 h TYR 72 CO -0.00 0.08 -0.00 -0.07 -1.32 0.00 0.00 178.16 176.85 1nu9 h LEU 73 N 0.23 0.42 -0.67 2.82 4.07 -0.89 -1.56 115.31 119.73 1nu9 h LEU 73 Ca 0.13 -0.31 0.05 0.00 0.08 0.00 0.00 57.88 57.83 1nu9 h LEU 73 Cb 0.10 -0.11 -0.05 0.00 1.08 0.00 0.00 40.66 41.68 1nu9 h LEU 73 CO -0.14 0.63 0.38 0.25 -1.08 0.00 0.00 178.44 178.49 1nu9 h LEU 74 N 0.20 0.59 -0.75 1.67 5.85 -0.70 0.72 115.31 122.89 1nu9 h LEU 74 Ca 0.07 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.69 1nu9 h LEU 74 Cb 0.42 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1nu9 h LEU 74 CO 0.01 0.39 -0.31 -0.08 -0.34 0.00 0.00 178.44 178.11 1nu9 h GLU 75 N 0.72 0.60 -0.81 1.25 4.57 -0.66 -1.20 114.58 119.05 1nu9 h GLU 75 Ca 0.29 -0.26 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1nu9 h GLU 75 Cb 0.14 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.68 1nu9 h GLU 75 CO -0.16 0.84 0.35 0.00 -1.18 0.00 0.00 179.01 178.86 1nu9 h ARG 76 N 0.51 1.19 -0.58 1.92 2.47 -0.43 -0.93 114.38 118.52 1nu9 h ARG 76 Ca 0.06 -0.20 -0.02 0.00 -1.26 0.00 0.00 59.98 58.56 1nu9 h ARG 76 Cb 0.79 -0.20 -0.03 0.00 -1.65 0.00 0.00 29.97 28.88 1nu9 h ARG 76 CO 0.06 0.94 0.27 -0.22 0.56 0.00 0.00 179.97 181.58 1nu9 h LYS 77 N 1.16 0.84 -0.40 0.04 3.64 -0.50 -0.95 116.57 120.41 1nu9 h LYS 77 Ca 0.27 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1nu9 h LYS 77 Cb 0.17 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 1nu9 h LYS 77 CO -0.03 0.69 0.20 0.87 -2.27 0.00 0.00 179.45 178.92 1nu9 h LYS 78 N 0.79 0.57 -0.38 1.90 1.57 -0.71 0.14 116.57 120.45 1nu9 h LYS 78 Ca 0.20 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1nu9 h LYS 78 Cb 0.14 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1nu9 h LYS 78 CO -0.02 0.49 0.17 0.28 -0.57 0.00 0.00 179.45 179.80 1nu9 h VAL 79 N 0.51 1.18 -0.26 0.50 2.07 -1.00 -2.62 116.25 116.64 1nu9 h VAL 79 Ca 0.14 -0.53 -0.09 0.00 0.82 0.00 0.00 66.70 67.04 1nu9 h VAL 79 Cb 0.10 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1nu9 h VAL 79 CO -0.02 0.19 -0.21 1.56 0.02 0.00 0.00 177.57 179.12 1nu9 h GLN 80 N 0.48 0.46 -0.72 1.57 4.20 -0.88 -2.78 115.11 117.45 1nu9 h GLN 80 Ca 0.13 -0.16 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 1nu9 h GLN 80 Cb 0.15 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 1nu9 h GLN 80 CO -0.01 0.65 0.25 -0.92 -0.67 0.00 0.00 178.83 178.13 1nu9 h TYR 81 N 0.42 1.12 -0.76 2.96 3.20 -0.52 0.13 116.97 123.51 1nu9 h TYR 81 Ca 0.07 -0.09 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1nu9 h TYR 81 Cb 0.60 -0.33 -0.04 0.00 1.54 0.00 0.00 36.73 38.50 1nu9 h TYR 81 CO 0.02 0.87 0.43 1.49 -1.64 0.00 0.00 178.16 179.33 1nu9 h GLU 82 N 1.06 1.05 -0.21 1.82 4.57 -1.24 0.74 114.58 122.37 1nu9 h GLU 82 Ca 0.24 -0.11 -0.15 0.00 -1.18 0.00 0.00 59.36 58.15 1nu9 h GLU 82 Cb 0.25 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 1nu9 h GLU 82 CO -0.01 0.77 -0.49 0.93 -1.18 0.00 0.00 179.01 179.03 1nu9 h GLU 83 N 1.05 0.57 -0.45 1.92 4.39 -1.16 -2.94 114.58 117.96 1nu9 h GLU 83 Ca 0.27 -0.33 -0.00 0.00 0.34 0.00 0.00 59.36 59.64 1nu9 h GLU 83 Cb 0.01 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1nu9 h GLU 83 CO -0.05 0.93 0.27 -0.92 -1.16 0.00 0.00 179.01 178.08 1nu9 h TYR 84 N 0.45 0.59 -0.59 4.33 3.20 -0.01 -1.45 116.97 123.49 1nu9 h TYR 84 Ca 0.02 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.95 1nu9 h TYR 84 Cb 1.02 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 39.04 1nu9 h TYR 84 CO 0.04 0.42 0.30 0.87 -1.64 0.00 0.00 178.16 178.15 1nu9 h LYS 85 N 0.59 0.54 -0.06 1.82 1.57 -0.78 0.44 116.57 120.69 1nu9 h LYS 85 Ca 0.16 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.82 1nu9 h LYS 85 Cb 0.01 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1nu9 h LYS 85 CO -0.03 0.36 -0.35 0.87 -0.57 0.00 0.00 179.45 179.73 1nu9 h LYS 86 N 0.56 0.12 -0.16 3.15 1.57 -1.32 -1.61 116.57 118.88 1nu9 h LYS 86 Ca 0.27 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.90 1nu9 h LYS 86 Cb 0.21 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1nu9 h LYS 86 CO -0.20 0.45 -0.33 1.25 -0.57 0.00 0.00 179.45 180.06 1nu9 h LEU 87 N 0.10 0.57 -0.76 2.94 6.46 0.01 -2.19 115.31 122.44 1nu9 h LEU 87 Ca 0.01 -0.55 0.07 0.00 -0.12 0.00 0.00 57.88 57.28 1nu9 h LEU 87 Cb 0.66 -0.16 -0.06 0.00 -0.73 0.00 0.00 40.66 40.37 1nu9 h LEU 87 CO 0.05 1.02 0.45 0.22 -0.62 0.00 0.00 178.44 179.55 1nu9 h TYR 88 N 0.14 0.82 -0.90 1.25 3.20 0.09 0.20 116.97 121.77 1nu9 h TYR 88 Ca 0.00 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 1nu9 h TYR 88 Cb 0.92 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.89 1nu9 h TYR 88 CO 0.10 0.39 0.56 -0.22 -1.64 0.00 0.00 178.16 177.35 1nu9 h LYS 89 N 0.81 1.22 -0.39 1.82 3.64 -1.19 -0.28 116.57 122.19 1nu9 h LYS 89 Ca 0.34 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.50 1nu9 h LYS 89 Cb 0.21 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1nu9 h LYS 89 CO -0.19 0.84 -0.25 -0.22 -2.27 0.00 0.00 179.45 177.36 1nu9 h LYS 90 N 1.24 0.85 -0.88 1.90 3.64 -0.57 -2.24 116.57 120.51 1nu9 h LYS 90 Ca 0.33 -0.40 0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1nu9 h LYS 90 Cb -0.08 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.67 1nu9 h LYS 90 CO -0.06 1.04 0.55 -0.92 -2.27 0.00 0.00 179.45 177.79 1nu9 h TYR 91 N 0.66 1.02 -0.60 1.91 3.20 0.05 -2.06 116.97 121.15 1nu9 h TYR 91 Ca 0.08 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.89 1nu9 h TYR 91 Cb 0.82 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 1nu9 h TYR 91 CO 0.06 0.52 0.02 0.87 -1.64 0.00 0.00 178.16 177.99 1nu9 h LYS 92 N 1.00 1.04 0.00 1.82 1.79 -0.88 -0.59 116.57 120.76 1nu9 h LYS 92 Ca 0.38 -0.32 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1nu9 h LYS 92 Cb 0.17 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1nu9 h LYS 92 CO -0.17 1.02 0.00 0.93 -1.08 0.00 0.00 179.45 180.14 1nu9 h GLU 93 N 0.94 0.00 0.00 3.15 5.08 -0.77 -2.08 114.58 120.89 1nu9 h GLU 93 Ca 0.17 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 1nu9 h GLU 93 Cb 0.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1nu9 h GLU 93 CO 0.03 0.00 -2.01 0.39 -1.00 0.00 0.00 179.01 176.42 1nu9 n GLU 94 N -3.03 0.66 -3.14 2.33 1.02 -0.84 -4.51 120.64 113.14 1nu9 n GLU 94 Ca -0.01 -0.17 -0.21 0.00 -0.02 0.00 0.00 57.16 56.74 1nu9 n GLU 94 Cb 0.16 -1.53 -0.04 0.00 -0.02 0.00 0.00 31.44 30.01 1nu9 n GLU 94 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1nu9 n ASN 95 N -2.32 1.82 0.25 1.62 4.13 -0.29 -4.97 115.26 115.50 1nu9 n ASN 95 Ca -0.07 -3.17 0.16 0.00 1.68 0.00 0.00 54.58 53.18 1nu9 n ASN 95 Cb 0.63 -0.61 0.74 0.00 -1.54 0.00 0.00 39.78 39.00 1nu9 n ASN 95 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1nu9 h PRO 96 N 3.14 0.00 -0.28 3.52 0.13 -1.61 0.15 132.00 137.05 1nu9 h PRO 96 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1nu9 h PRO 96 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1nu9 h PRO 96 CO 0.59 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.61 1nu9 n THR 97 N -3.11 0.35 -2.43 1.56 -2.24 -1.26 -4.93 114.28 102.22 1nu9 n THR 97 Ca 0.01 -0.54 -0.37 0.00 -2.27 0.00 0.00 64.05 60.89 1nu9 n THR 97 Cb 0.52 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.38 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 -1.51 6.50 0.00 3.42 0.15 0.53 -4.96 113.70 117.83 1nu9 s SER 98 Ca 0.35 2.13 0.15 0.00 0.70 0.00 0.00 55.95 59.28 1nu9 s SER 98 Cb 0.20 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 61.94 1nu9 s SER 98 CO 0.28 -0.68 0.85 0.29 1.20 0.00 0.00 173.24 175.19 1nu9 n LYS 99 N -0.29 1.63 -1.69 5.44 4.01 -1.26 -5.01 118.16 120.98 1nu9 n LYS 99 Ca 0.06 -0.92 -0.44 0.00 -0.51 0.00 0.00 58.31 56.51 1nu9 n LYS 99 Cb 0.49 -1.25 -0.02 0.00 -0.51 0.00 0.00 35.03 33.74 1nu9 n LYS 99 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 1nu9 n VAL 100 N 0.08 1.00 -3.70 -0.18 0.24 -1.26 -4.98 118.33 109.53 1nu9 n VAL 100 Ca 0.07 -0.25 -0.35 0.00 -2.04 0.00 0.00 64.34 61.77 1nu9 n VAL 100 Cb 0.33 -1.63 -0.05 0.00 -1.47 0.00 0.00 33.84 31.02 1nu9 n VAL 100 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1nu9 s LYS 101 N -0.47 3.64 0.22 7.34 1.02 -1.26 -5.06 119.74 125.17 1nu9 s LYS 101 Ca 0.67 0.01 -0.30 0.00 0.02 0.00 0.00 55.97 56.36 1nu9 s LYS 101 Cb -0.60 -3.06 -0.09 0.00 -0.52 0.00 0.00 37.83 33.56 1nu9 s LYS 101 CO 0.50 0.62 1.39 1.41 -0.92 0.00 0.00 175.35 178.35 1nu9 s MET 102 N -1.79 4.32 0.56 1.68 -2.45 -1.26 -4.98 119.30 115.38 1nu9 s MET 102 Ca 0.29 2.19 -0.19 0.00 -1.25 0.00 0.00 55.69 56.74 1nu9 s MET 102 Cb -0.13 -3.15 -0.05 0.00 1.25 0.00 0.00 34.83 32.75 1nu9 s MET 102 CO 0.17 -0.36 1.13 0.15 1.05 0.00 0.00 175.02 177.16 1nu9 s LYS 103 N -0.17 3.26 0.70 4.11 1.02 -1.26 -5.04 119.74 122.36 1nu9 s LYS 103 Ca 0.59 1.59 -0.07 0.00 0.02 0.00 0.00 55.97 58.09 1nu9 s LYS 103 Cb -0.40 -1.99 0.05 0.00 -0.52 0.00 0.00 37.83 34.97 1nu9 s LYS 103 CO 0.40 -0.92 1.02 0.95 -0.92 0.00 0.00 175.35 175.88 1nu9 s THR 104 N -1.85 2.47 0.25 2.17 -4.23 -1.26 -4.84 115.64 108.36 1nu9 s THR 104 Ca 0.72 -0.18 -0.05 0.00 -1.18 0.00 0.00 61.69 61.00 1nu9 s THR 104 Cb -0.24 -3.08 0.26 0.00 1.34 0.00 0.00 72.50 70.78 1nu9 s THR 104 CO 0.29 -0.08 1.91 0.15 -0.54 0.00 0.00 174.62 176.35 1nu9 h PHE 105 N -0.58 1.23 0.00 3.99 3.57 -1.96 -0.10 116.94 123.08 1nu9 h PHE 105 Ca -0.45 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.07 1nu9 h PHE 105 Cb 1.31 -0.41 -0.00 0.00 2.79 0.00 0.00 35.95 39.63 1nu9 h PHE 105 CO 0.36 0.72 -0.06 -0.44 -2.23 0.00 0.00 178.31 176.66 1nu9 h ASP 106 N 1.28 0.00 0.51 0.41 5.19 -2.04 -2.78 116.42 118.99 1nu9 h ASP 106 Ca 0.39 0.00 -0.29 0.00 -0.62 0.00 0.00 57.03 56.51 1nu9 h ASP 106 Cb -0.04 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.42 1nu9 h ASP 106 CO -0.11 0.06 -1.66 1.56 -3.12 0.00 0.00 179.24 175.96 1nu9 h GLN 107 N 0.00 0.02 -7.10 3.56 4.20 -1.70 -3.47 115.11 110.62 1nu9 h GLN 107 Ca -0.00 -0.03 -0.54 0.00 0.06 0.00 0.00 58.65 58.14 1nu9 h GLN 107 Cb 0.59 0.01 0.19 0.00 0.30 0.00 0.00 27.48 28.57 1nu9 h GLN 107 CO 0.01 0.58 0.17 0.98 -0.67 0.00 0.00 178.83 179.89 1nu9 n TYR 108 N -3.10 0.78 -4.02 2.96 9.36 -0.13 -4.93 117.16 118.09 1nu9 n TYR 108 Ca -0.16 0.39 -0.09 0.00 3.32 0.00 0.00 57.90 61.35 1nu9 n TYR 108 Cb 1.04 -2.05 -0.11 0.00 -0.63 0.00 0.00 39.34 37.59 1nu9 n TYR 108 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 1nu9 s THR 109 N -2.14 0.22 0.13 2.97 -4.23 -1.26 -5.00 115.64 106.33 1nu9 s THR 109 Ca 0.71 -1.10 -0.35 0.00 -1.18 0.00 0.00 61.69 59.77 1nu9 s THR 109 Cb -0.29 -0.55 -0.15 0.00 1.34 0.00 0.00 72.50 72.86 1nu9 s THR 109 CO 0.53 -0.57 1.51 -0.38 -0.54 0.00 0.00 174.62 175.18 1nu9 n ILE 110 N 1.31 0.01 0.17 2.99 5.41 -1.26 -4.89 119.36 123.10 1nu9 n ILE 110 Ca -0.22 -0.00 0.08 0.00 1.00 0.00 0.00 62.75 63.61 1nu9 n ILE 110 Cb 0.56 -1.32 -0.11 0.00 -0.71 0.00 0.00 39.64 38.06 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 3.18 0.84 -4.82 0.38 1.02 -1.26 -4.97 120.64 115.01 1nu9 n GLU 111 Ca 0.17 -0.11 -0.30 0.00 -0.02 0.00 0.00 57.16 56.90 1nu9 n GLU 111 Cb 0.26 -1.34 -0.17 0.00 -0.02 0.00 0.00 31.44 30.17 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 -3.49 2.73 -0.15 1.62 -0.00 -1.26 -4.93 116.67 111.20 1nu9 s ASP 112 Ca -0.03 -0.50 -0.28 0.00 -0.00 0.00 0.00 52.55 51.74 1nu9 s ASP 112 Cb 0.10 -1.25 0.07 0.00 -0.00 0.00 0.00 42.92 41.85 1nu9 s ASP 112 CO 0.65 0.09 0.69 -0.22 -0.00 0.00 0.00 175.17 176.38 1nu9 s LEU 113 N 0.65 -0.67 0.27 1.23 2.96 -1.26 -5.05 118.68 116.80 1nu9 s LEU 113 Ca -0.13 1.04 0.10 0.00 -0.22 0.00 0.00 54.13 54.92 1nu9 s LEU 113 Cb -0.16 2.48 -0.05 0.00 0.50 0.00 0.00 46.19 48.96 1nu9 s LEU 113 CO 0.03 -0.44 -0.07 0.42 -1.32 0.00 0.00 176.35 174.97 1nu9 s THR 114 N -0.48 3.15 0.29 3.68 -4.23 -1.26 -1.40 115.64 115.40 1nu9 s THR 114 Ca -0.06 -2.05 -0.00 0.00 -1.18 0.00 0.00 61.69 58.39 1nu9 s THR 114 Cb -0.02 -2.67 0.17 0.00 1.34 0.00 0.00 72.50 71.31 1nu9 s THR 114 CO 0.06 -0.37 1.85 0.24 -0.54 0.00 0.00 174.62 175.86 1nu9 h MET 115 N 2.04 0.81 -0.33 3.99 2.86 -1.92 -1.89 114.93 120.48 1nu9 h MET 115 Ca -0.43 -0.15 0.07 0.00 -2.06 0.00 0.00 59.70 57.13 1nu9 h MET 115 Cb 1.25 -0.13 -0.07 0.00 0.06 0.00 0.00 31.60 32.71 1nu9 h MET 115 CO 0.60 0.71 -0.12 0.00 1.06 0.00 0.00 176.91 179.16 1nu9 h ARG 116 N 0.79 -0.04 -0.26 1.72 3.08 -1.92 0.27 114.38 118.02 1nu9 h ARG 116 Ca 0.18 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.27 1nu9 h ARG 116 Cb 0.25 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.27 1nu9 h ARG 116 CO -0.01 -0.03 0.04 0.93 -1.07 0.00 0.00 179.97 179.83 1nu9 h GLU 117 N -0.05 0.12 0.07 0.04 5.08 -1.65 0.19 114.58 118.40 1nu9 h GLU 117 Ca 0.17 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1nu9 h GLU 117 Cb 0.30 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1nu9 h GLU 117 CO -0.37 0.08 -0.04 -0.92 -1.00 0.00 0.00 179.01 176.77 1nu9 h TYR 118 N 0.13 -0.09 -0.68 4.33 3.20 -0.71 0.17 116.97 123.32 1nu9 h TYR 118 Ca 0.12 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1nu9 h TYR 118 Cb 0.14 0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 1nu9 h TYR 118 CO -0.17 -0.06 0.39 -0.91 -1.64 0.00 0.00 178.16 175.76 1nu9 h ASN 119 N -0.10 0.84 -0.32 -2.11 -0.26 -0.26 0.30 115.58 113.66 1nu9 h ASN 119 Ca -0.01 -0.08 -0.08 0.00 -0.56 0.00 0.00 56.30 55.57 1nu9 h ASN 119 Cb 0.08 -0.21 -0.01 0.00 -1.06 0.00 0.00 38.32 37.11 1nu9 h ASN 119 CO 0.02 0.68 -0.10 -0.33 -1.06 0.00 0.00 177.43 176.64 1nu9 h GLU 120 N 0.93 0.64 -0.21 0.81 5.08 -0.36 0.49 114.58 121.95 1nu9 h GLU 120 Ca 0.24 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1nu9 h GLU 120 Cb 0.02 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1nu9 h GLU 120 CO -0.04 0.83 0.10 -0.07 -1.00 0.00 0.00 179.01 178.83 1nu9 h LEU 121 N 0.41 0.14 -0.44 1.33 3.38 -0.51 0.14 115.31 119.77 1nu9 h LEU 121 Ca 0.08 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1nu9 h LEU 121 Cb 0.61 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1nu9 h LEU 121 CO 0.04 0.11 0.29 0.74 0.09 0.00 0.00 178.44 179.71 1nu9 h THR 122 N 0.21 1.11 -0.58 0.22 2.02 -0.80 -1.47 112.91 113.62 1nu9 h THR 122 Ca 0.09 -0.20 -0.07 0.00 0.77 0.00 0.00 66.41 66.99 1nu9 h THR 122 Cb 0.03 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 1nu9 h THR 122 CO -0.06 0.11 0.08 -0.08 0.37 0.00 0.00 175.52 175.94 1nu9 h GLU 123 N 0.59 0.98 -0.12 6.66 4.22 -0.67 -1.97 114.58 124.26 1nu9 h GLU 123 Ca 0.16 -0.27 -0.00 0.00 0.08 0.00 0.00 59.36 59.33 1nu9 h GLU 123 Cb -0.07 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 1nu9 h GLU 123 CO -0.04 0.93 0.07 1.03 -2.18 0.00 0.00 179.01 178.83 1nu9 h SER 124 N 0.87 0.15 -0.57 1.04 0.87 -0.24 0.82 113.55 116.49 1nu9 h SER 124 Ca 0.18 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 1nu9 h SER 124 Cb 0.44 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 1nu9 h SER 124 CO 0.01 0.17 0.24 -0.07 -0.53 0.00 0.00 176.83 176.64 1nu9 h LEU 125 N 0.12 0.81 -0.27 2.23 3.38 -1.20 0.08 115.31 120.46 1nu9 h LEU 125 Ca 0.04 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1nu9 h LEU 125 Cb 0.05 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1nu9 h LEU 125 CO -0.01 0.73 0.11 0.50 0.09 0.00 0.00 178.44 179.86 1nu9 h LYS 126 N 0.87 0.40 -0.83 1.13 3.64 -0.94 -0.09 116.57 120.76 1nu9 h LYS 126 Ca 0.21 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1nu9 h LYS 126 Cb 0.18 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 1nu9 h LYS 126 CO -0.02 0.42 0.36 1.03 -2.27 0.00 0.00 179.45 178.98 1nu9 h SER 127 N 0.29 1.12 -0.62 4.20 0.87 -0.54 -0.66 113.55 118.20 1nu9 h SER 127 Ca 0.09 -0.16 -0.06 0.00 -1.23 0.00 0.00 61.79 60.43 1nu9 h SER 127 Cb 0.17 -0.29 -0.03 0.00 -0.44 0.00 0.00 62.40 61.82 1nu9 h SER 127 CO -0.01 0.96 0.15 0.00 -0.53 0.00 0.00 176.83 177.41 1nu9 h ALA 128 N 1.20 0.82 -0.48 6.23 0.00 -0.61 -0.04 119.26 126.37 1nu9 h ALA 128 Ca 0.28 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1nu9 h ALA 128 Cb 0.17 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1nu9 h ALA 128 CO -0.03 0.53 -0.18 0.28 0.00 0.00 0.00 179.25 179.85 1nu9 h VAL 129 N 0.91 1.27 -0.41 0.00 2.07 -0.73 -1.11 116.25 118.25 1nu9 h VAL 129 Ca 0.19 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.38 1nu9 h VAL 129 Cb 0.35 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 1nu9 h VAL 129 CO 0.00 0.46 0.23 0.11 0.02 0.00 0.00 177.57 178.39 1nu9 h LYS 130 N 0.83 0.56 -0.53 1.57 1.57 -0.72 0.02 116.57 119.87 1nu9 h LYS 130 Ca 0.12 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1nu9 h LYS 130 Cb 0.74 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.91 1nu9 h LYS 130 CO 0.06 0.44 0.20 -0.44 -0.57 0.00 0.00 179.45 179.14 1nu9 h ASP 131 N 0.53 0.70 -0.55 0.86 3.32 -0.84 -1.52 116.42 118.92 1nu9 h ASP 131 Ca 0.14 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 1nu9 h ASP 131 Cb 0.04 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1nu9 h ASP 131 CO -0.02 0.64 0.15 0.15 -1.72 0.00 0.00 179.24 178.44 1nu9 h PHE 132 N 0.76 0.90 -0.26 4.55 3.57 -0.44 -0.74 116.94 125.28 1nu9 h PHE 132 Ca 0.18 -0.10 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 1nu9 h PHE 132 Cb 0.17 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 1nu9 h PHE 132 CO 0.01 0.77 -0.04 0.93 -2.23 0.00 0.00 178.31 177.75 1nu9 h GLU 133 N 0.77 0.41 -0.07 1.11 5.08 -0.28 -0.91 114.58 120.69 1nu9 h GLU 133 Ca 0.17 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 1nu9 h GLU 133 Cb 0.31 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 1nu9 h GLU 133 CO -0.00 0.47 -0.11 0.87 -1.00 0.00 0.00 179.01 179.24 1nu9 h LYS 134 N 0.39 0.19 -0.85 2.33 1.57 -0.97 -1.81 116.57 117.43 1nu9 h LYS 134 Ca 0.08 -0.12 0.11 0.00 -1.87 0.00 0.00 60.65 58.86 1nu9 h LYS 134 Cb 0.33 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.59 1nu9 h LYS 134 CO 0.01 0.68 0.55 -0.44 -0.57 0.00 0.00 179.45 179.68 1nu9 h ASP 135 N -0.28 0.70 -0.32 0.86 3.45 -0.88 -0.67 116.42 119.27 1nu9 h ASP 135 Ca 0.01 0.02 -0.08 0.00 0.43 0.00 0.00 57.03 57.41 1nu9 h ASP 135 Cb 0.66 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 39.31 1nu9 h ASP 135 CO 0.02 0.40 -0.11 0.58 -1.57 0.00 0.00 179.24 178.56 1nu9 h VAL 136 N 0.76 1.28 -0.64 -1.35 2.07 -1.05 -0.86 116.25 116.47 1nu9 h VAL 136 Ca 0.40 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 1nu9 h VAL 136 Cb 0.51 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 1nu9 h VAL 136 CO -0.17 0.38 0.33 -0.08 0.02 0.00 0.00 177.57 178.05 1nu9 h GLU 137 N 0.42 0.90 -0.05 1.57 4.81 -0.36 -1.04 114.58 120.84 1nu9 h GLU 137 Ca 0.08 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1nu9 h GLU 137 Cb 0.62 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 1nu9 h GLU 137 CO 0.04 0.71 0.02 0.82 -0.73 0.00 0.00 179.01 179.86 1nu9 h ILE 138 N 0.87 1.14 -0.64 2.32 2.04 -1.11 -2.57 117.51 119.56 1nu9 h ILE 138 Ca 0.22 -0.41 0.12 0.00 1.00 0.00 0.00 64.86 65.79 1nu9 h ILE 138 Cb 0.08 1.33 -0.09 0.00 -0.74 0.00 0.00 36.82 37.40 1nu9 h ILE 138 CO -0.03 0.12 0.16 0.40 0.00 0.00 0.00 178.15 178.79 1nu9 h ILE 139 N -0.08 0.63 0.00 -0.67 1.08 -0.80 -1.86 117.51 115.80 1nu9 h ILE 139 Ca 0.02 -0.10 0.00 0.00 -0.39 0.00 0.00 64.86 64.39 1nu9 h ILE 139 Cb 0.17 0.31 0.00 0.00 -3.07 0.00 0.00 36.82 34.23 1nu9 h ILE 139 CO -0.00 0.05 0.00 -0.62 -0.69 0.00 0.00 178.15 176.89 1nu9 n GLU 140 N -5.11 0.19 0.04 2.37 1.02 -0.42 -2.66 120.64 116.06 1nu9 n GLU 140 Ca 0.10 0.34 -0.12 0.00 -0.02 0.00 0.00 57.16 57.46 1nu9 n GLU 140 Cb 0.35 -1.81 -0.14 0.00 -0.02 0.00 0.00 31.44 29.83 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 0.17 -0.46 1.62 2.35 -0.93 -3.31 115.58 115.02 1nu9 h ASN 141 Ca 0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.50 1nu9 h ASN 141 Cb 0.45 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.77 1nu9 h ASN 141 CO 0.00 1.21 0.00 0.00 -1.65 0.00 0.00 177.43 176.99 1nu9 n GLN 142 N -3.31 2.25 -3.10 0.81 10.64 -1.09 -4.49 117.38 119.09 1nu9 n GLN 142 Ca -0.12 -1.73 -0.13 0.00 -1.83 0.00 0.00 57.00 53.19 1nu9 n GLN 142 Cb 1.02 -1.44 -0.04 0.00 -0.86 0.00 0.00 30.24 28.92 1nu9 n GLN 142 CO 0.00 0.00 0.00 -1.01 -1.83 0.00 0.00 177.06 174.22 1nu9 s HIS 143 N -1.46 -0.57 0.57 2.61 3.76 -1.09 -5.04 115.29 114.08 1nu9 s HIS 143 Ca 0.32 -1.08 0.28 0.00 -0.15 0.00 0.00 55.06 54.43 1nu9 s HIS 143 Cb 0.18 -0.19 1.50 0.00 1.11 0.00 0.00 32.58 35.18 1nu9 s HIS 143 CO 0.20 -1.08 1.97 1.12 -0.85 0.00 0.00 174.74 176.11 1nu9 h HIS 144 N 5.74 0.00 0.00 1.40 2.07 -1.79 -0.47 115.15 122.11 1nu9 h HIS 144 Ca 0.12 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.64 1nu9 h HIS 144 Cb 1.05 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.03 1nu9 h HIS 144 CO 0.19 0.00 0.00 -0.40 -3.07 0.00 0.00 177.93 174.65 1nu9 n ASP 145 N -3.95 0.00 0.00 3.10 3.85 -1.26 -2.40 116.55 115.89 1nu9 n ASP 145 Ca 0.08 0.37 0.10 0.00 -0.71 0.00 0.00 54.79 54.63 1nu9 n ASP 145 Cb 0.58 -0.44 -0.09 0.00 -1.35 0.00 0.00 41.12 39.82 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 -1.44 0.95 -4.72 -2.12 4.77 -0.19 -1.64 117.00 112.62 1nu9 n LEU 146 Ca 0.06 -0.45 -0.42 0.00 -0.03 0.00 0.00 56.01 55.17 1nu9 n LEU 146 Cb 0.20 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.24 1nu9 n LEU 146 CO 0.17 0.24 1.20 -0.75 -1.33 0.00 0.00 177.39 176.91 1nu9 s LYS 147 N -3.00 4.23 0.40 3.23 2.47 -1.01 -4.88 119.74 121.18 1nu9 s LYS 147 Ca 0.08 2.32 -0.26 0.00 -1.56 0.00 0.00 55.97 56.55 1nu9 s LYS 147 Cb 0.16 -3.16 -0.10 0.00 -1.46 0.00 0.00 37.83 33.27 1nu9 s LYS 147 CO 0.85 -0.57 1.34 -2.30 0.16 0.00 0.00 175.35 174.84 1nu9 n PRO 148 N 3.81 2.15 -1.62 4.03 -0.02 -1.26 -4.52 135.00 137.57 1nu9 n PRO 148 Ca 0.13 0.76 -0.31 0.00 -2.02 0.00 0.00 63.50 62.06 1nu9 n PRO 148 Cb 0.39 -2.47 0.05 0.00 -0.02 0.00 0.00 33.50 31.45 1nu9 n PRO 148 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1nu9 s PHE 149 N -1.16 3.05 0.85 6.00 0.08 0.12 -4.96 117.98 121.95 1nu9 s PHE 149 Ca 0.59 1.45 -0.12 0.00 0.12 0.00 0.00 56.93 58.97 1nu9 s PHE 149 Cb -0.50 -2.92 0.10 0.00 -0.57 0.00 0.00 43.02 39.13 1nu9 s PHE 149 CO 0.60 -1.26 1.12 0.95 -0.10 0.00 0.00 175.22 176.53 1nu9 s THR 150 N -2.93 2.48 0.21 0.64 -4.23 -1.26 -4.74 115.64 105.80 1nu9 s THR 150 Ca 0.59 0.15 -0.09 0.00 -1.18 0.00 0.00 61.69 61.16 1nu9 s THR 150 Cb -0.15 -2.94 0.15 0.00 1.34 0.00 0.00 72.50 70.90 1nu9 s THR 150 CO 0.52 -0.20 1.82 0.44 -0.54 0.00 0.00 174.62 176.66 1nu9 h ASP 151 N -1.26 0.63 -0.34 3.99 3.32 -1.98 0.13 116.42 120.91 1nu9 h ASP 151 Ca -0.48 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.57 1nu9 h ASP 151 Cb 1.30 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.73 1nu9 h ASP 151 CO 0.61 0.42 0.17 -0.08 -1.72 0.00 0.00 179.24 178.64 1nu9 h GLU 152 N 0.76 0.48 -0.67 3.56 4.81 -2.00 -0.07 114.58 121.45 1nu9 h GLU 152 Ca 0.30 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.47 1nu9 h GLU 152 Cb 0.12 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 1nu9 h GLU 152 CO -0.15 0.42 0.44 1.98 -0.73 0.00 0.00 179.01 180.97 1nu9 h MET 153 N 0.41 0.87 -0.82 1.92 4.05 -1.71 -1.61 114.93 118.04 1nu9 h MET 153 Ca 0.12 -0.05 -0.03 0.00 -0.28 0.00 0.00 59.70 59.45 1nu9 h MET 153 Cb 0.09 -0.20 -0.04 0.00 -0.80 0.00 0.00 31.60 30.66 1nu9 h MET 153 CO -0.02 0.58 0.38 1.49 0.23 0.00 0.00 176.91 179.57 1nu9 h GLU 154 N 0.90 1.19 -0.51 0.39 4.81 -0.51 -1.72 114.58 119.13 1nu9 h GLU 154 Ca 0.25 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.27 1nu9 h GLU 154 Cb -0.08 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.07 1nu9 h GLU 154 CO -0.06 0.93 0.20 1.49 -0.73 0.00 0.00 179.01 180.83 1nu9 h GLU 155 N 1.17 0.77 -0.61 1.92 4.81 -0.49 0.15 114.58 122.30 1nu9 h GLU 155 Ca 0.28 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 1nu9 h GLU 155 Cb 0.14 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1nu9 h GLU 155 CO -0.03 0.68 0.04 0.87 -0.73 0.00 0.00 179.01 179.84 1nu9 h LYS 156 N 0.68 1.04 -0.22 1.92 1.57 -1.09 -1.44 116.57 119.03 1nu9 h LYS 156 Ca 0.17 -0.31 -0.09 0.00 -1.87 0.00 0.00 60.65 58.56 1nu9 h LYS 156 Cb 0.21 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 1nu9 h LYS 156 CO -0.01 1.00 -0.20 0.00 -0.57 0.00 0.00 179.45 179.67 1nu9 h ALA 157 N 1.06 0.32 -0.35 3.86 0.00 -1.08 -2.78 119.26 120.29 1nu9 h ALA 157 Ca 0.18 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1nu9 h ALA 157 Cb 0.51 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1nu9 h ALA 157 CO 0.02 0.26 0.15 1.15 0.00 0.00 0.00 179.25 180.83 1nu9 h THR 158 N 0.22 1.13 -0.11 0.00 2.02 -0.59 -1.99 112.91 113.59 1nu9 h THR 158 Ca 0.04 -0.40 -0.14 0.00 0.77 0.00 0.00 66.41 66.67 1nu9 h THR 158 Cb 0.74 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1nu9 h THR 158 CO 0.05 0.16 -0.55 0.00 0.37 0.00 0.00 175.52 175.55 1nu9 h ALA 159 N 1.68 0.85 -0.40 6.16 0.00 -1.11 -0.88 119.26 125.55 1nu9 h ALA 159 Ca 0.12 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.46 1nu9 h ALA 159 Cb 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1nu9 h ALA 159 CO -0.01 0.69 0.01 0.00 0.00 0.00 0.00 179.25 179.94 1nu9 h ARG 160 N 0.26 0.71 -0.18 0.00 3.08 -1.11 -1.08 114.38 116.05 1nu9 h ARG 160 Ca 0.00 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 1nu9 h ARG 160 Cb 1.05 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 1nu9 h ARG 160 CO 0.09 0.79 0.08 0.28 -1.07 0.00 0.00 179.97 180.14 1nu9 h VAL 161 N 0.54 1.14 -0.53 2.04 2.07 -1.17 -2.01 116.25 118.33 1nu9 h VAL 161 Ca 0.12 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.19 1nu9 h VAL 161 Cb 0.46 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 1nu9 h VAL 161 CO 0.02 0.13 0.17 0.44 0.02 0.00 0.00 177.57 178.35 1nu9 h ASP 162 N 0.16 0.73 -0.55 0.57 3.32 -1.11 -0.65 116.42 118.88 1nu9 h ASP 162 Ca 0.06 -0.11 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 1nu9 h ASP 162 Cb 0.13 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 1nu9 h ASP 162 CO -0.01 0.69 -0.04 -0.78 -1.72 0.00 0.00 179.24 177.38 1nu9 h ASP 163 N 0.77 1.00 -0.36 6.45 -0.00 -0.98 -0.48 116.42 122.82 1nu9 h ASP 163 Ca 0.18 -0.33 -0.05 0.00 -0.00 0.00 0.00 57.03 56.84 1nu9 h ASP 163 Cb 0.22 -0.27 -0.01 0.00 -0.00 0.00 0.00 39.33 39.27 1nu9 h ASP 163 CO -0.01 1.09 0.05 0.25 -0.00 0.00 0.00 179.24 180.61 1nu9 h LEU 164 N 0.89 0.58 -1.23 2.28 6.46 -0.85 -2.43 115.31 121.01 1nu9 h LEU 164 Ca 0.15 -0.27 0.03 0.00 -0.12 0.00 0.00 57.88 57.67 1nu9 h LEU 164 Cb 0.60 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 40.33 1nu9 h LEU 164 CO 0.04 0.71 0.53 0.00 -0.62 0.00 0.00 178.44 179.09 1nu9 h ALA 165 N 0.90 1.49 0.00 1.25 0.00 -0.89 -1.54 119.26 120.46 1nu9 h ALA 165 Ca 0.11 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1nu9 h ALA 165 Cb 0.38 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1nu9 h ALA 165 CO 0.01 0.44 -0.28 -0.91 0.00 0.00 0.00 179.25 178.51 1nu9 h ASN 166 N 1.02 0.00 -0.22 0.00 -0.26 -0.77 0.16 115.58 115.51 1nu9 h ASN 166 Ca 0.31 0.00 -0.19 0.00 -0.56 0.00 0.00 56.30 55.86 1nu9 h ASN 166 Cb -0.01 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.25 1nu9 h ASN 166 CO -0.08 0.28 -0.58 0.11 -1.06 0.00 0.00 177.43 176.10 1nu9 h LYS 167 N 0.00 0.82 -0.51 0.81 1.57 -0.84 -0.43 116.57 117.98 1nu9 h LYS 167 Ca -0.00 -0.54 0.01 0.00 -1.87 0.00 0.00 60.65 58.25 1nu9 h LYS 167 Cb 0.61 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 1nu9 h LYS 167 CO 0.04 1.17 0.34 0.00 -0.57 0.00 0.00 179.45 180.42 1nu9 h ALA 168 N 0.71 0.65 -0.20 3.86 0.00 -0.32 -1.08 119.26 122.90 1nu9 h ALA 168 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1nu9 h ALA 168 Cb 1.18 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1nu9 h ALA 168 CO 0.12 0.08 0.08 1.88 0.00 0.00 0.00 179.25 181.42 1nu9 h TYR 169 N 0.68 0.27 -0.18 0.00 0.05 -0.51 -0.50 116.97 116.78 1nu9 h TYR 169 Ca 0.19 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.95 1nu9 h TYR 169 Cb -0.06 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 37.58 1nu9 h TYR 169 CO -0.04 0.21 0.02 0.77 -1.05 0.00 0.00 178.16 178.07 1nu9 h SER 170 N 0.28 0.29 -0.32 3.88 0.02 -0.25 -0.05 113.55 117.40 1nu9 h SER 170 Ca 0.07 -0.28 0.04 0.00 -0.84 0.00 0.00 61.79 60.78 1nu9 h SER 170 Cb 0.05 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.48 1nu9 h SER 170 CO -0.01 0.50 0.10 0.58 -1.14 0.00 0.00 176.83 176.85 1nu9 h VAL 171 N 0.07 0.89 -0.59 2.27 2.07 -0.55 0.72 116.25 121.14 1nu9 h VAL 171 Ca 0.05 -0.08 0.09 0.00 0.82 0.00 0.00 66.70 67.58 1nu9 h VAL 171 Cb 0.34 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.68 1nu9 h VAL 171 CO 0.01 0.04 0.22 0.22 0.02 0.00 0.00 177.57 178.08 1nu9 h TYR 172 N 0.23 0.39 -0.05 1.57 3.20 -0.83 -1.43 116.97 120.05 1nu9 h TYR 172 Ca 0.15 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.94 1nu9 h TYR 172 Cb 0.13 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 1nu9 h TYR 172 CO -0.15 0.11 -0.43 0.74 -1.64 0.00 0.00 178.16 176.79 1nu9 h PHE 173 N 0.41 0.14 0.00 -3.82 0.04 -0.18 -0.94 116.94 112.58 1nu9 h PHE 173 Ca 0.29 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 61.03 1nu9 h PHE 173 Cb 0.35 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.47 1nu9 h PHE 173 CO -0.16 0.53 0.00 0.00 -0.60 0.00 0.00 178.31 178.08 1nu9 h ALA 174 N 1.47 1.00 0.00 2.45 0.00 0.21 -3.29 119.26 121.10 1nu9 h ALA 174 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1nu9 h ALA 174 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1nu9 h ALA 174 CO 0.06 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.50 1nu9 n PHE 175 N -2.33 0.00 0.30 0.00 3.01 -1.00 -4.74 117.46 112.70 1nu9 n PHE 175 Ca 0.02 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.67 1nu9 n PHE 175 Cb 0.26 0.00 0.90 0.00 -0.01 0.00 0.00 39.48 40.63 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 0.33 0.06 -0.38 -4.37 3.04 -1.24 -2.19 116.25 111.49 1nu9 h VAL 176 Ca 0.00 -0.32 0.00 0.00 -1.01 0.00 0.00 66.70 65.37 1nu9 h VAL 176 Cb 0.16 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 30.75 1nu9 h VAL 176 CO 0.00 0.01 0.00 0.54 -1.01 0.00 0.00 177.57 177.11 1nu9 n ARG 177 N -3.14 3.45 -3.53 4.17 1.74 -1.26 -4.76 116.66 113.32 1nu9 n ARG 177 Ca -0.01 -2.83 -0.42 0.00 -0.77 0.00 0.00 57.85 53.83 1nu9 n ARG 177 Cb 0.21 -1.88 -0.10 0.00 -1.02 0.00 0.00 32.46 29.68 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 -1.46 5.84 0.30 0.55 3.68 -0.82 -4.97 116.67 119.79 1nu9 s ASP 178 Ca 0.44 -1.24 0.04 0.00 2.13 0.00 0.00 52.55 53.92 1nu9 s ASP 178 Cb 0.33 -2.07 0.77 0.00 -1.45 0.00 0.00 42.92 40.50 1nu9 s ASP 178 CO 0.13 -0.51 1.66 0.71 0.13 0.00 0.00 175.17 177.29 1nu9 h THR 179 N 5.89 0.34 -0.19 1.71 1.35 -1.90 0.17 112.91 120.28 1nu9 h THR 179 Ca -0.25 -0.09 -0.05 0.00 -0.55 0.00 0.00 66.41 65.47 1nu9 h THR 179 Cb 1.10 0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 67.57 1nu9 h THR 179 CO 0.76 0.05 -0.10 -0.61 -0.25 0.00 0.00 175.52 175.36 1nu9 h GLN 180 N 0.26 0.30 0.00 4.72 5.75 -1.94 -3.32 115.11 120.88 1nu9 h GLN 180 Ca 0.58 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 59.01 1nu9 h GLN 180 Cb 1.19 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.70 1nu9 h GLN 180 CO -0.63 0.42 0.00 0.72 -2.65 0.00 0.00 178.83 176.69 1nu9 n HIS 181 N -4.27 0.00 -0.22 3.99 8.25 -0.10 -4.83 115.22 118.04 1nu9 n HIS 181 Ca -0.00 -0.35 0.02 0.00 -0.26 0.00 0.00 57.72 57.13 1nu9 n HIS 181 Cb 0.27 -0.03 0.11 0.00 1.12 0.00 0.00 29.99 31.45 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 0.10 -0.61 -0.41 3.64 -0.85 -1.84 116.57 116.59 1nu9 h LYS 182 Ca 0.00 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1nu9 h LYS 182 Cb 0.38 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.15 1nu9 h LYS 182 CO 0.00 0.06 0.37 1.15 -2.27 0.00 0.00 179.45 178.76 1nu9 h THR 183 N 0.10 1.18 -0.60 1.00 2.02 -1.87 -0.09 112.91 114.66 1nu9 h THR 183 Ca 0.34 -0.41 -0.04 0.00 0.77 0.00 0.00 66.41 67.08 1nu9 h THR 183 Cb 0.57 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 1nu9 h THR 183 CO -0.58 0.19 0.23 -0.33 0.37 0.00 0.00 175.52 175.40 1nu9 h GLU 184 N 0.83 0.87 -0.11 6.66 3.07 -1.77 -0.98 114.58 123.16 1nu9 h GLU 184 Ca 0.22 -0.14 -0.03 0.00 -0.50 0.00 0.00 59.36 58.91 1nu9 h GLU 184 Cb -0.02 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 27.74 1nu9 h GLU 184 CO -0.04 0.72 -0.04 0.00 -1.40 0.00 0.00 179.01 178.25 1nu9 h ALA 185 N 1.39 0.15 -0.81 3.43 0.00 -0.83 -1.87 119.26 120.72 1nu9 h ALA 185 Ca 0.20 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1nu9 h ALA 185 Cb 0.18 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1nu9 h ALA 185 CO -0.02 -0.10 0.54 -0.07 0.00 0.00 0.00 179.25 179.60 1nu9 h LEU 186 N -0.12 0.92 -0.45 0.00 3.38 -0.72 -0.69 115.31 117.62 1nu9 h LEU 186 Ca 0.03 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1nu9 h LEU 186 Cb 0.46 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1nu9 h LEU 186 CO 0.01 0.66 -0.58 -0.33 0.09 0.00 0.00 178.44 178.30 1nu9 h GLU 187 N 1.09 0.61 0.07 1.13 5.08 -1.14 -1.08 114.58 120.33 1nu9 h GLU 187 Ca 0.30 -0.40 0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1nu9 h GLU 187 Cb -0.10 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 1nu9 h GLU 187 CO -0.07 1.01 -0.17 1.25 -1.00 0.00 0.00 179.01 180.04 1nu9 h LEU 188 N 0.46 -0.47 -0.30 1.33 5.85 -0.57 0.57 115.31 122.19 1nu9 h LEU 188 Ca 0.00 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1nu9 h LEU 188 Cb 1.14 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 1nu9 h LEU 188 CO 0.11 -0.24 0.15 0.50 -0.34 0.00 0.00 178.44 178.63 1nu9 h LYS 189 N -0.31 0.31 -0.28 1.25 3.11 -1.07 0.61 116.57 120.19 1nu9 h LYS 189 Ca 0.03 -0.02 -0.04 0.00 -2.81 0.00 0.00 60.65 57.81 1nu9 h LYS 189 Cb 0.34 -0.07 -0.02 0.00 -1.00 0.00 0.00 32.23 31.49 1nu9 h LYS 189 CO -0.11 0.20 -0.01 0.00 -2.81 0.00 0.00 179.45 176.72 1nu9 h ALA 190 N 1.15 1.46 0.07 5.00 0.00 -0.62 -0.66 119.26 125.66 1nu9 h ALA 190 Ca 0.12 -0.18 -0.26 0.00 0.00 0.00 0.00 54.91 54.60 1nu9 h ALA 190 Cb 0.04 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.71 1nu9 h ALA 190 CO -0.08 0.38 -1.10 0.87 0.00 0.00 0.00 179.25 179.32 1nu9 h LYS 191 N 0.42 0.42 -0.54 0.00 1.57 0.69 -1.71 116.57 117.42 1nu9 h LYS 191 Ca 0.09 -0.55 -0.07 0.00 -1.87 0.00 0.00 60.65 58.25 1nu9 h LYS 191 Cb 0.29 0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 1nu9 h LYS 191 CO 0.01 1.21 0.04 0.28 -0.57 0.00 0.00 179.45 180.42 1nu9 h VAL 192 N 0.20 1.26 -0.73 0.50 2.07 -0.65 -2.29 116.25 116.61 1nu9 h VAL 192 Ca -0.12 -1.03 -0.06 0.00 0.82 0.00 0.00 66.70 66.30 1nu9 h VAL 192 Cb 1.78 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.38 1nu9 h VAL 192 CO 0.19 0.37 0.21 0.44 0.02 0.00 0.00 177.57 178.80 1nu9 h ASP 193 N 0.80 1.07 -0.14 0.57 3.32 -1.10 -2.50 116.42 118.44 1nu9 h ASP 193 Ca 0.16 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1nu9 h ASP 193 Cb 0.47 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1nu9 h ASP 193 CO 0.02 1.00 0.07 0.25 -1.72 0.00 0.00 179.24 178.87 1nu9 h LEU 194 N 1.09 0.18 -0.93 1.55 7.12 -1.05 -1.73 115.31 121.53 1nu9 h LEU 194 Ca 0.23 -0.09 -0.11 0.00 0.13 0.00 0.00 57.88 58.04 1nu9 h LEU 194 Cb 0.33 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.40 1nu9 h LEU 194 CO -0.00 0.22 -0.51 -0.37 -0.13 0.00 0.00 178.44 177.64 1nu9 h VAL 195 N 0.12 1.37 -0.15 1.05 -1.51 -1.35 -3.05 116.25 112.73 1nu9 h VAL 195 Ca 0.05 -1.77 -0.16 0.00 -1.23 0.00 0.00 66.70 63.59 1nu9 h VAL 195 Cb 0.09 1.93 -0.01 0.00 -2.13 0.00 0.00 31.29 31.17 1nu9 h VAL 195 CO -0.01 0.51 -0.59 -0.07 -1.23 0.00 0.00 177.57 176.19 1nu9 h LEU 196 N 0.04 0.56 0.00 4.19 4.07 -1.31 -3.45 115.31 119.40 1nu9 h LEU 196 Ca -0.00 -0.31 0.00 0.00 0.08 0.00 0.00 57.88 57.65 1nu9 h LEU 196 Cb 0.92 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.50 1nu9 h LEU 196 CO 0.07 1.02 0.00 0.61 -1.08 0.00 0.00 178.44 179.06 1nu9 n GLY 197 N 0.30 0.46 3.75 0.83 0.00 -0.66 -1.06 105.19 108.80 1nu9 n GLY 197 Ca -0.03 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 1nu9 n GLY 197 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nu9 n ASP 198 N 0.00 3.93 -0.21 1.61 8.00 -1.26 -4.74 116.55 123.88 1nu9 n ASP 198 Ca 0.00 1.14 0.16 0.00 0.71 0.00 0.00 54.79 56.81 1nu9 n ASP 198 Cb 0.00 -1.60 0.49 0.00 -0.02 0.00 0.00 41.12 39.99 1nu9 n ASP 198 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1nu9 h GLU 199 N 4.92 0.44 -0.00 -1.24 5.08 -1.93 0.03 114.58 121.88 1nu9 h GLU 199 Ca -0.47 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1nu9 h GLU 199 Cb 1.22 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1nu9 h GLU 199 CO 0.80 0.29 -0.03 -0.40 -1.00 0.00 0.00 179.01 178.67 1nu9 n ASP 200 N -4.50 0.05 -2.73 1.42 5.75 -1.26 -4.28 116.55 110.99 1nu9 n ASP 200 Ca 0.17 0.19 -0.08 0.00 -0.01 0.00 0.00 54.79 55.06 1nu9 n ASP 200 Cb 0.59 -0.37 0.06 0.00 -1.03 0.00 0.00 41.12 40.38 1nu9 n ASP 200 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1nu9 n LYS 201 N -1.40 0.74 -1.50 0.11 2.85 -0.18 -5.16 118.16 113.63 1nu9 n LYS 201 Ca 0.10 -1.63 -0.32 0.00 -1.05 0.00 0.00 58.31 55.41 1nu9 n LYS 201 Cb 0.30 -1.22 0.07 0.00 -0.65 0.00 0.00 35.03 33.53 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 0.54 2.48 0.14 -1.58 0.04 -0.18 -4.12 135.00 132.32 1nu9 s PRO 202 Ca 0.29 1.33 -0.31 0.00 0.04 0.00 0.00 61.00 62.35 1nu9 s PRO 202 Cb 0.24 -1.91 -0.11 0.00 0.04 0.00 0.00 34.50 32.76 1nu9 s PRO 202 CO -0.19 -1.49 1.81 -1.01 0.04 0.00 0.00 177.00 176.15 1nu9 s HIS 203 N -2.56 2.29 0.35 0.56 3.76 -0.22 -4.94 115.29 114.52 1nu9 s HIS 203 Ca 0.65 0.04 -0.27 0.00 -0.15 0.00 0.00 55.06 55.33 1nu9 s HIS 203 Cb -0.20 -4.17 -0.09 0.00 1.11 0.00 0.00 32.58 29.23 1nu9 s HIS 203 CO 0.48 -4.77 1.15 1.03 -0.85 0.00 0.00 174.74 171.79 1nu9 s ARG 204 N 2.44 4.28 -1.14 1.40 0.52 -1.26 -4.92 118.95 120.27 1nu9 s ARG 204 Ca 0.80 1.85 -0.11 0.00 -0.52 0.00 0.00 55.73 57.74 1nu9 s ARG 204 Cb -0.47 -2.87 0.23 0.00 0.52 0.00 0.00 34.95 32.36 1nu9 s ARG 204 CO 0.36 -0.12 1.24 0.42 0.02 0.00 0.00 175.30 177.21 1nu9 s ILE 205 N -1.33 5.55 -2.63 1.52 -1.09 -1.26 -4.83 121.20 117.13 1nu9 s ILE 205 Ca 0.52 -3.02 0.25 0.00 -2.23 0.00 0.00 60.65 56.18 1nu9 s ILE 205 Cb -0.31 -4.74 0.31 0.00 -1.58 0.00 0.00 42.46 36.13 1nu9 s ILE 205 CO 0.40 -1.38 1.44 -1.54 -1.23 0.00 0.00 174.94 172.64 1nu9 n SER 206 N 4.09 2.21 -3.87 3.58 3.41 -1.26 -4.63 113.62 117.15 1nu9 n SER 206 Ca 0.29 -1.69 -0.08 0.00 -0.26 0.00 0.00 58.87 57.13 1nu9 n SER 206 Cb 0.41 0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 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 -2.09 -0.21 0.46 4.04 2.20 -1.26 0.15 114.94 118.23 1nu9 s ASN 207 Ca 0.30 -0.68 0.15 0.00 -0.94 0.00 0.00 52.86 51.70 1nu9 s ASN 207 Cb 0.20 0.65 1.11 0.00 -2.00 0.00 0.00 41.25 41.21 1nu9 s ASN 207 CO 0.36 -1.21 2.03 -0.33 -2.94 0.00 0.00 177.10 175.00 1nu9 h GLU 208 N 2.12 0.28 -0.03 3.55 5.08 -1.75 -2.14 114.58 121.68 1nu9 h GLU 208 Ca -0.24 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 1nu9 h GLU 208 Cb 1.25 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 1nu9 h GLU 208 CO 0.30 0.18 -0.05 -0.09 -1.00 0.00 0.00 179.01 178.36 1nu9 h ARG 209 N 0.29 0.09 -0.72 2.33 2.43 -1.68 -1.16 114.38 115.95 1nu9 h ARG 209 Ca 0.20 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1nu9 h ARG 209 Cb 0.43 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 1nu9 h ARG 209 CO -0.04 0.59 0.39 0.82 -1.51 0.00 0.00 179.97 180.21 1nu9 h ILE 210 N -0.40 1.22 -0.47 1.20 2.04 -1.78 0.19 117.51 119.51 1nu9 h ILE 210 Ca 0.00 -0.55 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 1nu9 h ILE 210 Cb 0.58 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1nu9 h ILE 210 CO 0.01 0.24 0.12 -0.08 0.00 0.00 0.00 178.15 178.45 1nu9 h GLU 211 N 1.01 0.75 -0.24 2.37 4.81 -1.33 0.11 114.58 122.05 1nu9 h GLU 211 Ca 0.25 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 59.26 1nu9 h GLU 211 Cb 0.04 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1nu9 h GLU 211 CO -0.04 0.73 -0.05 -0.22 -0.73 0.00 0.00 179.01 178.69 1nu9 h LYS 212 N 0.63 0.46 -0.04 1.92 3.64 -0.62 -2.10 116.57 120.46 1nu9 h LYS 212 Ca 0.15 -0.17 -0.17 0.00 -1.27 0.00 0.00 60.65 59.18 1nu9 h LYS 212 Cb 0.31 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 1nu9 h LYS 212 CO -0.00 0.68 -0.73 0.93 -2.27 0.00 0.00 179.45 178.06 1nu9 h GLU 213 N 0.20 0.25 -0.53 1.90 4.39 -0.59 -2.07 114.58 118.13 1nu9 h GLU 213 Ca 0.06 -0.22 -0.12 0.00 0.34 0.00 0.00 59.36 59.43 1nu9 h GLU 213 Cb 0.51 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.19 1nu9 h GLU 213 CO 0.02 0.88 -0.12 1.98 -1.16 0.00 0.00 179.01 180.61 1nu9 h MET 214 N 0.17 1.03 -0.04 2.33 4.05 -1.00 0.19 114.93 121.65 1nu9 h MET 214 Ca -0.03 -0.39 -0.00 0.00 -0.28 0.00 0.00 59.70 59.00 1nu9 h MET 214 Cb 1.30 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 32.04 1nu9 h MET 214 CO 0.12 1.08 0.01 0.82 0.23 0.00 0.00 176.91 179.17 1nu9 h ILE 215 N 0.90 1.15 -0.85 1.77 1.08 -1.32 -0.05 117.51 120.18 1nu9 h ILE 215 Ca 0.14 -0.44 -0.01 0.00 -0.39 0.00 0.00 64.86 64.15 1nu9 h ILE 215 Cb 0.69 1.38 -0.04 0.00 -3.07 0.00 0.00 36.82 35.78 1nu9 h ILE 215 CO 0.05 0.12 0.48 0.11 -0.69 0.00 0.00 178.15 178.22 1nu9 h LYS 216 N -0.12 1.18 -0.08 2.37 1.57 -1.20 0.56 116.57 120.86 1nu9 h LYS 216 Ca 0.01 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1nu9 h LYS 216 Cb 0.18 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 1nu9 h LYS 216 CO -0.00 0.85 0.04 -0.44 -0.57 0.00 0.00 179.45 179.33 1nu9 h ASP 217 N 1.19 0.10 -0.20 0.86 3.45 -0.43 0.12 116.42 121.50 1nu9 h ASP 217 Ca 0.30 -0.10 0.00 0.00 0.43 0.00 0.00 57.03 57.66 1nu9 h ASP 217 Cb 0.01 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 38.74 1nu9 h ASP 217 CO -0.05 0.17 0.13 -0.07 -1.57 0.00 0.00 179.24 177.85 1nu9 h LEU 218 N 0.01 0.23 -0.53 1.55 3.38 -0.68 0.83 115.31 120.11 1nu9 h LEU 218 Ca 0.03 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.02 1nu9 h LEU 218 Cb 0.10 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1nu9 h LEU 218 CO -0.00 0.17 0.29 -0.33 0.09 0.00 0.00 178.44 178.66 1nu9 h GLU 219 N 0.27 0.55 -0.55 1.13 5.08 -0.77 -1.90 114.58 118.40 1nu9 h GLU 219 Ca 0.07 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 1nu9 h GLU 219 Cb -0.03 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 1nu9 h GLU 219 CO -0.02 0.36 0.18 0.66 -1.00 0.00 0.00 179.01 179.19 1nu9 h SER 220 N 0.56 0.75 -0.37 1.42 4.64 -0.12 -0.30 113.55 120.13 1nu9 h SER 220 Ca 0.23 -0.11 -0.11 0.00 -0.47 0.00 0.00 61.79 61.33 1nu9 h SER 220 Cb 0.10 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.98 1nu9 h SER 220 CO -0.14 0.70 -0.17 0.40 -0.87 0.00 0.00 176.83 176.76 1nu9 h ILE 221 N 0.79 1.27 -0.38 0.95 2.04 -0.41 0.21 117.51 121.98 1nu9 h ILE 221 Ca 0.18 -1.28 -0.12 0.00 1.00 0.00 0.00 64.86 64.64 1nu9 h ILE 221 Cb 0.22 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1nu9 h ILE 221 CO -0.01 0.44 -0.25 0.40 0.00 0.00 0.00 178.15 178.73 1nu9 h ILE 222 N 0.75 1.28 -0.08 -0.67 2.04 -0.94 -2.58 117.51 117.31 1nu9 h ILE 222 Ca 0.11 -1.40 -0.09 0.00 1.00 0.00 0.00 64.86 64.48 1nu9 h ILE 222 Cb 0.69 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 1nu9 h ILE 222 CO 0.05 0.47 -0.35 -0.33 0.00 0.00 0.00 178.15 177.98 1nu9 h GLU 223 N 0.65 0.15 -0.72 2.37 5.08 -0.72 -2.04 114.58 119.35 1nu9 h GLU 223 Ca 0.08 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1nu9 h GLU 223 Cb 0.82 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.03 1nu9 h GLU 223 CO 0.07 0.49 0.45 -0.44 -1.00 0.00 0.00 179.01 178.58 1nu9 h ASP 224 N 0.13 0.86 -0.26 1.42 3.45 -0.30 0.70 116.42 122.42 1nu9 h ASP 224 Ca 0.02 -0.05 0.01 0.00 0.43 0.00 0.00 57.03 57.44 1nu9 h ASP 224 Cb 0.69 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 39.23 1nu9 h ASP 224 CO 0.05 0.65 0.13 0.15 -1.57 0.00 0.00 179.24 178.66 1nu9 h PHE 225 N 0.98 0.25 -0.38 4.55 3.57 -0.99 -0.52 116.94 124.40 1nu9 h PHE 225 Ca 0.26 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.63 1nu9 h PHE 225 Cb -0.06 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1nu9 h PHE 225 CO -0.01 0.14 -0.33 0.74 -2.23 0.00 0.00 178.31 176.62 1nu9 h PHE 226 N 0.28 1.01 -0.00 0.41 -1.00 -1.16 -2.19 116.94 114.29 1nu9 h PHE 226 Ca 0.10 -0.28 0.01 0.00 2.81 0.00 0.00 57.97 60.61 1nu9 h PHE 226 Cb 0.02 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 39.35 1nu9 h PHE 226 CO -0.09 1.07 -0.05 0.82 -1.61 0.00 0.00 178.31 178.45 1nu9 h ILE 227 N 0.72 0.88 -0.18 -0.55 1.08 -0.51 -0.88 117.51 118.06 1nu9 h ILE 227 Ca 0.07 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.45 1nu9 h ILE 227 Cb 0.89 0.88 -0.01 0.00 -3.07 0.00 0.00 36.82 35.51 1nu9 h ILE 227 CO 0.08 0.00 -0.27 -0.33 -0.69 0.00 0.00 178.15 176.94 1nu9 h GLU 228 N -0.08 0.35 0.00 2.37 5.08 -1.07 -2.97 114.58 118.26 1nu9 h GLU 228 Ca 0.02 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1nu9 h GLU 228 Cb 0.11 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1nu9 h GLU 228 CO -0.05 0.60 -0.52 1.79 -1.00 0.00 0.00 179.01 179.83 1nu9 h THR 229 N 0.31 0.00 0.00 1.13 1.35 -1.37 -3.47 112.91 110.86 1nu9 h THR 229 Ca 0.05 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 1nu9 h THR 229 Cb 0.65 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1nu9 h THR 229 CO 0.05 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 1nu9 n GLY 230 N 1.25 0.52 3.94 5.82 0.00 -0.38 -5.04 105.19 111.30 1nu9 n GLY 230 Ca 0.03 -0.14 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 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 3.57 -0.09 0.99 1.43 -0.96 -5.02 118.68 118.61 1nu9 s LEU 231 Ca 0.00 0.44 -0.10 0.00 -1.03 0.00 0.00 54.13 53.44 1nu9 s LEU 231 Cb 0.00 -3.31 -0.05 0.00 0.03 0.00 0.00 46.19 42.86 1nu9 s LEU 231 CO 0.00 -0.75 0.23 0.20 0.23 0.00 0.00 176.35 176.26 1nu9 s ASN 232 N -4.22 6.52 -0.28 2.29 0.02 -1.26 -4.53 114.94 113.47 1nu9 s ASN 232 Ca 0.49 0.62 -0.29 0.00 -1.02 0.00 0.00 52.86 52.66 1nu9 s ASN 232 Cb -0.10 -2.13 0.01 0.00 0.02 0.00 0.00 41.25 39.05 1nu9 s ASN 232 CO 0.40 0.36 1.05 -0.75 0.02 0.00 0.00 177.10 178.17 1nu9 s LYS 233 N -0.90 4.14 0.51 -0.60 2.20 -1.26 -4.68 119.74 119.15 1nu9 s LYS 233 Ca 0.18 1.17 -0.20 0.00 -0.36 0.00 0.00 55.97 56.75 1nu9 s LYS 233 Cb -0.13 -3.70 -0.07 0.00 -1.51 0.00 0.00 37.83 32.42 1nu9 s LYS 233 CO 0.07 -0.78 1.09 -1.25 -0.36 0.00 0.00 175.35 174.11 1nu9 s PRO 234 N 3.44 3.57 0.47 4.03 0.04 -1.26 -4.80 135.00 140.49 1nu9 s PRO 234 Ca 0.44 1.50 0.27 0.00 0.04 0.00 0.00 61.00 63.25 1nu9 s PRO 234 Cb -0.13 -2.06 0.92 0.00 0.04 0.00 0.00 34.50 33.27 1nu9 s PRO 234 CO 0.11 -0.65 1.82 -0.44 0.04 0.00 0.00 177.00 177.89 1nu9 h ASP 235 N 1.39 0.00 -3.23 6.66 3.45 -1.95 -3.42 116.42 119.32 1nu9 h ASP 235 Ca -0.50 0.00 -0.59 0.00 0.43 0.00 0.00 57.03 56.37 1nu9 h ASP 235 Cb 1.24 0.00 -0.36 0.00 -0.56 0.00 0.00 39.33 39.65 1nu9 h ASP 235 CO 0.58 0.13 -0.82 0.20 -1.57 0.00 0.00 179.24 177.76 1nu9 s ASN 236 N -6.03 2.85 -0.11 6.45 0.01 -1.26 -5.10 114.94 111.74 1nu9 s ASN 236 Ca 0.02 -0.60 0.01 0.00 -0.71 0.00 0.00 52.86 51.58 1nu9 s ASN 236 Cb 0.09 -1.13 0.02 0.00 0.41 0.00 0.00 41.25 40.63 1nu9 s ASN 236 CO 0.62 -0.10 -0.12 -0.63 -1.51 0.00 0.00 177.10 175.36 1nu9 s ILE 237 N 1.50 1.28 0.06 0.60 1.01 -1.26 -4.96 121.20 119.43 1nu9 s ILE 237 Ca 0.03 -0.48 -0.31 0.00 0.00 0.00 0.00 60.65 59.89 1nu9 s ILE 237 Cb -0.14 -1.22 -0.07 0.00 0.01 0.00 0.00 42.46 41.04 1nu9 s ILE 237 CO -0.09 0.40 1.46 -0.89 0.00 0.00 0.00 174.94 175.82 1nu9 s THR 238 N 1.33 3.38 0.29 2.92 2.01 -1.26 -4.89 115.64 119.41 1nu9 s THR 238 Ca -0.01 0.88 -0.29 0.00 0.31 0.00 0.00 61.69 62.58 1nu9 s THR 238 Cb -0.14 -3.57 -0.10 0.00 0.01 0.00 0.00 72.50 68.70 1nu9 s THR 238 CO -0.05 0.03 1.40 -0.44 -0.69 0.00 0.00 174.62 174.87 1nu9 s SER 239 N 1.69 6.65 0.23 3.53 0.01 -1.26 -4.66 113.70 119.89 1nu9 s SER 239 Ca 0.66 2.72 -0.30 0.00 1.31 0.00 0.00 55.95 60.34 1nu9 s SER 239 Cb -0.36 -2.64 -0.09 0.00 0.21 0.00 0.00 66.02 63.15 1nu9 s SER 239 CO 0.29 -0.67 1.31 -0.47 0.41 0.00 0.00 173.24 174.11 1nu9 s TYR 240 N -0.48 3.22 -0.23 2.43 5.04 -0.27 -4.89 117.35 122.17 1nu9 s TYR 240 Ca 0.55 1.26 -0.04 0.00 -2.44 0.00 0.00 57.07 56.41 1nu9 s TYR 240 Cb -0.42 -3.62 0.08 0.00 0.35 0.00 0.00 41.96 38.35 1nu9 s TYR 240 CO 0.48 -1.88 0.09 0.34 -1.34 0.00 0.00 175.55 173.25 1nu9 s ASP 241 N 0.14 3.06 0.32 4.32 3.68 -1.26 -4.83 116.67 122.10 1nu9 s ASP 241 Ca 0.55 -1.00 0.11 0.00 2.13 0.00 0.00 52.55 54.33 1nu9 s ASP 241 Cb -0.37 -0.43 0.97 0.00 -1.45 0.00 0.00 42.92 41.63 1nu9 s ASP 241 CO 0.41 -0.38 1.65 -1.28 0.13 0.00 0.00 175.17 175.71 1nu9 h SER 242 N 8.34 0.33 0.46 -0.34 0.87 -1.94 0.72 113.55 121.98 1nu9 h SER 242 Ca -0.17 0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1nu9 h SER 242 Cb 1.08 0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 63.23 1nu9 h SER 242 CO 0.37 -0.15 -0.04 0.77 -0.53 0.00 0.00 176.83 177.25 1nu9 h SER 243 N 0.27 0.00 0.00 6.23 4.64 -1.99 -2.14 113.55 120.56 1nu9 h SER 243 Ca 0.68 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.95 1nu9 h SER 243 Cb 1.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.58 1nu9 h SER 243 CO -0.63 0.04 -1.45 0.29 -0.87 0.00 0.00 176.83 174.21 1nu9 n LYS 244 N -3.26 1.11 0.00 4.77 5.02 0.22 -4.80 118.16 121.21 1nu9 n LYS 244 Ca -0.01 -0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 1nu9 n LYS 244 Cb 0.20 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 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 -1.97 0.00 -1.62 2.13 8.25 0.81 -4.27 115.22 118.55 1nu9 n HIS 245 Ca -0.06 -0.25 -0.52 0.00 -0.26 0.00 0.00 57.72 56.64 1nu9 n HIS 245 Cb 0.41 -0.03 -0.06 0.00 1.12 0.00 0.00 29.99 31.44 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 -0.25 1.76 -0.30 4.41 -0.00 -0.81 -3.62 115.22 116.41 1nu9 n HIS 246 Ca 0.00 0.53 0.15 0.00 0.46 0.00 0.00 57.72 58.86 1nu9 n HIS 246 Cb 0.23 -2.40 0.40 0.00 -0.12 0.00 0.00 29.99 28.10 1nu9 n HIS 246 CO 0.00 0.00 0.00 -0.92 0.46 0.00 0.00 176.34 175.88 1nu9 h TYR 247 N 5.36 0.83 0.01 1.57 3.20 -1.91 0.11 116.97 126.13 1nu9 h TYR 247 Ca -0.47 0.03 -0.41 0.00 3.14 0.00 0.00 58.73 61.01 1nu9 h TYR 247 Cb 1.32 -0.25 -0.07 0.00 1.54 0.00 0.00 36.73 39.27 1nu9 h TYR 247 CO 0.64 0.21 -2.46 1.17 -1.64 0.00 0.00 178.16 176.08 1nu9 n LYS 248 N -4.63 0.63 0.16 1.82 4.81 -1.26 -3.89 118.16 115.81 1nu9 n LYS 248 Ca 0.21 0.21 0.02 0.00 -0.87 0.00 0.00 58.31 57.87 1nu9 n LYS 248 Cb 0.61 -1.52 0.25 0.00 0.02 0.00 0.00 35.03 34.39 1nu9 n LYS 248 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1nu9 h ASN 249 N -0.39 0.00 -1.63 3.14 2.35 -1.93 -3.36 115.58 113.75 1nu9 h ASN 249 Ca -0.62 0.00 -0.44 0.00 -0.55 0.00 0.00 56.30 54.70 1nu9 h ASN 249 Cb 1.79 0.00 -0.39 0.00 0.05 0.00 0.00 38.32 39.77 1nu9 h ASN 249 CO -0.21 0.51 -1.16 1.41 -1.65 0.00 0.00 177.43 176.32 1nu9 n HIS 250 N -3.74 0.29 -0.36 1.19 8.25 0.38 -4.97 115.22 116.26 1nu9 n HIS 250 Ca -0.01 -3.46 0.01 0.00 -0.26 0.00 0.00 57.72 54.01 1nu9 n HIS 250 Cb 0.55 -0.31 0.08 0.00 1.12 0.00 0.00 29.99 31.43 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 2.99 -1.20 -0.22 0.41 0.02 -1.66 0.13 113.55 114.01 1nu9 h SER 251 Ca 0.03 0.30 0.06 0.00 -0.84 0.00 0.00 61.79 61.34 1nu9 h SER 251 Cb 1.04 0.68 -0.06 0.00 0.14 0.00 0.00 62.40 64.19 1nu9 h SER 251 CO 0.48 -0.30 -0.19 -0.33 -1.14 0.00 0.00 176.83 175.35 1nu9 h GLU 252 N -0.01 -0.19 -0.57 3.45 3.07 -1.91 0.17 114.58 118.59 1nu9 h GLU 252 Ca 0.39 0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.30 1nu9 h GLU 252 Cb 0.64 0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.55 1nu9 h GLU 252 CO -0.98 -0.13 0.33 0.78 -1.40 0.00 0.00 179.01 177.62 1nu9 h GLY 253 N -0.20 0.82 0.57 -3.84 0.00 -1.02 -0.05 103.07 99.36 1nu9 h GLY 253 Ca 0.13 -0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.23 1nu9 h GLY 253 CO -0.34 0.19 -0.28 -2.75 0.00 0.00 0.00 176.54 173.37 1nu9 h PHE 254 N 0.65 -0.74 -0.65 5.60 3.57 -0.10 -0.76 116.94 124.51 1nu9 h PHE 254 Ca 0.24 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.77 1nu9 h PHE 254 Cb 0.07 0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 1nu9 h PHE 254 CO -0.07 -0.39 0.43 0.93 -2.23 0.00 0.00 178.31 176.98 1nu9 h GLU 255 N -0.52 0.81 -0.59 1.11 4.39 -0.26 -0.89 114.58 118.63 1nu9 h GLU 255 Ca 0.02 -0.05 -0.10 0.00 0.34 0.00 0.00 59.36 59.57 1nu9 h GLU 255 Cb 0.53 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 1nu9 h GLU 255 CO -0.13 0.54 -0.02 0.00 -1.16 0.00 0.00 179.01 178.24 1nu9 h ALA 256 N 1.61 0.84 -0.18 3.43 0.00 -0.62 -1.65 119.26 122.68 1nu9 h ALA 256 Ca 0.25 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1nu9 h ALA 256 Cb -0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1nu9 h ALA 256 CO -0.06 0.67 0.01 1.25 0.00 0.00 0.00 179.25 181.12 1nu9 h LEU 257 N 0.96 0.31 -0.12 0.00 6.46 -0.17 0.20 115.31 122.96 1nu9 h LEU 257 Ca 0.17 -0.30 0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1nu9 h LEU 257 Cb 0.58 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.40 1nu9 h LEU 257 CO 0.03 0.53 -0.06 0.58 -0.62 0.00 0.00 178.44 178.91 1nu9 h VAL 258 N 0.08 0.82 -0.18 1.05 2.07 -1.17 0.70 116.25 119.61 1nu9 h VAL 258 Ca 0.05 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.60 1nu9 h VAL 258 Cb 0.37 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1nu9 h VAL 258 CO 0.01 0.00 0.03 0.50 0.02 0.00 0.00 177.57 178.13 1nu9 h LYS 259 N -0.04 0.10 -0.59 1.57 3.64 -1.22 0.15 116.57 120.18 1nu9 h LYS 259 Ca 0.07 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1nu9 h LYS 259 Cb 0.14 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1nu9 h LYS 259 CO -0.15 0.07 0.23 1.49 -2.27 0.00 0.00 179.45 178.82 1nu9 h GLU 260 N 0.11 0.85 -0.11 1.90 4.81 -0.65 -1.13 114.58 120.36 1nu9 h GLU 260 Ca 0.08 -0.14 -0.16 0.00 -0.13 0.00 0.00 59.36 59.02 1nu9 h GLU 260 Cb 0.07 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 29.31 1nu9 h GLU 260 CO -0.11 0.71 -0.54 1.15 -0.73 0.00 0.00 179.01 179.49 1nu9 h THR 261 N 0.84 1.36 -0.82 0.32 2.02 -0.43 -1.98 112.91 114.21 1nu9 h THR 261 Ca 0.20 -1.85 -0.03 0.00 0.77 0.00 0.00 66.41 65.50 1nu9 h THR 261 Cb 0.18 2.18 -0.04 0.00 -1.74 0.00 0.00 68.15 68.73 1nu9 h THR 261 CO -0.02 0.56 0.41 0.03 0.37 0.00 0.00 175.52 176.87 1nu9 h ARG 262 N 0.17 1.18 -0.51 6.66 3.08 -0.56 -1.59 114.38 122.80 1nu9 h ARG 262 Ca -0.04 -0.17 -0.09 0.00 0.07 0.00 0.00 59.98 59.76 1nu9 h ARG 262 Cb 1.18 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 1nu9 h ARG 262 CO 0.11 0.90 -0.02 0.93 -1.07 0.00 0.00 179.97 180.82 1nu9 h GLU 263 N 1.16 0.92 -0.16 0.04 5.08 -1.20 -2.12 114.58 118.31 1nu9 h GLU 263 Ca 0.28 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 1nu9 h GLU 263 Cb 0.10 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1nu9 h GLU 263 CO -0.04 0.95 -0.15 0.00 -1.00 0.00 0.00 179.01 178.78 1nu9 h ALA 264 N 0.93 1.47 -0.16 3.43 0.00 -1.00 -1.30 119.26 122.63 1nu9 h ALA 264 Ca 0.14 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1nu9 h ALA 264 Cb 0.55 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1nu9 h ALA 264 CO 0.03 0.37 0.01 0.28 0.00 0.00 0.00 179.25 179.94 1nu9 h VAL 265 N 0.24 1.24 -0.90 0.00 2.07 -1.02 -2.30 116.25 115.58 1nu9 h VAL 265 Ca 0.05 -0.80 0.09 0.00 0.82 0.00 0.00 66.70 66.86 1nu9 h VAL 265 Cb 0.41 1.46 -0.07 0.00 -1.52 0.00 0.00 31.29 31.56 1nu9 h VAL 265 CO 0.02 0.24 0.54 0.74 0.02 0.00 0.00 177.57 179.14 1nu9 h THR 266 N 0.04 0.95 -0.00 2.57 2.02 -0.83 -2.15 112.91 115.50 1nu9 h THR 266 Ca 0.05 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.91 1nu9 h THR 266 Cb 0.35 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 1nu9 h THR 266 CO 0.01 0.17 -0.05 0.59 0.37 0.00 0.00 175.52 176.60 1nu9 n ASN 267 N -4.67 0.37 -4.82 4.18 3.02 -0.54 -4.91 115.26 107.89 1nu9 n ASN 267 Ca 0.15 -0.67 -0.33 0.00 -0.03 0.00 0.00 54.58 53.70 1nu9 n ASN 267 Cb 0.27 -0.09 -0.06 0.00 -0.61 0.00 0.00 39.78 39.29 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 -2.34 3.01 0.52 5.41 0.00 -0.81 -5.08 121.76 122.47 1nu9 s ALA 268 Ca 0.34 0.44 0.08 0.00 0.00 0.00 0.00 51.96 52.81 1nu9 s ALA 268 Cb 0.21 -3.17 0.08 0.00 0.00 0.00 0.00 23.12 20.24 1nu9 s ALA 268 CO 0.44 0.05 0.64 0.27 0.00 0.00 0.00 175.76 177.16 1nu9 n ASN 269 N -0.70 2.07 -1.46 0.00 0.23 -1.26 -4.84 115.26 109.31 1nu9 n ASN 269 Ca 0.07 -2.47 0.06 0.00 -0.53 0.00 0.00 54.58 51.72 1nu9 n ASN 269 Cb 0.54 -0.30 0.30 0.00 -2.08 0.00 0.00 39.78 38.23 1nu9 n ASN 269 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1nu9 n ASP 270 N -2.27 4.31 -0.36 0.53 3.85 -1.26 -4.42 116.55 116.94 1nu9 n ASP 270 Ca 0.11 -2.56 0.09 0.00 -0.71 0.00 0.00 54.79 51.72 1nu9 n ASP 270 Cb 0.55 -0.59 0.27 0.00 -1.35 0.00 0.00 41.12 40.00 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 3.14 0.87 -0.56 -1.12 0.02 -1.95 -2.05 113.55 111.89 1nu9 h SER 271 Ca 0.00 0.07 0.16 0.00 -0.84 0.00 0.00 61.79 61.18 1nu9 h SER 271 Cb 1.46 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.87 1nu9 h SER 271 CO 0.30 0.41 0.55 4.11 -1.14 0.00 0.00 176.83 181.06 1nu9 h TRP 272 N 0.91 0.00 -0.05 3.45 5.08 -1.88 -2.20 115.95 121.26 1nu9 h TRP 272 Ca 0.53 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.47 1nu9 h TRP 272 Cb 0.63 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.79 1nu9 h TRP 272 CO -0.01 0.00 -0.09 0.87 -1.28 0.00 0.00 178.44 177.94 1nu9 h LYS 273 N 0.00 0.07 0.00 0.12 1.57 -1.73 -1.70 116.57 114.91 1nu9 h LYS 273 Ca 0.27 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1nu9 h LYS 273 Cb 1.37 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1nu9 h LYS 273 CO -0.00 0.17 0.00 0.25 -0.57 0.00 0.00 179.45 179.29 1nu9 n THR 274 N -4.39 0.34 -1.13 -0.16 -2.24 -0.83 -3.64 114.28 102.23 1nu9 n THR 274 Ca -0.02 0.08 0.07 0.00 -2.27 0.00 0.00 64.05 61.92 1nu9 n THR 274 Cb 0.19 -0.70 0.10 0.00 -2.10 0.00 0.00 70.33 67.81 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 -1.36 1.19 -1.44 -0.78 5.02 -0.64 -5.09 118.16 115.06 1nu9 n LYS 275 Ca 0.09 -2.16 -0.32 0.00 -2.02 0.00 0.00 58.31 53.90 1nu9 n LYS 275 Cb 0.21 -1.26 0.08 0.00 -0.02 0.00 0.00 35.03 34.04 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 -2.14 3.14 0.10 -0.18 -4.23 -1.20 -4.94 115.64 106.19 1nu9 s THR 276 Ca 0.23 0.45 -0.15 0.00 -1.18 0.00 0.00 61.69 61.03 1nu9 s THR 276 Cb 0.20 -2.92 -0.06 0.00 1.34 0.00 0.00 72.50 71.06 1nu9 s THR 276 CO 0.02 -0.41 1.48 0.58 -0.54 0.00 0.00 174.62 175.75 1nu9 h VAL 277 N -0.64 1.29 -2.58 2.29 2.07 -1.93 -3.45 116.25 113.30 1nu9 h VAL 277 Ca -0.45 -1.23 -0.46 0.00 0.82 0.00 0.00 66.70 65.37 1nu9 h VAL 277 Cb 1.24 1.40 0.01 0.00 -1.52 0.00 0.00 31.29 32.43 1nu9 h VAL 277 CO 0.52 0.40 -0.22 -0.54 0.02 0.00 0.00 177.57 177.75 1nu9 s LYS 278 N -4.65 3.33 -0.19 1.57 1.02 -1.26 -5.09 119.74 114.47 1nu9 s LYS 278 Ca -0.13 -0.51 -0.15 0.00 0.02 0.00 0.00 55.97 55.19 1nu9 s LYS 278 Cb 0.09 -2.69 -0.04 0.00 -0.52 0.00 0.00 37.83 34.67 1nu9 s LYS 278 CO 0.80 0.07 0.37 0.21 -0.92 0.00 0.00 175.35 175.89 1nu9 s LYS 279 N -4.32 4.20 -0.14 1.68 2.20 -1.26 -5.07 119.74 117.03 1nu9 s LYS 279 Ca 0.42 0.18 0.01 0.00 -0.36 0.00 0.00 55.97 56.22 1nu9 s LYS 279 Cb -0.10 -3.51 -0.00 0.00 -1.51 0.00 0.00 37.83 32.71 1nu9 s LYS 279 CO 0.35 0.03 -0.18 0.71 -0.36 0.00 0.00 175.35 175.90 1nu9 s TYR 280 N 1.10 2.73 0.00 4.03 1.51 -1.26 -5.22 117.35 120.24 1nu9 s TYR 280 Ca 0.19 -1.07 0.00 0.00 -1.01 0.00 0.00 57.07 55.18 1nu9 s TYR 280 Cb -0.14 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 39.87 1nu9 s TYR 280 CO 0.07 -0.47 0.00 0.41 -1.11 0.00 0.00 175.55 174.45