#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xva s ASP 2 N 0.00 6.67 0.16 4.52 1.11 -1.26 -5.05 116.67 122.82 1xva s ASP 2 Ca 0.00 0.82 -0.14 0.00 0.18 0.00 0.00 52.55 53.41 1xva s ASP 2 Cb 0.00 -2.35 -0.07 0.00 1.07 0.00 0.00 42.92 41.57 1xva s ASP 2 CO 0.00 -0.31 0.55 -0.44 1.18 0.00 0.00 175.17 176.15 1xva s SER 3 N 1.27 6.79 -0.06 0.27 0.01 -1.26 -5.10 113.70 115.63 1xva s SER 3 Ca 0.28 1.05 0.05 0.00 1.31 0.00 0.00 55.95 58.65 1xva s SER 3 Cb -0.16 -2.28 -0.02 0.00 0.21 0.00 0.00 66.02 63.78 1xva s SER 3 CO 0.10 0.07 -0.22 -0.69 0.41 0.00 0.00 173.24 172.92 1xva s VAL 4 N -1.52 2.37 -0.18 3.43 1.01 -1.26 -5.13 120.40 119.11 1xva s VAL 4 Ca 0.39 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.42 1xva s VAL 4 Cb -0.14 -1.89 0.02 0.00 0.00 0.00 0.00 36.38 34.37 1xva s VAL 4 CO 0.19 0.57 -0.19 -0.47 0.00 0.00 0.00 175.10 175.20 1xva s TYR 5 N -0.26 2.81 0.17 5.22 6.14 -1.26 -5.10 117.35 125.06 1xva s TYR 5 Ca -0.00 -1.68 -0.07 0.00 0.64 0.00 0.00 57.07 55.96 1xva s TYR 5 Cb -0.13 -1.92 -0.06 0.00 0.42 0.00 0.00 41.96 40.27 1xva s TYR 5 CO 0.03 -0.81 0.44 1.03 0.64 0.00 0.00 175.55 176.88 1xva s ARG 6 N 1.28 3.70 0.25 4.97 0.52 -1.26 -5.00 118.95 123.41 1xva s ARG 6 Ca 0.04 0.07 -0.05 0.00 -0.52 0.00 0.00 55.73 55.27 1xva s ARG 6 Cb -0.13 -2.79 0.33 0.00 0.52 0.00 0.00 34.95 32.88 1xva s ARG 6 CO -0.12 0.42 1.88 1.15 0.02 0.00 0.00 175.30 178.65 1xva h THR 7 N 2.11 1.12 -3.00 0.02 2.02 -2.07 -3.45 112.91 109.66 1xva h THR 7 Ca -0.47 -0.39 -0.08 0.00 0.77 0.00 0.00 66.41 66.25 1xva h THR 7 Cb 1.17 -0.12 -0.17 0.00 -1.74 0.00 0.00 68.15 67.29 1xva h THR 7 CO 0.71 0.21 -0.09 0.00 0.37 0.00 0.00 175.52 176.71 1xva s ARG 8 N -6.07 0.93 0.50 6.66 1.70 -1.26 -5.14 118.95 116.27 1xva s ARG 8 Ca -0.13 -0.34 -0.23 0.00 -0.47 0.00 0.00 55.73 54.56 1xva s ARG 8 Cb 0.19 0.42 -0.06 0.00 -0.57 0.00 0.00 34.95 34.92 1xva s ARG 8 CO 0.81 -0.32 1.38 -1.12 -1.08 0.00 0.00 175.30 174.97 1xva s SER 9 N -1.98 5.55 0.07 -2.89 0.01 -1.26 -4.92 113.70 108.28 1xva s SER 9 Ca -0.05 2.82 -0.31 0.00 1.31 0.00 0.00 55.95 59.72 1xva s SER 9 Cb -0.01 -2.64 -0.10 0.00 0.21 0.00 0.00 66.02 63.48 1xva s SER 9 CO -0.02 -1.39 1.89 0.18 0.41 0.00 0.00 173.24 174.32 1xva n LEU 10 N -0.65 4.04 0.00 2.44 4.32 -1.26 -1.78 117.00 124.11 1xva n LEU 10 Ca 0.08 0.95 0.00 0.00 -0.02 0.00 0.00 56.01 57.02 1xva n LEU 10 Cb 0.44 -1.52 0.00 0.00 -1.62 0.00 0.00 43.42 40.71 1xva n LEU 10 CO 0.55 0.16 0.00 0.61 -1.22 0.00 0.00 177.39 177.50 1xva n GLY 11 N 4.36 0.23 3.89 -0.72 0.00 -1.26 -5.09 105.19 106.60 1xva n GLY 11 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1xva n GLY 11 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xva s VAL 12 N -2.00 5.03 0.44 1.61 -7.23 -0.73 -5.09 120.40 112.43 1xva s VAL 12 Ca 0.00 0.16 0.06 0.00 -1.81 0.00 0.00 61.98 60.39 1xva s VAL 12 Cb 0.00 -3.67 -0.05 0.00 0.56 0.00 0.00 36.38 33.21 1xva s VAL 12 CO 0.00 -0.17 0.07 0.00 -0.31 0.00 0.00 175.10 174.70 1xva s ALA 13 N -1.91 3.55 -0.25 1.32 0.00 -1.26 -4.77 121.76 118.45 1xva s ALA 13 Ca 0.44 -1.77 -0.21 0.00 0.00 0.00 0.00 51.96 50.42 1xva s ALA 13 Cb -0.11 -0.05 0.07 0.00 0.00 0.00 0.00 23.12 23.03 1xva s ALA 13 CO 0.26 -0.13 0.65 0.00 0.00 0.00 0.00 175.76 176.54 1xva s ALA 14 N -2.72 -1.63 0.18 0.00 0.00 -1.26 -5.11 121.76 111.22 1xva s ALA 14 Ca 0.30 1.94 -0.26 0.00 0.00 0.00 0.00 51.96 53.94 1xva s ALA 14 Cb 0.06 -1.13 0.05 0.00 0.00 0.00 0.00 23.12 22.10 1xva s ALA 14 CO 0.16 -0.32 1.55 0.93 0.00 0.00 0.00 175.76 178.08 1xva h GLU 15 N 5.59 -0.03 -0.43 0.00 3.07 -2.01 -2.84 114.58 117.93 1xva h GLU 15 Ca -0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.57 1xva h GLU 15 Cb 1.18 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 1xva h GLU 15 CO 0.12 -0.02 0.00 0.41 -1.40 0.00 0.00 179.01 178.12 1xva n GLY 16 N -1.35 1.15 3.17 -3.84 0.00 -1.26 -4.93 105.19 98.13 1xva n GLY 16 Ca 0.05 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.32 1xva n GLY 16 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1xva s ILE 17 N -1.43 1.27 0.69 -0.61 -4.36 -1.07 -5.12 121.20 110.57 1xva s ILE 17 Ca 0.33 -0.99 -0.17 0.00 -0.26 0.00 0.00 60.65 59.56 1xva s ILE 17 Cb 0.17 -1.12 0.01 0.00 1.25 0.00 0.00 42.46 42.77 1xva s ILE 17 CO 0.23 0.12 1.26 -2.84 0.24 0.00 0.00 174.94 173.95 1xva s PRO 18 N -1.01 2.35 0.97 0.37 0.02 -1.26 -4.65 135.00 131.78 1xva s PRO 18 Ca 0.04 1.94 -0.12 0.00 0.02 0.00 0.00 61.00 62.88 1xva s PRO 18 Cb -0.08 -1.84 0.17 0.00 0.02 0.00 0.00 34.50 32.78 1xva s PRO 18 CO 0.01 -1.72 1.09 -0.51 -0.33 0.00 0.00 177.00 175.54 1xva s ASP 19 N -1.65 2.87 0.20 2.53 1.01 -1.26 -4.91 116.67 115.46 1xva s ASP 19 Ca 0.79 1.35 -0.20 0.00 0.71 0.00 0.00 52.55 55.20 1xva s ASP 19 Cb -0.34 -2.02 0.16 0.00 1.01 0.00 0.00 42.92 41.73 1xva s ASP 19 CO 0.42 -3.00 1.56 1.56 0.21 0.00 0.00 175.17 175.92 1xva h GLN 20 N -1.80 -0.08 -0.39 8.23 4.20 -1.93 -2.77 115.11 120.57 1xva h GLN 20 Ca -0.53 0.01 -0.29 0.00 0.06 0.00 0.00 58.65 57.90 1xva h GLN 20 Cb 1.31 0.02 -0.25 0.00 0.30 0.00 0.00 27.48 28.85 1xva h GLN 20 CO 0.56 -0.05 -0.72 0.66 -0.67 0.00 0.00 178.83 178.60 1xva n TYR 21 N -5.44 1.40 0.91 2.96 4.01 -1.26 -4.84 117.16 114.90 1xva n TYR 21 Ca 0.07 -1.83 0.11 0.00 -0.16 0.00 0.00 57.90 56.09 1xva n TYR 21 Cb 0.37 -0.29 0.53 0.00 -0.31 0.00 0.00 39.34 39.65 1xva n TYR 21 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xva n ALA 22 N -0.80 2.12 -2.62 -0.72 0.00 -1.05 -3.58 120.51 113.86 1xva n ALA 22 Ca 0.30 -0.09 0.03 0.00 0.00 0.00 0.00 53.44 53.67 1xva n ALA 22 Cb 0.86 -1.38 0.03 0.00 0.00 0.00 0.00 19.45 18.95 1xva n ALA 22 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xva n ASP 23 N -1.43 1.19 -4.85 0.00 2.03 -1.26 -4.70 116.55 107.52 1xva n ASP 23 Ca 0.07 -2.01 -0.29 0.00 0.52 0.00 0.00 54.79 53.09 1xva n ASP 23 Cb 0.25 -0.36 0.10 0.00 -0.72 0.00 0.00 41.12 40.39 1xva n ASP 23 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1xva s GLY 24 N -2.64 1.60 0.14 0.27 0.00 -1.23 -4.89 107.32 100.56 1xva s GLY 24 Ca 0.31 -0.66 -0.17 0.00 0.00 0.00 0.00 44.72 44.21 1xva s GLY 24 CO -0.12 -0.15 1.77 -2.09 0.00 0.00 0.00 173.10 172.51 1xva h GLU 25 N -1.14 0.52 -0.96 2.90 4.81 -1.95 -1.58 114.58 117.18 1xva h GLU 25 Ca -0.46 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 58.78 1xva h GLU 25 Cb 1.33 -0.11 -0.07 0.00 0.63 0.00 0.00 28.75 30.53 1xva h GLU 25 CO 0.64 0.40 0.61 0.00 -0.73 0.00 0.00 179.01 179.93 1xva h ALA 26 N 1.09 1.33 0.01 2.92 0.00 -1.94 -0.86 119.26 121.81 1xva h ALA 26 Ca 0.14 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.83 1xva h ALA 26 Cb 0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1xva h ALA 26 CO -0.02 0.38 -0.88 0.00 0.00 0.00 0.00 179.25 178.73 1xva h ALA 27 N 1.44 0.52 0.20 0.00 0.00 -1.76 -1.60 119.26 118.05 1xva h ALA 27 Ca 0.42 -0.73 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1xva h ALA 27 Cb 0.18 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1xva h ALA 27 CO -0.18 0.93 -0.10 0.00 0.00 0.00 0.00 179.25 179.91 1xva h ARG 28 N 0.10 -0.26 -0.46 0.00 3.08 -0.74 -1.09 114.38 115.01 1xva h ARG 28 Ca -0.04 0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1xva h ARG 28 Cb 1.52 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.61 1xva h ARG 28 CO 0.13 -0.07 -0.03 -0.39 -1.07 0.00 0.00 179.97 178.54 1xva h VAL 29 N -0.41 1.25 -0.53 2.04 -1.51 -1.09 -2.65 116.25 113.34 1xva h VAL 29 Ca -0.03 -1.04 0.05 0.00 -1.23 0.00 0.00 66.70 64.44 1xva h VAL 29 Cb 0.32 0.93 -0.05 0.00 -2.13 0.00 0.00 31.29 30.36 1xva h VAL 29 CO 0.05 0.36 0.27 -0.25 -1.23 0.00 0.00 177.57 176.77 1xva h TRP 30 N 0.72 0.50 -0.07 5.19 7.01 -1.21 -0.40 115.95 127.70 1xva h TRP 30 Ca 0.14 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.18 1xva h TRP 30 Cb 0.49 -0.15 -0.00 0.00 -2.10 0.00 0.00 29.16 27.40 1xva h TRP 30 CO 0.02 0.25 0.05 1.96 -2.79 0.00 0.00 178.44 177.93 1xva h GLN 31 N 0.53 0.00 -0.15 2.65 4.20 -0.82 0.12 115.11 121.64 1xva h GLN 31 Ca 0.23 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.75 1xva h GLN 31 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1xva h GLN 31 CO -0.16 0.00 -0.71 -0.07 -0.67 0.00 0.00 178.83 177.23 1xva h LEU 32 N 0.00 0.74 0.01 1.46 3.38 -1.07 -2.72 115.31 117.11 1xva h LEU 32 Ca 0.03 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.54 1xva h LEU 32 Cb 0.13 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1xva h LEU 32 CO -0.00 1.23 -0.00 0.22 0.09 0.00 0.00 178.44 179.98 1xva h TYR 33 N 0.45 -0.01 0.00 1.13 3.20 0.17 -2.00 116.97 119.90 1xva h TYR 33 Ca -0.03 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 1xva h TYR 33 Cb 1.30 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 39.57 1xva h TYR 33 CO 0.06 0.29 -0.08 -0.84 -1.64 0.00 0.00 178.16 175.96 1xva h ILE 34 N -0.32 0.27 0.00 1.81 -0.00 -1.09 0.64 117.51 118.81 1xva h ILE 34 Ca -0.00 -0.56 0.00 0.00 -0.00 0.00 0.00 64.86 64.30 1xva h ILE 34 Cb 0.31 1.44 0.00 0.00 -0.00 0.00 0.00 36.82 38.57 1xva h ILE 34 CO 0.00 0.08 -0.12 0.61 -0.00 0.00 0.00 178.15 178.72 1xva n GLY 35 N -0.31 -1.57 0.16 0.16 0.00 -1.03 -3.54 105.19 99.07 1xva n GLY 35 Ca -0.01 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.03 1xva n GLY 35 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xva h ASP 36 N 0.00 0.00 -0.45 1.61 5.19 -0.09 -3.38 116.42 119.30 1xva h ASP 36 Ca 0.00 -0.02 -0.25 0.00 -0.62 0.00 0.00 57.03 56.14 1xva h ASP 36 Cb 0.64 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.12 1xva h ASP 36 CO 0.00 0.01 0.76 -0.89 -3.12 0.00 0.00 179.24 176.00 1xva s THR 37 N -3.24 3.40 0.20 0.35 2.01 -1.20 -4.16 115.64 113.00 1xva s THR 37 Ca 0.05 -0.60 0.00 0.00 0.31 0.00 0.00 61.69 61.45 1xva s THR 37 Cb 0.08 -4.26 0.00 0.00 0.01 0.00 0.00 72.50 68.34 1xva s THR 37 CO 0.71 -0.76 0.00 -1.14 -0.69 0.00 0.00 174.62 172.74 1xva n ARG 38 N 8.42 0.00 -1.62 4.92 0.63 -1.26 -4.97 116.66 122.78 1xva n ARG 38 Ca 0.43 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.95 1xva n ARG 38 Cb 0.46 -0.17 -0.03 0.00 0.45 0.00 0.00 32.46 33.17 1xva n ARG 38 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1xva n SER 39 N -3.40 3.36 -4.77 6.15 7.64 -1.26 -4.97 113.62 116.37 1xva n SER 39 Ca 0.00 -2.77 -0.40 0.00 1.01 0.00 0.00 58.87 56.71 1xva n SER 39 Cb 0.02 -1.46 -0.02 0.00 -1.01 0.00 0.00 64.21 61.75 1xva n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xva s ARG 40 N 4.35 4.29 0.23 1.43 1.70 -1.26 0.90 118.95 130.59 1xva s ARG 40 Ca 0.54 2.19 -0.30 0.00 -0.47 0.00 0.00 55.73 57.69 1xva s ARG 40 Cb 0.12 -3.01 -0.09 0.00 -0.57 0.00 0.00 34.95 31.40 1xva s ARG 40 CO 0.03 -0.23 1.30 0.99 -1.08 0.00 0.00 175.30 176.31 1xva s THR 41 N -1.17 3.11 0.24 4.99 2.01 0.12 -4.84 115.64 120.11 1xva s THR 41 Ca 0.50 0.96 -0.06 0.00 0.31 0.00 0.00 61.69 63.41 1xva s THR 41 Cb -0.39 -3.61 0.24 0.00 0.01 0.00 0.00 72.50 68.74 1xva s THR 41 CO 0.52 0.16 1.67 0.00 -0.69 0.00 0.00 174.62 176.29 1xva h ALA 42 N 4.91 0.90 -0.35 7.40 0.00 -1.92 -0.14 119.26 130.06 1xva h ALA 42 Ca -0.46 0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.68 1xva h ALA 42 Cb 1.22 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 19.23 1xva h ALA 42 CO 0.75 -0.36 0.09 0.93 0.00 0.00 0.00 179.25 180.65 1xva h GLU 43 N 0.22 0.22 0.73 0.00 4.39 -1.93 0.64 114.58 118.85 1xva h GLU 43 Ca 0.41 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 60.07 1xva h GLU 43 Cb 0.71 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1xva h GLU 43 CO -0.54 0.14 -0.48 -0.92 -1.16 0.00 0.00 179.01 176.06 1xva h TYR 44 N 0.22 -1.29 -0.21 4.33 3.20 -1.58 -0.25 116.97 121.39 1xva h TYR 44 Ca 0.16 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.08 1xva h TYR 44 Cb 0.16 0.47 -0.06 0.00 1.54 0.00 0.00 36.73 38.84 1xva h TYR 44 CO -0.17 -0.70 -0.15 -0.22 -1.64 0.00 0.00 178.16 175.28 1xva h LYS 45 N -1.14 -0.14 -0.27 1.82 3.64 -0.99 -1.63 116.57 117.85 1xva h LYS 45 Ca -0.09 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.35 1xva h LYS 45 Cb 0.93 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.73 1xva h LYS 45 CO 0.07 -0.09 -0.03 0.00 -2.27 0.00 0.00 179.45 177.13 1xva h ALA 46 N 1.00 0.21 -0.43 5.00 0.00 -0.87 -1.52 119.26 122.64 1xva h ALA 46 Ca 0.12 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 1xva h ALA 46 Cb 0.32 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1xva h ALA 46 CO -0.30 -0.44 0.12 2.35 0.00 0.00 0.00 179.25 180.98 1xva h TRP 47 N 0.04 0.72 0.01 0.00 7.01 -0.69 -1.93 115.95 121.11 1xva h TRP 47 Ca 0.13 -0.08 -0.11 0.00 2.11 0.00 0.00 58.89 60.94 1xva h TRP 47 Cb 0.19 -0.20 0.01 0.00 -2.10 0.00 0.00 29.16 27.05 1xva h TRP 47 CO -0.24 0.66 -0.45 1.25 -2.79 0.00 0.00 178.44 176.88 1xva h LEU 48 N 0.56 0.37 -0.73 0.65 5.85 -1.15 -0.52 115.31 120.35 1xva h LEU 48 Ca 0.14 -0.79 0.01 0.00 0.84 0.00 0.00 57.88 58.08 1xva h LEU 48 Cb 0.30 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1xva h LEU 48 CO -0.00 1.12 0.48 -0.07 -0.34 0.00 0.00 178.44 179.63 1xva h LEU 49 N -0.33 0.83 -0.70 2.25 4.07 -1.33 -2.46 115.31 117.63 1xva h LEU 49 Ca -0.06 -0.02 -0.04 0.00 0.08 0.00 0.00 57.88 57.85 1xva h LEU 49 Cb 1.20 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 42.70 1xva h LEU 49 CO 0.09 0.60 0.30 1.23 -1.08 0.00 0.00 178.44 179.57 1xva h GLY 50 N 0.98 1.12 0.99 0.83 0.00 -1.24 -0.30 103.07 105.44 1xva h GLY 50 Ca 0.27 -0.60 0.03 0.00 0.00 0.00 0.00 47.33 47.03 1xva h GLY 50 CO -0.06 0.56 0.62 -2.00 0.00 0.00 0.00 176.54 175.66 1xva h LEU 51 N 1.00 1.04 0.03 3.11 5.85 -0.72 -1.27 115.31 124.35 1xva h LEU 51 Ca 0.24 -0.02 -0.27 0.00 0.84 0.00 0.00 57.88 58.67 1xva h LEU 51 Cb 0.19 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 1xva h LEU 51 CO -0.02 0.73 -1.48 0.25 -0.34 0.00 0.00 178.44 177.58 1xva h LEU 52 N 1.22 0.10 -0.13 2.25 5.85 -1.00 -2.60 115.31 121.00 1xva h LEU 52 Ca 0.37 -0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1xva h LEU 52 Cb -0.04 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 1xva h LEU 52 CO -0.10 1.14 0.02 0.03 -0.34 0.00 0.00 178.44 179.18 1xva h ARG 53 N 0.02 0.21 0.00 1.25 3.08 -0.94 0.15 114.38 118.15 1xva h ARG 53 Ca -0.20 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.79 1xva h ARG 53 Cb 1.94 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 31.97 1xva h ARG 53 CO 0.11 0.41 -0.02 0.37 -1.07 0.00 0.00 179.97 179.78 1xva h GLN 54 N -0.02 0.00 -0.16 0.04 4.15 -1.20 0.75 115.11 118.66 1xva h GLN 54 Ca 0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1xva h GLN 54 Cb 0.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.00 1xva h GLN 54 CO 0.00 0.02 0.00 0.72 -1.93 0.00 0.00 178.83 177.64 1xva n HIS 55 N -3.82 0.18 -2.66 3.99 8.25 -0.99 -4.95 115.22 115.23 1xva n HIS 55 Ca -0.03 -0.09 -0.13 0.00 -0.26 0.00 0.00 57.72 57.21 1xva n HIS 55 Cb 0.11 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.23 1xva n HIS 55 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xva n GLY 56 N 1.41 -0.02 3.78 -1.41 0.00 0.25 -4.99 105.19 104.21 1xva n GLY 56 Ca 0.16 -0.27 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 1xva n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xva n HIS 58 N 0.56 -0.51 -3.29 0.00 -0.00 -1.26 -4.83 115.22 105.89 1xva n HIS 58 Ca 0.02 0.09 -0.38 0.00 0.46 0.00 0.00 57.72 57.91 1xva n HIS 58 Cb 0.49 0.47 -0.06 0.00 -0.12 0.00 0.00 29.99 30.76 1xva n HIS 58 CO 0.00 0.00 0.00 -0.98 0.46 0.00 0.00 176.34 175.82 1xva s ARG 59 N -2.00 4.29 -0.02 1.57 1.70 -1.26 -0.76 118.95 122.47 1xva s ARG 59 Ca 0.00 0.44 0.03 0.00 -0.47 0.00 0.00 55.73 55.73 1xva s ARG 59 Cb 0.00 -3.48 -0.00 0.00 -0.57 0.00 0.00 34.95 30.90 1xva s ARG 59 CO 0.00 0.06 -0.10 0.14 -1.08 0.00 0.00 175.30 174.31 1xva s VAL 60 N 0.95 0.86 -0.20 4.99 -7.23 -0.69 -0.71 120.40 118.38 1xva s VAL 60 Ca 0.25 -0.44 -0.06 0.00 -1.81 0.00 0.00 61.98 59.92 1xva s VAL 60 Cb -0.15 -0.73 -0.03 0.00 0.56 0.00 0.00 36.38 36.03 1xva s VAL 60 CO 0.10 0.25 0.03 -0.22 -0.31 0.00 0.00 175.10 174.95 1xva s LEU 61 N -0.09 3.48 -0.32 1.32 2.96 0.29 -0.92 118.68 125.41 1xva s LEU 61 Ca 0.01 -0.10 -0.10 0.00 -0.22 0.00 0.00 54.13 53.72 1xva s LEU 61 Cb -0.06 -1.89 -0.01 0.00 0.50 0.00 0.00 46.19 44.74 1xva s LEU 61 CO -0.00 0.09 0.17 -0.62 -1.32 0.00 0.00 176.35 174.67 1xva s ASP 62 N 0.83 5.63 0.00 3.68 -1.08 -0.35 -0.61 116.67 124.78 1xva s ASP 62 Ca 0.02 -0.53 0.23 0.00 -0.52 0.00 0.00 52.55 51.74 1xva s ASP 62 Cb -0.14 -2.02 0.52 0.00 -1.46 0.00 0.00 42.92 39.81 1xva s ASP 62 CO 0.02 -0.21 1.44 1.33 0.52 0.00 0.00 175.17 178.27 1xva n VAL 63 N 5.00 0.37 -3.01 1.11 0.24 -0.61 -1.52 118.33 119.91 1xva n VAL 63 Ca -0.14 -0.60 -0.19 0.00 -2.04 0.00 0.00 64.34 61.38 1xva n VAL 63 Cb 0.49 0.82 -0.02 0.00 -1.47 0.00 0.00 33.84 33.66 1xva n VAL 63 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xva n ALA 64 N 1.10 2.94 -0.08 2.33 0.00 -1.23 -4.64 120.51 120.93 1xva n ALA 64 Ca 0.18 -3.65 -0.06 0.00 0.00 0.00 0.00 53.44 49.90 1xva n ALA 64 Cb 0.52 -0.87 -0.00 0.00 0.00 0.00 0.00 19.45 19.09 1xva n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xva n GLY 66 N -1.32 1.76 0.11 0.00 0.00 -1.26 -2.35 105.19 102.13 1xva n GLY 66 Ca 0.00 -0.62 0.12 0.00 0.00 0.00 0.00 46.02 45.52 1xva n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xva n THR 67 N 0.00 0.75 0.00 2.61 -2.24 -1.25 -4.10 114.28 110.05 1xva n THR 67 Ca 0.00 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1xva n THR 67 Cb 0.00 -0.99 0.00 0.00 -2.10 0.00 0.00 70.33 67.24 1xva n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xva n GLY 68 N 0.37 1.11 0.21 3.38 0.00 -0.99 -2.07 105.19 107.20 1xva n GLY 68 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 1xva n GLY 68 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xva h VAL 69 N 0.00 0.60 -0.44 1.61 2.07 -1.90 0.46 116.25 118.66 1xva h VAL 69 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 1xva h VAL 69 Cb 0.00 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 1xva h VAL 69 CO 0.00 0.00 -0.17 0.44 0.02 0.00 0.00 177.57 177.86 1xva h ASP 70 N -0.35 0.85 -0.60 0.57 3.32 -1.96 -3.00 116.42 115.25 1xva h ASP 70 Ca 0.02 -0.29 -0.09 0.00 0.02 0.00 0.00 57.03 56.70 1xva h ASP 70 Cb 0.36 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1xva h ASP 70 CO -0.09 1.01 0.03 0.28 -1.72 0.00 0.00 179.24 178.75 1xva h SER 71 N 0.74 1.00 -0.68 6.45 0.02 -1.67 -2.80 113.55 116.61 1xva h SER 71 Ca 0.11 -0.29 -0.05 0.00 -0.84 0.00 0.00 61.79 60.73 1xva h SER 71 Cb 0.68 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1xva h SER 71 CO 0.05 1.05 0.26 0.40 -1.14 0.00 0.00 176.83 177.45 1xva h ILE 72 N 0.93 1.24 -0.75 3.27 2.04 0.03 -0.52 117.51 123.75 1xva h ILE 72 Ca 0.17 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 1xva h ILE 72 Cb 0.51 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 1xva h ILE 72 CO 0.02 0.32 0.43 -0.03 0.00 0.00 0.00 178.15 178.89 1xva h MET 73 N 1.02 1.04 0.03 2.37 4.05 -1.47 -0.83 114.93 121.14 1xva h MET 73 Ca 0.23 -0.11 -0.26 0.00 -0.28 0.00 0.00 59.70 59.29 1xva h MET 73 Cb 0.23 -0.21 0.01 0.00 -0.80 0.00 0.00 31.60 30.83 1xva h MET 73 CO -0.02 0.75 -1.05 -0.07 0.23 0.00 0.00 176.91 176.75 1xva h LEU 74 N 1.05 0.72 0.01 3.39 3.38 -0.88 -2.42 115.31 120.56 1xva h LEU 74 Ca 0.27 -0.61 0.02 0.00 0.09 0.00 0.00 57.88 57.66 1xva h LEU 74 Cb 0.00 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1xva h LEU 74 CO -0.05 1.41 -0.17 0.58 0.09 0.00 0.00 178.44 180.31 1xva h VAL 75 N 0.29 0.60 -0.86 1.22 2.07 -0.86 -1.38 116.25 117.32 1xva h VAL 75 Ca -0.12 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.55 1xva h VAL 75 Cb 1.71 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 32.01 1xva h VAL 75 CO 0.19 0.00 0.56 -0.33 0.02 0.00 0.00 177.57 178.01 1xva h GLU 76 N -0.28 0.60 -0.11 1.57 5.08 -1.21 -1.01 114.58 119.21 1xva h GLU 76 Ca 0.05 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1xva h GLU 76 Cb 0.34 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1xva h GLU 76 CO -0.15 0.40 0.00 0.39 -1.00 0.00 0.00 179.01 178.65 1xva n GLU 77 N -4.54 1.50 -0.16 2.33 -0.58 -0.67 -4.93 120.64 113.60 1xva n GLU 77 Ca 0.17 -0.75 0.00 0.00 -0.42 0.00 0.00 57.16 56.15 1xva n GLU 77 Cb 0.49 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 1xva n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xva n GLY 78 N 1.02 0.63 3.89 0.62 0.00 -0.38 -5.05 105.19 105.93 1xva n GLY 78 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1xva n GLY 78 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xva s PHE 79 N -2.26 2.65 -0.39 1.61 0.40 -0.61 -5.00 117.98 114.38 1xva s PHE 79 Ca 0.00 0.68 -0.08 0.00 -0.60 0.00 0.00 56.93 56.93 1xva s PHE 79 Cb 0.00 -3.60 0.07 0.00 0.51 0.00 0.00 43.02 40.00 1xva s PHE 79 CO 0.00 -2.00 0.21 0.45 0.70 0.00 0.00 175.22 174.58 1xva s SER 80 N -4.59 5.50 -0.10 1.36 0.15 0.06 -4.56 113.70 111.51 1xva s SER 80 Ca 0.64 -1.46 0.01 0.00 0.70 0.00 0.00 55.95 55.84 1xva s SER 80 Cb -0.10 -1.93 -0.02 0.00 -1.71 0.00 0.00 66.02 62.26 1xva s SER 80 CO 0.50 -0.48 -0.11 0.68 1.20 0.00 0.00 173.24 175.03 1xva s VAL 81 N 1.38 3.26 -0.13 4.45 -7.23 -1.26 -1.70 120.40 119.18 1xva s VAL 81 Ca 0.02 -0.61 -0.02 0.00 -1.81 0.00 0.00 61.98 59.56 1xva s VAL 81 Cb -0.22 -2.35 -0.02 0.00 0.56 0.00 0.00 36.38 34.35 1xva s VAL 81 CO 0.01 0.55 -0.09 0.42 -0.31 0.00 0.00 175.10 175.69 1xva s THR 82 N -0.15 3.46 -0.09 5.32 -4.23 -0.10 -3.09 115.64 116.76 1xva s THR 82 Ca 0.00 -0.52 0.03 0.00 -1.18 0.00 0.00 61.69 60.02 1xva s THR 82 Cb -0.13 -2.48 0.01 0.00 1.34 0.00 0.00 72.50 71.24 1xva s THR 82 CO 0.03 0.52 -0.19 -0.44 -0.54 0.00 0.00 174.62 174.00 1xva s SER 83 N 0.24 2.53 0.12 3.99 0.01 0.15 -1.22 113.70 119.52 1xva s SER 83 Ca -0.06 -0.45 0.06 0.00 1.31 0.00 0.00 55.95 56.81 1xva s SER 83 Cb -0.15 -1.16 -0.04 0.00 0.21 0.00 0.00 66.02 64.89 1xva s SER 83 CO 0.04 0.09 -0.14 0.68 0.41 0.00 0.00 173.24 174.33 1xva s VAL 84 N 0.56 1.28 0.03 3.43 -7.23 -0.58 -0.53 120.40 117.36 1xva s VAL 84 Ca -0.15 -1.69 -0.20 0.00 -1.81 0.00 0.00 61.98 58.12 1xva s VAL 84 Cb -0.17 -1.49 0.04 0.00 0.56 0.00 0.00 36.38 35.32 1xva s VAL 84 CO 0.05 -0.42 0.45 -0.62 -0.31 0.00 0.00 175.10 174.25 1xva s ASP 85 N -2.42 -0.35 0.28 4.85 -1.08 -1.08 -1.34 116.67 115.53 1xva s ASP 85 Ca 0.08 0.12 0.24 0.00 -0.52 0.00 0.00 52.55 52.47 1xva s ASP 85 Cb -0.05 0.44 0.48 0.00 -1.46 0.00 0.00 42.92 42.33 1xva s ASP 85 CO 0.03 -0.65 1.56 0.00 0.52 0.00 0.00 175.17 176.63 1xva h ALA 86 N 3.04 0.88 -2.89 3.66 0.00 -1.71 -2.13 119.26 120.11 1xva h ALA 86 Ca -0.31 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 53.99 1xva h ALA 86 Cb 1.20 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.85 1xva h ALA 86 CO 0.42 0.00 -0.34 0.45 0.00 0.00 0.00 179.25 179.78 1xva s SER 87 N -5.17 6.24 0.23 0.00 0.15 -1.26 -4.91 113.70 108.97 1xva s SER 87 Ca 0.07 0.27 0.07 0.00 0.70 0.00 0.00 55.95 57.06 1xva s SER 87 Cb 0.10 -2.17 0.20 0.00 -1.71 0.00 0.00 66.02 62.43 1xva s SER 87 CO 0.66 -0.06 1.52 0.44 1.20 0.00 0.00 173.24 177.00 1xva h ASP 88 N 7.77 0.14 -0.31 5.45 3.32 -1.98 -1.75 116.42 129.06 1xva h ASP 88 Ca -0.35 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 56.59 1xva h ASP 88 Cb 1.17 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.66 1xva h ASP 88 CO 0.66 0.79 0.15 0.11 -1.72 0.00 0.00 179.24 179.23 1xva h LYS 89 N 0.08 0.49 0.08 3.56 1.57 -2.01 -1.19 116.57 119.14 1xva h LYS 89 Ca -0.01 -0.06 -0.30 0.00 -1.87 0.00 0.00 60.65 58.41 1xva h LYS 89 Cb 1.23 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.42 1xva h LYS 89 CO 0.10 0.40 -1.56 0.52 -0.57 0.00 0.00 179.45 178.34 1xva h MET 90 N 0.49 0.16 -0.31 3.15 2.86 -1.88 -3.33 114.93 116.06 1xva h MET 90 Ca 0.12 -0.27 -0.11 0.00 -2.06 0.00 0.00 59.70 57.39 1xva h MET 90 Cb 0.09 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1xva h MET 90 CO -0.01 0.96 -0.25 1.25 1.06 0.00 0.00 176.91 179.91 1xva h LEU 91 N 0.04 0.62 -1.28 1.22 5.85 -0.77 -2.29 115.31 118.70 1xva h LEU 91 Ca -0.24 -0.22 0.40 0.00 0.84 0.00 0.00 57.88 58.65 1xva h LEU 91 Cb 1.99 -0.17 -0.13 0.00 0.37 0.00 0.00 40.66 42.71 1xva h LEU 91 CO 0.13 0.86 0.75 0.50 -0.34 0.00 0.00 178.44 180.33 1xva h LYS 92 N 0.54 0.14 0.03 1.25 3.64 -1.35 -1.31 116.57 119.51 1xva h LYS 92 Ca 0.07 -0.01 -0.26 0.00 -1.27 0.00 0.00 60.65 59.19 1xva h LYS 92 Cb 0.72 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.52 1xva h LYS 92 CO 0.06 0.10 -1.05 1.88 -2.27 0.00 0.00 179.45 178.16 1xva h TYR 93 N 0.15 0.82 -0.03 1.91 0.05 -1.60 -2.37 116.97 115.89 1xva h TYR 93 Ca 0.79 -0.47 -0.00 0.00 0.05 0.00 0.00 58.73 59.10 1xva h TYR 93 Cb 2.27 -0.08 -0.00 0.00 1.01 0.00 0.00 36.73 39.92 1xva h TYR 93 CO -0.01 1.30 0.01 0.00 -1.05 0.00 0.00 178.16 178.42 1xva h ALA 94 N 0.54 0.04 -0.79 3.88 0.00 -0.68 -2.25 119.26 120.00 1xva h ALA 94 Ca -0.12 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 54.81 1xva h ALA 94 Cb 1.70 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 19.40 1xva h ALA 94 CO 0.19 -0.37 0.42 -0.07 0.00 0.00 0.00 179.25 179.43 1xva h LEU 95 N -0.11 0.56 -0.48 0.00 4.07 -1.40 -0.89 115.31 117.05 1xva h LEU 95 Ca 0.01 0.07 -0.07 0.00 0.08 0.00 0.00 57.88 57.97 1xva h LEU 95 Cb 0.18 -0.03 -0.02 0.00 1.08 0.00 0.00 40.66 41.86 1xva h LEU 95 CO -0.00 0.30 0.04 0.50 -1.08 0.00 0.00 178.44 178.19 1xva h LYS 96 N 0.68 0.82 -0.29 1.13 3.64 -1.30 -1.74 116.57 119.52 1xva h LYS 96 Ca 0.40 -0.24 0.01 0.00 -1.27 0.00 0.00 60.65 59.55 1xva h LYS 96 Cb 0.45 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 1xva h LYS 96 CO -0.29 0.85 0.16 0.93 -2.27 0.00 0.00 179.45 178.83 1xva h GLU 97 N 0.69 0.32 -0.76 1.90 4.39 -0.60 -1.65 114.58 118.87 1xva h GLU 97 Ca 0.14 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.86 1xva h GLU 97 Cb 0.45 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.98 1xva h GLU 97 CO 0.02 0.21 0.48 -0.09 -1.16 0.00 0.00 179.01 178.47 1xva h ARG 98 N 0.33 0.90 -0.53 2.33 2.43 -0.98 -1.43 114.38 117.42 1xva h ARG 98 Ca 0.11 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1xva h ARG 98 Cb 0.01 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 1xva h ARG 98 CO -0.06 0.59 0.23 2.35 -1.51 0.00 0.00 179.97 181.57 1xva h TRP 99 N 0.93 0.80 -0.98 2.20 2.91 -1.12 0.24 115.95 120.93 1xva h TRP 99 Ca 0.31 -0.05 0.02 0.00 1.13 0.00 0.00 58.89 60.29 1xva h TRP 99 Cb 0.04 -0.24 -0.05 0.00 -0.51 0.00 0.00 29.16 28.39 1xva h TRP 99 CO -0.04 0.64 0.64 -0.91 -1.03 0.00 0.00 178.44 177.75 1xva h ASN 100 N 0.72 1.10 -0.70 2.65 -0.26 -0.56 -2.86 115.58 115.67 1xva h ASN 100 Ca 0.18 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.90 1xva h ASN 100 Cb 0.17 -0.27 0.00 0.00 -1.06 0.00 0.00 38.32 37.17 1xva h ASN 100 CO -0.02 0.79 0.00 0.54 -1.06 0.00 0.00 177.43 177.68 1xva n ARG 101 N -4.40 3.17 -0.32 0.81 1.74 -0.61 -4.61 116.66 112.43 1xva n ARG 101 Ca 0.12 -2.76 0.24 0.00 -0.77 0.00 0.00 57.85 54.67 1xva n ARG 101 Cb 0.04 -1.71 0.44 0.00 -1.02 0.00 0.00 32.46 30.21 1xva n ARG 101 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1xva n ARG 102 N 1.42 -0.07 0.21 5.56 0.63 0.04 -0.35 116.66 124.11 1xva n ARG 102 Ca 0.25 1.39 0.10 0.00 -0.92 0.00 0.00 57.85 58.67 1xva n ARG 102 Cb 0.74 -2.36 0.34 0.00 0.45 0.00 0.00 32.46 31.62 1xva n ARG 102 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1xva h LYS 103 N 0.00 0.00 -6.17 -0.14 1.79 -1.85 -3.32 116.57 106.88 1xva h LYS 103 Ca 0.72 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 58.62 1xva h LYS 103 Cb 1.75 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 32.35 1xva h LYS 103 CO -0.82 0.19 0.80 -1.21 -1.08 0.00 0.00 179.45 177.33 1xva s GLU 104 N -3.40 4.28 0.37 3.15 2.02 0.52 -4.91 118.70 120.74 1xva s GLU 104 Ca 0.03 1.54 0.07 0.00 0.02 0.00 0.00 54.97 56.63 1xva s GLU 104 Cb 0.08 -3.66 0.74 0.00 0.10 0.00 0.00 34.13 31.39 1xva s GLU 104 CO 0.65 -0.59 1.94 -1.35 0.02 0.00 0.00 175.26 175.93 1xva h PRO 105 N 7.71 0.42 0.00 0.39 0.11 -1.83 0.12 132.00 138.92 1xva h PRO 105 Ca -0.26 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 65.73 1xva h PRO 105 Cb 1.11 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1xva h PRO 105 CO 0.94 0.44 -0.23 0.00 -0.21 0.00 0.00 178.00 178.94 1xva h ALA 106 N 1.62 1.42 0.00 -0.75 0.00 -1.91 -2.68 119.26 116.95 1xva h ALA 106 Ca 0.10 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1xva h ALA 106 Cb 0.24 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1xva h ALA 106 CO 0.00 0.29 -0.93 0.74 0.00 0.00 0.00 179.25 179.35 1xva h PHE 107 N 0.00 0.00 0.00 0.00 -1.00 -1.02 -2.97 116.94 111.95 1xva h PHE 107 Ca -0.00 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.77 1xva h PHE 107 Cb 0.46 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.02 1xva h PHE 107 CO 0.00 0.37 -0.02 0.22 -1.61 0.00 0.00 178.31 177.27 1xva h ASP 108 N 0.00 0.00 -0.33 2.17 3.58 -1.13 -3.19 116.42 117.52 1xva h ASP 108 Ca -0.07 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.38 1xva h ASP 108 Cb 1.34 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.39 1xva h ASP 108 CO 0.04 0.02 0.00 0.29 -2.88 0.00 0.00 179.24 176.70 1xva n LYS 109 N -3.14 2.33 -2.81 0.28 4.76 -1.04 -4.93 118.16 113.62 1xva n LYS 109 Ca -0.01 -2.14 -0.42 0.00 -2.87 0.00 0.00 58.31 52.88 1xva n LYS 109 Cb 0.23 -1.46 -0.03 0.00 -1.84 0.00 0.00 35.03 31.93 1xva n LYS 109 CO 0.00 0.00 0.00 -0.46 -1.37 0.00 0.00 177.40 175.57 1xva s TRP 110 N -1.39 3.54 -0.31 2.13 -0.00 -1.20 -4.79 118.94 116.92 1xva s TRP 110 Ca 0.34 1.48 -0.10 0.00 -0.00 0.00 0.00 56.10 57.82 1xva s TRP 110 Cb 0.20 -3.06 -0.01 0.00 -0.00 0.00 0.00 33.47 30.60 1xva s TRP 110 CO 0.28 -0.11 0.16 0.08 -0.00 0.00 0.00 176.95 177.36 1xva s VAL 111 N 1.54 4.70 -0.11 5.86 1.01 -1.18 -5.05 120.40 127.17 1xva s VAL 111 Ca 0.45 -0.34 -0.00 0.00 0.00 0.00 0.00 61.98 62.08 1xva s VAL 111 Cb -0.18 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.80 1xva s VAL 111 CO 0.19 0.09 -0.10 -0.63 0.00 0.00 0.00 175.10 174.66 1xva s ILE 112 N 1.63 3.41 0.11 2.22 1.01 -1.26 0.30 121.20 128.62 1xva s ILE 112 Ca 0.05 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 60.05 1xva s ILE 112 Cb -0.17 -2.43 0.00 0.00 0.01 0.00 0.00 42.46 39.88 1xva s ILE 112 CO 0.07 0.54 0.24 -1.61 0.00 0.00 0.00 174.94 174.18 1xva s GLU 113 N -0.05 0.94 0.10 2.79 0.41 0.31 -4.94 118.70 118.26 1xva s GLU 113 Ca -0.01 -0.97 -0.26 0.00 -0.41 0.00 0.00 54.97 53.32 1xva s GLU 113 Cb -0.14 0.37 -0.06 0.00 -1.78 0.00 0.00 34.13 32.52 1xva s GLU 113 CO 0.03 -0.32 0.81 -1.21 -0.49 0.00 0.00 175.26 174.09 1xva s GLU 114 N -3.88 4.57 0.06 1.61 2.02 -1.26 -2.62 118.70 119.21 1xva s GLU 114 Ca 0.07 1.18 -0.26 0.00 0.02 0.00 0.00 54.97 55.98 1xva s GLU 114 Cb 0.04 -3.33 0.07 0.00 0.10 0.00 0.00 34.13 31.01 1xva s GLU 114 CO -0.09 0.37 0.62 0.00 0.02 0.00 0.00 175.26 176.18 1xva s ALA 115 N -0.42 -1.64 -0.04 5.21 0.00 -0.80 -4.85 121.76 119.23 1xva s ALA 115 Ca 0.39 0.85 0.06 0.00 0.00 0.00 0.00 51.96 53.26 1xva s ALA 115 Cb -0.22 0.46 -0.02 0.00 0.00 0.00 0.00 23.12 23.34 1xva s ALA 115 CO 0.26 -0.57 -0.22 1.21 0.00 0.00 0.00 175.76 176.44 1xva s ASN 116 N -2.01 3.37 0.31 0.00 3.04 -1.26 -1.88 114.94 116.52 1xva s ASN 116 Ca -0.05 -0.39 0.03 0.00 0.04 0.00 0.00 52.86 52.50 1xva s ASN 116 Cb -0.01 -0.62 0.63 0.00 -1.54 0.00 0.00 41.25 39.71 1xva s ASN 116 CO -0.02 0.31 1.87 -0.50 -3.04 0.00 0.00 177.10 175.72 1xva h TRP 117 N 5.59 1.02 -0.17 0.43 6.55 -1.93 0.00 115.95 127.44 1xva h TRP 117 Ca -0.41 0.03 -0.02 0.00 0.95 0.00 0.00 58.89 59.43 1xva h TRP 117 Cb 1.14 -0.33 -0.01 0.00 -0.86 0.00 0.00 29.16 29.11 1xva h TRP 117 CO 0.43 0.43 -0.01 -0.07 -1.05 0.00 0.00 178.44 178.18 1xva h LEU 118 N 0.91 0.22 -3.22 -4.49 4.07 -1.88 -3.04 115.31 107.88 1xva h LEU 118 Ca 0.45 -0.03 -0.11 0.00 0.08 0.00 0.00 57.88 58.28 1xva h LEU 118 Cb 0.48 -0.06 -0.06 0.00 1.08 0.00 0.00 40.66 42.10 1xva h LEU 118 CO -0.22 0.28 -0.20 0.35 -1.08 0.00 0.00 178.44 177.57 1xva n THR 119 N -4.39 2.40 0.13 0.22 -2.24 -0.80 -4.91 114.28 104.70 1xva n THR 119 Ca -0.00 -2.82 -0.13 0.00 -2.27 0.00 0.00 64.05 58.82 1xva n THR 119 Cb 0.18 -0.29 -0.07 0.00 -2.10 0.00 0.00 70.33 68.05 1xva n THR 119 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1xva h LEU 120 N 0.99 -0.36 -1.05 3.22 5.85 -0.89 -1.62 115.31 121.45 1xva h LEU 120 Ca 0.13 0.03 0.39 0.00 0.84 0.00 0.00 57.88 59.27 1xva h LEU 120 Cb 1.42 0.12 -0.16 0.00 0.37 0.00 0.00 40.66 42.40 1xva h LEU 120 CO 0.24 -0.22 0.59 -2.24 -0.34 0.00 0.00 178.44 176.48 1xva h ASP 121 N -0.33 0.38 0.39 1.25 2.03 -1.84 0.36 116.42 118.66 1xva h ASP 121 Ca -0.01 0.22 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 1xva h ASP 121 Cb 0.29 0.21 0.00 0.00 -0.83 0.00 0.00 39.33 39.00 1xva h ASP 121 CO -0.01 -0.31 -1.28 2.29 -1.03 0.00 0.00 179.24 178.90 1xva n LYS 122 N -5.12 0.43 0.05 4.15 2.85 -0.83 -4.22 118.16 115.48 1xva n LYS 122 Ca 0.36 -0.03 -0.02 0.00 -1.05 0.00 0.00 58.31 57.57 1xva n LYS 122 Cb 1.21 -1.61 -0.07 0.00 -0.65 0.00 0.00 35.03 33.91 1xva n LYS 122 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 1xva h ASP 123 N 0.00 0.00 -3.47 -5.58 3.32 0.50 -3.45 116.42 107.74 1xva h ASP 123 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 1xva h ASP 123 Cb 0.84 0.00 -0.38 0.00 0.22 0.00 0.00 39.33 40.00 1xva h ASP 123 CO 0.00 0.69 -0.78 -0.69 -1.72 0.00 0.00 179.24 176.73 1xva s VAL 124 N -2.85 1.20 -0.33 -1.35 1.01 0.31 -4.96 120.40 113.43 1xva s VAL 124 Ca -0.01 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 60.75 1xva s VAL 124 Cb 0.08 -1.50 -0.08 0.00 0.00 0.00 0.00 36.38 34.89 1xva s VAL 124 CO 0.80 -0.06 2.27 -0.81 0.00 0.00 0.00 175.10 177.30 1xva n PRO 125 N 4.81 1.48 -0.30 2.72 -0.04 -1.26 -4.64 135.00 137.75 1xva n PRO 125 Ca -0.11 0.34 0.23 0.00 -0.04 0.00 0.00 63.50 63.92 1xva n PRO 125 Cb 0.46 -3.02 0.53 0.00 -0.04 0.00 0.00 33.50 31.43 1xva n PRO 125 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xva h ALA 126 N 15.18 2.29 -0.63 0.55 0.00 -1.93 -3.48 119.26 131.24 1xva h ALA 126 Ca -0.33 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1xva h ALA 126 Cb 1.27 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1xva h ALA 126 CO 1.03 -0.66 0.00 0.41 0.00 0.00 0.00 179.25 180.03 1xva n GLY 127 N -1.51 2.09 0.35 0.00 0.00 -1.26 0.37 105.19 105.23 1xva n GLY 127 Ca 0.24 -0.53 0.03 0.00 0.00 0.00 0.00 46.02 45.76 1xva n GLY 127 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xva n ASP 128 N 2.78 1.02 0.00 1.61 -0.08 -1.26 -4.99 116.55 115.63 1xva n ASP 128 Ca 0.00 -1.98 0.00 0.00 -1.51 0.00 0.00 54.79 51.30 1xva n ASP 128 Cb 0.00 -0.13 0.00 0.00 2.34 0.00 0.00 41.12 43.33 1xva n ASP 128 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1xva n GLY 129 N 0.81 1.29 3.98 0.27 0.00 0.16 -4.61 105.19 107.08 1xva n GLY 129 Ca 0.07 -1.86 -0.20 0.00 0.00 0.00 0.00 46.02 44.03 1xva n GLY 129 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xva s PHE 130 N -2.71 3.31 0.05 1.61 0.40 -0.04 -4.58 117.98 116.02 1xva s PHE 130 Ca 0.00 -0.08 -0.16 0.00 -0.60 0.00 0.00 56.93 56.09 1xva s PHE 130 Cb 0.00 -1.77 -0.25 0.00 0.51 0.00 0.00 43.02 41.51 1xva s PHE 130 CO 0.00 0.23 1.14 -0.44 0.70 0.00 0.00 175.22 176.85 1xva h ASP 131 N 1.03 0.83 -3.58 1.36 3.32 -1.23 -0.97 116.42 117.17 1xva h ASP 131 Ca -0.49 -0.77 -0.32 0.00 0.02 0.00 0.00 57.03 55.47 1xva h ASP 131 Cb 1.24 -0.25 -0.33 0.00 0.22 0.00 0.00 39.33 40.21 1xva h ASP 131 CO 0.58 1.49 -0.74 0.00 -1.72 0.00 0.00 179.24 178.84 1xva s ALA 132 N -3.20 0.27 -0.21 3.45 0.00 -1.08 -0.91 121.76 120.08 1xva s ALA 132 Ca -0.10 0.11 -0.08 0.00 0.00 0.00 0.00 51.96 51.89 1xva s ALA 132 Cb 0.06 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 1xva s ALA 132 CO 0.90 -0.04 0.08 0.08 0.00 0.00 0.00 175.76 176.78 1xva s VAL 133 N 0.76 4.72 -0.08 0.00 1.01 -0.60 -0.54 120.40 125.67 1xva s VAL 133 Ca -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1xva s VAL 133 Cb -0.11 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 1xva s VAL 133 CO -0.01 0.40 -0.06 0.27 0.00 0.00 0.00 175.10 175.71 1xva s ILE 134 N 0.85 3.82 -0.43 2.22 -4.36 0.22 -1.40 121.20 122.13 1xva s ILE 134 Ca 0.04 -0.43 0.06 0.00 -0.26 0.00 0.00 60.65 60.06 1xva s ILE 134 Cb -0.14 -2.57 0.21 0.00 1.25 0.00 0.00 42.46 41.21 1xva s ILE 134 CO 0.02 0.59 0.55 0.00 0.24 0.00 0.00 174.94 176.35 1xva s LEU 136 N -0.37 2.03 0.00 0.00 1.02 -1.26 -2.64 118.68 117.45 1xva s LEU 136 Ca 0.33 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 54.01 1xva s LEU 136 Cb 0.11 -1.26 0.00 0.00 0.02 0.00 0.00 46.19 45.06 1xva s LEU 136 CO -0.15 0.22 0.00 0.61 0.02 0.00 0.00 176.35 177.04 1xva n GLY 137 N 3.02 1.96 2.51 -3.19 0.00 -1.26 -4.73 105.19 103.50 1xva n GLY 137 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 1xva n GLY 137 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1xva n ASN 138 N 0.00 -3.09 0.12 1.61 5.15 -1.26 -4.94 115.26 112.84 1xva n ASN 138 Ca 0.00 -0.33 -0.23 0.00 -0.60 0.00 0.00 54.58 53.42 1xva n ASN 138 Cb 0.00 -3.10 -0.15 0.00 -0.53 0.00 0.00 39.78 36.00 1xva n ASN 138 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1xva h SER 139 N -1.27 0.72 -0.02 1.20 0.02 -1.84 -3.35 113.55 109.01 1xva h SER 139 Ca -0.33 -0.86 -0.07 0.00 -0.84 0.00 0.00 61.79 59.69 1xva h SER 139 Cb 1.20 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.49 1xva h SER 139 CO 0.30 1.69 -0.18 0.15 -1.14 0.00 0.00 176.83 177.64 1xva h PHE 140 N 0.13 0.40 0.00 3.45 3.57 -1.86 -2.21 116.94 120.42 1xva h PHE 140 Ca -0.27 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.16 1xva h PHE 140 Cb 2.13 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 40.76 1xva h PHE 140 CO 0.11 0.54 0.00 0.00 -2.23 0.00 0.00 178.31 176.73 1xva n ALA 141 N -2.48 1.71 0.29 2.41 0.00 -1.25 -2.26 120.51 118.92 1xva n ALA 141 Ca -0.00 0.02 0.16 0.00 0.00 0.00 0.00 53.44 53.61 1xva n ALA 141 Cb 0.34 -1.33 0.85 0.00 0.00 0.00 0.00 19.45 19.31 1xva n ALA 141 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xva h HIS 142 N 0.00 0.00 -3.03 0.00 3.86 -1.58 0.09 115.15 114.49 1xva h HIS 142 Ca 0.00 0.00 -0.55 0.00 -1.16 0.00 0.00 60.37 58.66 1xva h HIS 142 Cb 0.34 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.74 1xva h HIS 142 CO 0.00 0.06 1.01 -1.17 0.86 0.00 0.00 177.93 178.69 1xva s LEU 143 N -6.95 3.40 0.89 2.43 2.96 -0.96 -4.78 118.68 115.67 1xva s LEU 143 Ca -0.03 0.05 -0.12 0.00 -0.22 0.00 0.00 54.13 53.81 1xva s LEU 143 Cb 0.13 -3.07 0.13 0.00 0.50 0.00 0.00 46.19 43.88 1xva s LEU 143 CO 0.54 -1.56 1.10 -2.16 -1.32 0.00 0.00 176.35 172.95 1xva s PRO 144 N 5.14 1.29 -0.80 0.98 0.04 -1.26 -4.57 135.00 135.83 1xva s PRO 144 Ca 0.43 0.61 -0.12 0.00 0.04 0.00 0.00 61.00 61.97 1xva s PRO 144 Cb -0.08 -1.83 0.21 0.00 0.04 0.00 0.00 34.50 32.84 1xva s PRO 144 CO 0.24 -2.17 0.71 0.34 0.04 0.00 0.00 177.00 176.16 1xva s ASP 145 N -3.67 6.47 -0.01 6.66 2.15 -1.26 -4.80 116.67 122.21 1xva s ASP 145 Ca 0.63 -2.76 -0.24 0.00 0.43 0.00 0.00 52.55 50.61 1xva s ASP 145 Cb -0.17 -2.14 -0.17 0.00 -0.30 0.00 0.00 42.92 40.15 1xva s ASP 145 CO 0.56 -0.52 1.19 0.28 -0.17 0.00 0.00 175.17 176.50 1xva h SER 146 N 7.59 -0.24 0.08 -0.34 0.02 -1.95 -3.25 113.55 115.46 1xva h SER 146 Ca 0.09 -0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1xva h SER 146 Cb 1.02 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.62 1xva h SER 146 CO 0.75 0.18 0.00 0.29 -1.14 0.00 0.00 176.83 176.90 1xva n LYS 147 N -5.03 0.06 0.00 3.45 5.02 -1.26 -4.87 118.16 115.53 1xva n LYS 147 Ca -0.09 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1xva n LYS 147 Cb 0.25 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 1xva n LYS 147 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xva n GLY 148 N -0.93 1.39 3.90 0.72 0.00 -1.23 -4.89 105.19 104.15 1xva n GLY 148 Ca 0.02 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 1xva n GLY 148 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1xva s ASP 149 N 0.00 5.98 -0.41 1.61 -4.77 -1.26 -4.97 116.67 112.85 1xva s ASP 149 Ca 0.00 0.98 -0.00 0.00 -3.30 0.00 0.00 52.55 50.22 1xva s ASP 149 Cb 0.00 -2.10 0.33 0.00 -1.09 0.00 0.00 42.92 40.06 1xva s ASP 149 CO 0.00 -0.85 1.93 0.00 0.70 0.00 0.00 175.17 176.94 1xva n GLN 150 N -2.52 2.04 -0.16 2.11 6.02 -1.26 -4.54 117.38 119.06 1xva n GLN 150 Ca 0.03 -2.12 -0.03 0.00 -0.01 0.00 0.00 57.00 54.87 1xva n GLN 150 Cb 0.56 -1.83 0.06 0.00 1.02 0.00 0.00 30.24 30.05 1xva n GLN 150 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1xva h SER 151 N 1.42 0.20 -0.38 1.08 4.64 -1.93 0.92 113.55 119.50 1xva h SER 151 Ca 0.41 0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.77 1xva h SER 151 Cb 1.20 0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 1xva h SER 151 CO 0.97 0.14 0.20 -0.33 -0.87 0.00 0.00 176.83 176.95 1xva h GLU 152 N 0.37 0.58 -0.50 4.77 5.08 -1.93 -0.44 114.58 122.51 1xva h GLU 152 Ca 0.24 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.43 1xva h GLU 152 Cb 0.25 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1xva h GLU 152 CO -0.24 0.45 -0.10 0.45 -1.00 0.00 0.00 179.01 178.58 1xva h HIS 153 N 0.58 1.01 -0.21 4.33 3.86 -1.17 -2.34 115.15 121.21 1xva h HIS 153 Ca 0.15 -0.19 -0.16 0.00 -1.16 0.00 0.00 60.37 59.01 1xva h HIS 153 Cb 0.07 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.27 1xva h HIS 153 CO 0.00 0.96 -0.52 0.00 0.86 0.00 0.00 177.93 179.23 1xva h ARG 154 N 0.82 0.59 -0.21 2.45 3.08 -0.14 -2.32 114.38 118.65 1xva h ARG 154 Ca 0.13 -0.36 -0.10 0.00 0.07 0.00 0.00 59.98 59.73 1xva h ARG 154 Cb 0.63 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 1xva h ARG 154 CO 0.04 0.96 -0.24 1.25 -1.07 0.00 0.00 179.97 180.91 1xva h LEU 155 N 0.46 0.58 -0.92 3.04 5.85 -1.08 -1.22 115.31 122.01 1xva h LEU 155 Ca 0.02 -0.49 -0.07 0.00 0.84 0.00 0.00 57.88 58.17 1xva h LEU 155 Cb 1.06 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 1xva h LEU 155 CO 0.10 0.95 0.02 0.00 -0.34 0.00 0.00 178.44 179.17 1xva h ALA 156 N 0.64 1.11 -0.18 1.25 0.00 -1.35 -2.31 119.26 118.42 1xva h ALA 156 Ca 0.03 -0.26 -0.17 0.00 0.00 0.00 0.00 54.91 54.52 1xva h ALA 156 Cb 0.80 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1xva h ALA 156 CO 0.06 0.57 -0.54 1.25 0.00 0.00 0.00 179.25 180.59 1xva h LEU 157 N 0.76 0.78 -0.46 0.00 5.85 -1.42 -0.57 115.31 120.25 1xva h LEU 157 Ca 0.15 -0.59 0.06 0.00 0.84 0.00 0.00 57.88 58.33 1xva h LEU 157 Cb 0.43 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 1xva h LEU 157 CO 0.02 1.24 0.18 0.50 -0.34 0.00 0.00 178.44 180.03 1xva h LYS 158 N 0.37 0.35 -0.66 1.25 3.64 -1.12 -0.13 116.57 120.27 1xva h LYS 158 Ca -0.02 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.26 1xva h LYS 158 Cb 1.16 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.88 1xva h LYS 158 CO 0.12 0.23 0.08 -0.91 -2.27 0.00 0.00 179.45 176.70 1xva h ASN 159 N 0.36 1.06 0.05 4.20 -0.26 -1.34 0.25 115.58 119.90 1xva h ASN 159 Ca 0.21 -0.26 -0.00 0.00 -0.56 0.00 0.00 56.30 55.69 1xva h ASN 159 Cb 0.20 -0.28 0.00 0.00 -1.06 0.00 0.00 38.32 37.18 1xva h ASN 159 CO -0.20 1.06 -0.03 0.40 -1.06 0.00 0.00 177.43 177.60 1xva h ILE 160 N 1.02 0.95 -0.56 2.81 2.04 -0.82 -2.09 117.51 120.86 1xva h ILE 160 Ca 0.20 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.15 1xva h ILE 160 Cb 0.47 0.95 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 1xva h ILE 160 CO 0.02 0.00 0.38 0.00 0.00 0.00 0.00 178.15 178.54 1xva h ALA 161 N 0.88 2.02 0.00 1.87 0.00 -0.67 -1.88 119.26 121.47 1xva h ALA 161 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xva h ALA 161 Cb 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1xva h ALA 161 CO 0.01 -0.14 0.00 -1.13 0.00 0.00 0.00 179.25 177.99 1xva n SER 162 N -4.47 0.00 -0.54 0.00 3.41 0.85 -1.73 113.62 111.14 1xva n SER 162 Ca 0.09 0.40 0.12 0.00 -0.26 0.00 0.00 58.87 59.21 1xva n SER 162 Cb 0.35 -0.43 0.09 0.00 -0.26 0.00 0.00 64.21 63.96 1xva n SER 162 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1xva n MET 163 N -1.43 1.37 -2.95 4.33 2.81 -0.71 -4.88 117.12 115.67 1xva n MET 163 Ca 0.02 -1.09 -0.41 0.00 -1.81 0.00 0.00 57.70 54.41 1xva n MET 163 Cb 0.06 -1.48 -0.04 0.00 -0.71 0.00 0.00 33.22 31.06 1xva n MET 163 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1xva s VAL 164 N -2.38 4.97 0.48 2.03 1.01 -0.70 -0.86 120.40 124.95 1xva s VAL 164 Ca 0.22 1.59 -0.22 0.00 0.00 0.00 0.00 61.98 63.57 1xva s VAL 164 Cb 0.19 -4.11 -0.07 0.00 0.00 0.00 0.00 36.38 32.39 1xva s VAL 164 CO 0.51 0.17 1.14 -0.60 0.00 0.00 0.00 175.10 176.32 1xva s ARG 165 N 1.22 3.68 0.22 2.72 3.52 -0.37 -4.72 118.95 125.22 1xva s ARG 165 Ca 0.40 1.69 -0.32 0.00 -0.13 0.00 0.00 55.73 57.37 1xva s ARG 165 Cb -0.18 -2.29 -0.12 0.00 -1.56 0.00 0.00 34.95 30.80 1xva s ARG 165 CO 0.18 -0.60 1.71 -2.30 -0.81 0.00 0.00 175.30 173.48 1xva n PRO 166 N -0.70 2.76 -0.23 5.12 -0.02 -1.26 0.70 135.00 141.36 1xva n PRO 166 Ca 0.08 0.99 0.00 0.00 -2.02 0.00 0.00 63.50 62.56 1xva n PRO 166 Cb 0.49 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.14 1xva n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xva n GLY 167 N 3.74 1.49 1.59 -1.23 0.00 -0.10 -5.02 105.19 105.66 1xva n GLY 167 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 1xva n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xva n GLY 168 N -2.00 0.10 3.18 -0.02 0.00 0.22 -4.74 105.19 101.93 1xva n GLY 168 Ca 0.00 -1.89 -0.25 0.00 0.00 0.00 0.00 46.02 43.87 1xva n GLY 168 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xva s LEU 169 N 0.00 2.05 -0.20 0.99 2.96 -0.09 -1.56 118.68 122.84 1xva s LEU 169 Ca 0.28 -0.35 -0.05 0.00 -0.22 0.00 0.00 54.13 53.80 1xva s LEU 169 Cb -0.01 -0.93 -0.02 0.00 0.50 0.00 0.00 46.19 45.72 1xva s LEU 169 CO 0.19 0.21 -0.00 -0.22 -1.32 0.00 0.00 176.35 175.21 1xva s LEU 170 N -0.51 3.27 -0.29 -0.68 2.96 -0.30 -1.56 118.68 121.57 1xva s LEU 170 Ca 0.07 -0.19 -0.01 0.00 -0.22 0.00 0.00 54.13 53.77 1xva s LEU 170 Cb -0.07 -1.83 0.05 0.00 0.50 0.00 0.00 46.19 44.84 1xva s LEU 170 CO -0.00 0.07 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.39 1xva s VAL 171 N 0.96 2.90 0.01 1.68 1.01 -0.49 -1.56 120.40 124.91 1xva s VAL 171 Ca 0.01 -1.38 0.01 0.00 0.00 0.00 0.00 61.98 60.62 1xva s VAL 171 Cb -0.14 -2.65 -0.01 0.00 0.00 0.00 0.00 36.38 33.57 1xva s VAL 171 CO 0.02 -0.07 -0.03 -0.51 0.00 0.00 0.00 175.10 174.50 1xva s ILE 172 N 1.24 0.20 0.31 2.22 2.07 -0.97 -1.06 121.20 125.23 1xva s ILE 172 Ca -0.05 -0.47 0.03 0.00 -1.41 0.00 0.00 60.65 58.75 1xva s ILE 172 Cb -0.20 -0.24 -0.04 0.00 0.13 0.00 0.00 42.46 42.11 1xva s ILE 172 CO -0.02 -0.18 0.16 1.51 -1.91 0.00 0.00 174.94 174.50 1xva s ASP 173 N -0.69 1.68 -0.01 4.50 1.47 -1.08 -0.82 116.67 121.71 1xva s ASP 173 Ca -0.06 -1.57 -0.20 0.00 1.18 0.00 0.00 52.55 51.91 1xva s ASP 173 Cb -0.05 0.38 0.04 0.00 -0.34 0.00 0.00 42.92 42.96 1xva s ASP 173 CO -0.00 -0.89 0.44 -1.38 0.68 0.00 0.00 175.17 174.02 1xva s HIS 174 N -3.56 -0.34 0.90 2.11 -3.43 -0.78 -4.34 115.29 105.86 1xva s HIS 174 Ca 0.35 0.50 -0.11 0.00 -0.80 0.00 0.00 55.06 55.00 1xva s HIS 174 Cb 0.05 0.21 0.13 0.00 -1.43 0.00 0.00 32.58 31.55 1xva s HIS 174 CO 0.17 -0.49 1.09 1.03 -2.00 0.00 0.00 174.74 174.54 1xva s ARG 175 N -1.55 1.19 -1.06 -0.38 1.81 -1.26 -0.68 118.95 117.02 1xva s ARG 175 Ca -0.11 0.99 -0.22 0.00 -1.72 0.00 0.00 55.73 54.67 1xva s ARG 175 Cb -0.03 -1.79 0.02 0.00 -0.45 0.00 0.00 34.95 32.71 1xva s ARG 175 CO 0.04 -2.33 1.64 1.21 -0.68 0.00 0.00 175.30 175.18 1xva s ASN 176 N -3.22 6.17 0.41 0.23 3.04 0.01 -4.65 114.94 116.94 1xva s ASN 176 Ca 0.64 -1.48 0.29 0.00 0.04 0.00 0.00 52.86 52.35 1xva s ASN 176 Cb -0.19 -2.57 1.14 0.00 -1.54 0.00 0.00 41.25 38.09 1xva s ASN 176 CO 0.58 -1.82 1.85 1.88 -3.04 0.00 0.00 177.10 176.54 1xva h TYR 177 N 9.71 0.00 -0.26 0.43 0.05 -1.90 -2.68 116.97 122.32 1xva h TYR 177 Ca 0.22 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.92 1xva h TYR 177 Cb 0.98 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.71 1xva h TYR 177 CO 1.29 0.00 -0.16 -0.44 -1.05 0.00 0.00 178.16 177.79 1xva h ASP 178 N 0.00 0.59 0.68 3.88 5.19 -1.86 0.42 116.42 125.32 1xva h ASP 178 Ca 0.00 -0.43 -0.03 0.00 -0.62 0.00 0.00 57.03 55.94 1xva h ASP 178 Cb 0.48 -0.16 0.01 0.00 0.18 0.00 0.00 39.33 39.83 1xva h ASP 178 CO 0.00 0.89 -0.33 0.22 -3.12 0.00 0.00 179.24 176.91 1xva h TYR 179 N 0.29 -0.85 -0.81 4.55 3.20 -1.94 -2.15 116.97 119.25 1xva h TYR 179 Ca 0.05 -0.02 0.19 0.00 3.14 0.00 0.00 58.73 62.10 1xva h TYR 179 Cb 0.69 0.28 -0.14 0.00 1.54 0.00 0.00 36.73 39.10 1xva h TYR 179 CO 0.07 -0.51 0.03 0.82 -1.64 0.00 0.00 178.16 176.92 1xva h ILE 180 N -1.20 0.28 -0.59 1.81 2.04 -1.52 -2.44 117.51 115.90 1xva h ILE 180 Ca -0.09 -0.03 -0.09 0.00 1.00 0.00 0.00 64.86 65.65 1xva h ILE 180 Cb 0.72 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1xva h ILE 180 CO 0.15 0.02 0.03 -0.07 0.00 0.00 0.00 178.15 178.28 1xva h LEU 181 N 0.10 0.99 -0.17 1.44 4.07 -0.85 -2.06 115.31 118.83 1xva h LEU 181 Ca 0.46 -0.29 -0.21 0.00 0.08 0.00 0.00 57.88 57.91 1xva h LEU 181 Cb 0.84 -0.27 0.01 0.00 1.08 0.00 0.00 40.66 42.32 1xva h LEU 181 CO -0.71 1.04 -0.72 0.28 -1.08 0.00 0.00 178.44 177.24 1xva h SER 182 N 0.91 0.93 1.36 -0.43 0.02 -0.89 -3.37 113.55 112.08 1xva h SER 182 Ca 0.17 -0.62 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1xva h SER 182 Cb 0.52 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1xva h SER 182 CO 0.02 1.39 -0.43 0.74 -1.14 0.00 0.00 176.83 177.41 1xva h THR 183 N 0.53 0.00 -0.34 -2.27 2.02 -1.59 -3.49 112.91 107.76 1xva h THR 183 Ca -0.04 -0.80 -0.15 0.00 0.77 0.00 0.00 66.41 66.19 1xva h THR 183 Cb 1.35 1.56 -0.06 0.00 -1.74 0.00 0.00 68.15 69.26 1xva h THR 183 CO 0.15 0.00 -0.13 0.61 0.37 0.00 0.00 175.52 176.52 1xva n GLY 184 N 1.21 0.77 2.71 2.16 0.00 -0.78 -4.97 105.19 106.29 1xva n GLY 184 Ca 0.03 -0.09 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 1xva n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xva s ALA 186 N 1.99 2.72 0.42 0.00 0.00 -1.26 -4.70 121.76 120.93 1xva s ALA 186 Ca 0.02 -1.28 -0.25 0.00 0.00 0.00 0.00 51.96 50.44 1xva s ALA 186 Cb -0.15 -4.25 -0.08 0.00 0.00 0.00 0.00 23.12 18.64 1xva s ALA 186 CO -0.07 -3.30 1.28 -1.25 0.00 0.00 0.00 175.76 172.42 1xva s PRO 187 N 5.79 3.91 0.46 0.00 0.05 -1.26 -4.79 135.00 139.16 1xva s PRO 187 Ca 0.38 2.10 -0.22 0.00 0.05 0.00 0.00 61.00 63.31 1xva s PRO 187 Cb -0.08 -2.69 -0.08 0.00 0.05 0.00 0.00 34.50 31.70 1xva s PRO 187 CO 0.16 -0.52 1.11 -1.25 0.05 0.00 0.00 177.00 176.54 1xva s PRO 188 N -2.32 3.81 -1.69 0.56 0.05 -1.26 -4.40 135.00 129.75 1xva s PRO 188 Ca 0.58 1.60 0.00 0.00 0.05 0.00 0.00 61.00 63.24 1xva s PRO 188 Cb -0.37 -2.32 0.00 0.00 0.05 0.00 0.00 34.50 31.86 1xva s PRO 188 CO 0.47 -0.47 0.00 0.41 0.05 0.00 0.00 177.00 177.46 1xva n GLY 189 N 0.25 1.27 3.44 0.56 0.00 -1.26 -4.92 105.19 104.52 1xva n GLY 189 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 1xva n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xva s LYS 190 N -3.62 3.35 -0.04 1.61 2.20 -1.26 -4.91 119.74 117.07 1xva s LYS 190 Ca 0.00 -1.35 0.02 0.00 -0.36 0.00 0.00 55.97 54.27 1xva s LYS 190 Cb 0.00 -4.58 0.01 0.00 -1.51 0.00 0.00 37.83 31.75 1xva s LYS 190 CO 0.00 -1.77 -0.06 1.21 -0.36 0.00 0.00 175.35 174.37 1xva s ASN 191 N 3.65 1.02 0.02 1.43 3.84 -1.26 -4.96 114.94 118.69 1xva s ASN 191 Ca 0.26 -0.15 0.22 0.00 0.21 0.00 0.00 52.86 53.40 1xva s ASN 191 Cb -0.12 -0.41 -0.17 0.00 -0.55 0.00 0.00 41.25 40.01 1xva s ASN 191 CO -0.00 -0.01 0.79 2.30 -2.79 0.00 0.00 177.10 177.39 1xva n ILE 192 N 3.72 0.10 -0.13 -5.21 -5.35 -1.26 -4.71 119.36 106.52 1xva n ILE 192 Ca -0.22 -0.31 -0.28 0.00 -0.27 0.00 0.00 62.75 61.67 1xva n ILE 192 Cb 0.52 0.26 -0.10 0.00 -1.74 0.00 0.00 39.64 38.59 1xva n ILE 192 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1xva n TYR 193 N -2.03 0.13 -4.36 4.28 4.01 -1.26 -4.39 117.16 113.55 1xva n TYR 193 Ca -0.00 0.06 -0.21 0.00 -0.16 0.00 0.00 57.90 57.59 1xva n TYR 193 Cb 0.47 -0.99 -0.13 0.00 -0.31 0.00 0.00 39.34 38.38 1xva n TYR 193 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1xva s TYR 194 N -2.51 1.32 0.02 -0.72 2.02 -1.26 0.12 117.35 116.34 1xva s TYR 194 Ca -0.37 -0.37 -0.23 0.00 -0.37 0.00 0.00 57.07 55.72 1xva s TYR 194 Cb 0.13 -0.78 -0.05 0.00 -0.40 0.00 0.00 41.96 40.86 1xva s TYR 194 CO 0.50 0.05 0.70 0.21 -1.57 0.00 0.00 175.55 175.44 1xva s LYS 195 N -1.25 4.43 -0.08 -0.62 2.20 0.26 -4.81 119.74 119.87 1xva s LYS 195 Ca 0.02 0.94 -0.22 0.00 -0.36 0.00 0.00 55.97 56.35 1xva s LYS 195 Cb -0.08 -3.36 -0.04 0.00 -1.51 0.00 0.00 37.83 32.84 1xva s LYS 195 CO 0.02 0.30 0.63 0.45 -0.36 0.00 0.00 175.35 176.39 1xva s SER 196 N -0.04 6.90 0.00 1.43 0.15 -1.26 -4.47 113.70 116.41 1xva s SER 196 Ca 0.36 1.08 0.24 0.00 0.70 0.00 0.00 55.95 58.33 1xva s SER 196 Cb -0.19 -2.38 0.50 0.00 -1.71 0.00 0.00 66.02 62.24 1xva s SER 196 CO 0.21 -0.08 1.43 0.47 1.20 0.00 0.00 173.24 176.47 1xva n ASP 197 N 3.72 2.71 -4.91 5.45 8.00 -1.26 -4.95 116.55 125.31 1xva n ASP 197 Ca -0.03 -1.87 -0.28 0.00 0.71 0.00 0.00 54.79 53.32 1xva n ASP 197 Cb 0.51 -0.10 -0.04 0.00 -0.02 0.00 0.00 41.12 41.47 1xva n ASP 197 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xva s LEU 198 N -1.75 4.26 -0.13 0.64 2.96 -1.26 -5.08 118.68 118.31 1xva s LEU 198 Ca 0.34 0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 54.36 1xva s LEU 198 Cb 0.21 -2.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.01 1xva s LEU 198 CO 0.30 0.09 0.05 -0.89 -1.32 0.00 0.00 176.35 174.59 1xva s THR 199 N -1.66 4.69 0.03 3.68 2.01 -1.26 -5.06 115.64 118.07 1xva s THR 199 Ca 0.34 -0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.26 1xva s THR 199 Cb -0.12 -3.05 -0.02 0.00 0.01 0.00 0.00 72.50 69.33 1xva s THR 199 CO 0.27 0.54 -0.04 -1.59 -0.69 0.00 0.00 174.62 173.11 1xva s LYS 200 N -0.34 0.37 -0.07 4.92 -2.85 -1.26 -2.02 119.74 118.49 1xva s LYS 200 Ca 0.08 -0.64 0.01 0.00 -1.00 0.00 0.00 55.97 54.42 1xva s LYS 200 Cb -0.12 -0.03 -0.03 0.00 -2.06 0.00 0.00 37.83 35.60 1xva s LYS 200 CO 0.02 -0.02 -0.08 0.34 0.10 0.00 0.00 175.35 175.71 1xva s ASP 201 N -1.46 4.54 -0.10 0.03 2.15 -0.13 -4.87 116.67 116.83 1xva s ASP 201 Ca -0.14 -0.06 0.01 0.00 0.43 0.00 0.00 52.55 52.79 1xva s ASP 201 Cb -0.10 -1.16 -0.02 0.00 -0.30 0.00 0.00 42.92 41.34 1xva s ASP 201 CO -0.01 0.35 -0.12 -0.63 -0.17 0.00 0.00 175.17 174.59 1xva s ILE 202 N -0.71 3.22 -0.15 4.11 1.01 -1.26 -1.53 121.20 125.89 1xva s ILE 202 Ca 0.11 -0.63 -0.03 0.00 0.00 0.00 0.00 60.65 60.10 1xva s ILE 202 Cb -0.11 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 40.00 1xva s ILE 202 CO 0.01 0.55 -0.05 -0.89 0.00 0.00 0.00 174.94 174.56 1xva s THR 203 N -0.06 3.76 -0.20 2.92 2.01 -1.00 -4.94 115.64 118.13 1xva s THR 203 Ca -0.02 -0.41 -0.05 0.00 0.31 0.00 0.00 61.69 61.52 1xva s THR 203 Cb -0.14 -2.63 -0.02 0.00 0.01 0.00 0.00 72.50 69.71 1xva s THR 203 CO 0.04 0.50 -0.00 -0.89 -0.69 0.00 0.00 174.62 173.58 1xva s THR 204 N 0.30 3.94 0.03 -0.82 2.01 -1.26 -2.21 115.64 117.63 1xva s THR 204 Ca -0.05 -0.32 0.06 0.00 0.31 0.00 0.00 61.69 61.69 1xva s THR 204 Cb -0.14 -2.78 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 1xva s THR 204 CO 0.03 0.43 -0.13 -0.44 -0.69 0.00 0.00 174.62 173.82 1xva s SER 205 N 1.01 4.17 -0.11 3.53 0.01 0.44 -4.93 113.70 117.83 1xva s SER 205 Ca 0.02 -0.32 0.02 0.00 1.31 0.00 0.00 55.95 56.98 1xva s SER 205 Cb -0.14 -0.81 0.01 0.00 0.21 0.00 0.00 66.02 65.29 1xva s SER 205 CO 0.02 0.26 -0.18 -0.69 0.41 0.00 0.00 173.24 173.05 1xva s VAL 206 N -0.98 1.67 -0.19 3.43 1.01 -1.26 -0.35 120.40 123.73 1xva s VAL 206 Ca 0.16 -0.76 -0.07 0.00 0.00 0.00 0.00 61.98 61.31 1xva s VAL 206 Cb -0.11 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1xva s VAL 206 CO 0.07 0.47 0.04 -0.22 0.00 0.00 0.00 175.10 175.47 1xva s LEU 207 N 0.77 3.66 -0.14 3.92 2.96 -0.58 -5.01 118.68 124.25 1xva s LEU 207 Ca -0.10 0.00 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 1xva s LEU 207 Cb -0.16 -1.92 0.00 0.00 0.50 0.00 0.00 46.19 44.61 1xva s LEU 207 CO 0.01 0.15 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.10 1xva s THR 208 N 0.53 2.32 -0.18 3.68 2.01 -1.26 -0.44 115.64 122.29 1xva s THR 208 Ca 0.02 -0.90 -0.02 0.00 0.31 0.00 0.00 61.69 61.10 1xva s THR 208 Cb -0.13 -1.94 -0.01 0.00 0.01 0.00 0.00 72.50 70.43 1xva s THR 208 CO 0.01 0.54 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.71 1xva s VAL 209 N 0.70 3.20 0.00 3.82 1.01 -0.45 -4.86 120.40 123.82 1xva s VAL 209 Ca -0.09 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.31 1xva s VAL 209 Cb -0.16 -2.40 0.00 0.00 0.00 0.00 0.00 36.38 33.82 1xva s VAL 209 CO 0.01 0.48 0.00 0.59 0.00 0.00 0.00 175.10 176.18 1xva n ASN 210 N 4.20 0.00 -0.15 3.32 5.03 -1.26 -0.99 115.26 125.41 1xva n ASN 210 Ca -0.18 0.00 0.10 0.00 0.87 0.00 0.00 54.58 55.36 1xva n ASN 210 Cb 0.52 0.00 0.50 0.00 -1.02 0.00 0.00 39.78 39.77 1xva n ASN 210 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1xva n ASN 211 N -2.45 0.46 -4.48 6.41 4.05 -1.26 -4.81 115.26 113.18 1xva n ASN 211 Ca 0.00 -1.51 -0.37 0.00 0.45 0.00 0.00 54.58 53.15 1xva n ASN 211 Cb 0.00 -0.03 -0.12 0.00 1.23 0.00 0.00 39.78 40.86 1xva n ASN 211 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 177.26 172.62 1xva s LYS 212 N -1.94 3.67 -0.16 1.20 -2.85 -0.17 -5.03 119.74 114.47 1xva s LYS 212 Ca 0.29 -0.48 -0.40 0.00 -1.00 0.00 0.00 55.97 54.38 1xva s LYS 212 Cb 0.14 -3.44 -0.17 0.00 -2.06 0.00 0.00 37.83 32.30 1xva s LYS 212 CO 0.23 -0.22 1.52 0.00 0.10 0.00 0.00 175.35 176.97 1xva n ALA 213 N 4.96 -1.00 -0.00 0.59 0.00 -1.26 -1.34 120.51 122.46 1xva n ALA 213 Ca -0.15 0.47 -0.00 0.00 0.00 0.00 0.00 53.44 53.76 1xva n ALA 213 Cb 0.51 -2.08 -0.00 0.00 0.00 0.00 0.00 19.45 17.88 1xva n ALA 213 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1xva n HIS 214 N 3.83 0.00 -3.57 0.00 -0.00 0.42 -4.80 115.22 111.10 1xva n HIS 214 Ca 0.24 0.00 -0.14 0.00 0.46 0.00 0.00 57.72 58.28 1xva n HIS 214 Cb 0.12 -0.01 -0.06 0.00 -0.12 0.00 0.00 29.99 29.92 1xva n HIS 214 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1xva s MET 215 N -2.01 0.83 -0.18 1.57 1.75 -1.19 -4.56 119.30 115.52 1xva s MET 215 Ca -0.00 0.44 -0.01 0.00 -1.25 0.00 0.00 55.69 54.87 1xva s MET 215 Cb 0.00 0.40 0.00 0.00 2.84 0.00 0.00 34.83 38.07 1xva s MET 215 CO 0.01 -0.21 -0.14 0.08 -0.65 0.00 0.00 175.02 174.11 1xva s VAL 216 N -0.64 2.67 -0.13 10.11 1.01 -0.23 -1.53 120.40 131.66 1xva s VAL 216 Ca -0.05 -0.75 -0.02 0.00 0.00 0.00 0.00 61.98 61.17 1xva s VAL 216 Cb -0.02 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 1xva s VAL 216 CO 0.04 0.50 -0.07 -0.89 0.00 0.00 0.00 175.10 174.67 1xva s THR 217 N 1.11 3.58 -0.14 3.92 2.01 0.53 -1.12 115.64 125.53 1xva s THR 217 Ca 0.00 -0.48 0.01 0.00 0.31 0.00 0.00 61.69 61.53 1xva s THR 217 Cb -0.14 -2.53 -0.00 0.00 0.01 0.00 0.00 72.50 69.84 1xva s THR 217 CO -0.04 0.53 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.48 1xva s LEU 218 N 0.09 2.43 -0.27 4.42 1.02 0.13 -0.42 118.68 126.08 1xva s LEU 218 Ca -0.02 -0.46 -0.14 0.00 0.02 0.00 0.00 54.13 53.52 1xva s LEU 218 Cb -0.14 -1.53 -0.04 0.00 0.02 0.00 0.00 46.19 44.50 1xva s LEU 218 CO 0.03 0.12 0.34 -1.81 0.02 0.00 0.00 176.35 175.05 1xva s ASP 219 N 0.59 6.21 -0.30 2.29 1.01 -0.94 -1.28 116.67 124.26 1xva s ASP 219 Ca -0.10 0.24 -0.08 0.00 0.71 0.00 0.00 52.55 53.33 1xva s ASP 219 Cb -0.16 -2.19 0.00 0.00 1.01 0.00 0.00 42.92 41.58 1xva s ASP 219 CO 0.03 -0.15 0.10 -0.31 0.21 0.00 0.00 175.17 175.05 1xva s TYR 220 N 1.96 3.15 -0.34 4.23 1.51 0.21 -2.37 117.35 125.69 1xva s TYR 220 Ca 0.14 -0.84 -0.15 0.00 -1.01 0.00 0.00 57.07 55.20 1xva s TYR 220 Cb -0.16 -2.28 -0.01 0.00 -0.11 0.00 0.00 41.96 39.40 1xva s TYR 220 CO 0.10 -0.53 0.37 0.99 -1.11 0.00 0.00 175.55 175.37 1xva s THR 221 N 1.54 5.16 -0.19 -0.71 2.01 -0.58 -1.15 115.64 121.71 1xva s THR 221 Ca 0.03 0.05 -0.06 0.00 0.31 0.00 0.00 61.69 62.03 1xva s THR 221 Cb -0.17 -3.84 -0.03 0.00 0.01 0.00 0.00 72.50 68.47 1xva s THR 221 CO 0.03 -0.11 0.03 -0.69 -0.69 0.00 0.00 174.62 173.20 1xva s VAL 222 N 2.04 4.36 -0.45 3.82 1.01 0.13 -0.95 120.40 130.36 1xva s VAL 222 Ca 0.12 -0.18 -0.28 0.00 0.00 0.00 0.00 61.98 61.64 1xva s VAL 222 Cb -0.16 -2.97 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1xva s VAL 222 CO 0.12 0.44 1.55 -1.58 0.00 0.00 0.00 175.10 175.63 1xva s GLN 223 N 0.72 3.35 -0.31 2.72 0.74 -0.86 -0.74 119.66 125.28 1xva s GLN 223 Ca 0.02 0.89 -0.15 0.00 0.05 0.00 0.00 55.36 56.16 1xva s GLN 223 Cb -0.14 -4.13 -0.02 0.00 1.10 0.00 0.00 33.01 29.82 1xva s GLN 223 CO 0.02 -1.86 0.39 0.54 -0.55 0.00 0.00 175.29 173.83 1xva s VAL 224 N 6.33 5.15 0.19 1.34 0.11 0.18 -4.55 120.40 129.14 1xva s VAL 224 Ca 0.64 0.33 -0.09 0.00 -2.93 0.00 0.00 61.98 59.93 1xva s VAL 224 Cb -0.15 -3.78 0.11 0.00 -1.53 0.00 0.00 36.38 31.03 1xva s VAL 224 CO 0.30 0.01 1.71 -0.65 -3.33 0.00 0.00 175.10 173.14 1xva h PRO 225 N 8.33 1.10 -0.70 1.54 0.11 -1.90 0.26 132.00 140.75 1xva h PRO 225 Ca -0.30 -0.26 -0.19 0.00 0.11 0.00 0.00 66.00 65.36 1xva h PRO 225 Cb 1.15 -0.15 -0.11 0.00 0.11 0.00 0.00 31.00 32.00 1xva h PRO 225 CO 0.68 0.97 0.23 0.41 -0.21 0.00 0.00 178.00 180.08 1xva n GLY 226 N -0.68 3.67 1.15 -0.55 0.00 -1.26 -2.50 105.19 105.02 1xva n GLY 226 Ca 0.05 -1.01 0.01 0.00 0.00 0.00 0.00 46.02 45.07 1xva n GLY 226 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xva n ALA 227 N -0.14 3.77 -2.89 4.61 0.00 -0.83 -4.81 120.51 120.23 1xva n ALA 227 Ca 0.39 -2.68 0.00 0.00 0.00 0.00 0.00 53.44 51.15 1xva n ALA 227 Cb 1.35 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1xva n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xva n GLY 228 N -0.77 4.94 0.00 0.00 0.00 0.14 -4.34 105.19 105.15 1xva n GLY 228 Ca 0.30 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1xva n GLY 228 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1xva n ARG 229 N 0.00 0.00 -1.51 1.61 3.00 -1.26 -4.49 116.66 114.01 1xva n ARG 229 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.48 1xva n ARG 229 Cb 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 32.46 32.40 1xva n ARG 229 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1xva n ASP 230 N 0.00 8.28 0.00 6.15 8.00 -1.26 -4.38 116.55 133.33 1xva n ASP 230 Ca 0.00 -2.76 0.00 0.00 0.71 0.00 0.00 54.79 52.74 1xva n ASP 230 Cb 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 41.12 39.62 1xva n ASP 230 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xva n GLY 231 N 2.85 1.00 3.77 0.44 0.00 -1.26 -5.05 105.19 106.94 1xva n GLY 231 Ca 0.71 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.40 1xva n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xva s ALA 232 N -2.66 2.42 0.53 4.61 0.00 -1.26 -4.60 121.76 120.80 1xva s ALA 232 Ca 0.00 0.48 -0.12 0.00 0.00 0.00 0.00 51.96 52.32 1xva s ALA 232 Cb 0.00 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.76 1xva s ALA 232 CO 0.00 -1.40 0.94 -1.25 0.00 0.00 0.00 175.76 174.05 1xva s PRO 233 N -4.30 3.74 0.52 0.00 0.04 -1.04 0.23 135.00 134.19 1xva s PRO 233 Ca 0.66 0.69 0.09 0.00 0.04 0.00 0.00 61.00 62.47 1xva s PRO 233 Cb -0.20 -2.19 0.05 0.00 0.04 0.00 0.00 34.50 32.20 1xva s PRO 233 CO 0.45 -0.33 0.67 0.20 0.04 0.00 0.00 177.00 178.03 1xva s GLY 234 N -3.63 1.87 -0.03 0.56 0.00 0.91 -4.39 107.32 102.61 1xva s GLY 234 Ca 0.55 -1.92 0.02 0.00 0.00 0.00 0.00 44.72 43.37 1xva s GLY 234 CO 0.41 -1.65 -0.09 -1.36 0.00 0.00 0.00 173.10 170.41 1xva s PHE 235 N -2.57 0.99 0.32 1.90 0.40 -1.26 0.47 117.98 118.22 1xva s PHE 235 Ca 0.57 -0.25 0.03 0.00 -0.60 0.00 0.00 56.93 56.67 1xva s PHE 235 Cb -0.06 -0.70 -0.02 0.00 0.51 0.00 0.00 43.02 42.74 1xva s PHE 235 CO 0.35 -0.11 0.33 -1.12 0.70 0.00 0.00 175.22 175.38 1xva s SER 236 N 0.21 1.22 -0.02 1.36 0.01 0.08 -4.91 113.70 111.66 1xva s SER 236 Ca -0.04 -1.61 -0.06 0.00 1.31 0.00 0.00 55.95 55.55 1xva s SER 236 Cb -0.09 0.58 0.00 0.00 0.21 0.00 0.00 66.02 66.72 1xva s SER 236 CO 0.01 -1.12 0.13 -0.75 0.41 0.00 0.00 173.24 171.91 1xva s LYS 237 N -3.40 0.36 0.27 12.44 2.20 -1.26 0.21 119.74 130.56 1xva s LYS 237 Ca 0.37 -0.18 -0.07 0.00 -0.36 0.00 0.00 55.97 55.72 1xva s LYS 237 Cb 0.02 0.15 -0.01 0.00 -1.51 0.00 0.00 37.83 36.48 1xva s LYS 237 CO 0.23 -0.08 0.40 -0.59 -0.36 0.00 0.00 175.35 174.96 1xva s PHE 238 N -0.84 0.75 0.05 4.03 -0.71 -0.30 -4.35 117.98 116.61 1xva s PHE 238 Ca -0.09 -1.04 0.03 0.00 -1.04 0.00 0.00 56.93 54.79 1xva s PHE 238 Cb -0.05 -0.05 -0.02 0.00 -1.21 0.00 0.00 43.02 41.68 1xva s PHE 238 CO 0.01 -0.96 -0.10 0.50 -1.34 0.00 0.00 175.22 173.33 1xva s ARG 239 N -3.74 0.63 0.01 1.99 3.52 -1.26 -0.62 118.95 119.47 1xva s ARG 239 Ca 0.28 -0.80 -0.16 0.00 -0.13 0.00 0.00 55.73 54.93 1xva s ARG 239 Cb 0.01 -0.48 0.03 0.00 -1.56 0.00 0.00 34.95 32.95 1xva s ARG 239 CO 0.13 0.10 0.34 -1.17 -0.81 0.00 0.00 175.30 173.89 1xva s LEU 240 N -1.57 0.72 0.25 -0.88 2.96 -0.40 -4.99 118.68 114.76 1xva s LEU 240 Ca -0.07 0.01 0.07 0.00 -0.22 0.00 0.00 54.13 53.92 1xva s LEU 240 Cb -0.10 1.43 -0.05 0.00 0.50 0.00 0.00 46.19 47.97 1xva s LEU 240 CO 0.01 -0.54 -0.09 -0.44 -1.32 0.00 0.00 176.35 173.96 1xva s SER 241 N -1.67 2.68 0.11 3.68 0.01 -1.26 -0.69 113.70 116.56 1xva s SER 241 Ca -0.09 -1.13 -0.15 0.00 1.31 0.00 0.00 55.95 55.89 1xva s SER 241 Cb -0.03 -0.15 0.03 0.00 0.21 0.00 0.00 66.02 66.08 1xva s SER 241 CO 0.01 -0.28 0.36 -0.31 0.41 0.00 0.00 173.24 173.43 1xva s TYR 242 N -3.00 -0.14 -0.22 2.43 1.51 -0.28 -4.62 117.35 113.03 1xva s TYR 242 Ca 0.27 -0.17 -0.21 0.00 -1.01 0.00 0.00 57.07 55.95 1xva s TYR 242 Cb 0.02 0.18 -0.02 0.00 -0.11 0.00 0.00 41.96 42.03 1xva s TYR 242 CO 0.10 -0.65 0.67 -0.47 -1.11 0.00 0.00 175.55 174.10 1xva s TYR 243 N -3.62 3.33 -1.17 2.71 5.04 0.02 -1.06 117.35 122.60 1xva s TYR 243 Ca 0.02 0.94 -0.22 0.00 -2.44 0.00 0.00 57.07 55.38 1xva s TYR 243 Cb 0.02 -2.87 -0.03 0.00 0.35 0.00 0.00 41.96 39.43 1xva s TYR 243 CO -0.10 -0.27 1.85 -1.25 -1.34 0.00 0.00 175.55 174.44 1xva s PRO 244 N 2.28 2.98 -0.33 4.97 0.04 -1.26 -4.86 135.00 138.82 1xva s PRO 244 Ca 0.29 -1.28 -0.29 0.00 0.04 0.00 0.00 61.00 59.76 1xva s PRO 244 Cb -0.16 -5.31 0.00 0.00 0.04 0.00 0.00 34.50 29.07 1xva s PRO 244 CO 0.09 -3.32 1.40 -1.01 0.04 0.00 0.00 177.00 174.20 1xva s HIS 245 N 8.66 2.47 0.41 0.56 3.76 -1.26 -4.96 115.29 124.93 1xva s HIS 245 Ca 0.63 0.74 -0.22 0.00 -0.15 0.00 0.00 55.06 56.07 1xva s HIS 245 Cb -0.00 -4.08 -0.11 0.00 1.11 0.00 0.00 32.58 29.50 1xva s HIS 245 CO 0.09 -2.02 0.94 0.00 -0.85 0.00 0.00 174.74 172.90 1xva h LEU 247 N 2.12 0.66 -0.78 0.00 5.85 -1.94 -1.15 115.31 120.07 1xva h LEU 247 Ca -0.49 -0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.04 1xva h LEU 247 Cb 1.18 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 1xva h LEU 247 CO 0.62 0.55 -0.28 0.00 -0.34 0.00 0.00 178.44 178.98 1xva h ALA 248 N 1.14 0.95 -0.41 1.25 0.00 -1.99 0.44 119.26 120.64 1xva h ALA 248 Ca 0.19 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.64 1xva h ALA 248 Cb 0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1xva h ALA 248 CO -0.03 0.61 -0.04 0.66 0.00 0.00 0.00 179.25 180.44 1xva h SER 249 N 0.53 0.75 -0.27 0.00 4.64 -1.89 -2.56 113.55 114.75 1xva h SER 249 Ca 0.07 -0.33 -0.03 0.00 -0.47 0.00 0.00 61.79 61.02 1xva h SER 249 Cb 0.76 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.63 1xva h SER 249 CO 0.06 0.91 0.05 0.15 -0.87 0.00 0.00 176.83 177.13 1xva h PHE 250 N 0.58 0.47 -0.93 4.77 3.57 -1.04 0.10 116.94 124.46 1xva h PHE 250 Ca 0.11 -0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.64 1xva h PHE 250 Cb 0.55 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.08 1xva h PHE 250 CO 0.04 0.54 0.58 1.15 -2.23 0.00 0.00 178.31 178.39 1xva h THR 251 N 0.27 0.97 0.54 4.41 2.02 -0.82 0.11 112.91 120.41 1xva h THR 251 Ca 0.08 -0.34 -0.03 0.00 0.77 0.00 0.00 66.41 66.90 1xva h THR 251 Cb 0.31 -0.09 0.01 0.00 -1.74 0.00 0.00 68.15 66.64 1xva h THR 251 CO 0.00 0.18 -0.26 -0.08 0.37 0.00 0.00 175.52 175.73 1xva h GLU 252 N 0.98 -0.70 -0.49 6.66 4.81 -0.86 -2.12 114.58 122.86 1xva h GLU 252 Ca 0.44 0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.81 1xva h GLU 252 Cb 0.33 0.16 -0.10 0.00 0.63 0.00 0.00 28.75 29.77 1xva h GLU 252 CO -0.23 -0.42 -0.22 1.25 -0.73 0.00 0.00 179.01 178.67 1xva h LEU 253 N -0.84 -0.76 -0.89 1.64 5.85 -0.50 -0.11 115.31 119.70 1xva h LEU 253 Ca -0.07 0.18 -0.11 0.00 0.84 0.00 0.00 57.88 58.71 1xva h LEU 253 Cb 0.60 0.41 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 1xva h LEU 253 CO 0.12 -0.24 -0.38 1.62 -0.34 0.00 0.00 178.44 179.22 1xva h VAL 254 N -0.11 1.30 0.00 1.05 3.04 -0.72 -2.17 116.25 118.64 1xva h VAL 254 Ca 0.23 -1.48 -0.17 0.00 -1.01 0.00 0.00 66.70 64.27 1xva h VAL 254 Cb 0.47 1.59 -0.02 0.00 -2.01 0.00 0.00 31.29 31.31 1xva h VAL 254 CO -0.56 0.45 -0.81 1.56 -1.01 0.00 0.00 177.57 177.20 1xva h GLN 255 N 0.30 0.00 -0.00 4.17 4.20 -0.82 -2.86 115.11 120.10 1xva h GLN 255 Ca 0.03 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1xva h GLN 255 Cb 0.80 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.58 1xva h GLN 255 CO 0.06 0.80 -0.13 1.49 -0.67 0.00 0.00 178.83 180.39 1xva h GLU 256 N 0.00 0.00 -0.02 1.46 4.81 -0.71 -0.29 114.58 119.83 1xva h GLU 256 Ca -0.01 -0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 1xva h GLU 256 Cb 1.62 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.99 1xva h GLU 256 CO 0.10 0.13 -0.38 0.00 -0.73 0.00 0.00 179.01 178.13 1xva h ALA 257 N 1.87 1.32 -0.01 2.92 0.00 -1.16 -1.36 119.26 122.85 1xva h ALA 257 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1xva h ALA 257 Cb 0.23 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1xva h ALA 257 CO 0.02 0.50 -0.04 1.19 0.00 0.00 0.00 179.25 180.92 1xva n PHE 258 N -4.07 0.00 -1.25 0.00 3.72 -1.06 -4.70 117.46 110.10 1xva n PHE 258 Ca -0.02 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.30 1xva n PHE 258 Cb 0.43 -0.07 -0.04 0.00 -0.94 0.00 0.00 39.48 38.86 1xva n PHE 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xva n GLY 259 N 1.15 0.92 1.64 1.37 0.00 -0.51 -2.05 105.19 107.71 1xva n GLY 259 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1xva n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xva n GLY 260 N -0.62 1.45 2.82 -0.02 0.00 -0.15 -4.96 105.19 103.72 1xva n GLY 260 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1xva n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xva n ARG 261 N -2.00 3.38 -3.65 1.61 1.74 -0.87 -4.90 116.66 111.96 1xva n ARG 261 Ca 0.00 -3.23 -0.14 0.00 -0.77 0.00 0.00 57.85 53.71 1xva n ARG 261 Cb 0.00 -3.04 -0.07 0.00 -1.02 0.00 0.00 32.46 28.33 1xva n ARG 261 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xva s GLN 263 N -1.79 3.82 -0.04 0.00 -0.21 -0.60 -4.83 119.66 116.02 1xva s GLN 263 Ca -0.09 0.37 -0.01 0.00 0.02 0.00 0.00 55.36 55.64 1xva s GLN 263 Cb -0.02 -2.55 0.03 0.00 1.00 0.00 0.00 33.01 31.48 1xva s GLN 263 CO 0.03 0.20 0.08 -1.58 -2.12 0.00 0.00 175.29 171.90 1xva s HIS 264 N -1.99 -0.04 0.03 0.91 5.65 -1.26 -1.10 115.29 117.49 1xva s HIS 264 Ca 0.49 0.29 0.03 0.00 0.25 0.00 0.00 55.06 56.12 1xva s HIS 264 Cb -0.11 -0.23 -0.02 0.00 -1.18 0.00 0.00 32.58 31.04 1xva s HIS 264 CO 0.23 -0.14 -0.10 -1.12 -0.65 0.00 0.00 174.74 172.96 1xva s SER 265 N 1.36 1.15 -0.06 9.88 0.01 -0.40 -5.00 113.70 120.64 1xva s SER 265 Ca -0.06 -0.42 0.01 0.00 1.31 0.00 0.00 55.95 56.79 1xva s SER 265 Cb -0.12 -0.05 0.02 0.00 0.21 0.00 0.00 66.02 66.08 1xva s SER 265 CO -0.04 -0.05 -0.05 0.54 0.41 0.00 0.00 173.24 174.05 1xva s VAL 266 N -0.89 0.65 0.37 3.43 0.11 -1.26 -0.87 120.40 121.93 1xva s VAL 266 Ca -0.03 -0.14 0.06 0.00 -2.93 0.00 0.00 61.98 58.95 1xva s VAL 266 Cb -0.07 -0.68 -0.00 0.00 -1.53 0.00 0.00 36.38 34.09 1xva s VAL 266 CO 0.01 0.27 0.52 -0.76 -3.33 0.00 0.00 175.10 171.80 1xva s LEU 267 N 1.20 3.85 0.00 2.54 1.02 0.35 -3.15 118.68 124.49 1xva s LEU 267 Ca -0.06 -0.22 0.00 0.00 0.02 0.00 0.00 54.13 53.87 1xva s LEU 267 Cb -0.14 -2.75 0.00 0.00 0.02 0.00 0.00 46.19 43.32 1xva s LEU 267 CO -0.02 -0.55 0.00 0.61 0.02 0.00 0.00 176.35 176.41 1xva n GLY 268 N -1.74 0.68 0.00 -3.19 0.00 0.22 -2.24 105.19 98.92 1xva n GLY 268 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1xva n GLY 268 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xva n ASP 269 N 0.00 0.00 -0.78 1.61 8.00 -1.26 -4.34 116.55 119.78 1xva n ASP 269 Ca 0.00 0.00 0.09 0.00 0.71 0.00 0.00 54.79 55.59 1xva n ASP 269 Cb 0.00 0.00 0.25 0.00 -0.02 0.00 0.00 41.12 41.35 1xva n ASP 269 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1xva n PHE 270 N 0.00 0.47 -4.14 1.24 3.72 -1.26 -4.76 117.46 112.73 1xva n PHE 270 Ca 0.00 -0.24 -0.23 0.00 -0.05 0.00 0.00 57.45 56.94 1xva n PHE 270 Cb 0.00 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 1xva n PHE 270 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 176.76 175.12 1xva s LYS 271 N -1.53 2.47 0.92 -1.08 0.00 -1.26 -5.00 119.74 114.26 1xva s LYS 271 Ca 0.32 -1.40 -0.12 0.00 0.00 0.00 0.00 55.97 54.77 1xva s LYS 271 Cb 0.17 -2.26 0.08 0.00 0.00 0.00 0.00 37.83 35.82 1xva s LYS 271 CO 0.23 0.24 0.79 -0.35 0.00 0.00 0.00 175.35 176.26 1xva n PRO 272 N -1.09 -0.30 -4.09 1.78 -0.04 -1.26 0.72 135.00 130.72 1xva n PRO 272 Ca -0.05 -0.03 -0.32 0.00 -0.04 0.00 0.00 63.50 63.06 1xva n PRO 272 Cb 0.60 -2.12 -0.16 0.00 -0.04 0.00 0.00 33.50 31.78 1xva n PRO 272 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1xva s TYR 273 N -2.45 2.76 -0.27 0.54 5.04 -1.19 -4.22 117.35 117.56 1xva s TYR 273 Ca 0.63 -1.71 -0.05 0.00 -2.44 0.00 0.00 57.07 53.50 1xva s TYR 273 Cb -0.23 -1.86 0.01 0.00 0.35 0.00 0.00 41.96 40.23 1xva s TYR 273 CO 0.62 -0.80 0.02 1.03 -1.34 0.00 0.00 175.55 175.08 1xva s ARG 274 N 1.29 3.09 0.06 4.97 3.00 -1.26 -4.93 118.95 125.17 1xva s ARG 274 Ca 0.02 -0.84 -0.30 0.00 0.00 0.00 0.00 55.73 54.61 1xva s ARG 274 Cb -0.14 -3.22 -0.09 0.00 0.00 0.00 0.00 34.95 31.50 1xva s ARG 274 CO -0.11 -0.39 1.88 -1.25 0.00 0.00 0.00 175.30 175.44 1xva s PRO 275 N 1.45 4.15 0.00 3.54 0.04 -1.26 -0.89 135.00 142.03 1xva s PRO 275 Ca 0.02 2.57 0.00 0.00 0.04 0.00 0.00 61.00 63.63 1xva s PRO 275 Cb -0.17 -3.92 0.00 0.00 0.04 0.00 0.00 34.50 30.45 1xva s PRO 275 CO -0.00 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.55 1xva n GLY 276 N 4.38 0.78 3.67 0.56 0.00 -1.26 -5.08 105.19 108.24 1xva n GLY 276 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1xva n GLY 276 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1xva s GLN 277 N -0.75 0.97 0.04 1.61 -2.07 -0.07 -4.98 119.66 114.40 1xva s GLN 277 Ca 0.00 1.52 -0.26 0.00 -1.82 0.00 0.00 55.36 54.80 1xva s GLN 277 Cb 0.00 -1.72 -0.17 0.00 -1.09 0.00 0.00 33.01 30.02 1xva s GLN 277 CO 0.00 -2.66 1.43 0.00 -1.32 0.00 0.00 175.29 172.75 1xva h ALA 278 N -1.89 -0.33 -2.30 2.60 0.00 -1.98 -3.44 119.26 111.92 1xva h ALA 278 Ca -0.44 -0.15 -0.54 0.00 0.00 0.00 0.00 54.91 53.78 1xva h ALA 278 Cb 1.27 0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.20 1xva h ALA 278 CO 0.42 -0.58 1.23 -0.47 0.00 0.00 0.00 179.25 179.85 1xva s TYR 279 N -5.23 1.41 -0.38 0.00 5.04 -1.26 -4.95 117.35 111.98 1xva s TYR 279 Ca -0.15 -0.23 -0.20 0.00 -2.44 0.00 0.00 57.07 54.06 1xva s TYR 279 Cb 0.03 -4.15 0.01 0.00 0.35 0.00 0.00 41.96 38.20 1xva s TYR 279 CO 0.60 -5.07 0.59 0.14 -1.34 0.00 0.00 175.55 170.47 1xva s VAL 280 N 4.76 4.92 0.62 3.14 -7.23 -1.26 -5.04 120.40 120.31 1xva s VAL 280 Ca 0.86 0.34 -0.16 0.00 -1.81 0.00 0.00 61.98 61.22 1xva s VAL 280 Cb -0.40 -4.07 -0.02 0.00 0.56 0.00 0.00 36.38 32.45 1xva s VAL 280 CO 0.39 -0.36 1.10 -2.84 -0.31 0.00 0.00 175.10 173.07 1xva s PRO 281 N 2.61 3.02 0.18 4.82 0.02 -1.26 -4.97 135.00 139.42 1xva s PRO 281 Ca 0.22 1.38 0.10 0.00 0.02 0.00 0.00 61.00 62.71 1xva s PRO 281 Cb -0.15 -1.98 -0.06 0.00 0.02 0.00 0.00 34.50 32.33 1xva s PRO 281 CO 0.15 -1.08 1.36 0.00 -0.33 0.00 0.00 177.00 177.11 1xva s TYR 283 N -2.88 -0.00 -0.18 0.00 1.51 -1.26 -0.81 117.35 113.73 1xva s TYR 283 Ca 0.02 0.02 -0.05 0.00 -1.01 0.00 0.00 57.07 56.05 1xva s TYR 283 Cb 0.10 -0.01 -0.03 0.00 -0.11 0.00 0.00 41.96 41.91 1xva s TYR 283 CO 0.79 -0.04 0.00 -0.06 -1.11 0.00 0.00 175.55 175.13 1xva s PHE 284 N -0.17 3.08 -0.15 2.71 0.08 0.14 -4.31 117.98 119.36 1xva s PHE 284 Ca -0.02 -0.28 -0.06 0.00 0.12 0.00 0.00 56.93 56.68 1xva s PHE 284 Cb -0.01 -2.05 -0.04 0.00 -0.57 0.00 0.00 43.02 40.35 1xva s PHE 284 CO -0.00 -0.09 0.07 0.42 -0.10 0.00 0.00 175.22 175.52 1xva s ILE 285 N 0.67 4.89 -0.14 0.64 1.01 -0.95 -1.87 121.20 125.44 1xva s ILE 285 Ca -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 60.65 60.61 1xva s ILE 285 Cb -0.14 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 1xva s ILE 285 CO 0.02 0.53 -0.05 -1.00 0.00 0.00 0.00 174.94 174.44 1xva s HIS 286 N -0.22 3.00 -0.15 3.97 3.76 -0.00 -0.49 115.29 125.15 1xva s HIS 286 Ca 0.08 -0.28 0.02 0.00 -0.15 0.00 0.00 55.06 54.73 1xva s HIS 286 Cb -0.12 -1.92 0.01 0.00 1.11 0.00 0.00 32.58 31.66 1xva s HIS 286 CO 0.01 0.00 -0.21 0.54 -0.85 0.00 0.00 174.74 174.24 1xva s VAL 287 N 0.21 2.00 -0.05 -0.90 0.11 -0.05 -2.28 120.40 119.43 1xva s VAL 287 Ca -0.03 -0.93 0.06 0.00 -2.93 0.00 0.00 61.98 58.15 1xva s VAL 287 Cb -0.14 -1.78 -0.01 0.00 -1.53 0.00 0.00 36.38 32.91 1xva s VAL 287 CO 0.03 0.54 -0.24 -0.76 -3.33 0.00 0.00 175.10 171.34 1xva s LEU 288 N 1.00 2.16 -0.12 2.54 2.01 -0.60 -1.27 118.68 124.40 1xva s LEU 288 Ca -0.03 -0.46 -0.01 0.00 0.01 0.00 0.00 54.13 53.63 1xva s LEU 288 Cb -0.15 -1.40 -0.03 0.00 0.01 0.00 0.00 46.19 44.63 1xva s LEU 288 CO -0.06 0.26 -0.07 -0.75 1.01 0.00 0.00 176.35 176.75 1xva s LYS 289 N -0.27 3.26 -0.24 1.70 2.20 -0.26 -1.15 119.74 124.98 1xva s LYS 289 Ca -0.00 -0.56 -0.29 0.00 -0.36 0.00 0.00 55.97 54.76 1xva s LYS 289 Cb -0.13 -2.74 -0.01 0.00 -1.51 0.00 0.00 37.83 33.45 1xva s LYS 289 CO 0.03 0.41 1.29 0.21 -0.36 0.00 0.00 175.35 176.93 1xva s LYS 290 N -0.11 4.04 -0.82 4.03 2.20 -0.60 -1.55 119.74 126.92 1xva s LYS 290 Ca 0.01 1.43 0.01 0.00 -0.36 0.00 0.00 55.97 57.06 1xva s LYS 290 Cb -0.13 -3.84 0.26 0.00 -1.51 0.00 0.00 37.83 32.61 1xva s LYS 290 CO 0.03 -0.96 0.95 0.25 -0.36 0.00 0.00 175.35 175.26 1xva n THR 291 N 5.88 3.31 0.00 3.43 -2.24 -1.09 -0.92 114.28 122.65 1xva n THR 291 Ca 0.15 -5.38 0.00 0.00 -2.27 0.00 0.00 64.05 56.54 1xva n THR 291 Cb 0.46 -2.16 0.00 0.00 -2.10 0.00 0.00 70.33 66.53 1xva n THR 291 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11