#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pvj s SER 7 N 0.00 3.82 0.03 7.83 0.15 -1.26 -5.13 113.70 119.14 2pvj s SER 7 Ca 0.00 -0.44 -0.07 0.00 0.70 0.00 0.00 55.95 56.14 2pvj s SER 7 Cb 0.00 -0.60 -0.00 0.00 -1.71 0.00 0.00 66.02 63.70 2pvj s SER 7 CO 0.00 0.24 0.13 -1.59 1.20 0.00 0.00 173.24 173.23 2pvj s LYS 8 N -1.55 0.61 0.49 5.44 -2.85 -1.26 -4.29 119.74 116.33 2pvj s LYS 8 Ca 0.15 -0.67 -0.24 0.00 -1.00 0.00 0.00 55.97 54.22 2pvj s LYS 8 Cb -0.10 0.24 -0.07 0.00 -2.06 0.00 0.00 37.83 35.84 2pvj s LYS 8 CO 0.06 -0.16 1.36 0.00 0.10 0.00 0.00 175.35 176.71 2pvj s ALA 9 N -2.44 3.03 -0.78 0.59 0.00 -1.26 -4.92 121.76 115.98 2pvj s ALA 9 Ca -0.06 1.33 0.26 0.00 0.00 0.00 0.00 51.96 53.49 2pvj s ALA 9 Cb -0.02 -3.55 0.64 0.00 0.00 0.00 0.00 23.12 20.19 2pvj s ALA 9 CO -0.04 -1.19 1.56 0.54 0.00 0.00 0.00 175.76 176.63 2pvj n ARG 10 N -0.57 0.19 -4.06 0.00 1.74 -1.26 -4.62 116.66 108.08 2pvj n ARG 10 Ca 0.08 0.10 -0.08 0.00 -0.77 0.00 0.00 57.85 57.17 2pvj n ARG 10 Cb 0.44 -1.66 -0.10 0.00 -1.02 0.00 0.00 32.46 30.12 2pvj n ARG 10 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2pvj s VAL 11 N -3.09 0.24 -1.22 1.55 -7.23 -1.26 -4.88 120.40 104.50 2pvj s VAL 11 Ca 0.09 -1.51 0.00 0.00 -1.81 0.00 0.00 61.98 58.75 2pvj s VAL 11 Cb 0.15 -1.11 0.00 0.00 0.56 0.00 0.00 36.38 35.98 2pvj s VAL 11 CO 0.65 -0.81 0.00 -1.22 -0.31 0.00 0.00 175.10 173.41 2pvj n TYR 12 N 0.61 -0.97 -0.06 2.82 4.01 -1.26 -4.85 117.16 117.46 2pvj n TYR 12 Ca -0.17 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.55 2pvj n TYR 12 Cb 0.59 -2.73 0.24 0.00 -0.31 0.00 0.00 39.34 37.13 2pvj n TYR 12 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2pvj h ALA 13 N 0.90 1.28 -0.60 -0.72 0.00 -1.90 -3.17 119.26 115.06 2pvj h ALA 13 Ca -0.29 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2pvj h ALA 13 Cb 1.07 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2pvj h ALA 13 CO 0.37 0.49 0.00 -0.40 0.00 0.00 0.00 179.25 179.72 2pvj n ASP 14 N -4.27 5.04 -0.08 0.00 3.85 -1.26 -4.37 116.55 115.46 2pvj n ASP 14 Ca 0.03 -2.64 -0.07 0.00 -0.71 0.00 0.00 54.79 51.39 2pvj n ASP 14 Cb 0.24 -0.61 -0.00 0.00 -1.35 0.00 0.00 41.12 39.40 2pvj n ASP 14 CO 0.00 0.00 0.00 0.58 -1.01 0.00 0.00 177.20 176.77 2pvj h VAL 15 N 3.89 0.85 0.00 2.12 2.07 -1.89 -1.62 116.25 121.67 2pvj h VAL 15 Ca 0.00 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.47 2pvj h VAL 15 Cb 1.63 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 2pvj h VAL 15 CO 0.32 0.03 -0.00 0.78 0.02 0.00 0.00 177.57 178.72 2pvj h ASN 16 N 0.16 0.00 -0.11 0.57 2.35 -1.82 -2.80 115.58 113.93 2pvj h ASN 16 Ca 0.14 -0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.69 2pvj h ASN 16 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 2pvj h ASN 16 CO -0.19 0.00 -0.65 0.58 -1.65 0.00 0.00 177.43 175.52 2pvj h VAL 17 N 0.00 1.30 0.00 2.81 2.07 -1.68 -3.26 116.25 117.48 2pvj h VAL 17 Ca 0.00 -1.88 -0.11 0.00 0.82 0.00 0.00 66.70 65.52 2pvj h VAL 17 Cb 0.81 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.40 2pvj h VAL 17 CO 0.00 0.60 -0.73 -0.07 0.02 0.00 0.00 177.57 177.39 2pvj h LEU 18 N 0.53 0.00-10.24 2.57 3.38 -1.30 -3.46 115.31 106.78 2pvj h LEU 18 Ca -0.02 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.46 2pvj h LEU 18 Cb 1.26 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.03 2pvj h LEU 18 CO 0.13 0.49 0.23 -0.13 0.09 0.00 0.00 178.44 179.25 2pvj s ARG 19 N -2.97 3.71 0.89 1.13 0.52 -1.06 -5.07 118.95 116.10 2pvj s ARG 19 Ca 0.02 0.54 -0.13 0.00 -0.52 0.00 0.00 55.73 55.65 2pvj s ARG 19 Cb 0.08 -2.27 0.13 0.00 0.52 0.00 0.00 34.95 33.40 2pvj s ARG 19 CO 0.76 -0.24 1.16 -1.25 0.02 0.00 0.00 175.30 175.75 2pvj s PRO 20 N -4.41 1.29 0.57 3.54 0.04 -1.26 -4.93 135.00 129.83 2pvj s PRO 20 Ca 0.52 0.20 0.27 0.00 0.04 0.00 0.00 61.00 62.04 2pvj s PRO 20 Cb -0.10 -1.86 1.68 0.00 0.04 0.00 0.00 34.50 34.25 2pvj s PRO 20 CO 0.40 -2.08 2.21 1.57 0.04 0.00 0.00 177.00 179.14 2pvj h LYS 21 N -1.41 0.00 0.00 4.56 2.10 -1.97 -1.23 116.57 118.61 2pvj h LYS 21 Ca -0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 2pvj h LYS 21 Cb 1.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.66 2pvj h LYS 21 CO 0.61 0.03 0.00 1.05 -2.00 0.00 0.00 179.45 179.14 2pvj h GLU 22 N 0.00 0.00 0.00 0.07 9.09 -1.92 -0.79 114.58 121.03 2pvj h GLU 22 Ca -0.00 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.24 2pvj h GLU 22 Cb 0.06 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.14 2pvj h GLU 22 CO 0.00 0.00 -1.03 -0.92 0.05 0.00 0.00 179.01 177.12 2pvj h TYR 23 N 0.00 0.00 -0.00 2.06 3.20 -1.58 -3.43 116.97 117.22 2pvj h TYR 23 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2pvj h TYR 23 Cb 0.10 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.37 2pvj h TYR 23 CO 0.00 1.13 -0.85 -2.67 -1.64 0.00 0.00 178.16 174.14 2pvj n TRP 24 N -4.49 0.00 -1.91 -3.82 4.27 -1.20 -4.69 117.44 105.61 2pvj n TRP 24 Ca -0.25 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 52.94 2pvj n TRP 24 Cb 0.57 0.00 -0.00 0.00 -1.36 0.00 0.00 31.31 30.52 2pvj n TRP 24 CO 0.00 0.00 0.00 -3.47 -2.29 0.00 0.00 177.69 171.93 2pvj n ASP 25 N -1.31 4.74 0.28 -0.67 2.03 -0.31 -4.75 116.55 116.55 2pvj n ASP 25 Ca 0.04 -2.92 0.12 0.00 0.52 0.00 0.00 54.79 52.54 2pvj n ASP 25 Cb 0.31 -1.58 0.78 0.00 -0.72 0.00 0.00 41.12 39.90 2pvj n ASP 25 CO 0.00 0.00 0.00 0.10 -1.92 0.00 0.00 177.20 175.38 2pvj h TYR 26 N 5.80 0.00 0.00 -0.67 -0.00 -1.84 -1.88 116.97 118.38 2pvj h TYR 26 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.27 2pvj h TYR 26 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.33 2pvj h TYR 26 CO 1.42 0.02 0.00 0.93 -0.00 0.00 0.00 178.16 180.53 2pvj h GLU 27 N 0.00 0.00 -0.00 0.10 5.08 -1.90 -2.07 114.58 115.79 2pvj h GLU 27 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2pvj h GLU 27 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2pvj h GLU 27 CO 0.00 0.00 -0.10 0.00 -1.00 0.00 0.00 179.01 177.91 2pvj n ALA 28 N -1.96 2.63 -1.78 3.43 0.00 -0.71 -4.90 120.51 117.24 2pvj n ALA 28 Ca 0.00 -0.18 -0.41 0.00 0.00 0.00 0.00 53.44 52.85 2pvj n ALA 28 Cb 0.21 -1.39 -0.00 0.00 0.00 0.00 0.00 19.45 18.26 2pvj n ALA 28 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2pvj s LEU 29 N -2.82 4.34 -0.31 0.00 2.96 -0.78 -5.00 118.68 117.07 2pvj s LEU 29 Ca 0.19 2.99 -0.03 0.00 -0.22 0.00 0.00 54.13 57.06 2pvj s LEU 29 Cb 0.19 -3.66 0.04 0.00 0.50 0.00 0.00 46.19 43.26 2pvj s LEU 29 CO 0.53 -0.83 0.03 -0.89 -1.32 0.00 0.00 176.35 173.88 2pvj s THR 30 N -1.07 3.27 0.12 3.68 2.01 -1.26 -5.08 115.64 117.31 2pvj s THR 30 Ca 0.53 -1.25 -0.31 0.00 0.31 0.00 0.00 61.69 60.97 2pvj s THR 30 Cb -0.46 -2.85 -0.08 0.00 0.01 0.00 0.00 72.50 69.12 2pvj s THR 30 CO 0.61 -0.10 1.48 -0.69 -0.69 0.00 0.00 174.62 175.23 2pvj s VAL 31 N 1.32 3.08 -0.41 3.82 1.01 -1.26 -4.98 120.40 122.97 2pvj s VAL 31 Ca -0.03 0.74 -0.13 0.00 0.00 0.00 0.00 61.98 62.55 2pvj s VAL 31 Cb -0.19 -3.47 0.04 0.00 0.00 0.00 0.00 36.38 32.75 2pvj s VAL 31 CO 0.00 0.05 0.29 -1.10 0.00 0.00 0.00 175.10 174.34 2pvj s GLN 32 N 1.38 2.89 0.25 2.72 -1.52 -1.26 -5.07 119.66 119.05 2pvj s GLN 32 Ca 0.67 -1.15 -0.30 0.00 -1.95 0.00 0.00 55.36 52.63 2pvj s GLN 32 Cb -0.39 -3.92 -0.09 0.00 -0.22 0.00 0.00 33.01 28.39 2pvj s GLN 32 CO 0.30 -0.81 0.99 -1.58 -0.25 0.00 0.00 175.29 173.94 2pvj s TRP 33 N 1.61 3.85 0.00 0.91 0.52 -1.26 -4.65 118.94 119.92 2pvj s TRP 33 Ca 0.04 1.84 0.00 0.00 0.02 0.00 0.00 56.10 58.00 2pvj s TRP 33 Cb -0.21 -3.08 0.00 0.00 -1.15 0.00 0.00 33.47 29.03 2pvj s TRP 33 CO 0.08 0.11 0.00 0.41 0.02 0.00 0.00 176.95 177.57 2pvj n GLY 34 N 1.44 1.13 3.39 0.98 0.00 0.93 -5.00 105.19 108.05 2pvj n GLY 34 Ca -0.01 -1.91 -0.36 0.00 0.00 0.00 0.00 46.02 43.73 2pvj n GLY 34 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2pvj s GLU 35 N 2.13 3.53 0.32 1.61 2.56 -1.26 -4.76 118.70 122.83 2pvj s GLU 35 Ca 0.00 -0.55 0.03 0.00 0.00 0.00 0.00 54.97 54.45 2pvj s GLU 35 Cb 0.00 -3.20 0.60 0.00 2.00 0.00 0.00 34.13 33.54 2pvj s GLU 35 CO 0.00 -0.20 1.91 1.96 -0.56 0.00 0.00 175.26 178.37 2pvj h GLN 36 N 8.19 0.91 0.00 4.30 4.20 -1.94 -1.94 115.11 128.83 2pvj h GLN 36 Ca -0.40 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.26 2pvj h GLN 36 Cb 1.17 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.74 2pvj h GLN 36 CO 0.59 0.60 0.00 -0.25 -0.67 0.00 0.00 178.83 179.10 2pvj n ASP 37 N -4.50 0.00 0.16 1.46 8.00 -1.26 -1.64 116.55 118.77 2pvj n ASP 37 Ca 0.14 0.45 0.13 0.00 0.71 0.00 0.00 54.79 56.21 2pvj n ASP 37 Cb 0.24 -0.46 0.34 0.00 -0.02 0.00 0.00 41.12 41.22 2pvj n ASP 37 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2pvj h ASP 38 N 0.00 0.00 -4.39 -2.24 3.32 -1.75 -3.45 116.42 107.91 2pvj h ASP 38 Ca 0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 2pvj h ASP 38 Cb 0.09 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 39.34 2pvj h ASP 38 CO 0.00 0.00 -0.85 -0.31 -1.72 0.00 0.00 179.24 176.36 2pvj s TYR 39 N -3.19 1.85 0.02 4.55 2.02 -0.65 -0.67 117.35 121.28 2pvj s TYR 39 Ca 0.08 -0.37 0.04 0.00 -0.37 0.00 0.00 57.07 56.45 2pvj s TYR 39 Cb 0.09 -1.20 -0.02 0.00 -0.40 0.00 0.00 41.96 40.44 2pvj s TYR 39 CO 0.60 -0.04 -0.11 -1.21 -1.57 0.00 0.00 175.55 173.22 2pvj s GLU 40 N -0.45 0.81 0.20 -0.62 2.02 -0.77 -4.97 118.70 114.92 2pvj s GLU 40 Ca 0.07 -0.62 -0.30 0.00 0.02 0.00 0.00 54.97 54.14 2pvj s GLU 40 Cb -0.08 -0.77 -0.08 0.00 0.10 0.00 0.00 34.13 33.30 2pvj s GLU 40 CO -0.01 0.19 1.13 0.08 0.02 0.00 0.00 175.26 176.68 2pvj s VAL 41 N -0.73 3.71 -0.17 2.63 1.01 -1.26 -1.51 120.40 124.08 2pvj s VAL 41 Ca 0.00 1.50 -0.03 0.00 0.00 0.00 0.00 61.98 63.46 2pvj s VAL 41 Cb -0.07 -3.96 -0.10 0.00 0.00 0.00 0.00 36.38 32.26 2pvj s VAL 41 CO 0.01 0.27 -0.18 0.52 0.00 0.00 0.00 175.10 175.72 2pvj n VAL 42 N 2.19 0.98 -3.59 2.92 0.31 0.50 -4.93 118.33 116.71 2pvj n VAL 42 Ca 0.02 -0.33 -0.10 0.00 -0.01 0.00 0.00 64.34 63.93 2pvj n VAL 42 Cb 0.45 -1.34 -0.05 0.00 -0.91 0.00 0.00 33.84 31.99 2pvj n VAL 42 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2pvj s ARG 43 N -2.33 0.56 0.15 5.55 1.70 -1.08 -4.98 118.95 118.51 2pvj s ARG 43 Ca -0.24 0.22 -0.30 0.00 -0.47 0.00 0.00 55.73 54.95 2pvj s ARG 43 Cb 0.07 0.26 -0.07 0.00 -0.57 0.00 0.00 34.95 34.65 2pvj s ARG 43 CO 0.36 -0.16 1.00 0.21 -1.08 0.00 0.00 175.30 175.64 2pvj s LYS 44 N -0.84 4.68 -0.00 3.89 2.20 -1.26 0.47 119.74 128.88 2pvj s LYS 44 Ca -0.00 1.54 0.01 0.00 -0.36 0.00 0.00 55.97 57.16 2pvj s LYS 44 Cb -0.01 -3.33 -0.01 0.00 -1.51 0.00 0.00 37.83 32.96 2pvj s LYS 44 CO -0.00 0.21 0.03 1.33 -0.36 0.00 0.00 175.35 176.55 2pvj n VAL 45 N 2.50 0.00 -3.71 4.02 0.24 0.26 -4.84 118.33 116.79 2pvj n VAL 45 Ca 0.02 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 62.03 2pvj n VAL 45 Cb 0.48 0.78 -0.00 0.00 -1.47 0.00 0.00 33.84 33.63 2pvj n VAL 45 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2pvj s GLY 46 N -1.50 -0.29 0.12 7.63 0.00 -0.86 -5.01 107.32 107.40 2pvj s GLY 46 Ca 0.00 0.40 -0.15 0.00 0.00 0.00 0.00 44.72 44.97 2pvj s GLY 46 CO 0.03 0.90 0.36 1.09 0.00 0.00 0.00 173.10 175.48 2pvj s ARG 47 N -2.56 1.03 0.29 2.90 1.04 -1.26 -0.15 118.95 120.24 2pvj s ARG 47 Ca 0.16 -0.76 -0.17 0.00 -1.04 0.00 0.00 55.73 53.92 2pvj s ARG 47 Cb 0.02 0.44 0.06 0.00 -2.04 0.00 0.00 34.95 33.44 2pvj s ARG 47 CO -0.01 -0.39 0.84 0.41 -0.04 0.00 0.00 175.30 176.11 2pvj n GLY 48 N -0.19 0.87 0.20 3.88 0.00 -0.14 -4.96 105.19 104.85 2pvj n GLY 48 Ca -0.16 -1.20 0.15 0.00 0.00 0.00 0.00 46.02 44.81 2pvj n GLY 48 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2pvj h LYS 49 N 0.00 0.00 0.00 1.61 2.10 -2.03 -3.24 116.57 115.01 2pvj h LYS 49 Ca -0.29 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.15 2pvj h LYS 49 Cb 1.15 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.44 2pvj h LYS 49 CO 0.38 0.00 -2.20 0.66 -2.00 0.00 0.00 179.45 176.28 2pvj n TYR 50 N -2.70 0.03 -3.66 0.07 4.01 -1.26 -4.87 117.16 108.78 2pvj n TYR 50 Ca 0.02 0.01 -0.03 0.00 -0.16 0.00 0.00 57.90 57.74 2pvj n TYR 50 Cb 0.30 -0.80 -0.01 0.00 -0.31 0.00 0.00 39.34 38.52 2pvj n TYR 50 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2pvj s SER 51 N -5.10 -0.18 -0.13 7.72 1.04 -1.22 -2.04 113.70 113.80 2pvj s SER 51 Ca -0.09 -0.23 -0.03 0.00 0.48 0.00 0.00 55.95 56.08 2pvj s SER 51 Cb 0.09 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 2pvj s SER 51 CO 0.86 -0.64 -0.02 -1.61 0.98 0.00 0.00 173.24 172.81 2pvj s GLU 52 N -2.97 3.39 -0.11 4.02 2.02 -0.67 -0.97 118.70 123.41 2pvj s GLU 52 Ca 0.11 -0.46 0.00 0.00 0.02 0.00 0.00 54.97 54.64 2pvj s GLU 52 Cb 0.00 -2.88 -0.02 0.00 0.10 0.00 0.00 34.13 31.34 2pvj s GLU 52 CO -0.02 0.44 -0.12 0.08 0.02 0.00 0.00 175.26 175.67 2pvj s VAL 53 N -0.17 3.21 0.09 2.63 1.01 0.79 -1.03 120.40 126.93 2pvj s VAL 53 Ca 0.04 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.45 2pvj s VAL 53 Cb -0.13 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 2pvj s VAL 53 CO 0.02 0.54 -0.13 -0.36 0.00 0.00 0.00 175.10 175.17 2pvj s PHE 54 N -0.01 1.22 0.04 5.22 0.40 -0.08 -0.57 117.98 124.20 2pvj s PHE 54 Ca -0.03 -0.51 -0.26 0.00 -0.60 0.00 0.00 56.93 55.53 2pvj s PHE 54 Cb -0.14 -0.67 -0.05 0.00 0.51 0.00 0.00 43.02 42.67 2pvj s PHE 54 CO 0.04 0.06 0.82 -2.00 0.70 0.00 0.00 175.22 174.84 2pvj s GLU 55 N -2.09 4.53 0.27 0.44 2.12 0.18 -0.97 118.70 123.17 2pvj s GLU 55 Ca 0.01 1.15 0.03 0.00 0.36 0.00 0.00 54.97 56.52 2pvj s GLU 55 Cb -0.08 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 30.91 2pvj s GLU 55 CO 0.02 0.20 0.10 0.41 -0.54 0.00 0.00 175.26 175.45 2pvj n GLY 56 N 2.51 3.54 3.08 -1.50 0.00 0.42 -0.37 105.19 112.87 2pvj n GLY 56 Ca -0.00 -2.05 -0.12 0.00 0.00 0.00 0.00 46.02 43.85 2pvj n GLY 56 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2pvj s ILE 57 N -2.55 0.02 -0.39 -0.61 2.07 -0.57 -1.66 121.20 117.51 2pvj s ILE 57 Ca 0.14 -0.14 -0.24 0.00 -1.41 0.00 0.00 60.65 58.99 2pvj s ILE 57 Cb 0.01 -0.31 0.02 0.00 0.13 0.00 0.00 42.46 42.30 2pvj s ILE 57 CO 0.10 -0.08 0.84 0.21 -1.91 0.00 0.00 174.94 174.10 2pvj s ASN 58 N -0.21 6.57 0.62 4.50 3.84 0.12 -1.84 114.94 128.54 2pvj s ASN 58 Ca -0.03 0.34 0.41 0.00 0.21 0.00 0.00 52.86 53.79 2pvj s ASN 58 Cb -0.03 -2.42 2.07 0.00 -0.55 0.00 0.00 41.25 40.33 2pvj s ASN 58 CO 0.01 -0.83 2.24 -0.37 -2.79 0.00 0.00 177.10 175.35 2pvj h VAL 59 N 5.84 0.00 0.12 -5.21 -1.51 -1.21 0.64 116.25 114.92 2pvj h VAL 59 Ca -0.24 -0.16 -0.01 0.00 -1.23 0.00 0.00 66.70 65.06 2pvj h VAL 59 Cb 1.09 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 2pvj h VAL 59 CO 0.95 0.00 -0.06 0.78 -1.23 0.00 0.00 177.57 178.01 2pvj h ASN 60 N 0.00 -0.14 -0.04 4.19 4.21 -1.92 -3.38 115.58 118.51 2pvj h ASN 60 Ca 0.00 -0.31 0.00 0.00 1.21 0.00 0.00 56.30 57.20 2pvj h ASN 60 Cb 0.16 0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.40 2pvj h ASN 60 CO 0.00 0.46 0.00 -0.46 -1.29 0.00 0.00 177.43 176.14 2pvj n ASN 61 N -4.86 2.74 -1.88 5.81 0.23 -1.19 -4.97 115.26 111.14 2pvj n ASN 61 Ca -0.06 -1.86 -0.21 0.00 -0.53 0.00 0.00 54.58 51.92 2pvj n ASN 61 Cb 0.22 -0.01 -0.06 0.00 -2.08 0.00 0.00 39.78 37.85 2pvj n ASN 61 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2pvj n ASN 62 N 1.17 -5.63 -4.85 0.53 4.13 0.22 -4.98 115.26 105.85 2pvj n ASN 62 Ca 0.12 0.30 -0.36 0.00 1.68 0.00 0.00 54.58 56.33 2pvj n ASN 62 Cb 0.52 -4.83 -0.06 0.00 -1.54 0.00 0.00 39.78 33.87 2pvj n ASN 62 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 2pvj s GLU 63 N -4.25 3.89 0.69 3.52 2.02 -1.22 -4.79 118.70 118.56 2pvj s GLU 63 Ca 0.00 0.37 -0.13 0.00 0.02 0.00 0.00 54.97 55.22 2pvj s GLU 63 Cb 0.00 -3.03 0.01 0.00 0.10 0.00 0.00 34.13 31.22 2pvj s GLU 63 CO 0.00 0.56 1.10 0.15 0.02 0.00 0.00 175.26 177.08 2pvj s LYS 64 N -1.73 2.70 0.34 1.61 1.02 -1.26 -0.70 119.74 121.72 2pvj s LYS 64 Ca 0.33 1.27 -0.16 0.00 0.02 0.00 0.00 55.97 57.43 2pvj s LYS 64 Cb -0.15 -1.95 0.04 0.00 -0.52 0.00 0.00 37.83 35.25 2pvj s LYS 64 CO 0.18 -1.31 0.73 0.00 -0.92 0.00 0.00 175.35 174.02 2pvj s ILE 66 N -2.92 1.84 -0.22 0.00 -1.09 0.67 -0.44 121.20 119.04 2pvj s ILE 66 Ca 0.16 -0.85 -0.06 0.00 -2.23 0.00 0.00 60.65 57.66 2pvj s ILE 66 Cb -0.05 -1.64 -0.02 0.00 -1.58 0.00 0.00 42.46 39.17 2pvj s ILE 66 CO 0.11 0.51 0.02 -0.63 -1.23 0.00 0.00 174.94 173.72 2pvj s ILE 67 N 0.83 4.05 -0.31 2.92 1.01 -0.14 -0.19 121.20 129.36 2pvj s ILE 67 Ca -0.08 -0.27 -0.03 0.00 0.00 0.00 0.00 60.65 60.27 2pvj s ILE 67 Cb -0.16 -2.86 0.05 0.00 0.01 0.00 0.00 42.46 39.51 2pvj s ILE 67 CO -0.01 0.39 0.03 -0.54 0.00 0.00 0.00 174.94 174.82 2pvj s LYS 68 N 1.30 2.45 -0.40 2.79 1.02 -0.21 -0.90 119.74 125.79 2pvj s LYS 68 Ca 0.04 -1.27 -0.24 0.00 0.02 0.00 0.00 55.97 54.52 2pvj s LYS 68 Cb -0.15 -3.27 0.02 0.00 -0.52 0.00 0.00 37.83 33.92 2pvj s LYS 68 CO 0.02 -0.65 0.83 0.42 -0.92 0.00 0.00 175.35 175.05 2pvj s ILE 69 N 1.28 4.64 0.28 2.17 1.01 -0.20 -1.08 121.20 129.31 2pvj s ILE 69 Ca -0.04 0.81 -0.28 0.00 0.00 0.00 0.00 60.65 61.14 2pvj s ILE 69 Cb -0.20 -4.30 -0.09 0.00 0.01 0.00 0.00 42.46 37.88 2pvj s ILE 69 CO -0.00 -0.59 0.98 -0.76 0.00 0.00 0.00 174.94 174.57 2pvj s LEU 70 N 3.33 4.52 0.67 2.97 1.43 -0.51 -1.68 118.68 129.41 2pvj s LEU 70 Ca 0.33 1.98 -0.09 0.00 -1.03 0.00 0.00 54.13 55.33 2pvj s LEU 70 Cb -0.12 -3.76 0.02 0.00 0.03 0.00 0.00 46.19 42.36 2pvj s LEU 70 CO 0.20 0.00 1.02 -0.54 0.23 0.00 0.00 176.35 177.26 2pvj s LYS 71 N -1.54 2.78 -0.28 1.70 1.02 -0.87 -4.52 119.74 118.04 2pvj s LYS 71 Ca 0.45 0.21 -0.42 0.00 0.02 0.00 0.00 55.97 56.23 2pvj s LYS 71 Cb -0.25 -2.12 -0.19 0.00 -0.52 0.00 0.00 37.83 34.75 2pvj s LYS 71 CO 0.31 -0.95 1.31 -2.30 -0.92 0.00 0.00 175.35 172.79 2pvj n PRO 72 N -2.86 0.00 -3.99 -1.68 -0.02 -1.26 -4.96 135.00 120.24 2pvj n PRO 72 Ca 0.06 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.43 2pvj n PRO 72 Cb 0.58 -1.42 -0.12 0.00 -0.02 0.00 0.00 33.50 32.52 2pvj n PRO 72 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2pvj s VAL 73 N 1.65 0.20 0.44 -1.45 0.11 -1.26 -5.12 120.40 114.97 2pvj s VAL 73 Ca 0.94 -0.65 -0.23 0.00 -2.93 0.00 0.00 61.98 59.11 2pvj s VAL 73 Cb -1.33 -0.28 -0.08 0.00 -1.53 0.00 0.00 36.38 33.16 2pvj s VAL 73 CO 0.68 -0.29 1.10 -0.54 -3.33 0.00 0.00 175.10 172.72 2pvj s LYS 74 N -0.99 3.89 0.23 1.54 -0.14 -1.26 -4.90 119.74 118.12 2pvj s LYS 74 Ca -0.09 1.61 -0.06 0.00 -1.36 0.00 0.00 55.97 56.07 2pvj s LYS 74 Cb -0.07 -2.39 0.40 0.00 -1.68 0.00 0.00 37.83 34.09 2pvj s LYS 74 CO -0.00 -0.40 1.74 -0.22 -0.76 0.00 0.00 175.35 175.71 2pvj h LYS 75 N 2.10 0.45 -0.37 1.68 3.64 -2.01 -2.01 116.57 120.05 2pvj h LYS 75 Ca -0.49 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.88 2pvj h LYS 75 Cb 1.23 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.93 2pvj h LYS 75 CO 0.61 0.30 0.21 -0.22 -2.27 0.00 0.00 179.45 178.07 2pvj h LYS 76 N 0.46 0.41 -0.34 1.90 3.64 -1.98 -1.80 116.57 118.85 2pvj h LYS 76 Ca 0.38 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.70 2pvj h LYS 76 Cb 0.54 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 2pvj h LYS 76 CO -0.36 0.27 0.08 -0.22 -2.27 0.00 0.00 179.45 176.95 2pvj h LYS 77 N 0.42 0.55 -0.19 1.90 3.64 -1.77 -2.23 116.57 118.90 2pvj h LYS 77 Ca 0.15 -0.13 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 2pvj h LYS 77 Cb 0.02 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2pvj h LYS 77 CO -0.08 0.60 -0.34 0.97 -2.27 0.00 0.00 179.45 178.34 2pvj h ILE 78 N 0.40 1.29 -0.34 2.00 2.10 -1.31 -2.45 117.51 119.20 2pvj h ILE 78 Ca 0.11 -1.41 -0.07 0.00 1.08 0.00 0.00 64.86 64.57 2pvj h ILE 78 Cb 0.30 1.52 -0.02 0.00 -1.09 0.00 0.00 36.82 37.53 2pvj h ILE 78 CO 0.00 0.43 -0.09 0.11 -1.08 0.00 0.00 178.15 177.53 2pvj h LYS 79 N 0.34 0.57 -0.29 2.19 1.57 -1.20 -1.39 116.57 118.36 2pvj h LYS 79 Ca 0.04 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 2pvj h LYS 79 Cb 0.76 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2pvj h LYS 79 CO 0.06 0.66 0.07 -0.09 -0.57 0.00 0.00 179.45 179.58 2pvj h ARG 80 N 0.53 0.46 -0.44 3.15 2.43 -0.96 -0.32 114.38 119.24 2pvj h ARG 80 Ca 0.10 -0.11 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 2pvj h ARG 80 Cb 0.47 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 2pvj h ARG 80 CO 0.03 0.55 0.15 1.49 -1.51 0.00 0.00 179.97 180.67 2pvj h GLU 81 N 0.30 0.68 -0.30 0.20 4.81 -1.20 -1.97 114.58 117.09 2pvj h GLU 81 Ca 0.09 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 2pvj h GLU 81 Cb 0.29 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 2pvj h GLU 81 CO 0.00 0.65 0.11 0.82 -0.73 0.00 0.00 179.01 179.86 2pvj h ILE 82 N 0.57 1.19 -0.68 2.32 2.04 -1.15 -1.58 117.51 120.22 2pvj h ILE 82 Ca 0.14 -0.57 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 2pvj h ILE 82 Cb 0.24 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 2pvj h ILE 82 CO -0.01 0.20 0.39 0.50 0.00 0.00 0.00 178.15 179.23 2pvj h LYS 83 N 0.33 0.93 -0.46 2.37 1.63 -0.97 -1.06 116.57 119.35 2pvj h LYS 83 Ca 0.10 -0.10 -0.05 0.00 -0.85 0.00 0.00 60.65 59.76 2pvj h LYS 83 Cb 0.20 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.62 2pvj h LYS 83 CO -0.01 0.68 0.11 0.82 -3.45 0.00 0.00 179.45 177.60 2pvj h ILE 84 N 0.92 1.24 -0.96 2.00 2.04 -1.26 0.18 117.51 121.67 2pvj h ILE 84 Ca 0.24 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.27 2pvj h ILE 84 Cb 0.00 0.90 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 2pvj h ILE 84 CO -0.04 0.29 0.60 -0.07 0.00 0.00 0.00 178.15 178.94 2pvj h LEU 85 N 0.61 1.13 -0.36 1.44 3.38 -0.97 -1.10 115.31 119.45 2pvj h LEU 85 Ca 0.14 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 57.96 2pvj h LEU 85 Cb 0.33 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2pvj h LEU 85 CO 0.00 0.85 -0.18 1.56 0.09 0.00 0.00 178.44 180.76 2pvj h GLN 86 N 1.32 0.76 -0.15 1.13 4.20 -0.88 -3.05 115.11 118.44 2pvj h GLN 86 Ca 0.35 -0.34 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 2pvj h GLN 86 Cb -0.10 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 2pvj h GLN 86 CO -0.07 0.95 -0.10 -0.91 -0.67 0.00 0.00 178.83 178.03 2pvj h ASN 87 N 0.55 0.21 -3.60 1.46 2.35 -0.56 -3.47 115.58 112.52 2pvj h ASN 87 Ca 0.08 -0.04 -0.65 0.00 -0.55 0.00 0.00 56.30 55.15 2pvj h ASN 87 Cb 0.73 -0.05 -0.15 0.00 0.05 0.00 0.00 38.32 38.89 2pvj h ASN 87 CO 0.05 0.34 -0.03 -0.76 -1.65 0.00 0.00 177.43 175.39 2pvj s LEU 88 N -8.82 4.35 0.00 1.61 1.43 -0.45 -4.99 118.68 111.81 2pvj s LEU 88 Ca -0.05 -0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 2pvj s LEU 88 Cb 0.16 -2.61 0.00 0.00 0.03 0.00 0.00 46.19 43.77 2pvj s LEU 88 CO 0.73 -0.50 0.00 0.61 0.23 0.00 0.00 176.35 177.41 2pvj n GLY 90 N 4.79 0.00 3.78 -3.19 0.00 -1.26 -4.87 105.19 104.44 2pvj n GLY 90 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 2pvj n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2pvj s GLY 91 N 0.00 1.99 -0.14 -0.02 0.00 -1.26 -4.91 107.32 102.98 2pvj s GLY 91 Ca 0.00 0.42 -0.35 0.00 0.00 0.00 0.00 44.72 44.80 2pvj s GLY 91 CO 0.00 0.76 1.91 -1.05 0.00 0.00 0.00 173.10 174.73 2pvj n PRO 92 N -2.71 1.99 -1.93 2.90 -0.02 -1.26 -2.41 135.00 131.56 2pvj n PRO 92 Ca 0.10 0.71 -0.19 0.00 -2.02 0.00 0.00 63.50 62.10 2pvj n PRO 92 Cb 0.52 -2.61 -0.05 0.00 -0.02 0.00 0.00 33.50 31.34 2pvj n PRO 92 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2pvj n ASN 93 N 7.03 -5.31 -4.66 2.55 3.02 -1.26 -3.54 115.26 113.09 2pvj n ASN 93 Ca 0.25 0.28 -0.39 0.00 -0.03 0.00 0.00 54.58 54.69 2pvj n ASN 93 Cb 0.28 -4.59 -0.07 0.00 -0.61 0.00 0.00 39.78 34.79 2pvj n ASN 93 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2pvj s ILE 94 N -2.78 5.16 0.39 2.41 -1.09 -1.01 -0.81 121.20 123.46 2pvj s ILE 94 Ca 0.00 0.80 -0.26 0.00 -2.23 0.00 0.00 60.65 58.96 2pvj s ILE 94 Cb 0.00 -3.77 -0.11 0.00 -1.58 0.00 0.00 42.46 37.00 2pvj s ILE 94 CO 0.00 0.21 1.21 0.55 -1.23 0.00 0.00 174.94 175.68 2pvj n VAL 95 N 4.51 2.35 -3.39 2.92 3.14 -1.02 -4.78 118.33 122.07 2pvj n VAL 95 Ca -0.07 -0.50 -0.38 0.00 -2.96 0.00 0.00 64.34 60.44 2pvj n VAL 95 Cb 0.51 -1.46 -0.07 0.00 -1.06 0.00 0.00 33.84 31.77 2pvj n VAL 95 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2pvj s LYS 96 N -2.04 4.28 -0.32 1.45 1.02 -1.26 -4.95 119.74 117.92 2pvj s LYS 96 Ca 0.60 0.30 -0.22 0.00 0.02 0.00 0.00 55.97 56.67 2pvj s LYS 96 Cb -0.55 -3.46 -0.00 0.00 -0.52 0.00 0.00 37.83 33.31 2pvj s LYS 96 CO 0.59 0.13 0.71 -1.17 -0.92 0.00 0.00 175.35 174.69 2pvj s LEU 97 N 0.75 4.14 -0.07 3.17 2.96 -1.26 -1.97 118.68 126.40 2pvj s LEU 97 Ca 0.22 0.45 -0.08 0.00 -0.22 0.00 0.00 54.13 54.50 2pvj s LEU 97 Cb -0.14 -2.93 -0.29 0.00 0.50 0.00 0.00 46.19 43.33 2pvj s LEU 97 CO 0.08 -0.58 0.59 -0.07 -1.32 0.00 0.00 176.35 175.05 2pvj h LEU 98 N 9.38 0.51 -7.89 -0.68 3.38 -0.25 -3.49 115.31 116.27 2pvj h LEU 98 Ca -0.26 -0.88 0.09 0.00 0.09 0.00 0.00 57.88 56.93 2pvj h LEU 98 Cb 1.11 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.63 2pvj h LEU 98 CO 0.85 1.76 0.28 -0.62 0.09 0.00 0.00 178.44 180.79 2pvj s ASP 99 N -7.15 -0.26 -0.06 -0.43 -1.08 -1.01 -5.00 116.67 101.68 2pvj s ASP 99 Ca -0.17 -0.54 -0.02 0.00 -0.52 0.00 0.00 52.55 51.30 2pvj s ASP 99 Cb 0.06 0.68 0.03 0.00 -1.46 0.00 0.00 42.92 42.23 2pvj s ASP 99 CO 0.83 -1.25 0.05 -0.63 0.52 0.00 0.00 175.17 174.68 2pvj s ILE 100 N -3.79 0.04 0.23 4.11 1.01 -1.26 -0.94 121.20 120.60 2pvj s ILE 100 Ca 0.11 0.28 0.03 0.00 0.00 0.00 0.00 60.65 61.07 2pvj s ILE 100 Cb -0.05 -0.31 -0.05 0.00 0.01 0.00 0.00 42.46 42.06 2pvj s ILE 100 CO 0.05 0.16 0.01 0.68 0.00 0.00 0.00 174.94 175.84 2pvj s VAL 101 N 2.10 0.97 0.01 2.92 -7.23 -0.60 -0.05 120.40 118.52 2pvj s VAL 101 Ca 0.05 -2.02 -0.09 0.00 -1.81 0.00 0.00 61.98 58.10 2pvj s VAL 101 Cb -0.12 -2.38 0.00 0.00 0.56 0.00 0.00 36.38 34.44 2pvj s VAL 101 CO -0.04 -0.29 0.18 0.00 -0.31 0.00 0.00 175.10 174.64 2pvj s ARG 102 N -3.88 0.58 -0.10 4.82 1.70 -1.26 0.13 118.95 120.93 2pvj s ARG 102 Ca 0.29 -0.46 -0.23 0.00 -0.47 0.00 0.00 55.73 54.86 2pvj s ARG 102 Cb 0.06 0.24 -0.03 0.00 -0.57 0.00 0.00 34.95 34.65 2pvj s ARG 102 CO 0.09 -0.15 0.71 0.34 -1.08 0.00 0.00 175.30 175.21 2pvj s ASP 103 N -1.62 6.94 0.09 -2.89 2.15 -0.18 -4.84 116.67 116.32 2pvj s ASP 103 Ca -0.11 1.14 -0.33 0.00 0.43 0.00 0.00 52.55 53.68 2pvj s ASP 103 Cb -0.05 -2.41 -0.15 0.00 -0.30 0.00 0.00 42.92 40.01 2pvj s ASP 103 CO 0.00 -0.19 1.60 -0.61 -0.17 0.00 0.00 175.17 175.81 2pvj h GLN 104 N 6.96 -0.82 -0.66 4.34 4.15 -1.96 0.80 115.11 127.92 2pvj h GLN 104 Ca -0.38 0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.08 2pvj h GLN 104 Cb 1.18 0.19 -0.03 0.00 0.21 0.00 0.00 27.48 29.02 2pvj h GLN 104 CO 0.77 -0.54 0.34 1.25 -1.93 0.00 0.00 178.83 178.72 2pvj h HIS 105 N -0.85 0.93 0.00 3.99 2.76 -2.00 -3.23 115.15 116.76 2pvj h HIS 105 Ca -0.05 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.09 2pvj h HIS 105 Cb 0.73 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.40 2pvj h HIS 105 CO -0.18 0.68 -1.61 -1.13 -1.30 0.00 0.00 177.93 174.40 2pvj n SER 106 N -4.50 0.33 -1.22 3.26 3.41 -1.23 -4.97 113.62 108.71 2pvj n SER 106 Ca 0.05 -0.12 -0.15 0.00 -0.26 0.00 0.00 58.87 58.39 2pvj n SER 106 Cb 0.11 1.51 -0.06 0.00 -0.26 0.00 0.00 64.21 65.51 2pvj n SER 106 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2pvj n LYS 107 N -2.17 -1.06 -2.47 4.33 4.76 0.28 -4.96 118.16 116.88 2pvj n LYS 107 Ca -0.02 0.99 -0.43 0.00 -2.87 0.00 0.00 58.31 55.98 2pvj n LYS 107 Cb 0.52 -5.14 -0.02 0.00 -1.84 0.00 0.00 35.03 28.54 2pvj n LYS 107 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2pvj s THR 108 N -2.58 4.33 0.29 -0.18 2.01 -1.23 -4.72 115.64 113.56 2pvj s THR 108 Ca 0.00 1.63 -0.05 0.00 0.31 0.00 0.00 61.69 63.57 2pvj s THR 108 Cb 0.00 -4.05 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 2pvj s THR 108 CO 0.00 -0.08 0.56 -2.16 -0.69 0.00 0.00 174.62 172.25 2pvj s PRO 109 N 2.88 3.65 -0.02 4.92 0.04 -1.26 -1.01 135.00 144.20 2pvj s PRO 109 Ca 0.54 0.04 0.02 0.00 0.04 0.00 0.00 61.00 61.64 2pvj s PRO 109 Cb -0.22 -2.64 0.01 0.00 0.04 0.00 0.00 34.50 31.69 2pvj s PRO 109 CO 0.17 0.21 -0.06 -1.12 0.04 0.00 0.00 177.00 176.24 2pvj s SER 110 N -3.09 0.90 -0.19 6.66 0.01 0.12 -1.42 113.70 116.69 2pvj s SER 110 Ca 0.44 -0.13 -0.09 0.00 1.31 0.00 0.00 55.95 57.48 2pvj s SER 110 Cb -0.11 -0.26 -0.05 0.00 0.21 0.00 0.00 66.02 65.82 2pvj s SER 110 CO 0.29 0.03 0.10 -0.76 0.41 0.00 0.00 173.24 173.31 2pvj s LEU 111 N 0.30 4.05 -0.25 2.44 1.43 -0.24 -1.56 118.68 124.86 2pvj s LEU 111 Ca -0.04 0.18 -0.08 0.00 -1.03 0.00 0.00 54.13 53.16 2pvj s LEU 111 Cb -0.08 -2.04 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 2pvj s LEU 111 CO 0.00 0.19 0.09 -0.63 0.23 0.00 0.00 176.35 176.22 2pvj s ILE 112 N 0.31 4.51 0.38 -0.59 -1.09 -0.12 -1.05 121.20 123.55 2pvj s ILE 112 Ca 0.06 -0.11 0.08 0.00 -2.23 0.00 0.00 60.65 58.45 2pvj s ILE 112 Cb -0.12 -3.11 -0.07 0.00 -1.58 0.00 0.00 42.46 37.59 2pvj s ILE 112 CO -0.01 0.34 0.01 -0.36 -1.23 0.00 0.00 174.94 173.68 2pvj s PHE 113 N 1.51 2.51 0.57 3.97 0.08 0.73 0.52 117.98 127.87 2pvj s PHE 113 Ca 0.06 -0.58 -0.19 0.00 0.12 0.00 0.00 56.93 56.34 2pvj s PHE 113 Cb -0.15 -1.66 -0.04 0.00 -0.57 0.00 0.00 43.02 40.59 2pvj s PHE 113 CO 0.05 0.45 1.17 -1.83 -0.10 0.00 0.00 175.22 174.96 2pvj s GLU 114 N -3.71 3.14 -0.03 0.44 -1.05 -0.83 -0.24 118.70 116.43 2pvj s GLU 114 Ca 0.35 1.71 -0.19 0.00 -0.15 0.00 0.00 54.97 56.69 2pvj s GLU 114 Cb 0.06 -1.97 -0.05 0.00 -0.44 0.00 0.00 34.13 31.73 2pvj s GLU 114 CO 0.18 -1.04 0.55 -0.47 0.95 0.00 0.00 175.26 175.43 2pvj s TYR 115 N -1.70 3.66 -0.09 4.83 5.04 -1.26 -4.27 117.35 123.56 2pvj s TYR 115 Ca 0.75 1.11 0.02 0.00 -2.44 0.00 0.00 57.07 56.51 2pvj s TYR 115 Cb -0.27 -2.55 0.02 0.00 0.35 0.00 0.00 41.96 39.50 2pvj s TYR 115 CO 0.30 0.36 -0.12 0.08 -1.34 0.00 0.00 175.55 174.83 2pvj s VAL 116 N -0.16 1.25 -1.30 3.14 1.01 -1.26 -4.97 120.40 118.11 2pvj s VAL 116 Ca 0.29 -0.50 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 2pvj s VAL 116 Cb -0.17 -1.16 0.04 0.00 0.00 0.00 0.00 36.38 35.09 2pvj s VAL 116 CO 0.15 0.39 1.87 -3.20 0.00 0.00 0.00 175.10 174.32 2pvj n ASN 117 N 4.16 4.43 -4.78 3.32 4.05 -1.26 -4.95 115.26 120.24 2pvj n ASN 117 Ca -0.20 -2.87 -0.37 0.00 0.45 0.00 0.00 54.58 51.60 2pvj n ASN 117 Cb 0.51 -1.71 -0.03 0.00 1.23 0.00 0.00 39.78 39.78 2pvj n ASN 117 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 177.26 174.42 2pvj s ASN 118 N 4.25 6.65 -0.13 1.20 2.47 -1.26 -3.99 114.94 124.13 2pvj s ASN 118 Ca 0.54 2.09 0.01 0.00 0.42 0.00 0.00 52.86 55.92 2pvj s ASN 118 Cb 0.06 -2.59 -0.01 0.00 -1.45 0.00 0.00 41.25 37.26 2pvj s ASN 118 CO 0.05 -0.57 -0.16 -0.89 -3.72 0.00 0.00 177.10 171.81 2pvj s THR 119 N -1.63 2.78 -0.26 -5.21 2.01 -1.19 -4.99 115.64 107.16 2pvj s THR 119 Ca 0.59 -0.75 -0.40 0.00 0.31 0.00 0.00 61.69 61.43 2pvj s THR 119 Cb -0.23 -2.15 -0.18 0.00 0.01 0.00 0.00 72.50 69.94 2pvj s THR 119 CO 0.29 0.53 1.25 -0.67 -0.69 0.00 0.00 174.62 175.33 2pvj n ASP 120 N 3.60 0.61 0.28 3.53 -0.08 -1.26 -4.57 116.55 118.66 2pvj n ASP 120 Ca -0.18 1.08 0.12 0.00 -1.51 0.00 0.00 54.79 54.30 2pvj n ASP 120 Cb 0.53 -0.82 0.79 0.00 2.34 0.00 0.00 41.12 43.95 2pvj n ASP 120 CO 0.00 0.00 0.00 2.19 0.12 0.00 0.00 177.20 179.51 2pvj h PHE 121 N 3.77 0.00 0.00 -0.67 -0.00 -1.96 0.17 116.94 118.25 2pvj h PHE 121 Ca -0.43 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 57.52 2pvj h PHE 121 Cb 1.28 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 37.23 2pvj h PHE 121 CO 0.56 0.03 -0.08 0.87 -0.00 0.00 0.00 178.31 179.69 2pvj h LYS 122 N 0.00 0.00 0.00 6.09 1.57 -2.01 -1.32 116.57 120.90 2pvj h LYS 122 Ca -0.00 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.42 2pvj h LYS 122 Cb 0.06 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.30 2pvj h LYS 122 CO 0.00 0.08 -2.37 0.28 -0.57 0.00 0.00 179.45 176.87 2pvj n VAL 123 N -3.32 1.38 0.06 0.50 0.31 0.00 -4.59 118.33 112.68 2pvj n VAL 123 Ca -0.01 -0.59 -0.12 0.00 -0.01 0.00 0.00 64.34 63.62 2pvj n VAL 123 Cb 0.27 -1.20 -0.08 0.00 -0.91 0.00 0.00 33.84 31.92 2pvj n VAL 123 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2pvj h LEU 124 N 0.00 -0.18 -0.82 7.52 5.85 -0.70 -3.35 115.31 123.63 2pvj h LEU 124 Ca -0.54 -0.35 0.17 0.00 0.84 0.00 0.00 57.88 58.01 2pvj h LEU 124 Cb 1.91 0.05 -0.11 0.00 0.37 0.00 0.00 40.66 42.88 2pvj h LEU 124 CO -0.06 0.32 0.34 1.88 -0.34 0.00 0.00 178.44 180.58 2pvj h TYR 125 N -0.77 0.57 0.00 1.25 -1.99 -1.48 -0.29 116.97 114.26 2pvj h TYR 125 Ca -0.02 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.75 2pvj h TYR 125 Cb 0.52 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 39.13 2pvj h TYR 125 CO 0.08 0.02 0.00 -1.35 -0.00 0.00 0.00 178.16 176.90 2pvj h PRO 126 N 0.43 0.00 -0.01 4.88 0.11 -1.78 -1.70 132.00 133.93 2pvj h PRO 126 Ca 0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.59 2pvj h PRO 126 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2pvj h PRO 126 CO -0.46 0.00 -0.50 0.25 -0.21 0.00 0.00 178.00 177.08 2pvj n THR 127 N -2.87 0.00 -2.26 -1.15 -2.24 -0.13 -4.96 114.28 100.67 2pvj n THR 127 Ca -0.02 -0.22 -0.41 0.00 -2.27 0.00 0.00 64.05 61.12 2pvj n THR 127 Cb 0.08 1.15 -0.03 0.00 -2.10 0.00 0.00 70.33 69.43 2pvj n THR 127 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2pvj s LEU 128 N -2.53 4.45 0.81 3.22 1.43 -0.64 -5.03 118.68 120.38 2pvj s LEU 128 Ca 0.18 2.41 -0.09 0.00 -1.03 0.00 0.00 54.13 55.61 2pvj s LEU 128 Cb 0.18 -3.62 0.13 0.00 0.03 0.00 0.00 46.19 42.91 2pvj s LEU 128 CO 0.59 -0.44 1.13 0.42 0.23 0.00 0.00 176.35 178.28 2pvj s THR 129 N -0.39 2.12 0.13 5.49 -4.23 -1.26 -4.87 115.64 112.63 2pvj s THR 129 Ca 0.52 -0.25 -0.20 0.00 -1.18 0.00 0.00 61.69 60.59 2pvj s THR 129 Cb -0.36 -2.88 -0.03 0.00 1.34 0.00 0.00 72.50 70.58 2pvj s THR 129 CO 0.42 0.00 1.70 -0.78 -0.54 0.00 0.00 174.62 175.42 2pvj h ASP 130 N -0.98 -0.21 -0.88 3.99 -0.00 -1.96 -1.93 116.42 114.45 2pvj h ASP 130 Ca -0.42 0.06 -0.02 0.00 -0.00 0.00 0.00 57.03 56.65 2pvj h ASP 130 Cb 1.27 0.13 -0.04 0.00 -0.00 0.00 0.00 39.33 40.69 2pvj h ASP 130 CO 0.47 -0.08 0.46 0.22 -0.00 0.00 0.00 179.24 180.31 2pvj h TYR 131 N -0.01 1.24 -0.78 0.28 3.20 -1.94 -2.42 116.97 116.52 2pvj h TYR 131 Ca 0.10 -0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.97 2pvj h TYR 131 Cb 0.16 -0.39 -0.05 0.00 1.54 0.00 0.00 36.73 37.99 2pvj h TYR 131 CO -0.22 0.87 0.49 -0.44 -1.64 0.00 0.00 178.16 177.22 2pvj h ASP 132 N 1.25 0.79 -0.16 -2.11 3.32 -1.78 0.12 116.42 117.84 2pvj h ASP 132 Ca 0.31 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.36 2pvj h ASP 132 Cb 0.07 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2pvj h ASP 132 CO -0.04 0.53 0.09 0.40 -1.72 0.00 0.00 179.24 178.49 2pvj h ILE 133 N 0.93 1.10 -0.70 0.35 2.04 -0.99 -0.18 117.51 120.05 2pvj h ILE 133 Ca 0.33 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 2pvj h ILE 133 Cb 0.08 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 2pvj h ILE 133 CO -0.14 0.09 0.39 0.03 0.00 0.00 0.00 178.15 178.52 2pvj h ARG 134 N 0.16 0.98 0.38 2.37 3.08 -0.95 -1.37 114.38 119.02 2pvj h ARG 134 Ca 0.06 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 2pvj h ARG 134 Cb 0.07 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 29.93 2pvj h ARG 134 CO -0.01 0.74 -0.18 -0.92 -1.07 0.00 0.00 179.97 178.52 2pvj h TYR 135 N 0.97 -0.47 -0.58 3.04 3.20 -0.50 -1.53 116.97 121.10 2pvj h TYR 135 Ca 0.25 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 2pvj h TYR 135 Cb 0.04 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 2pvj h TYR 135 CO -0.00 -0.22 0.10 1.88 -1.64 0.00 0.00 178.16 178.27 2pvj h TYR 136 N -0.62 0.97 -0.52 -3.82 0.05 -0.96 -1.20 116.97 110.86 2pvj h TYR 136 Ca -0.05 -0.11 -0.10 0.00 0.05 0.00 0.00 58.73 58.52 2pvj h TYR 136 Cb 0.46 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 37.90 2pvj h TYR 136 CO -0.02 0.82 -0.07 0.82 -1.05 0.00 0.00 178.16 178.66 2pvj h ILE 137 N 0.88 1.26 -0.58 -2.88 1.08 -1.25 -0.60 117.51 115.42 2pvj h ILE 137 Ca 0.18 -1.19 -0.01 0.00 -0.39 0.00 0.00 64.86 63.45 2pvj h ILE 137 Cb 0.37 0.94 -0.03 0.00 -3.07 0.00 0.00 36.82 35.04 2pvj h ILE 137 CO 0.01 0.42 0.32 0.22 -0.69 0.00 0.00 178.15 178.42 2pvj h TYR 138 N 0.84 0.80 -0.68 1.37 3.20 -0.83 0.48 116.97 122.15 2pvj h TYR 138 Ca 0.14 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 2pvj h TYR 138 Cb 0.60 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 2pvj h TYR 138 CO 0.04 0.58 0.25 0.93 -1.64 0.00 0.00 178.16 178.32 2pvj h GLU 139 N 0.79 1.01 -0.39 1.82 4.39 -0.84 -1.84 114.58 119.51 2pvj h GLU 139 Ca 0.20 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.62 2pvj h GLU 139 Cb 0.04 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 2pvj h GLU 139 CO -0.03 0.84 -0.20 1.25 -1.16 0.00 0.00 179.01 179.70 2pvj h LEU 140 N 0.99 0.77 -1.32 1.33 5.85 -0.59 -2.75 115.31 119.59 2pvj h LEU 140 Ca 0.23 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 2pvj h LEU 140 Cb 0.22 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2pvj h LEU 140 CO -0.02 0.96 0.10 -0.07 -0.34 0.00 0.00 178.44 179.07 2pvj h LEU 141 N 0.67 0.51 -0.86 2.25 3.38 -0.23 -1.88 115.31 119.17 2pvj h LEU 141 Ca 0.10 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.01 2pvj h LEU 141 Cb 0.70 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 2pvj h LEU 141 CO 0.05 0.51 0.57 0.11 0.09 0.00 0.00 178.44 179.77 2pvj h LYS 142 N 0.55 1.12 -0.59 1.13 1.57 -1.06 0.50 116.57 119.80 2pvj h LYS 142 Ca 0.13 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 2pvj h LYS 142 Cb 0.20 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 2pvj h LYS 142 CO -0.01 0.74 0.00 0.00 -0.57 0.00 0.00 179.45 179.62 2pvj h ALA 143 N 1.32 0.79 -0.17 3.86 0.00 -1.30 -1.48 119.26 122.27 2pvj h ALA 143 Ca 0.32 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 2pvj h ALA 143 Cb -0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 2pvj h ALA 143 CO -0.07 0.63 -0.27 -0.07 0.00 0.00 0.00 179.25 179.46 2pvj h LEU 144 N 0.93 0.54 -1.17 0.00 3.38 -0.89 -1.30 115.31 116.79 2pvj h LEU 144 Ca 0.17 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 2pvj h LEU 144 Cb 0.55 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 2pvj h LEU 144 CO 0.03 0.96 0.20 -0.78 0.09 0.00 0.00 178.44 178.94 2pvj h ASP 145 N 0.14 0.71 0.24 -0.43 3.58 -0.90 -0.38 116.42 119.37 2pvj h ASP 145 Ca 0.02 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.36 2pvj h ASP 145 Cb 0.85 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.72 2pvj h ASP 145 CO 0.06 0.65 -0.12 0.22 -2.88 0.00 0.00 179.24 177.18 2pvj h TYR 146 N 0.76 -0.30 -0.51 0.28 3.20 -1.12 -0.04 116.97 119.25 2pvj h TYR 146 Ca 0.18 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.99 2pvj h TYR 146 Cb 0.18 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 2pvj h TYR 146 CO 0.01 -0.05 0.08 0.00 -1.64 0.00 0.00 178.16 176.56 2pvj h HIS 148 N 0.76 1.09 0.00 0.00 3.86 -1.02 0.03 115.15 119.86 2pvj h HIS 148 Ca 0.16 -0.10 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2pvj h HIS 148 Cb 0.35 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.50 2pvj h HIS 148 CO 0.02 0.87 0.00 0.66 0.86 0.00 0.00 177.93 180.33 2pvj h SER 149 N 1.02 0.00 -0.58 2.45 4.64 -0.18 -1.00 113.55 119.90 2pvj h SER 149 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2pvj h SER 149 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2pvj h SER 149 CO -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.95 2pvj n GLN 150 N -3.07 4.07 -1.95 4.77 1.13 -0.47 -4.93 117.38 116.92 2pvj n GLN 150 Ca -0.00 -2.80 -0.11 0.00 -1.94 0.00 0.00 57.00 52.14 2pvj n GLN 150 Cb 0.25 -2.03 -0.02 0.00 0.11 0.00 0.00 30.24 28.55 2pvj n GLN 150 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2pvj n GLY 151 N 0.87 0.30 3.18 1.08 0.00 -0.38 -4.92 105.19 105.32 2pvj n GLY 151 Ca 0.25 -0.45 -0.27 0.00 0.00 0.00 0.00 46.02 45.55 2pvj n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pvj s ILE 152 N -2.51 1.56 -0.16 -0.61 1.01 -0.13 -0.65 121.20 119.70 2pvj s ILE 152 Ca 0.00 -0.81 -0.06 0.00 0.00 0.00 0.00 60.65 59.78 2pvj s ILE 152 Cb 0.00 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 2pvj s ILE 152 CO 0.00 0.44 0.05 -0.04 0.00 0.00 0.00 174.94 175.39 2pvj s MET 153 N -0.20 3.78 0.00 2.79 -1.94 -0.05 -3.15 119.30 120.53 2pvj s MET 153 Ca 0.01 -0.35 -0.21 0.00 -1.71 0.00 0.00 55.69 53.42 2pvj s MET 153 Cb -0.10 -3.13 -0.20 0.00 2.01 0.00 0.00 34.83 33.42 2pvj s MET 153 CO 0.01 0.36 1.18 1.25 -0.01 0.00 0.00 175.02 177.81 2pvj h HIS 154 N 6.36 0.42 -0.33 -0.03 2.76 -1.91 -1.33 115.15 121.09 2pvj h HIS 154 Ca -0.39 -0.18 -0.14 0.00 -2.20 0.00 0.00 60.37 57.45 2pvj h HIS 154 Cb 1.18 -0.07 -0.06 0.00 1.55 0.00 0.00 27.41 30.02 2pvj h HIS 154 CO 0.58 0.92 -0.13 0.54 -1.30 0.00 0.00 177.93 178.54 2pvj n ARG 155 N -4.45 -1.28 -2.70 5.26 1.74 -1.26 -2.32 116.66 111.64 2pvj n ARG 155 Ca -0.08 0.67 -0.03 0.00 -0.77 0.00 0.00 57.85 57.64 2pvj n ARG 155 Cb 0.49 -4.78 0.11 0.00 -1.02 0.00 0.00 32.46 27.25 2pvj n ARG 155 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2pvj n ASP 156 N -0.61 -0.87 -4.69 0.55 2.03 -1.26 -0.92 116.55 110.77 2pvj n ASP 156 Ca -0.07 -2.25 -0.42 0.00 0.52 0.00 0.00 54.79 52.57 2pvj n ASP 156 Cb 0.43 0.48 -0.03 0.00 -0.72 0.00 0.00 41.12 41.28 2pvj n ASP 156 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2pvj s VAL 157 N -0.71 3.85 0.01 5.18 1.01 -1.26 -4.77 120.40 123.71 2pvj s VAL 157 Ca 0.15 1.23 -0.29 0.00 0.00 0.00 0.00 61.98 63.07 2pvj s VAL 157 Cb 0.42 -3.79 0.10 0.00 0.00 0.00 0.00 36.38 33.11 2pvj s VAL 157 CO -0.10 0.01 0.94 -1.59 0.00 0.00 0.00 175.10 174.35 2pvj s LYS 158 N 2.25 0.84 0.34 2.72 -2.85 -1.26 -4.78 119.74 116.99 2pvj s LYS 158 Ca 0.62 -0.35 0.08 0.00 -1.00 0.00 0.00 55.97 55.32 2pvj s LYS 158 Cb -0.30 0.36 0.78 0.00 -2.06 0.00 0.00 37.83 36.61 2pvj s LYS 158 CO 0.26 -0.37 1.84 -1.35 0.10 0.00 0.00 175.35 175.83 2pvj h PRO 159 N 2.00 0.71 0.00 1.78 0.11 -1.93 -0.49 132.00 134.19 2pvj h PRO 159 Ca -0.22 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2pvj h PRO 159 Cb 1.23 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2pvj h PRO 159 CO 0.29 0.47 0.00 0.45 -0.21 0.00 0.00 178.00 179.00 2pvj h HIS 160 N 0.73 0.00 -0.42 0.65 3.86 -1.96 -1.94 115.15 116.08 2pvj h HIS 160 Ca 0.49 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.70 2pvj h HIS 160 Cb 0.76 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.23 2pvj h HIS 160 CO -0.00 0.00 0.00 0.09 0.86 0.00 0.00 177.93 178.88 2pvj n ASN 161 N -2.98 4.03 -3.94 2.45 3.02 -0.20 -4.80 115.26 112.83 2pvj n ASN 161 Ca -0.02 -2.57 -0.31 0.00 -0.03 0.00 0.00 54.58 51.65 2pvj n ASN 161 Cb 0.11 -0.48 -0.15 0.00 -0.61 0.00 0.00 39.78 38.65 2pvj n ASN 161 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2pvj s VAL 162 N -2.04 1.88 -0.02 2.41 1.01 -0.73 -0.96 120.40 121.94 2pvj s VAL 162 Ca 0.41 -2.02 -0.26 0.00 0.00 0.00 0.00 61.98 60.11 2pvj s VAL 162 Cb 0.28 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 2pvj s VAL 162 CO 0.16 -0.57 0.79 -0.04 0.00 0.00 0.00 175.10 175.44 2pvj s MET 163 N 1.12 4.49 -0.08 2.72 -1.94 -0.23 -4.92 119.30 120.46 2pvj s MET 163 Ca 0.09 1.08 -0.01 0.00 -1.71 0.00 0.00 55.69 55.14 2pvj s MET 163 Cb -0.19 -3.43 0.03 0.00 2.01 0.00 0.00 34.83 33.25 2pvj s MET 163 CO -0.12 0.09 -0.03 0.42 -0.01 0.00 0.00 175.02 175.37 2pvj s ILE 164 N 0.63 0.63 -0.57 2.53 1.01 -1.26 -1.00 121.20 123.17 2pvj s ILE 164 Ca 0.42 -0.05 -0.18 0.00 0.00 0.00 0.00 60.65 60.84 2pvj s ILE 164 Cb -0.19 -0.72 0.11 0.00 0.01 0.00 0.00 42.46 41.67 2pvj s ILE 164 CO 0.22 0.30 0.63 -0.62 0.00 0.00 0.00 174.94 175.47 2pvj s ASP 165 N 1.79 6.19 0.33 3.58 -1.08 -0.27 -3.15 116.67 124.05 2pvj s ASP 165 Ca 0.04 -1.57 0.04 0.00 -0.52 0.00 0.00 52.55 50.53 2pvj s ASP 165 Cb -0.13 -2.27 0.57 0.00 -1.46 0.00 0.00 42.92 39.64 2pvj s ASP 165 CO -0.06 -1.02 1.86 -0.74 0.52 0.00 0.00 175.17 175.73 2pvj h HIS 166 N 9.08 0.57 -0.43 -5.34 -0.00 -1.84 0.32 115.15 117.51 2pvj h HIS 166 Ca -0.30 -0.06 -0.02 0.00 -0.00 0.00 0.00 60.37 60.00 2pvj h HIS 166 Cb 1.09 -0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 28.32 2pvj h HIS 166 CO 0.80 0.56 0.20 1.49 -0.00 0.00 0.00 177.93 180.98 2pvj h GLU 167 N 0.53 0.62 -0.00 5.26 4.57 -1.91 -2.71 114.58 120.93 2pvj h GLU 167 Ca 0.11 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2pvj h GLU 167 Cb 0.34 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.82 2pvj h GLU 167 CO 0.01 0.54 -0.34 1.28 -1.18 0.00 0.00 179.01 179.32 2pvj n LEU 168 N -4.66 0.54 -3.76 1.64 4.77 -1.09 -4.94 117.00 109.49 2pvj n LEU 168 Ca 0.01 0.01 -0.26 0.00 -0.03 0.00 0.00 56.01 55.73 2pvj n LEU 168 Cb 0.12 -0.25 0.05 0.00 -2.33 0.00 0.00 43.42 41.01 2pvj n LEU 168 CO 0.37 0.12 0.13 0.54 -1.33 0.00 0.00 177.39 177.22 2pvj n ARG 169 N -1.26 -6.31 -4.30 3.23 1.74 0.11 -4.98 116.66 104.89 2pvj n ARG 169 Ca 0.08 0.69 -0.34 0.00 -0.77 0.00 0.00 57.85 57.51 2pvj n ARG 169 Cb 0.33 -5.60 -0.11 0.00 -1.02 0.00 0.00 32.46 26.06 2pvj n ARG 169 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2pvj s LYS 170 N -6.37 3.50 0.02 5.56 2.20 -0.77 -4.97 119.74 118.92 2pvj s LYS 170 Ca 0.52 -0.44 0.07 0.00 -0.36 0.00 0.00 55.97 55.76 2pvj s LYS 170 Cb -0.25 -2.94 -0.02 0.00 -1.51 0.00 0.00 37.83 33.11 2pvj s LYS 170 CO 0.79 0.42 -0.20 -1.17 -0.36 0.00 0.00 175.35 174.82 2pvj s LEU 171 N -0.09 2.13 -0.02 5.43 0.20 -1.26 -1.11 118.68 123.96 2pvj s LEU 171 Ca 0.04 -0.47 -0.00 0.00 0.69 0.00 0.00 54.13 54.39 2pvj s LEU 171 Cb -0.13 -0.98 0.02 0.00 -0.43 0.00 0.00 46.19 44.68 2pvj s LEU 171 CO 0.02 0.18 0.03 -0.13 -0.29 0.00 0.00 176.35 176.16 2pvj s ARG 172 N -0.95 -0.03 -0.24 1.98 1.81 -0.17 -4.62 118.95 116.74 2pvj s ARG 172 Ca 0.07 0.16 -0.20 0.00 -1.72 0.00 0.00 55.73 54.04 2pvj s ARG 172 Cb -0.08 -0.20 -0.02 0.00 -0.45 0.00 0.00 34.95 34.19 2pvj s ARG 172 CO 0.01 -0.14 0.62 -1.17 -0.68 0.00 0.00 175.30 173.94 2pvj s LEU 173 N 0.89 4.09 0.00 2.53 2.96 0.01 -1.06 118.68 128.09 2pvj s LEU 173 Ca -0.07 0.73 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 2pvj s LEU 173 Cb -0.11 -2.85 0.00 0.00 0.50 0.00 0.00 46.19 43.74 2pvj s LEU 173 CO -0.03 -0.33 0.03 2.30 -1.32 0.00 0.00 176.35 177.00 2pvj n ILE 174 N 5.04 0.00 -3.16 6.68 -5.35 -0.14 -2.43 119.36 120.00 2pvj n ILE 174 Ca -0.01 -1.99 -0.15 0.00 -0.27 0.00 0.00 62.75 60.33 2pvj n ILE 174 Cb 0.49 0.36 0.01 0.00 -1.74 0.00 0.00 39.64 38.77 2pvj n ILE 174 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2pvj n ASP 175 N -1.30 -7.01 -0.94 7.28 9.92 -1.26 -4.85 116.55 118.38 2pvj n ASP 175 Ca -0.16 0.05 0.04 0.00 -0.53 0.00 0.00 54.79 54.19 2pvj n ASP 175 Cb 0.54 -4.11 0.17 0.00 -0.64 0.00 0.00 41.12 37.08 2pvj n ASP 175 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 2pvj n TRP 176 N -0.92 0.77 0.31 1.24 7.02 -1.26 -4.42 117.44 120.17 2pvj n TRP 176 Ca -0.01 -0.29 0.20 0.00 -1.02 0.00 0.00 57.50 56.38 2pvj n TRP 176 Cb 0.55 -0.18 1.00 0.00 -2.42 0.00 0.00 31.31 30.26 2pvj n TRP 176 CO 0.00 0.00 0.00 0.78 -2.02 0.00 0.00 177.69 176.45 2pvj h GLY 177 N 4.83 0.00 -1.09 6.99 0.00 -1.91 -2.17 103.07 109.72 2pvj h GLY 177 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2pvj h GLY 177 CO 0.14 0.00 -0.12 1.04 0.00 0.00 0.00 176.54 177.60 2pvj n LEU 178 N -2.99 2.08 -4.75 3.11 4.77 -1.26 -4.83 117.00 113.13 2pvj n LEU 178 Ca -0.02 -0.91 -0.32 0.00 -0.03 0.00 0.00 56.01 54.73 2pvj n LEU 178 Cb 0.14 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.32 2pvj n LEU 178 CO 0.21 0.38 0.72 0.00 -1.33 0.00 0.00 177.39 177.37 2pvj s ALA 179 N -1.55 2.17 0.09 -1.18 0.00 -0.82 -4.64 121.76 115.83 2pvj s ALA 179 Ca 0.17 0.49 -0.08 0.00 0.00 0.00 0.00 51.96 52.54 2pvj s ALA 179 Cb 0.13 -3.35 -0.00 0.00 0.00 0.00 0.00 23.12 19.90 2pvj s ALA 179 CO 0.28 -1.80 0.19 -1.21 0.00 0.00 0.00 175.76 173.21 2pvj s GLU 180 N -4.47 0.86 0.16 0.00 0.41 -0.50 -4.92 118.70 110.23 2pvj s GLU 180 Ca 0.66 -0.99 -0.26 0.00 -0.41 0.00 0.00 54.97 53.96 2pvj s GLU 180 Cb -0.21 0.34 -0.08 0.00 -1.78 0.00 0.00 34.13 32.41 2pvj s GLU 180 CO 0.50 -0.27 0.82 -0.06 -0.49 0.00 0.00 175.26 175.76 2pvj s PHE 181 N -3.87 3.89 -0.17 1.61 0.40 -1.26 -0.87 117.98 117.71 2pvj s PHE 181 Ca 0.06 1.67 -0.20 0.00 -0.60 0.00 0.00 56.93 57.87 2pvj s PHE 181 Cb 0.05 -2.83 -0.03 0.00 0.51 0.00 0.00 43.02 40.71 2pvj s PHE 181 CO -0.10 0.45 0.56 -0.47 0.70 0.00 0.00 175.22 176.36 2pvj s TYR 182 N -0.90 3.43 -0.09 0.36 5.04 0.18 -4.90 117.35 120.46 2pvj s TYR 182 Ca 0.38 0.90 0.01 0.00 -2.44 0.00 0.00 57.07 55.91 2pvj s TYR 182 Cb -0.23 -2.70 0.02 0.00 0.35 0.00 0.00 41.96 39.40 2pvj s TYR 182 CO 0.27 -0.04 -0.10 -1.01 -1.34 0.00 0.00 175.55 173.32 2pvj s HIS 183 N 1.40 1.50 -0.15 4.97 3.76 -1.26 -4.51 115.29 121.00 2pvj s HIS 183 Ca 0.27 -0.66 -0.39 0.00 -0.15 0.00 0.00 55.06 54.14 2pvj s HIS 183 Cb -0.16 -1.17 -0.16 0.00 1.11 0.00 0.00 32.58 32.21 2pvj s HIS 183 CO 0.11 -0.40 1.63 -2.30 -0.85 0.00 0.00 174.74 172.93 2pvj n PRO 184 N 4.35 1.22 -0.10 8.40 -0.02 -1.26 -1.61 135.00 145.97 2pvj n PRO 184 Ca -0.18 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2pvj n PRO 184 Cb 0.51 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 2pvj n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2pvj n GLY 185 N 3.69 2.29 3.76 -1.23 0.00 -1.26 -5.02 105.19 107.42 2pvj n GLY 185 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 2pvj n GLY 185 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2pvj s LYS 186 N -0.17 4.28 -0.34 1.61 2.20 -0.64 -4.89 119.74 121.80 2pvj s LYS 186 Ca 0.00 2.31 -0.18 0.00 -0.36 0.00 0.00 55.97 57.74 2pvj s LYS 186 Cb 0.00 -3.07 -0.01 0.00 -1.51 0.00 0.00 37.83 33.25 2pvj s LYS 186 CO 0.00 -0.33 0.49 -1.21 -0.36 0.00 0.00 175.35 173.94 2pvj s GLU 187 N -1.35 3.68 0.34 4.03 2.02 -1.26 -4.20 118.70 121.96 2pvj s GLU 187 Ca 0.53 -0.12 0.06 0.00 0.02 0.00 0.00 54.97 55.46 2pvj s GLU 187 Cb -0.42 -3.78 -0.01 0.00 0.10 0.00 0.00 34.13 30.02 2pvj s GLU 187 CO 0.51 -0.59 0.48 0.71 0.02 0.00 0.00 175.26 176.40 2pvj s TYR 188 N 2.34 3.14 0.12 1.61 1.51 -0.14 -4.96 117.35 120.96 2pvj s TYR 188 Ca 0.18 -0.17 -0.30 0.00 -1.01 0.00 0.00 57.07 55.77 2pvj s TYR 188 Cb -0.16 -2.00 -0.07 0.00 -0.11 0.00 0.00 41.96 39.63 2pvj s TYR 188 CO 0.13 -0.02 1.16 1.21 -1.11 0.00 0.00 175.55 176.92 2pvj s ASN 189 N -4.17 7.15 0.00 2.29 3.84 -1.26 -4.66 114.94 118.13 2pvj s ASN 189 Ca 0.45 2.07 0.29 0.00 0.21 0.00 0.00 52.86 55.87 2pvj s ASN 189 Cb -0.10 -2.59 1.19 0.00 -0.55 0.00 0.00 41.25 39.21 2pvj s ASN 189 CO 0.32 -0.37 1.84 1.33 -2.79 0.00 0.00 177.10 177.43 2pvj n VAL 190 N 3.17 0.00 -1.60 -5.21 0.24 -1.26 -4.40 118.33 109.27 2pvj n VAL 190 Ca 0.06 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.34 61.89 2pvj n VAL 190 Cb 0.46 -0.08 -0.01 0.00 -1.47 0.00 0.00 33.84 32.74 2pvj n VAL 190 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2pvj n ARG 191 N -0.97 3.43 -4.31 7.34 1.74 -1.26 -4.85 116.66 117.78 2pvj n ARG 191 Ca 0.14 -2.55 -0.17 0.00 -0.77 0.00 0.00 57.85 54.50 2pvj n ARG 191 Cb 0.28 -2.99 -0.10 0.00 -1.02 0.00 0.00 32.46 28.63 2pvj n ARG 191 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2pvj s VAL 192 N 2.20 0.35 0.38 1.55 -7.23 -1.26 -5.11 120.40 111.27 2pvj s VAL 192 Ca 0.57 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.74 2pvj s VAL 192 Cb 0.16 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.55 2pvj s VAL 192 CO -0.07 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.72 2pvj n ALA 193 N -0.51 -2.95 -2.66 1.32 0.00 -0.10 -4.83 120.51 110.78 2pvj n ALA 193 Ca 0.01 0.54 -0.37 0.00 0.00 0.00 0.00 53.44 53.62 2pvj n ALA 193 Cb 0.65 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.92 2pvj n ALA 193 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2pvj s SER 194 N -6.72 6.63 0.20 0.00 0.01 -1.26 -4.92 113.70 107.64 2pvj s SER 194 Ca 0.00 0.75 -0.12 0.00 1.31 0.00 0.00 55.95 57.88 2pvj s SER 194 Cb 0.00 -2.17 0.24 0.00 0.21 0.00 0.00 66.02 64.30 2pvj s SER 194 CO 0.00 0.35 1.26 -1.14 0.41 0.00 0.00 173.24 174.12 2pvj n ARG 195 N 1.79 -0.16 0.10 12.44 0.63 -1.26 0.23 116.66 130.42 2pvj n ARG 195 Ca -0.16 1.26 0.08 0.00 -0.92 0.00 0.00 57.85 58.11 2pvj n ARG 195 Cb 0.53 -1.87 0.40 0.00 0.45 0.00 0.00 32.46 31.97 2pvj n ARG 195 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 2pvj n TYR 196 N -5.23 0.50 -0.02 -0.14 4.01 -1.26 -2.18 117.16 112.83 2pvj n TYR 196 Ca 0.09 0.23 0.01 0.00 -0.16 0.00 0.00 57.90 58.08 2pvj n TYR 196 Cb 0.35 -0.87 0.03 0.00 -0.31 0.00 0.00 39.34 38.54 2pvj n TYR 196 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 2pvj n PHE 197 N -1.99 0.09 -2.35 -0.72 3.72 0.14 -4.62 117.46 111.73 2pvj n PHE 197 Ca 0.01 -0.44 -0.42 0.00 -0.05 0.00 0.00 57.45 56.55 2pvj n PHE 197 Cb 0.10 -0.04 -0.03 0.00 -0.94 0.00 0.00 39.48 38.57 2pvj n PHE 197 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2pvj s LYS 198 N -0.91 4.45 0.63 -1.08 1.02 -0.88 -4.10 119.74 118.87 2pvj s LYS 198 Ca 0.05 1.89 -0.12 0.00 0.02 0.00 0.00 55.97 57.80 2pvj s LYS 198 Cb 0.03 -3.27 -0.03 0.00 -0.52 0.00 0.00 37.83 34.04 2pvj s LYS 198 CO 0.03 -0.19 1.04 0.20 -0.92 0.00 0.00 175.35 175.51 2pvj s GLY 199 N 0.51 1.75 0.40 -3.33 0.00 -1.26 -4.90 107.32 100.50 2pvj s GLY 199 Ca 0.56 0.05 0.17 0.00 0.00 0.00 0.00 44.72 45.50 2pvj s GLY 199 CO 0.34 0.34 1.81 -2.55 0.00 0.00 0.00 173.10 173.04 2pvj h PRO 200 N -0.25 0.43 -0.99 2.90 0.11 -1.92 -0.53 132.00 131.74 2pvj h PRO 200 Ca -0.44 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 65.70 2pvj h PRO 200 Cb 1.20 -0.10 -0.07 0.00 0.11 0.00 0.00 31.00 32.15 2pvj h PRO 200 CO 0.60 0.28 0.64 1.05 -0.21 0.00 0.00 178.00 180.36 2pvj h GLU 201 N 0.44 1.13 -0.23 1.05 9.09 -1.90 -0.57 114.58 123.59 2pvj h GLU 201 Ca 0.53 -0.07 -0.16 0.00 0.05 0.00 0.00 59.36 59.71 2pvj h GLU 201 Cb 1.29 -0.25 -0.00 0.00 -1.65 0.00 0.00 28.75 28.13 2pvj h GLU 201 CO -0.24 0.75 -0.52 -0.07 0.05 0.00 0.00 179.01 178.97 2pvj h LEU 202 N 1.16 0.72 -1.15 3.06 3.38 -1.34 0.14 115.31 121.29 2pvj h LEU 202 Ca 0.43 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2pvj h LEU 202 Cb 0.17 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2pvj h LEU 202 CO -0.17 1.11 0.00 -0.07 0.09 0.00 0.00 178.44 179.40 2pvj h LEU 203 N 0.51 0.00 -2.92 1.67 3.38 -1.00 -2.97 115.31 113.98 2pvj h LEU 203 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2pvj h LEU 203 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2pvj h LEU 203 CO 0.10 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.96 2pvj n VAL 204 N -3.00 1.05 -3.00 1.22 0.24 -0.32 -4.99 118.33 109.53 2pvj n VAL 204 Ca 0.01 -1.04 -0.16 0.00 -2.04 0.00 0.00 64.34 61.12 2pvj n VAL 204 Cb 0.34 0.47 0.04 0.00 -1.47 0.00 0.00 33.84 33.21 2pvj n VAL 204 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2pvj n ASP 205 N 0.26 -4.86 -4.50 -1.34 9.92 -1.04 -4.89 116.55 110.11 2pvj n ASP 205 Ca 0.10 -0.28 -0.43 0.00 -0.53 0.00 0.00 54.79 53.65 2pvj n ASP 205 Cb 0.41 -3.59 -0.05 0.00 -0.64 0.00 0.00 41.12 37.25 2pvj n ASP 205 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2pvj s LEU 206 N -5.02 4.40 0.21 0.64 0.20 0.47 -4.92 118.68 114.66 2pvj s LEU 206 Ca 0.30 -0.53 0.12 0.00 0.69 0.00 0.00 54.13 54.70 2pvj s LEU 206 Cb -0.13 -2.70 -0.01 0.00 -0.43 0.00 0.00 46.19 42.91 2pvj s LEU 206 CO 0.37 -1.10 1.40 1.56 -0.29 0.00 0.00 176.35 178.29 2pvj h GLN 207 N 9.19 0.00 -2.46 1.98 4.20 -1.83 -3.38 115.11 122.81 2pvj h GLN 207 Ca -0.27 0.00 -0.64 0.00 0.06 0.00 0.00 58.65 57.80 2pvj h GLN 207 Cb 1.08 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.74 2pvj h GLN 207 CO 1.04 0.72 1.89 -0.40 -0.67 0.00 0.00 178.83 181.41 2pvj n ASP 208 N -3.32 7.58 -4.36 1.46 5.75 -1.26 -0.97 116.55 121.43 2pvj n ASP 208 Ca 0.01 -3.07 -0.26 0.00 -0.01 0.00 0.00 54.79 51.45 2pvj n ASP 208 Cb 0.81 -1.35 0.16 0.00 -1.03 0.00 0.00 41.12 39.70 2pvj n ASP 208 CO 0.00 0.00 0.00 -0.72 -0.11 0.00 0.00 177.20 176.37 2pvj s TYR 209 N -0.88 1.30 0.00 2.11 -0.85 -1.26 -4.60 117.35 113.16 2pvj s TYR 209 Ca 0.57 -0.13 0.00 0.00 -0.52 0.00 0.00 57.07 57.00 2pvj s TYR 209 Cb 0.24 -3.50 0.00 0.00 0.38 0.00 0.00 41.96 39.08 2pvj s TYR 209 CO -0.12 -2.25 0.00 -0.40 -1.52 0.00 0.00 175.55 171.26 2pvj n ASP 210 N -3.29 0.00 -0.27 -0.18 5.68 -1.26 -4.94 116.55 112.29 2pvj n ASP 210 Ca 0.17 0.00 0.26 0.00 -0.50 0.00 0.00 54.79 54.72 2pvj n ASP 210 Cb 0.60 0.00 0.62 0.00 -1.14 0.00 0.00 41.12 41.20 2pvj n ASP 210 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 2pvj h TYR 211 N 0.00 0.32 0.00 2.11 0.05 -1.95 -1.27 116.97 116.23 2pvj h TYR 211 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 2pvj h TYR 211 Cb 0.00 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 37.65 2pvj h TYR 211 CO 0.00 0.05 0.18 0.66 -1.05 0.00 0.00 178.16 178.00 2pvj h SER 212 N 0.21 0.00 -0.67 3.88 4.64 -1.95 -1.27 113.55 118.39 2pvj h SER 212 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 2pvj h SER 212 Cb 1.66 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.71 2pvj h SER 212 CO -0.13 0.00 0.44 0.25 -0.87 0.00 0.00 176.83 176.51 2pvj h LEU 213 N 0.00 0.77 -2.05 5.97 5.85 -1.59 -1.60 115.31 122.66 2pvj h LEU 213 Ca 0.00 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2pvj h LEU 213 Cb 0.36 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 2pvj h LEU 213 CO 0.00 0.57 -0.07 0.44 -0.34 0.00 0.00 178.44 179.04 2pvj h ASP 214 N 0.90 0.00 0.74 1.25 3.32 -1.44 -1.91 116.42 119.28 2pvj h ASP 214 Ca 0.24 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.15 2pvj h ASP 214 Cb -0.09 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 2pvj h ASP 214 CO -0.05 0.07 -0.66 0.24 -1.72 0.00 0.00 179.24 177.12 2pvj h MET 215 N 0.00 0.00 -0.15 3.56 2.86 -1.39 -0.40 114.93 119.41 2pvj h MET 215 Ca -0.00 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 2pvj h MET 215 Cb 0.15 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 2pvj h MET 215 CO 0.01 0.66 -0.21 2.35 1.06 0.00 0.00 176.91 180.78 2pvj h TRP 216 N 0.00 0.51 -0.75 -0.22 2.91 -1.16 -1.36 115.95 115.88 2pvj h TRP 216 Ca -0.01 -0.17 0.03 0.00 1.13 0.00 0.00 58.89 59.88 2pvj h TRP 216 Cb 1.21 -0.10 -0.05 0.00 -0.51 0.00 0.00 29.16 29.71 2pvj h TRP 216 CO 0.00 0.84 0.48 0.77 -1.03 0.00 0.00 178.44 179.49 2pvj h SER 217 N 0.04 0.78 -0.82 2.65 0.02 -1.35 -0.15 113.55 114.73 2pvj h SER 217 Ca 0.02 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 2pvj h SER 217 Cb 0.78 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 63.11 2pvj h SER 217 CO 0.05 0.54 0.39 0.25 -1.14 0.00 0.00 176.83 176.92 2pvj h LEU 218 N 0.93 1.08 -1.10 5.07 5.85 -1.02 -1.73 115.31 124.39 2pvj h LEU 218 Ca 0.30 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.88 2pvj h LEU 218 Cb 0.02 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.73 2pvj h LEU 218 CO -0.11 0.92 0.57 1.23 -0.34 0.00 0.00 178.44 180.71 2pvj h GLY 219 N 1.17 1.25 0.94 3.75 0.00 -0.02 0.39 103.07 110.56 2pvj h GLY 219 Ca 0.28 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 2pvj h GLY 219 CO -0.03 0.47 0.10 0.00 0.00 0.00 0.00 176.54 177.08 2pvj h MET 221 N 0.52 0.70 -0.31 0.00 2.07 -0.80 -1.38 114.93 115.72 2pvj h MET 221 Ca 0.13 -0.07 -0.01 0.00 -2.07 0.00 0.00 59.70 57.67 2pvj h MET 221 Cb 0.31 -0.14 -0.01 0.00 -1.87 0.00 0.00 31.60 29.88 2pvj h MET 221 CO 0.00 0.52 0.14 0.35 1.07 0.00 0.00 176.91 178.99 2pvj h PHE 222 N 0.68 0.45 -0.88 -0.22 3.57 -0.70 -1.65 116.94 118.21 2pvj h PHE 222 Ca 0.18 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.66 2pvj h PHE 222 Cb 0.01 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.57 2pvj h PHE 222 CO -0.02 0.42 0.58 0.00 -2.23 0.00 0.00 178.31 177.05 2pvj h ALA 223 N 0.99 1.37 -0.65 2.41 0.00 -0.73 -1.59 119.26 121.06 2pvj h ALA 223 Ca 0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2pvj h ALA 223 Cb 0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2pvj h ALA 223 CO -0.01 0.58 0.18 0.78 0.00 0.00 0.00 179.25 180.78 2pvj h GLY 224 N 1.19 1.08 0.51 0.00 0.00 -0.86 -1.94 103.07 103.06 2pvj h GLY 224 Ca 0.32 -0.64 -0.00 0.00 0.00 0.00 0.00 47.33 47.01 2pvj h GLY 224 CO -0.07 0.60 -0.02 -0.33 0.00 0.00 0.00 176.54 176.71 2pvj h MET 225 N 0.97 -0.06 0.00 4.80 2.07 -0.58 -1.67 114.93 120.45 2pvj h MET 225 Ca 0.21 0.00 -0.12 0.00 -2.07 0.00 0.00 59.70 57.72 2pvj h MET 225 Cb 0.31 0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 30.04 2pvj h MET 225 CO -0.00 0.40 -0.59 -0.84 1.07 0.00 0.00 176.91 176.95 2pvj h ILE 226 N -0.55 1.30 -0.01 -1.22 3.07 -1.34 -3.05 117.51 115.71 2pvj h ILE 226 Ca -0.01 -2.09 0.00 0.00 1.55 0.00 0.00 64.86 64.31 2pvj h ILE 226 Cb 0.49 2.16 0.00 0.00 -0.27 0.00 0.00 36.82 39.20 2pvj h ILE 226 CO 0.01 0.57 -0.29 0.49 -1.05 0.00 0.00 178.15 177.88 2pvj n PHE 227 N -3.67 0.00 -3.67 0.16 3.72 -0.73 -4.53 117.46 108.73 2pvj n PHE 227 Ca -0.01 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.14 2pvj n PHE 227 Cb 0.62 -0.07 0.07 0.00 -0.94 0.00 0.00 39.48 39.16 2pvj n PHE 227 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2pvj n ARG 228 N -0.27 -7.20 -3.82 -1.08 5.12 -0.71 -4.76 116.66 103.94 2pvj n ARG 228 Ca 0.12 0.77 -0.28 0.00 -1.93 0.00 0.00 57.85 56.52 2pvj n ARG 228 Cb 0.40 -5.77 -0.16 0.00 -1.16 0.00 0.00 32.46 25.77 2pvj n ARG 228 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2pvj s LYS 229 N -6.32 1.03 -0.18 5.56 2.20 -0.75 -5.05 119.74 116.23 2pvj s LYS 229 Ca 0.55 -0.58 0.00 0.00 -0.36 0.00 0.00 55.97 55.58 2pvj s LYS 229 Cb -0.25 -2.20 0.01 0.00 -1.51 0.00 0.00 37.83 33.88 2pvj s LYS 229 CO 0.76 -0.59 -0.18 -2.00 -0.36 0.00 0.00 175.35 172.98 2pvj s GLU 230 N 1.70 3.05 0.61 4.03 -6.30 -1.26 -2.58 118.70 117.96 2pvj s GLU 230 Ca -0.02 -0.80 -0.03 0.00 -2.50 0.00 0.00 54.97 51.61 2pvj s GLU 230 Cb -0.17 -2.63 0.04 0.00 0.00 0.00 0.00 34.13 31.37 2pvj s GLU 230 CO -0.07 -0.19 0.89 -1.25 0.02 0.00 0.00 175.26 174.66 2pvj s PRO 231 N 1.28 2.51 0.02 4.30 0.04 -1.26 -5.08 135.00 136.80 2pvj s PRO 231 Ca 0.04 -0.39 -0.23 0.00 0.04 0.00 0.00 61.00 60.47 2pvj s PRO 231 Cb -0.13 -2.32 -0.17 0.00 0.04 0.00 0.00 34.50 31.92 2pvj s PRO 231 CO -0.11 -0.90 1.33 0.35 0.04 0.00 0.00 177.00 177.72 2pvj h PHE 232 N -0.23 0.24 -3.38 0.56 3.57 -1.75 -3.37 116.94 112.58 2pvj h PHE 232 Ca -0.44 -0.07 -0.73 0.00 3.53 0.00 0.00 57.97 60.26 2pvj h PHE 232 Cb 1.29 -0.05 -0.30 0.00 2.79 0.00 0.00 35.95 39.69 2pvj h PHE 232 CO 0.38 0.61 -0.32 -0.06 -2.23 0.00 0.00 178.31 176.69 2pvj s PHE 233 N -4.38 3.46 -1.14 0.41 0.08 -1.26 -5.02 117.98 110.13 2pvj s PHE 233 Ca -0.15 -1.97 -0.10 0.00 0.12 0.00 0.00 56.93 54.83 2pvj s PHE 233 Cb 0.04 -3.52 0.26 0.00 -0.57 0.00 0.00 43.02 39.23 2pvj s PHE 233 CO 0.72 -0.98 1.19 0.98 -0.10 0.00 0.00 175.22 177.03 2pvj n TYR 234 N 4.63 5.15 -3.57 0.36 9.36 -1.26 -4.59 117.16 127.24 2pvj n TYR 234 Ca -0.04 -3.77 -0.28 0.00 3.32 0.00 0.00 57.90 57.13 2pvj n TYR 234 Cb 0.41 -1.79 -0.03 0.00 -0.63 0.00 0.00 39.34 37.30 2pvj n TYR 234 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 2pvj s GLY 235 N 1.51 1.87 0.04 2.98 0.00 -1.26 -4.99 107.32 107.47 2pvj s GLY 235 Ca 0.33 -0.70 0.23 0.00 0.00 0.00 0.00 44.72 44.59 2pvj s GLY 235 CO -0.06 -0.63 1.09 -2.39 0.00 0.00 0.00 173.10 171.11 2pvj n HIS 236 N -0.66 0.21 -3.93 1.90 1.44 -1.26 -4.81 115.22 108.11 2pvj n HIS 236 Ca -0.03 0.06 -0.08 0.00 -2.01 0.00 0.00 57.72 55.65 2pvj n HIS 236 Cb 0.54 -0.38 -0.03 0.00 0.12 0.00 0.00 29.99 30.24 2pvj n HIS 236 CO 0.00 0.00 0.00 0.16 -2.81 0.00 0.00 176.34 173.69 2pvj s ASP 237 N -3.71 -0.10 0.35 4.39 1.47 -1.26 -5.02 116.67 112.78 2pvj s ASP 237 Ca 0.05 -0.85 0.06 0.00 1.18 0.00 0.00 52.55 52.99 2pvj s ASP 237 Cb 0.15 0.67 0.73 0.00 -0.34 0.00 0.00 42.92 44.13 2pvj s ASP 237 CO 0.79 -1.28 1.92 0.78 0.68 0.00 0.00 175.17 178.06 2pvj h ASN 238 N 2.12 0.70 -0.15 2.11 2.35 -1.97 0.90 115.58 121.66 2pvj h ASN 238 Ca -0.24 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.48 2pvj h ASN 238 Cb 1.25 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 39.48 2pvj h ASN 238 CO 0.31 0.43 -0.08 0.45 -1.65 0.00 0.00 177.43 176.89 2pvj h HIS 239 N 0.78 0.36 0.00 1.19 3.86 -1.97 -2.95 115.15 116.42 2pvj h HIS 239 Ca 0.37 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.45 2pvj h HIS 239 Cb 0.39 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.77 2pvj h HIS 239 CO -0.00 0.64 -0.15 0.22 0.86 0.00 0.00 177.93 179.50 2pvj h ASP 240 N -0.03 0.00 -0.44 2.45 3.58 -1.79 -2.27 116.42 117.92 2pvj h ASP 240 Ca 0.03 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.46 2pvj h ASP 240 Cb 0.55 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.58 2pvj h ASP 240 CO 0.02 0.15 0.17 -0.61 -2.88 0.00 0.00 179.24 176.09 2pvj h GLN 241 N 0.00 0.66 -0.46 0.28 5.75 -0.68 -0.18 115.11 120.47 2pvj h GLN 241 Ca -0.00 -0.12 -0.07 0.00 -0.15 0.00 0.00 58.65 58.30 2pvj h GLN 241 Cb 0.31 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.74 2pvj h GLN 241 CO 0.02 0.61 -0.01 1.25 -2.65 0.00 0.00 178.83 178.04 2pvj h LEU 242 N 0.56 0.74 -0.46 -2.39 5.85 -1.30 -2.20 115.31 116.10 2pvj h LEU 242 Ca 0.14 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2pvj h LEU 242 Cb 0.20 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2pvj h LEU 242 CO -0.01 0.81 0.25 0.58 -0.34 0.00 0.00 178.44 179.74 2pvj h VAL 243 N 0.72 1.17 -0.87 1.05 2.07 -0.98 0.33 116.25 119.74 2pvj h VAL 243 Ca 0.14 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2pvj h VAL 243 Cb 0.46 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 2pvj h VAL 243 CO 0.02 0.18 0.56 0.11 0.02 0.00 0.00 177.57 178.46 2pvj h LYS 244 N 0.61 1.16 -0.21 1.57 1.79 -0.69 -0.68 116.57 120.12 2pvj h LYS 244 Ca 0.16 -0.08 -0.06 0.00 -2.18 0.00 0.00 60.65 58.49 2pvj h LYS 244 Cb 0.06 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.44 2pvj h LYS 244 CO -0.03 0.78 -0.11 0.82 -1.08 0.00 0.00 179.45 179.84 2pvj h ILE 245 N 1.19 1.31 -0.26 1.86 2.04 -0.95 -3.14 117.51 119.55 2pvj h ILE 245 Ca 0.32 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.99 2pvj h ILE 245 Cb -0.11 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2pvj h ILE 245 CO -0.07 0.36 0.09 0.00 0.00 0.00 0.00 178.15 178.53 2pvj h ALA 246 N 0.70 1.68 0.00 1.87 0.00 -0.43 -0.21 119.26 122.87 2pvj h ALA 246 Ca 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2pvj h ALA 246 Cb 0.60 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2pvj h ALA 246 CO 0.03 0.26 0.00 1.63 0.00 0.00 0.00 179.25 181.17 2pvj n LYS 247 N -4.42 0.08 -0.04 0.00 5.02 -0.31 -0.74 118.16 117.76 2pvj n LYS 247 Ca 0.01 0.19 -0.08 0.00 -2.02 0.00 0.00 58.31 56.41 2pvj n LYS 247 Cb 0.14 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 2pvj n LYS 247 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2pvj n VAL 248 N -1.43 1.13 0.35 -0.18 0.31 -0.51 -4.62 118.33 113.38 2pvj n VAL 248 Ca 0.05 0.10 0.14 0.00 -0.01 0.00 0.00 64.34 64.62 2pvj n VAL 248 Cb 0.17 -1.85 0.44 0.00 -0.91 0.00 0.00 33.84 31.69 2pvj n VAL 248 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2pvj h LEU 249 N -0.49 0.00 0.00 7.52 4.07 -1.18 0.16 115.31 125.40 2pvj h LEU 249 Ca -0.13 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.83 2pvj h LEU 249 Cb 0.81 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.55 2pvj h LEU 249 CO -0.08 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.89 2pvj n GLY 250 N 0.60 0.00 0.23 0.83 0.00 0.08 -4.39 105.19 102.54 2pvj n GLY 250 Ca 0.03 -1.55 0.13 0.00 0.00 0.00 0.00 46.02 44.63 2pvj n GLY 250 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2pvj h THR 251 N 0.00 0.00 -0.23 2.61 1.35 -1.10 -3.28 112.91 112.27 2pvj h THR 251 Ca 0.00 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 2pvj h THR 251 Cb 0.00 1.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.28 2pvj h THR 251 CO 0.00 0.00 0.15 0.44 -0.25 0.00 0.00 175.52 175.86 2pvj h ASP 252 N 0.00 0.26 0.14 5.36 3.45 -1.87 0.18 116.42 123.94 2pvj h ASP 252 Ca 0.00 -0.01 -0.07 0.00 0.43 0.00 0.00 57.03 57.39 2pvj h ASP 252 Cb 0.88 -0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 39.57 2pvj h ASP 252 CO 0.00 0.19 -0.24 1.23 -1.57 0.00 0.00 179.24 178.85 2pvj h GLY 253 N 0.31 0.19 0.89 2.75 0.00 -1.81 -1.88 103.07 103.52 2pvj h GLY 253 Ca 0.08 -0.14 -0.09 0.00 0.00 0.00 0.00 47.33 47.18 2pvj h GLY 253 CO -0.02 0.13 -0.19 -2.00 0.00 0.00 0.00 176.54 174.46 2pvj h LEU 254 N 0.17 0.61 -0.37 3.11 5.85 -1.48 -1.48 115.31 121.71 2pvj h LEU 254 Ca 0.03 -0.44 0.01 0.00 0.84 0.00 0.00 57.88 58.32 2pvj h LEU 254 Cb 0.52 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2pvj h LEU 254 CO 0.04 0.93 0.22 0.78 -0.34 0.00 0.00 178.44 180.07 2pvj h ASN 255 N 0.30 0.37 -0.58 1.25 -0.26 -0.69 0.72 115.58 116.69 2pvj h ASN 255 Ca 0.05 0.00 0.01 0.00 -0.56 0.00 0.00 56.30 55.80 2pvj h ASN 255 Cb 0.73 -0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 37.88 2pvj h ASN 255 CO 0.05 0.27 0.37 0.00 -1.06 0.00 0.00 177.43 177.06 2pvj h ALA 256 N 1.16 0.73 -0.06 -0.83 0.00 -1.30 -0.62 119.26 118.35 2pvj h ALA 256 Ca 0.15 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2pvj h ALA 256 Cb -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2pvj h ALA 256 CO -0.06 0.14 -0.03 -0.92 0.00 0.00 0.00 179.25 178.38 2pvj h TYR 257 N 0.75 -0.07 -0.70 0.00 3.20 -0.65 -0.95 116.97 118.55 2pvj h TYR 257 Ca 0.22 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.07 2pvj h TYR 257 Cb -0.06 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 2pvj h TYR 257 CO -0.04 -0.05 0.33 -0.07 -1.64 0.00 0.00 178.16 176.69 2pvj h LEU 258 N -0.03 0.90 -0.43 2.82 3.38 -0.56 -2.79 115.31 118.60 2pvj h LEU 258 Ca 0.03 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 2pvj h LEU 258 Cb 0.07 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2pvj h LEU 258 CO -0.07 0.76 -0.26 0.78 0.09 0.00 0.00 178.44 179.74 2pvj h ASN 259 N 0.99 0.96 -0.88 -0.43 2.35 -0.77 0.10 115.58 117.90 2pvj h ASN 259 Ca 0.24 -0.42 0.01 0.00 -0.55 0.00 0.00 56.30 55.58 2pvj h ASN 259 Cb 0.11 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.16 2pvj h ASN 259 CO -0.03 1.18 0.58 0.50 -1.65 0.00 0.00 177.43 178.01 2pvj h LYS 260 N 0.76 1.14 -0.54 0.81 3.64 -0.92 -2.67 116.57 118.79 2pvj h LYS 260 Ca 0.09 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2pvj h LYS 260 Cb 0.84 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2pvj h LYS 260 CO 0.07 0.75 0.00 0.66 -2.27 0.00 0.00 179.45 178.67 2pvj n TYR 261 N -4.41 1.14 -3.84 1.91 4.01 -1.10 -4.98 117.16 109.88 2pvj n TYR 261 Ca 0.10 -0.61 -0.25 0.00 -0.16 0.00 0.00 57.90 56.97 2pvj n TYR 261 Cb 0.04 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 38.89 2pvj n TYR 261 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2pvj n ARG 262 N 0.81 -3.30 -4.34 -0.72 3.00 -0.59 -4.93 116.66 106.59 2pvj n ARG 262 Ca 0.22 0.46 -0.35 0.00 -0.01 0.00 0.00 57.85 58.18 2pvj n ARG 262 Cb 0.76 -4.61 -0.09 0.00 0.00 0.00 0.00 32.46 28.52 2pvj n ARG 262 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2pvj s ILE 263 N -3.81 4.36 -0.20 0.55 1.01 0.25 -5.03 121.20 118.34 2pvj s ILE 263 Ca 0.09 -0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.48 2pvj s ILE 263 Cb -0.03 -2.85 0.02 0.00 0.01 0.00 0.00 42.46 39.61 2pvj s ILE 263 CO 0.87 0.58 -0.16 -0.70 0.00 0.00 0.00 174.94 175.53 2pvj s GLU 264 N -0.97 2.89 0.54 2.79 2.12 -1.26 -4.65 118.70 120.16 2pvj s GLU 264 Ca 0.14 -0.91 -0.20 0.00 0.36 0.00 0.00 54.97 54.37 2pvj s GLU 264 Cb -0.11 -2.69 -0.06 0.00 0.26 0.00 0.00 34.13 31.52 2pvj s GLU 264 CO 0.03 -0.28 1.14 -0.51 -0.54 0.00 0.00 175.26 175.10 2pvj s LEU 265 N 1.28 3.77 0.35 2.70 1.43 -1.26 -4.96 118.68 121.99 2pvj s LEU 265 Ca 0.02 2.20 -0.29 0.00 -1.03 0.00 0.00 54.13 55.04 2pvj s LEU 265 Cb -0.15 -4.55 -0.11 0.00 0.03 0.00 0.00 46.19 41.42 2pvj s LEU 265 CO -0.10 -1.21 1.42 -1.81 0.23 0.00 0.00 176.35 174.87 2pvj s ASP 266 N -1.72 6.54 0.29 2.29 1.01 -1.26 -4.73 116.67 119.09 2pvj s ASP 266 Ca 0.72 2.87 0.02 0.00 0.71 0.00 0.00 52.55 56.87 2pvj s ASP 266 Cb -0.25 -2.66 0.71 0.00 1.01 0.00 0.00 42.92 41.74 2pvj s ASP 266 CO 0.28 -0.73 1.63 -0.65 0.21 0.00 0.00 175.17 175.91 2pvj h PRO 267 N 3.38 0.15 -0.77 8.23 0.11 -1.99 0.14 132.00 141.24 2pvj h PRO 267 Ca -0.50 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2pvj h PRO 267 Cb 1.23 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2pvj h PRO 267 CO 0.66 0.10 0.32 -0.56 -0.21 0.00 0.00 178.00 178.31 2pvj h GLN 268 N 0.15 1.14 -0.25 1.05 3.07 -2.00 -2.29 115.11 115.97 2pvj h GLN 268 Ca 0.56 -0.20 -0.05 0.00 0.09 0.00 0.00 58.65 59.04 2pvj h GLN 268 Cb 1.13 -0.19 -0.01 0.00 0.08 0.00 0.00 27.48 28.50 2pvj h GLN 268 CO -0.71 0.92 -0.05 1.25 0.09 0.00 0.00 178.83 180.33 2pvj h LEU 269 N 1.10 0.49 -0.96 0.06 5.85 -1.17 -2.35 115.31 118.33 2pvj h LEU 269 Ca 0.26 -0.36 0.09 0.00 0.84 0.00 0.00 57.88 58.70 2pvj h LEU 269 Cb 0.20 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.02 2pvj h LEU 269 CO -0.02 0.74 0.60 -0.08 -0.34 0.00 0.00 178.44 179.34 2pvj h GLU 270 N 0.24 1.01 -0.44 1.25 4.81 -0.95 -1.03 114.58 119.46 2pvj h GLU 270 Ca 0.07 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 2pvj h GLU 270 Cb 0.52 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 2pvj h GLU 270 CO 0.02 0.67 0.09 0.00 -0.73 0.00 0.00 179.01 179.06 2pvj h ALA 271 N 1.48 0.59 -0.27 2.92 0.00 -1.26 -2.45 119.26 120.27 2pvj h ALA 271 Ca 0.44 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 2pvj h ALA 271 Cb 0.30 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2pvj h ALA 271 CO -0.21 0.29 -0.12 -0.07 0.00 0.00 0.00 179.25 179.14 2pvj h LEU 272 N 0.59 0.44 -0.36 0.00 3.38 -0.82 -3.01 115.31 115.53 2pvj h LEU 272 Ca 0.14 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.84 2pvj h LEU 272 Cb 0.36 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2pvj h LEU 272 CO 0.01 0.59 -0.38 0.58 0.09 0.00 0.00 178.44 179.33 2pvj h VAL 273 N 0.42 1.28 0.00 1.22 2.07 -1.04 -3.48 116.25 116.73 2pvj h VAL 273 Ca 0.08 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 66.04 2pvj h VAL 273 Cb 0.47 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 2pvj h VAL 273 CO 0.03 0.52 0.00 0.61 0.02 0.00 0.00 177.57 178.74 2pvj n GLY 274 N 0.16 1.76 3.13 2.17 0.00 -0.94 -4.67 105.19 106.81 2pvj n GLY 274 Ca -0.03 -0.51 -0.27 0.00 0.00 0.00 0.00 46.02 45.22 2pvj n GLY 274 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2pvj s ARG 275 N 0.00 1.90 -0.04 1.61 3.52 -1.26 -4.94 118.95 119.74 2pvj s ARG 275 Ca 0.00 -0.61 -0.06 0.00 -0.13 0.00 0.00 55.73 54.93 2pvj s ARG 275 Cb 0.00 -1.61 0.01 0.00 -1.56 0.00 0.00 34.95 31.79 2pvj s ARG 275 CO 0.00 0.21 0.14 -1.01 -0.81 0.00 0.00 175.30 173.83 2pvj s HIS 276 N 0.15 -0.09 0.38 5.12 3.76 -1.26 -4.97 115.29 118.38 2pvj s HIS 276 Ca -0.07 0.22 -0.15 0.00 -0.15 0.00 0.00 55.06 54.91 2pvj s HIS 276 Cb -0.13 0.02 -0.09 0.00 1.11 0.00 0.00 32.58 33.49 2pvj s HIS 276 CO 0.03 -0.14 0.81 -1.54 -0.85 0.00 0.00 174.74 173.05 2pvj s SER 277 N -0.38 6.72 0.17 1.40 1.04 -1.26 -0.83 113.70 120.56 2pvj s SER 277 Ca -0.05 1.35 -0.30 0.00 0.48 0.00 0.00 55.95 57.43 2pvj s SER 277 Cb -0.03 -2.41 -0.08 0.00 0.10 0.00 0.00 66.02 63.60 2pvj s SER 277 CO 0.01 -0.33 1.30 -0.60 0.98 0.00 0.00 173.24 174.60 2pvj s ARG 278 N -3.36 4.39 -0.24 4.02 3.52 -1.26 -4.20 118.95 121.82 2pvj s ARG 278 Ca 0.55 2.01 -0.09 0.00 -0.13 0.00 0.00 55.73 58.08 2pvj s ARG 278 Cb -0.10 -3.22 -0.04 0.00 -1.56 0.00 0.00 34.95 30.03 2pvj s ARG 278 CO 0.22 -0.26 0.11 0.15 -0.81 0.00 0.00 175.30 174.70 2pvj s LYS 279 N 0.17 3.83 0.35 5.12 -0.14 0.57 -4.93 119.74 124.72 2pvj s LYS 279 Ca 0.58 -0.39 -0.27 0.00 -1.36 0.00 0.00 55.97 54.52 2pvj s LYS 279 Cb -0.35 -3.41 -0.12 0.00 -1.68 0.00 0.00 37.83 32.27 2pvj s LYS 279 CO 0.36 -0.07 1.23 -2.30 -0.76 0.00 0.00 175.35 173.81 2pvj n PRO 280 N 4.63 1.95 0.20 -1.68 -0.02 -1.26 -4.83 135.00 133.99 2pvj n PRO 280 Ca -0.16 0.69 0.16 0.00 -2.02 0.00 0.00 63.50 62.17 2pvj n PRO 280 Cb 0.52 -2.25 0.80 0.00 -0.02 0.00 0.00 33.50 32.54 2pvj n PRO 280 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 2pvj h TRP 281 N 2.35 0.00 0.00 6.00 4.06 -1.97 -1.61 115.95 124.77 2pvj h TRP 281 Ca -0.45 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.50 2pvj h TRP 281 Cb 1.30 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.46 2pvj h TRP 281 CO 0.49 0.00 0.00 1.28 -3.56 0.00 0.00 178.44 176.65 2pvj n LEU 282 N -3.98 0.17 0.05 -4.49 4.77 -1.26 -2.63 117.00 109.62 2pvj n LEU 282 Ca 0.01 0.53 0.09 0.00 -0.03 0.00 0.00 56.01 56.61 2pvj n LEU 282 Cb 0.28 -0.50 0.39 0.00 -2.33 0.00 0.00 43.42 41.26 2pvj n LEU 282 CO 0.29 -0.24 0.78 0.29 -1.33 0.00 0.00 177.39 177.19 2pvj n LYS 283 N -1.67 0.07 -0.14 3.23 4.76 -0.61 -1.71 118.16 122.09 2pvj n LYS 283 Ca 0.04 0.30 0.12 0.00 -2.87 0.00 0.00 58.31 55.91 2pvj n LYS 283 Cb 0.24 -1.64 0.20 0.00 -1.84 0.00 0.00 35.03 31.99 2pvj n LYS 283 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2pvj n PHE 284 N -1.78 0.38 -2.84 2.13 3.72 -1.08 -4.94 117.46 113.05 2pvj n PHE 284 Ca 0.03 -0.19 -0.40 0.00 -0.05 0.00 0.00 57.45 56.84 2pvj n PHE 284 Cb 0.20 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.68 2pvj n PHE 284 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 2pvj s MET 285 N -1.62 4.70 0.27 -1.08 1.75 -0.69 -4.94 119.30 117.68 2pvj s MET 285 Ca 0.36 1.33 -0.11 0.00 -1.25 0.00 0.00 55.69 56.02 2pvj s MET 285 Cb 0.22 -3.30 -0.00 0.00 2.84 0.00 0.00 34.83 34.59 2pvj s MET 285 CO 0.31 0.46 0.49 0.54 -0.65 0.00 0.00 175.02 176.17 2pvj s ASN 286 N -0.85 0.05 0.55 1.11 2.20 -1.26 -5.03 114.94 111.71 2pvj s ASN 286 Ca 0.40 -1.02 0.28 0.00 -0.94 0.00 0.00 52.86 51.58 2pvj s ASN 286 Cb -0.24 0.61 1.45 0.00 -2.00 0.00 0.00 41.25 41.07 2pvj s ASN 286 CO 0.29 -1.19 1.95 0.00 -2.94 0.00 0.00 177.10 175.21 2pvj h ALA 287 N 2.23 2.50 0.01 3.54 0.00 -2.00 -1.54 119.26 124.00 2pvj h ALA 287 Ca -0.27 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.41 2pvj h ALA 287 Cb 1.25 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2pvj h ALA 287 CO 0.36 -0.79 -0.92 -0.44 0.00 0.00 0.00 179.25 177.46 2pvj h ASP 288 N 0.00 0.35 -0.40 0.00 5.19 -1.97 -3.32 116.42 116.26 2pvj h ASP 288 Ca 0.29 -0.29 -0.23 0.00 -0.62 0.00 0.00 57.03 56.18 2pvj h ASP 288 Cb 1.24 -0.11 -0.14 0.00 0.18 0.00 0.00 39.33 40.50 2pvj h ASP 288 CO -0.00 1.10 -0.11 -0.46 -3.12 0.00 0.00 179.24 176.64 2pvj n ASN 289 N -3.67 2.82 0.10 6.45 0.23 -0.64 -4.70 115.26 115.85 2pvj n ASN 289 Ca -0.05 -3.80 -0.22 0.00 -0.53 0.00 0.00 54.58 49.98 2pvj n ASN 289 Cb 0.83 -0.63 -0.13 0.00 -2.08 0.00 0.00 39.78 37.77 2pvj n ASN 289 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 2pvj h GLN 290 N 1.13 0.59 -0.05 -3.83 4.15 -1.50 -3.20 115.11 112.40 2pvj h GLN 290 Ca 0.25 -0.82 0.00 0.00 0.77 0.00 0.00 58.65 58.85 2pvj h GLN 290 Cb 1.61 0.28 0.00 0.00 0.21 0.00 0.00 27.48 29.57 2pvj h GLN 290 CO 0.46 1.37 0.00 -2.39 -1.93 0.00 0.00 178.83 176.34 2pvj n HIS 291 N -3.77 0.00 -0.57 3.99 1.44 -1.26 -3.39 115.22 111.67 2pvj n HIS 291 Ca -0.14 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.57 2pvj n HIS 291 Cb 1.00 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 31.10 2pvj n HIS 291 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2pvj n LEU 292 N -0.46 0.31 -2.45 2.39 4.77 -1.21 -4.61 117.00 115.73 2pvj n LEU 292 Ca 0.00 -0.33 -0.31 0.00 -0.03 0.00 0.00 56.01 55.34 2pvj n LEU 292 Cb 0.01 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.13 2pvj n LEU 292 CO 0.00 0.08 0.72 0.52 -1.33 0.00 0.00 177.39 177.38 2pvj n VAL 293 N -0.04 2.91 -0.61 4.08 0.31 -1.21 -4.83 118.33 118.93 2pvj n VAL 293 Ca 0.00 -4.30 -0.29 0.00 -0.01 0.00 0.00 64.34 59.74 2pvj n VAL 293 Cb 0.14 -1.21 0.22 0.00 -0.91 0.00 0.00 33.84 32.08 2pvj n VAL 293 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2pvj s SER 294 N -2.69 1.64 0.42 4.52 1.04 -1.26 -4.70 113.70 112.67 2pvj s SER 294 Ca 0.52 1.73 0.10 0.00 0.48 0.00 0.00 55.95 58.79 2pvj s SER 294 Cb 0.43 -2.39 0.93 0.00 0.10 0.00 0.00 66.02 65.10 2pvj s SER 294 CO -0.16 -3.82 2.01 -0.65 0.98 0.00 0.00 173.24 171.59 2pvj h PRO 295 N -2.36 0.49 -0.55 4.02 0.11 -1.99 -1.93 132.00 129.78 2pvj h PRO 295 Ca -0.55 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.44 2pvj h PRO 295 Cb 1.31 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2pvj h PRO 295 CO 0.48 0.32 -0.00 0.93 -0.21 0.00 0.00 178.00 179.51 2pvj h GLU 296 N 0.50 0.98 -0.40 1.05 4.39 -1.99 0.04 114.58 119.15 2pvj h GLU 296 Ca 0.23 -0.31 -0.03 0.00 0.34 0.00 0.00 59.36 59.59 2pvj h GLU 296 Cb 0.28 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 2pvj h GLU 296 CO -0.06 0.98 0.14 0.00 -1.16 0.00 0.00 179.01 178.91 2pvj h ALA 297 N 0.96 0.53 -0.35 3.43 0.00 -1.71 -0.89 119.26 121.22 2pvj h ALA 297 Ca 0.16 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2pvj h ALA 297 Cb 0.55 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2pvj h ALA 297 CO 0.03 0.15 0.07 0.82 0.00 0.00 0.00 179.25 180.33 2pvj h ILE 298 N 0.51 1.23 -0.55 0.00 1.08 -1.25 -0.06 117.51 118.47 2pvj h ILE 298 Ca 0.13 -0.80 0.01 0.00 -0.39 0.00 0.00 64.86 63.81 2pvj h ILE 298 Cb 0.23 1.07 -0.03 0.00 -3.07 0.00 0.00 36.82 35.02 2pvj h ILE 298 CO -0.01 0.27 0.36 -0.78 -0.69 0.00 0.00 178.15 177.31 2pvj h ASP 299 N 0.42 0.63 -0.10 1.72 3.58 -0.85 0.14 116.42 121.97 2pvj h ASP 299 Ca 0.11 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.54 2pvj h ASP 299 Cb 0.33 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.22 2pvj h ASP 299 CO 0.00 0.46 0.04 0.15 -2.88 0.00 0.00 179.24 177.01 2pvj h PHE 300 N 0.74 0.15 -0.62 0.28 3.57 -1.02 -2.42 116.94 117.61 2pvj h PHE 300 Ca 0.20 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.72 2pvj h PHE 300 Cb -0.09 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.57 2pvj h PHE 300 CO -0.04 0.24 0.38 1.25 -2.23 0.00 0.00 178.31 177.92 2pvj h LEU 301 N 0.01 0.63 -1.73 0.59 5.85 -0.69 -2.18 115.31 117.79 2pvj h LEU 301 Ca 0.03 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.79 2pvj h LEU 301 Cb 0.15 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2pvj h LEU 301 CO -0.00 0.44 0.25 -0.78 -0.34 0.00 0.00 178.44 178.00 2pvj h ASP 302 N 0.76 0.30 0.39 1.25 3.58 -0.54 -0.60 116.42 121.56 2pvj h ASP 302 Ca 0.25 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.69 2pvj h ASP 302 Cb 0.01 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 40.99 2pvj h ASP 302 CO -0.10 0.21 -0.06 0.29 -2.88 0.00 0.00 179.24 176.70 2pvj n LYS 303 N -4.48 0.64 -0.13 0.28 5.02 -0.84 -3.79 118.16 114.86 2pvj n LYS 303 Ca 0.04 -0.14 -0.25 0.00 -2.02 0.00 0.00 58.31 55.94 2pvj n LYS 303 Cb 0.18 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.59 2pvj n LYS 303 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2pvj n LEU 304 N -1.05 2.17 -4.38 -0.35 4.77 -0.35 -1.97 117.00 115.84 2pvj n LEU 304 Ca 0.15 0.18 -0.43 0.00 -0.03 0.00 0.00 56.01 55.88 2pvj n LEU 304 Cb 0.25 -0.79 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 2pvj n LEU 304 CO 0.23 0.65 1.77 0.18 -1.33 0.00 0.00 177.39 178.89 2pvj n LEU 305 N -3.87 5.41 -4.30 2.23 4.77 -0.53 -4.53 117.00 116.18 2pvj n LEU 305 Ca -0.49 -4.27 -0.29 0.00 -0.03 0.00 0.00 56.01 50.93 2pvj n LEU 305 Cb 0.89 -1.65 -0.15 0.00 -2.33 0.00 0.00 43.42 40.17 2pvj n LEU 305 CO 0.09 0.63 -0.56 -0.13 -1.33 0.00 0.00 177.39 176.09 2pvj s ARG 306 N 2.49 1.86 0.09 3.23 1.81 -1.26 -4.90 118.95 122.27 2pvj s ARG 306 Ca 0.47 -0.96 -0.27 0.00 -1.72 0.00 0.00 55.73 53.25 2pvj s ARG 306 Cb 0.02 -1.89 -0.14 0.00 -0.45 0.00 0.00 34.95 32.49 2pvj s ARG 306 CO 0.02 0.51 1.68 1.88 -0.68 0.00 0.00 175.30 178.71 2pvj h TYR 307 N 5.20 -0.42 -2.75 -0.53 0.05 -1.91 -3.39 116.97 113.22 2pvj h TYR 307 Ca -0.44 -0.00 -0.57 0.00 0.05 0.00 0.00 58.73 57.77 2pvj h TYR 307 Cb 1.13 0.15 -0.03 0.00 1.01 0.00 0.00 36.73 38.99 2pvj h TYR 307 CO 0.43 -0.25 1.24 0.34 -1.05 0.00 0.00 178.16 178.87 2pvj s ASP 308 N -4.85 5.95 0.55 3.88 -1.08 -1.26 -4.71 116.67 115.15 2pvj s ASP 308 Ca -0.15 1.15 0.24 0.00 -0.52 0.00 0.00 52.55 53.27 2pvj s ASP 308 Cb 0.06 -2.53 1.47 0.00 -1.46 0.00 0.00 42.92 40.46 2pvj s ASP 308 CO 0.65 -1.69 2.08 1.12 0.52 0.00 0.00 175.17 177.85 2pvj h HIS 309 N 12.54 0.00 0.00 -5.34 2.07 -1.96 -0.34 115.15 122.12 2pvj h HIS 309 Ca -0.32 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.20 2pvj h HIS 309 Cb 1.16 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.14 2pvj h HIS 309 CO 0.96 0.00 -0.00 1.96 -3.07 0.00 0.00 177.93 177.78 2pvj h GLN 310 N 0.00 0.00 0.00 5.12 4.20 -1.94 -3.06 115.11 119.43 2pvj h GLN 310 Ca 0.12 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.68 2pvj h GLN 310 Cb 0.55 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 2pvj h GLN 310 CO -0.00 0.00 -0.92 0.93 -0.67 0.00 0.00 178.83 178.17 2pvj h GLU 311 N 0.00 0.00 -7.11 1.46 5.08 -1.44 -3.48 114.58 109.09 2pvj h GLU 311 Ca -0.00 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 2pvj h GLU 311 Cb 0.55 0.00 0.16 0.00 0.50 0.00 0.00 28.75 29.96 2pvj h GLU 311 CO 0.00 0.54 0.52 0.54 -1.00 0.00 0.00 179.01 179.61 2pvj n ARG 312 N -3.15 1.12 -2.00 2.33 1.74 -1.16 -4.95 116.66 110.60 2pvj n ARG 312 Ca -0.03 0.44 -0.38 0.00 -0.77 0.00 0.00 57.85 57.11 2pvj n ARG 312 Cb 0.82 -2.54 0.01 0.00 -1.02 0.00 0.00 32.46 29.74 2pvj n ARG 312 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2pvj s LEU 313 N -4.36 3.99 0.75 0.55 1.43 -0.83 -5.01 118.68 115.19 2pvj s LEU 313 Ca 0.83 2.59 -0.10 0.00 -1.03 0.00 0.00 54.13 56.42 2pvj s LEU 313 Cb -0.38 -4.18 0.05 0.00 0.03 0.00 0.00 46.19 41.72 2pvj s LEU 313 CO 0.40 -1.19 1.10 0.42 0.23 0.00 0.00 176.35 177.31 2pvj s THR 314 N -1.37 2.55 0.29 5.49 -4.23 -1.26 -4.83 115.64 112.28 2pvj s THR 314 Ca 0.65 0.06 -0.01 0.00 -1.18 0.00 0.00 61.69 61.21 2pvj s THR 314 Cb -0.36 -3.15 0.20 0.00 1.34 0.00 0.00 72.50 70.53 2pvj s THR 314 CO 0.44 -0.19 1.89 0.00 -0.54 0.00 0.00 174.62 176.21 2pvj h ALA 315 N -0.79 1.30 -0.42 3.99 0.00 -1.93 -0.40 119.26 121.00 2pvj h ALA 315 Ca -0.45 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.28 2pvj h ALA 315 Cb 1.30 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2pvj h ALA 315 CO 0.64 0.54 0.11 1.25 0.00 0.00 0.00 179.25 181.78 2pvj h LEU 316 N 0.92 0.63 -0.46 0.00 5.85 -1.93 -1.67 115.31 118.65 2pvj h LEU 316 Ca 0.22 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2pvj h LEU 316 Cb 0.12 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2pvj h LEU 316 CO -0.03 0.69 0.19 -0.33 -0.34 0.00 0.00 178.44 178.62 2pvj h GLU 317 N 0.54 0.69 -0.54 1.25 5.08 -1.83 -2.94 114.58 116.82 2pvj h GLU 317 Ca 0.13 -0.12 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2pvj h GLU 317 Cb 0.30 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.38 2pvj h GLU 317 CO 0.00 0.62 0.24 0.00 -1.00 0.00 0.00 179.01 178.86 2pvj h ALA 318 N 1.04 0.68 -0.15 3.43 0.00 -0.85 -1.31 119.26 122.11 2pvj h ALA 318 Ca 0.15 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2pvj h ALA 318 Cb 0.18 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2pvj h ALA 318 CO -0.01 -0.14 0.12 0.52 0.00 0.00 0.00 179.25 179.73 2pvj h MET 319 N 0.45 0.00 -0.01 0.00 2.86 -1.14 -1.81 114.93 115.28 2pvj h MET 319 Ca 0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 2pvj h MET 319 Cb 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 2pvj h MET 319 CO -0.22 0.00 -0.25 0.25 1.06 0.00 0.00 176.91 177.75 2pvj n THR 320 N -4.32 0.00 -1.79 2.22 -2.24 -0.53 -4.80 114.28 102.82 2pvj n THR 320 Ca 0.01 -0.16 -0.41 0.00 -2.27 0.00 0.00 64.05 61.21 2pvj n THR 320 Cb 0.24 0.52 -0.00 0.00 -2.10 0.00 0.00 70.33 68.99 2pvj n THR 320 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2pvj s HIS 321 N -2.44 2.60 0.65 4.78 2.46 -0.68 -4.84 115.29 117.81 2pvj s HIS 321 Ca 0.25 1.10 0.29 0.00 0.47 0.00 0.00 55.06 57.17 2pvj s HIS 321 Cb 0.19 -4.04 1.55 0.00 -0.13 0.00 0.00 32.58 30.16 2pvj s HIS 321 CO 0.50 -3.12 1.89 -1.35 -2.47 0.00 0.00 174.74 170.20 2pvj h PRO 322 N 3.27 0.00 -0.78 2.88 0.11 -1.91 -1.15 132.00 134.41 2pvj h PRO 322 Ca -0.50 0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.77 2pvj h PRO 322 Cb 1.24 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.29 2pvj h PRO 322 CO 0.66 0.00 0.52 -0.92 -0.21 0.00 0.00 178.00 178.05 2pvj h TYR 323 N 0.00 0.48 -0.64 0.65 3.20 -1.88 -0.42 116.97 118.35 2pvj h TYR 323 Ca 0.04 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2pvj h TYR 323 Cb 0.80 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.92 2pvj h TYR 323 CO 0.00 0.17 0.00 1.19 -1.64 0.00 0.00 178.16 177.88 2pvj n PHE 324 N -4.48 1.09 -0.35 -3.82 3.72 -0.44 -4.64 117.46 108.55 2pvj n PHE 324 Ca 0.15 -0.49 0.09 0.00 -0.05 0.00 0.00 57.45 57.16 2pvj n PHE 324 Cb 0.57 -0.09 0.28 0.00 -0.94 0.00 0.00 39.48 39.30 2pvj n PHE 324 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 2pvj h GLN 325 N 3.85 0.87 -0.39 -1.08 -0.00 -1.19 -1.02 115.11 116.15 2pvj h GLN 325 Ca 0.00 -0.05 -0.16 0.00 -0.00 0.00 0.00 58.65 58.44 2pvj h GLN 325 Cb 1.08 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.48 28.35 2pvj h GLN 325 CO 0.09 0.58 -0.37 0.37 -0.00 0.00 0.00 178.83 179.49 2pvj h GLN 326 N 0.90 0.95 -0.68 0.06 4.15 -1.82 -1.19 115.11 117.48 2pvj h GLN 326 Ca 0.52 -0.49 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 2pvj h GLN 326 Cb 0.63 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.31 2pvj h GLN 326 CO -0.29 1.15 0.36 0.28 -1.93 0.00 0.00 178.83 178.40 2pvj h VAL 327 N 0.78 1.22 -0.29 2.39 2.07 -1.67 -0.64 116.25 120.10 2pvj h VAL 327 Ca 0.07 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 66.98 2pvj h VAL 327 Cb 0.97 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2pvj h VAL 327 CO 0.09 0.24 0.02 0.03 0.02 0.00 0.00 177.57 177.97 2pvj h ARG 328 N 0.93 0.50 -0.68 1.57 3.08 -1.10 -2.01 114.38 116.67 2pvj h ARG 328 Ca 0.24 -0.15 0.02 0.00 0.07 0.00 0.00 59.98 60.16 2pvj h ARG 328 Cb 0.07 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 2pvj h ARG 328 CO -0.04 0.63 0.43 0.00 -1.07 0.00 0.00 179.97 179.93 2pvj h ALA 329 N 0.85 0.89 -0.55 0.04 0.00 -0.95 -1.12 119.26 118.41 2pvj h ALA 329 Ca 0.08 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2pvj h ALA 329 Cb 0.40 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2pvj h ALA 329 CO 0.01 0.22 0.10 0.00 0.00 0.00 0.00 179.25 179.59 2pvj h ALA 330 N 1.28 1.16 -0.29 0.00 0.00 -1.02 -2.63 119.26 117.75 2pvj h ALA 330 Ca 0.27 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 2pvj h ALA 330 Cb -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2pvj h ALA 330 CO -0.09 0.56 -0.26 1.49 0.00 0.00 0.00 179.25 180.95 2pvj h GLU 331 N 0.82 0.58 -0.01 0.00 4.81 -0.67 -3.51 114.58 116.59 2pvj h GLU 331 Ca 0.17 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2pvj h GLU 331 Cb 0.34 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.69 2pvj h GLU 331 CO 0.00 0.79 0.00 0.09 -0.73 0.00 0.00 179.01 179.16