#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bvz s LEU 2 N 0.00 3.88 0.02 -0.89 2.96 -1.26 -5.00 118.68 118.39 1bvz s LEU 2 Ca 0.00 -0.50 -0.03 0.00 -0.22 0.00 0.00 54.13 53.38 1bvz s LEU 2 Cb 0.00 -1.95 -0.28 0.00 0.50 0.00 0.00 46.19 44.46 1bvz s LEU 2 CO 0.00 -0.16 0.93 -0.07 -1.32 0.00 0.00 176.35 175.73 1bvz h LEU 3 N 8.29 0.38 0.00 -0.68 3.38 -2.04 -2.76 115.31 121.89 1bvz h LEU 3 Ca -0.33 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.14 1bvz h LEU 3 Cb 1.15 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1bvz h LEU 3 CO 0.60 1.41 0.00 -1.84 0.09 0.00 0.00 178.44 178.70 1bvz n GLU 4 N -3.46 0.09 -0.05 1.13 0.00 -1.26 -2.36 120.64 114.73 1bvz n GLU 4 Ca -0.14 0.24 -0.10 0.00 0.00 0.00 0.00 57.16 57.16 1bvz n GLU 4 Cb 1.04 -1.50 -0.15 0.00 0.00 0.00 0.00 31.44 30.83 1bvz n GLU 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1bvz n ALA 5 N -1.32 1.47 -1.88 -1.84 0.00 -1.04 -4.94 120.51 110.97 1bvz n ALA 5 Ca 0.03 -0.99 -0.41 0.00 0.00 0.00 0.00 53.44 52.07 1bvz n ALA 5 Cb 0.06 -0.57 -0.02 0.00 0.00 0.00 0.00 19.45 18.92 1bvz n ALA 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1bvz s ILE 6 N -2.55 2.69 -0.06 0.00 1.01 -0.99 -4.52 121.20 116.77 1bvz s ILE 6 Ca -0.08 0.58 -0.06 0.00 0.00 0.00 0.00 60.65 61.09 1bvz s ILE 6 Cb 0.07 -3.37 0.02 0.00 0.01 0.00 0.00 42.46 39.19 1bvz s ILE 6 CO 0.82 0.09 0.17 0.12 0.00 0.00 0.00 174.94 176.14 1bvz s PHE 7 N -0.04 -0.18 -0.19 3.97 5.36 -0.78 -5.01 117.98 121.09 1bvz s PHE 7 Ca 0.59 0.45 -0.18 0.00 -0.96 0.00 0.00 56.93 56.83 1bvz s PHE 7 Cb -0.41 0.06 0.05 0.00 -0.34 0.00 0.00 43.02 42.38 1bvz s PHE 7 CO 0.43 -0.09 0.52 -1.58 -1.46 0.00 0.00 175.22 173.04 1bvz s HIS 8 N 0.10 -0.56 0.07 10.12 5.65 -1.26 -2.48 115.29 126.92 1bvz s HIS 8 Ca -0.00 1.37 0.03 0.00 0.25 0.00 0.00 55.06 56.71 1bvz s HIS 8 Cb -0.01 0.19 -0.04 0.00 -1.18 0.00 0.00 32.58 31.54 1bvz s HIS 8 CO 0.00 -0.28 0.04 -1.21 -0.65 0.00 0.00 174.74 172.64 1bvz s GLU 9 N 0.24 2.76 -0.19 2.88 2.02 -1.26 -5.01 118.70 120.13 1bvz s GLU 9 Ca -0.00 -0.72 0.01 0.00 0.02 0.00 0.00 54.97 54.27 1bvz s GLU 9 Cb -0.04 -2.66 0.22 0.00 0.10 0.00 0.00 34.13 31.75 1bvz s GLU 9 CO 0.01 0.57 1.55 0.00 0.02 0.00 0.00 175.26 177.41 1bvz n ALA 10 N 0.68 4.01 -3.10 5.21 0.00 -1.26 -3.48 120.51 122.57 1bvz n ALA 10 Ca -0.10 -1.11 -0.00 0.00 0.00 0.00 0.00 53.44 52.22 1bvz n ALA 10 Cb 0.52 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1bvz n ALA 10 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1bvz n LYS 11 N 0.13 0.12 0.00 0.00 2.85 -1.24 -4.74 118.16 115.28 1bvz n LYS 11 Ca 0.22 -0.27 0.00 0.00 -1.05 0.00 0.00 58.31 57.21 1bvz n LYS 11 Cb 0.81 0.32 0.00 0.00 -0.65 0.00 0.00 35.03 35.50 1bvz n LYS 11 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1bvz n GLY 12 N -0.06 2.12 0.04 2.58 0.00 -1.21 -0.73 105.19 107.93 1bvz n GLY 12 Ca -0.01 -0.44 0.13 0.00 0.00 0.00 0.00 46.02 45.70 1bvz n GLY 12 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1bvz n SER 13 N 4.43 0.50 -0.01 1.61 7.64 -1.26 -4.09 113.62 122.44 1bvz n SER 13 Ca 0.00 0.25 0.10 0.00 1.01 0.00 0.00 58.87 60.22 1bvz n SER 13 Cb 0.00 -0.22 -0.16 0.00 -1.01 0.00 0.00 64.21 62.82 1bvz n SER 13 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1bvz n TYR 14 N -1.86 0.00 -3.64 1.43 4.01 -0.92 -4.70 117.16 111.48 1bvz n TYR 14 Ca 0.05 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.71 1bvz n TYR 14 Cb 0.39 -0.49 -0.09 0.00 -0.31 0.00 0.00 39.34 38.84 1bvz n TYR 14 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bvz s ALA 15 N -3.42 -1.21 -0.16 -0.72 0.00 0.09 -0.78 121.76 115.56 1bvz s ALA 15 Ca -0.08 1.52 -0.15 0.00 0.00 0.00 0.00 51.96 53.26 1bvz s ALA 15 Cb 0.13 -1.37 0.04 0.00 0.00 0.00 0.00 23.12 21.93 1bvz s ALA 15 CO 0.87 -0.79 0.44 1.52 0.00 0.00 0.00 175.76 177.79 1bvz s TYR 16 N 2.63 -0.49 0.37 0.00 -0.85 -0.76 -3.32 117.35 114.94 1bvz s TYR 16 Ca -0.01 1.18 -0.27 0.00 -0.52 0.00 0.00 57.07 57.45 1bvz s TYR 16 Cb -0.12 0.17 -0.09 0.00 0.38 0.00 0.00 41.96 42.30 1bvz s TYR 16 CO -0.13 -0.24 1.23 -2.14 -1.52 0.00 0.00 175.55 172.75 1bvz s PRO 17 N 0.30 4.16 0.00 -3.49 0.02 -1.26 -0.97 135.00 133.76 1bvz s PRO 17 Ca -0.01 2.00 0.14 0.00 0.02 0.00 0.00 61.00 63.15 1bvz s PRO 17 Cb -0.03 -2.84 0.07 0.00 0.02 0.00 0.00 34.50 31.71 1bvz s PRO 17 CO -0.00 -0.27 0.87 0.44 -0.33 0.00 0.00 177.00 177.71 1bvz n ILE 18 N 0.37 0.00 -3.86 2.83 -5.35 -0.46 -4.49 119.36 108.40 1bvz n ILE 18 Ca 0.03 -0.45 -0.03 0.00 -0.27 0.00 0.00 62.75 62.02 1bvz n ILE 18 Cb 0.44 1.24 0.01 0.00 -1.74 0.00 0.00 39.64 39.60 1bvz n ILE 18 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1bvz s SER 19 N -1.35 -0.01 0.14 7.28 0.15 -1.22 -4.95 113.70 113.74 1bvz s SER 19 Ca 0.14 -0.67 -0.05 0.00 0.70 0.00 0.00 55.95 56.08 1bvz s SER 19 Cb 0.11 0.51 -0.04 0.00 -1.71 0.00 0.00 66.02 64.89 1bvz s SER 19 CO 0.23 -1.01 1.35 -0.08 1.20 0.00 0.00 173.24 174.93 1bvz h GLU 20 N 2.00 0.47 -0.24 5.44 4.81 -1.93 -3.24 114.58 121.88 1bvz h GLU 20 Ca -0.27 -0.43 0.00 0.00 -0.13 0.00 0.00 59.36 58.52 1bvz h GLU 20 Cb 1.22 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.71 1bvz h GLU 20 CO 0.35 1.08 0.00 0.25 -0.73 0.00 0.00 179.01 179.96 1bvz n THR 21 N -3.81 0.31 -3.82 0.32 -2.24 -1.26 -4.42 114.28 99.35 1bvz n THR 21 Ca -0.06 -0.50 -0.17 0.00 -2.27 0.00 0.00 64.05 61.05 1bvz n THR 21 Cb 0.77 0.65 -0.16 0.00 -2.10 0.00 0.00 70.33 69.49 1bvz n THR 21 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1bvz s GLN 22 N -1.69 0.11 -0.14 -0.78 -0.21 -1.23 0.81 119.66 116.54 1bvz s GLN 22 Ca 0.34 0.16 -0.03 0.00 0.02 0.00 0.00 55.36 55.86 1bvz s GLN 22 Cb 0.19 -0.39 -0.03 0.00 1.00 0.00 0.00 33.01 33.79 1bvz s GLN 22 CO 0.28 -0.18 -0.05 -1.17 -2.12 0.00 0.00 175.29 172.06 1bvz s LEU 23 N 1.19 3.21 -0.27 2.90 2.96 -0.18 -1.36 118.68 127.13 1bvz s LEU 23 Ca -0.08 -0.12 -0.17 0.00 -0.22 0.00 0.00 54.13 53.55 1bvz s LEU 23 Cb -0.13 -1.76 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 1bvz s LEU 23 CO -0.03 0.21 0.47 -0.60 -1.32 0.00 0.00 176.35 175.09 1bvz s ARG 24 N 0.12 4.04 -0.11 1.98 3.52 -0.15 -0.98 118.95 127.37 1bvz s ARG 24 Ca -0.02 0.22 0.02 0.00 -0.13 0.00 0.00 55.73 55.83 1bvz s ARG 24 Cb -0.14 -3.66 -0.01 0.00 -1.56 0.00 0.00 34.95 29.58 1bvz s ARG 24 CO 0.03 -0.34 -0.18 0.54 -0.81 0.00 0.00 175.30 174.53 1bvz s VAL 25 N 2.25 2.61 0.03 7.11 0.11 -0.83 -1.83 120.40 129.85 1bvz s VAL 25 Ca 0.19 -0.83 0.06 0.00 -2.93 0.00 0.00 61.98 58.47 1bvz s VAL 25 Cb -0.16 -2.05 -0.02 0.00 -1.53 0.00 0.00 36.38 32.63 1bvz s VAL 25 CO 0.10 0.55 -0.17 -0.60 -3.33 0.00 0.00 175.10 171.64 1bvz s ARG 26 N 0.23 1.20 -0.08 1.54 3.52 0.04 -0.81 118.95 124.59 1bvz s ARG 26 Ca -0.12 -0.79 0.01 0.00 -0.13 0.00 0.00 55.73 54.70 1bvz s ARG 26 Cb -0.16 -1.24 0.02 0.00 -1.56 0.00 0.00 34.95 32.01 1bvz s ARG 26 CO 0.06 0.32 -0.09 -1.17 -0.81 0.00 0.00 175.30 173.61 1bvz s LEU 27 N -0.99 1.41 -0.02 -0.88 2.96 0.25 -4.82 118.68 116.59 1bvz s LEU 27 Ca 0.05 -0.27 -0.10 0.00 -0.22 0.00 0.00 54.13 53.59 1bvz s LEU 27 Cb -0.08 -0.76 -0.05 0.00 0.50 0.00 0.00 46.19 45.80 1bvz s LEU 27 CO 0.01 -0.04 0.31 -0.60 -1.32 0.00 0.00 176.35 174.71 1bvz s ARG 28 N 1.09 3.70 0.03 1.98 3.52 -1.04 -1.06 118.95 127.18 1bvz s ARG 28 Ca -0.07 0.14 -0.19 0.00 -0.13 0.00 0.00 55.73 55.48 1bvz s ARG 28 Cb -0.14 -3.16 0.04 0.00 -1.56 0.00 0.00 34.95 30.13 1bvz s ARG 28 CO -0.01 0.69 0.44 0.00 -0.81 0.00 0.00 175.30 175.61 1bvz s ALA 29 N -1.14 -1.09 0.35 6.12 0.00 -0.86 -1.87 121.76 123.27 1bvz s ALA 29 Ca 0.23 0.42 -0.28 0.00 0.00 0.00 0.00 51.96 52.33 1bvz s ALA 29 Cb -0.14 0.30 -0.11 0.00 0.00 0.00 0.00 23.12 23.17 1bvz s ALA 29 CO 0.12 -0.44 1.44 0.21 0.00 0.00 0.00 175.76 177.09 1bvz s LYS 30 N -2.27 4.18 -0.00 0.00 2.20 -1.26 -0.70 119.74 121.89 1bvz s LYS 30 Ca -0.06 2.46 -0.30 0.00 -0.36 0.00 0.00 55.97 57.71 1bvz s LYS 30 Cb -0.01 -3.00 -0.08 0.00 -1.51 0.00 0.00 37.83 33.23 1bvz s LYS 30 CO -0.01 -0.44 1.89 0.21 -0.36 0.00 0.00 175.35 176.64 1bvz s LYS 31 N -1.86 4.10 0.00 4.03 2.20 -0.85 -1.82 119.74 125.54 1bvz s LYS 31 Ca 0.52 2.45 0.00 0.00 -0.36 0.00 0.00 55.97 58.59 1bvz s LYS 31 Cb -0.45 -4.12 0.00 0.00 -1.51 0.00 0.00 37.83 31.75 1bvz s LYS 31 CO 0.59 -0.98 0.00 0.41 -0.36 0.00 0.00 175.35 175.00 1bvz n GLY 32 N 4.49 2.62 0.28 5.54 0.00 -1.26 -4.94 105.19 111.92 1bvz n GLY 32 Ca 0.20 -0.85 -0.05 0.00 0.00 0.00 0.00 46.02 45.31 1bvz n GLY 32 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1bvz h ASP 33 N 1.54 0.75 -3.38 1.61 5.19 -1.73 -3.41 116.42 116.99 1bvz h ASP 33 Ca 0.00 -0.19 -0.67 0.00 -0.62 0.00 0.00 57.03 55.55 1bvz h ASP 33 Cb 0.00 -0.20 -0.32 0.00 0.18 0.00 0.00 39.33 38.99 1bvz h ASP 33 CO 0.00 0.84 -0.78 -0.69 -3.12 0.00 0.00 179.24 175.49 1bvz s VAL 34 N -4.92 2.70 -0.11 -1.35 1.01 -1.26 -3.95 120.40 112.52 1bvz s VAL 34 Ca -0.09 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 60.99 1bvz s VAL 34 Cb 0.14 -2.29 -0.24 0.00 0.00 0.00 0.00 36.38 33.99 1bvz s VAL 34 CO 0.81 0.33 0.39 1.33 0.00 0.00 0.00 175.10 177.96 1bvz n VAL 35 N 4.66 1.65 -4.39 2.92 0.24 0.99 -4.91 118.33 119.49 1bvz n VAL 35 Ca -0.18 -0.72 -0.28 0.00 -2.04 0.00 0.00 64.34 61.12 1bvz n VAL 35 Cb 0.48 -1.31 -0.12 0.00 -1.47 0.00 0.00 33.84 31.42 1bvz n VAL 35 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1bvz s ARG 36 N -2.56 1.49 -0.05 7.34 3.52 -1.01 -4.98 118.95 122.69 1bvz s ARG 36 Ca -0.16 -1.40 0.03 0.00 -0.13 0.00 0.00 55.73 54.08 1bvz s ARG 36 Cb 0.07 -1.90 0.01 0.00 -1.56 0.00 0.00 34.95 31.57 1bvz s ARG 36 CO 0.78 0.43 -0.13 0.00 -0.81 0.00 0.00 175.30 175.57 1bvz s GLU 38 N 0.42 0.82 -0.16 0.00 2.12 -0.54 -2.47 118.70 118.89 1bvz s GLU 38 Ca -0.10 -0.10 -0.04 0.00 0.36 0.00 0.00 54.97 55.10 1bvz s GLU 38 Cb -0.13 -0.85 -0.03 0.00 0.26 0.00 0.00 34.13 33.38 1bvz s GLU 38 CO 0.03 -0.09 -0.03 0.08 -0.54 0.00 0.00 175.26 174.70 1bvz s VAL 39 N 0.97 3.94 -0.08 3.70 1.01 -0.26 0.03 120.40 129.71 1bvz s VAL 39 Ca -0.10 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.58 1bvz s VAL 39 Cb -0.14 -2.73 -0.01 0.00 0.00 0.00 0.00 36.38 33.49 1bvz s VAL 39 CO -0.00 0.49 -0.20 -0.76 0.00 0.00 0.00 175.10 174.62 1bvz s LEU 40 N 0.38 2.33 0.23 3.92 1.43 0.41 -0.84 118.68 126.54 1bvz s LEU 40 Ca -0.04 -0.43 -0.13 0.00 -1.03 0.00 0.00 54.13 52.50 1bvz s LEU 40 Cb -0.14 -1.46 -0.00 0.00 0.03 0.00 0.00 46.19 44.61 1bvz s LEU 40 CO 0.03 0.22 0.47 -0.72 0.23 0.00 0.00 176.35 176.58 1bvz s TYR 41 N -0.03 0.31 0.33 0.29 1.13 -0.94 -1.01 117.35 117.44 1bvz s TYR 41 Ca -0.06 -0.67 -0.18 0.00 -1.41 0.00 0.00 57.07 54.74 1bvz s TYR 41 Cb -0.15 0.19 0.04 0.00 -1.10 0.00 0.00 41.96 40.94 1bvz s TYR 41 CO 0.05 -0.96 0.76 0.00 -2.51 0.00 0.00 175.55 172.88 1bvz s ALA 42 N -4.00 -0.98 0.74 9.51 0.00 -0.29 -0.32 121.76 126.42 1bvz s ALA 42 Ca 0.20 -0.53 -0.16 0.00 0.00 0.00 0.00 51.96 51.47 1bvz s ALA 42 Cb -0.00 0.76 -0.02 0.00 0.00 0.00 0.00 23.12 23.86 1bvz s ALA 42 CO 0.07 -1.01 0.63 -3.47 0.00 0.00 0.00 175.76 171.98 1bvz n ASP 43 N -0.95 -0.84 0.16 0.00 2.03 -1.26 -1.08 116.55 114.61 1bvz n ASP 43 Ca -0.06 0.59 0.02 0.00 0.52 0.00 0.00 54.79 55.86 1bvz n ASP 43 Cb 0.59 -1.26 0.26 0.00 -0.72 0.00 0.00 41.12 39.99 1bvz n ASP 43 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1bvz h ARG 44 N -0.44 0.00 -0.46 -0.67 3.08 -1.87 -2.69 114.38 111.32 1bvz h ARG 44 Ca -0.46 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.59 1bvz h ARG 44 Cb 1.34 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.39 1bvz h ARG 44 CO 0.43 0.49 0.00 0.66 -1.07 0.00 0.00 179.97 180.49 1bvz n TYR 45 N -3.74 1.68 -1.25 3.04 4.01 -1.26 -4.99 117.16 114.66 1bvz n TYR 45 Ca -0.01 -0.79 -0.32 0.00 -0.16 0.00 0.00 57.90 56.62 1bvz n TYR 45 Cb 0.54 -0.45 0.10 0.00 -0.31 0.00 0.00 39.34 39.23 1bvz n TYR 45 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bvz s ALA 46 N -2.80 2.05 0.20 -0.72 0.00 -1.01 -5.01 121.76 114.47 1bvz s ALA 46 Ca 0.50 0.57 -0.13 0.00 0.00 0.00 0.00 51.96 52.91 1bvz s ALA 46 Cb 0.39 -3.38 -0.07 0.00 0.00 0.00 0.00 23.12 20.06 1bvz s ALA 46 CO 0.13 -1.97 0.58 0.45 0.00 0.00 0.00 175.76 174.95 1bvz s SER 47 N -2.68 6.74 0.48 0.00 0.15 -1.26 -4.97 113.70 112.17 1bvz s SER 47 Ca 0.67 1.05 0.26 0.00 0.70 0.00 0.00 55.95 58.63 1bvz s SER 47 Cb -0.22 -2.28 1.32 0.00 -1.71 0.00 0.00 66.02 63.13 1bvz s SER 47 CO 0.51 -0.01 1.85 -0.65 1.20 0.00 0.00 173.24 176.13 1bvz h PRO 48 N 2.97 0.17 0.00 5.44 0.11 -2.02 -2.52 132.00 136.15 1bvz h PRO 48 Ca -0.48 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.47 1bvz h PRO 48 Cb 1.18 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1bvz h PRO 48 CO 0.67 0.11 -0.74 1.05 -0.21 0.00 0.00 178.00 178.89 1bvz h GLU 49 N 0.18 0.00 -6.82 1.05 -0.00 -2.04 -3.45 114.58 103.50 1bvz h GLU 49 Ca 0.49 0.00 -0.49 0.00 -0.00 0.00 0.00 59.36 59.35 1bvz h GLU 49 Cb 1.62 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.37 1bvz h GLU 49 CO -0.10 0.74 0.42 -1.83 -0.00 0.00 0.00 179.01 178.23 1bvz s GLU 50 N -3.11 4.64 0.55 1.06 -1.05 -0.95 -5.01 118.70 114.83 1bvz s GLU 50 Ca 0.01 1.63 -0.10 0.00 -0.15 0.00 0.00 54.97 56.36 1bvz s GLU 50 Cb 0.10 -3.10 -0.04 0.00 -0.44 0.00 0.00 34.13 30.65 1bvz s GLU 50 CO 0.78 0.27 0.93 -1.83 0.95 0.00 0.00 175.26 176.35 1bvz s GLU 51 N -1.55 3.63 0.26 -4.83 4.04 -1.26 -4.91 118.70 114.08 1bvz s GLU 51 Ca 0.46 0.59 -0.14 0.00 0.04 0.00 0.00 54.97 55.92 1bvz s GLU 51 Cb -0.28 -2.20 -0.08 0.00 0.02 0.00 0.00 34.13 31.60 1bvz s GLU 51 CO 0.35 -0.39 0.65 -0.51 -1.84 0.00 0.00 175.26 173.52 1bvz s LEU 52 N -4.84 4.16 0.82 1.83 1.43 -1.26 -4.99 118.68 115.83 1bvz s LEU 52 Ca 0.53 1.16 -0.11 0.00 -1.03 0.00 0.00 54.13 54.68 1bvz s LEU 52 Cb -0.11 -3.80 0.09 0.00 0.03 0.00 0.00 46.19 42.40 1bvz s LEU 52 CO 0.47 -0.10 1.09 0.00 0.23 0.00 0.00 176.35 178.05 1bvz s ALA 53 N -1.82 1.96 -0.08 4.21 0.00 0.57 -4.82 121.76 121.79 1bvz s ALA 53 Ca 0.49 0.15 -0.00 0.00 0.00 0.00 0.00 51.96 52.60 1bvz s ALA 53 Cb -0.12 -3.25 0.02 0.00 0.00 0.00 0.00 23.12 19.78 1bvz s ALA 53 CO 0.19 -2.02 -0.05 -1.01 0.00 0.00 0.00 175.76 172.87 1bvz s HIS 54 N -2.91 1.08 -0.11 0.00 0.09 -1.26 -2.22 115.29 109.97 1bvz s HIS 54 Ca 0.62 -0.43 0.02 0.00 -0.00 0.00 0.00 55.06 55.26 1bvz s HIS 54 Cb -0.18 -0.97 0.02 0.00 -0.00 0.00 0.00 32.58 31.45 1bvz s HIS 54 CO 0.56 -0.37 -0.15 0.00 -0.00 0.00 0.00 174.74 174.79 1bvz s ALA 55 N 1.53 1.66 -0.26 -1.40 0.00 -0.02 -5.01 121.76 118.25 1bvz s ALA 55 Ca -0.00 -0.71 -0.27 0.00 0.00 0.00 0.00 51.96 50.98 1bvz s ALA 55 Cb -0.13 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.17 1bvz s ALA 55 CO -0.04 -0.09 0.94 -1.17 0.00 0.00 0.00 175.76 175.40 1bvz s LEU 56 N 1.01 4.06 -0.84 0.00 2.96 -1.26 -1.10 118.68 123.50 1bvz s LEU 56 Ca -0.06 1.12 -0.26 0.00 -0.22 0.00 0.00 54.13 54.71 1bvz s LEU 56 Cb -0.15 -3.36 0.04 0.00 0.50 0.00 0.00 46.19 43.22 1bvz s LEU 56 CO -0.02 -0.65 1.34 0.00 -1.32 0.00 0.00 176.35 175.71 1bvz s ALA 57 N 3.12 2.73 0.38 5.97 0.00 -1.03 -4.72 121.76 128.22 1bvz s ALA 57 Ca 0.40 -1.70 -0.27 0.00 0.00 0.00 0.00 51.96 50.39 1bvz s ALA 57 Cb -0.15 -4.36 -0.11 0.00 0.00 0.00 0.00 23.12 18.51 1bvz s ALA 57 CO 0.09 -3.41 1.35 0.41 0.00 0.00 0.00 175.76 174.19 1bvz n GLY 58 N 5.94 0.78 3.61 0.00 0.00 -1.12 -4.35 105.19 110.04 1bvz n GLY 58 Ca 0.14 0.27 -0.43 0.00 0.00 0.00 0.00 46.02 46.00 1bvz n GLY 58 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bvz s LYS 59 N -2.08 3.60 -0.03 1.61 2.20 -1.26 -0.55 119.74 123.23 1bvz s LYS 59 Ca 0.57 1.16 0.00 0.00 -0.36 0.00 0.00 55.97 57.34 1bvz s LYS 59 Cb -0.52 -4.04 -0.26 0.00 -1.51 0.00 0.00 37.83 31.51 1bvz s LYS 59 CO 0.61 -1.53 0.73 0.00 -0.36 0.00 0.00 175.35 174.80 1bvz h ALA 60 N 10.92 0.43 -2.14 3.13 0.00 -0.48 -3.48 119.26 127.64 1bvz h ALA 60 Ca -0.29 -1.25 0.00 0.00 0.00 0.00 0.00 54.91 53.37 1bvz h ALA 60 Cb 1.12 0.40 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1bvz h ALA 60 CO 1.06 1.29 0.00 0.41 0.00 0.00 0.00 179.25 182.01 1bvz n GLY 61 N 1.70 1.70 3.47 0.00 0.00 -0.92 -4.83 105.19 106.31 1bvz n GLY 61 Ca -0.19 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 44.84 1bvz n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bvz s SER 62 N 0.11 -0.59 0.27 1.61 0.01 -1.26 -1.13 113.70 112.71 1bvz s SER 62 Ca 0.00 0.31 0.02 0.00 1.31 0.00 0.00 55.95 57.59 1bvz s SER 62 Cb 0.00 0.56 -0.04 0.00 0.21 0.00 0.00 66.02 66.75 1bvz s SER 62 CO 0.00 -0.79 0.15 1.51 0.41 0.00 0.00 173.24 174.51 1bvz s ASP 63 N -2.05 1.16 0.19 2.44 1.47 -0.04 -4.63 116.67 115.21 1bvz s ASP 63 Ca -0.04 -1.49 0.03 0.00 1.18 0.00 0.00 52.55 52.23 1bvz s ASP 63 Cb -0.01 0.34 0.50 0.00 -0.34 0.00 0.00 42.92 43.42 1bvz s ASP 63 CO -0.03 -0.85 0.92 1.21 0.68 0.00 0.00 175.17 177.10 1bvz n GLU 64 N -0.49 -0.04 -0.00 2.11 4.07 -1.26 -3.52 120.64 121.50 1bvz n GLU 64 Ca 0.01 0.86 0.01 0.00 -0.06 0.00 0.00 57.16 57.99 1bvz n GLU 64 Cb 0.65 -1.40 -0.02 0.00 -0.06 0.00 0.00 31.44 30.62 1bvz n GLU 64 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1bvz n ARG 65 N -4.67 2.00 -4.56 5.31 1.74 -1.26 -5.01 116.66 110.20 1bvz n ARG 65 Ca 0.15 -0.01 -0.27 0.00 -0.77 0.00 0.00 57.85 56.95 1bvz n ARG 65 Cb 0.50 -0.91 -0.11 0.00 -1.02 0.00 0.00 32.46 30.92 1bvz n ARG 65 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1bvz s PHE 66 N -1.86 2.47 0.19 -1.55 0.40 -1.23 -2.00 117.98 114.40 1bvz s PHE 66 Ca -0.00 -0.59 0.09 0.00 -0.60 0.00 0.00 56.93 55.83 1bvz s PHE 66 Cb 0.01 -1.60 -0.04 0.00 0.51 0.00 0.00 43.02 41.90 1bvz s PHE 66 CO 0.09 0.50 -0.10 -0.51 0.70 0.00 0.00 175.22 175.91 1bvz s ASP 67 N -3.67 4.23 -0.01 1.36 1.01 0.13 -0.86 116.67 118.86 1bvz s ASP 67 Ca 0.34 -0.60 0.01 0.00 0.71 0.00 0.00 52.55 53.01 1bvz s ASP 67 Cb 0.06 -0.71 0.01 0.00 1.01 0.00 0.00 42.92 43.30 1bvz s ASP 67 CO 0.18 0.10 -0.01 -0.31 0.21 0.00 0.00 175.17 175.33 1bvz s TYR 68 N -1.76 0.23 0.31 4.23 2.02 -0.29 -2.03 117.35 120.06 1bvz s TYR 68 Ca 0.25 -0.01 0.10 0.00 -0.37 0.00 0.00 57.07 57.05 1bvz s TYR 68 Cb -0.09 -0.23 -0.06 0.00 -0.40 0.00 0.00 41.96 41.19 1bvz s TYR 68 CO 0.15 -0.05 -0.14 -0.06 -1.57 0.00 0.00 175.55 173.88 1bvz s PHE 69 N 0.40 2.31 -0.30 2.71 0.40 -0.22 0.28 117.98 123.55 1bvz s PHE 69 Ca -0.04 -0.43 -0.04 0.00 -0.60 0.00 0.00 56.93 55.82 1bvz s PHE 69 Cb -0.06 -1.17 0.19 0.00 0.51 0.00 0.00 43.02 42.49 1bvz s PHE 69 CO -0.01 0.63 0.73 -2.00 0.70 0.00 0.00 175.22 175.27 1bvz s GLU 70 N -3.57 0.46 0.41 0.44 2.12 0.29 -0.58 118.70 118.26 1bvz s GLU 70 Ca 0.31 0.76 0.08 0.00 0.36 0.00 0.00 54.97 56.48 1bvz s GLU 70 Cb -0.01 0.42 -0.03 0.00 0.26 0.00 0.00 34.13 34.77 1bvz s GLU 70 CO 0.15 -0.54 0.31 0.00 -0.54 0.00 0.00 175.26 174.64 1bvz s ALA 71 N 2.88 3.89 -0.12 6.30 0.00 0.01 -2.81 121.76 131.91 1bvz s ALA 71 Ca 0.15 -1.94 -0.01 0.00 0.00 0.00 0.00 51.96 50.16 1bvz s ALA 71 Cb -0.13 -0.83 0.04 0.00 0.00 0.00 0.00 23.12 22.19 1bvz s ALA 71 CO -0.19 -0.18 -0.03 -1.17 0.00 0.00 0.00 175.76 174.19 1bvz s LEU 72 N -4.05 1.08 -0.14 0.00 2.96 -1.26 -1.96 118.68 115.30 1bvz s LEU 72 Ca 0.45 -0.39 -0.14 0.00 -0.22 0.00 0.00 54.13 53.83 1bvz s LEU 72 Cb -0.01 -0.68 -0.05 0.00 0.50 0.00 0.00 46.19 45.95 1bvz s LEU 72 CO 0.26 -0.19 0.31 -0.76 -1.32 0.00 0.00 176.35 174.65 1bvz s LEU 73 N 1.81 4.27 -0.71 -0.68 1.02 -0.16 -4.90 118.68 119.34 1bvz s LEU 73 Ca 0.03 0.57 -0.21 0.00 0.02 0.00 0.00 54.13 54.54 1bvz s LEU 73 Cb -0.14 -2.41 0.09 0.00 0.02 0.00 0.00 46.19 43.76 1bvz s LEU 73 CO -0.07 0.12 0.94 -1.61 0.02 0.00 0.00 176.35 175.75 1bvz s GLU 74 N 0.29 3.21 -1.25 1.70 0.41 -1.26 -1.01 118.70 120.80 1bvz s GLU 74 Ca 0.18 -1.18 -0.10 0.00 -0.41 0.00 0.00 54.97 53.46 1bvz s GLU 74 Cb -0.13 -4.39 0.18 0.00 -1.78 0.00 0.00 34.13 28.00 1bvz s GLU 74 CO 0.05 -1.74 1.73 0.00 -0.49 0.00 0.00 175.26 174.82 1bvz h SER 76 N 6.05 0.00 -0.23 0.00 4.64 -1.88 0.81 113.55 122.94 1bvz h SER 76 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1bvz h SER 76 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1bvz h SER 76 CO 1.51 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 177.82 1bvz n THR 77 N -3.99 0.29 -2.33 2.95 -2.24 -1.26 -4.93 114.28 102.77 1bvz n THR 77 Ca 0.06 -0.40 -0.16 0.00 -2.27 0.00 0.00 64.05 61.27 1bvz n THR 77 Cb 0.49 0.38 -0.01 0.00 -2.10 0.00 0.00 70.33 69.08 1bvz n THR 77 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1bvz n LYS 78 N 0.45 -1.95 -3.70 -0.78 4.01 0.28 -4.87 118.16 111.59 1bvz n LYS 78 Ca 0.16 0.78 -0.11 0.00 -0.51 0.00 0.00 58.31 58.62 1bvz n LYS 78 Cb 0.34 -5.37 -0.12 0.00 -0.51 0.00 0.00 35.03 29.37 1bvz n LYS 78 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 1bvz s ARG 79 N -4.87 0.31 -0.01 1.97 0.52 -1.26 0.59 118.95 116.19 1bvz s ARG 79 Ca 0.00 0.71 -0.01 0.00 -0.52 0.00 0.00 55.73 55.92 1bvz s ARG 79 Cb 0.00 -0.04 0.01 0.00 0.52 0.00 0.00 34.95 35.44 1bvz s ARG 79 CO 0.00 -0.17 0.03 0.54 0.02 0.00 0.00 175.30 175.71 1bvz s VAL 80 N 1.48 -0.01 -0.03 3.52 0.11 -0.88 -4.06 120.40 120.52 1bvz s VAL 80 Ca -0.08 0.03 0.07 0.00 -2.93 0.00 0.00 61.98 59.07 1bvz s VAL 80 Cb -0.09 -0.05 -0.02 0.00 -1.53 0.00 0.00 36.38 34.69 1bvz s VAL 80 CO -0.11 0.01 -0.25 -1.59 -3.33 0.00 0.00 175.10 169.83 1bvz s LYS 81 N 0.16 2.26 -0.01 1.54 -2.85 -0.24 -0.63 119.74 119.97 1bvz s LYS 81 Ca -0.01 -0.91 -0.08 0.00 -1.00 0.00 0.00 55.97 53.96 1bvz s LYS 81 Cb -0.02 -2.09 0.01 0.00 -2.06 0.00 0.00 37.83 33.67 1bvz s LYS 81 CO -0.00 0.51 0.17 1.52 0.10 0.00 0.00 175.35 177.65 1bvz s TYR 82 N -0.49 -0.02 0.03 1.78 1.13 0.07 -1.14 117.35 118.71 1bvz s TYR 82 Ca 0.06 -0.01 0.02 0.00 -1.41 0.00 0.00 57.07 55.73 1bvz s TYR 82 Cb -0.11 -0.01 -0.02 0.00 -1.10 0.00 0.00 41.96 40.72 1bvz s TYR 82 CO 0.00 -0.29 -0.07 0.54 -2.51 0.00 0.00 175.55 173.23 1bvz s VAL 83 N -1.24 0.50 -0.21 -3.49 0.11 -0.18 -0.44 120.40 115.45 1bvz s VAL 83 Ca -0.13 -0.78 -0.10 0.00 -2.93 0.00 0.00 61.98 58.05 1bvz s VAL 83 Cb -0.07 -0.52 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 1bvz s VAL 83 CO 0.02 -0.20 0.12 -0.36 -3.33 0.00 0.00 175.10 171.35 1bvz s PHE 84 N -0.93 3.33 -0.52 1.54 0.08 -0.16 -0.44 117.98 120.88 1bvz s PHE 84 Ca -0.06 0.21 -0.25 0.00 0.12 0.00 0.00 56.93 56.95 1bvz s PHE 84 Cb -0.07 -2.19 0.03 0.00 -0.57 0.00 0.00 43.02 40.23 1bvz s PHE 84 CO 0.00 0.15 0.94 -1.17 -0.10 0.00 0.00 175.22 175.05 1bvz s LEU 85 N 0.68 4.03 0.01 -0.37 2.96 0.10 -1.07 118.68 125.02 1bvz s LEU 85 Ca 0.07 -0.14 -0.24 0.00 -0.22 0.00 0.00 54.13 53.60 1bvz s LEU 85 Cb -0.12 -2.99 -0.05 0.00 0.50 0.00 0.00 46.19 43.53 1bvz s LEU 85 CO 0.01 -1.17 0.72 -0.76 -1.32 0.00 0.00 176.35 173.83 1bvz s LEU 86 N 3.91 4.41 -0.07 -0.68 1.43 0.44 -1.47 118.68 126.66 1bvz s LEU 86 Ca 0.34 1.33 0.05 0.00 -1.03 0.00 0.00 54.13 54.81 1bvz s LEU 86 Cb -0.11 -3.13 -0.00 0.00 0.03 0.00 0.00 46.19 42.97 1bvz s LEU 86 CO 0.22 0.00 -0.22 -0.89 0.23 0.00 0.00 176.35 175.70 1bvz s THR 87 N 0.11 1.85 0.00 5.49 2.01 -0.76 -1.50 115.64 122.84 1bvz s THR 87 Ca 0.37 -0.93 0.00 0.00 0.31 0.00 0.00 61.69 61.44 1bvz s THR 87 Cb -0.19 -1.59 0.00 0.00 0.01 0.00 0.00 72.50 70.73 1bvz s THR 87 CO 0.21 0.52 0.00 0.61 -0.69 0.00 0.00 174.62 175.26 1bvz n GLY 88 N 3.28 1.25 0.20 4.40 0.00 -0.63 -0.01 105.19 113.69 1bvz n GLY 88 Ca -0.19 -2.01 -0.19 0.00 0.00 0.00 0.00 46.02 43.63 1bvz n GLY 88 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1bvz h PRO 89 N 0.00 0.72 0.00 1.61 0.11 -1.84 -3.08 132.00 129.53 1bvz h PRO 89 Ca 0.00 -0.71 0.00 0.00 0.11 0.00 0.00 66.00 65.40 1bvz h PRO 89 Cb 0.00 0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.30 1bvz h PRO 89 CO 0.00 1.30 0.00 1.04 -0.21 0.00 0.00 178.00 180.13 1bvz n GLN 90 N -3.88 0.04 -1.37 1.05 6.02 -1.26 -4.85 117.38 113.15 1bvz n GLN 90 Ca -0.10 0.32 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 1bvz n GLN 90 Cb 0.84 -1.59 0.00 0.00 1.02 0.00 0.00 30.24 30.51 1bvz n GLN 90 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1bvz n GLY 91 N -0.20 1.00 3.68 1.08 0.00 -1.16 -5.06 105.19 104.52 1bvz n GLY 91 Ca 0.03 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1bvz n GLY 91 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bvz s GLU 92 N -2.84 1.09 -0.48 1.61 8.01 -1.26 -4.72 118.70 120.11 1bvz s GLU 92 Ca 0.00 1.42 0.07 0.00 0.01 0.00 0.00 54.97 56.47 1bvz s GLU 92 Cb 0.00 -1.75 0.19 0.00 -4.31 0.00 0.00 34.13 28.26 1bvz s GLU 92 CO 0.00 -2.54 0.67 0.00 0.01 0.00 0.00 175.26 173.40 1bvz s ALA 93 N -2.69 -1.93 0.01 5.21 0.00 -1.25 -1.60 121.76 119.52 1bvz s ALA 93 Ca 0.66 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 52.23 1bvz s ALA 93 Cb -0.22 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.22 1bvz s ALA 93 CO 0.58 -2.22 0.02 0.08 0.00 0.00 0.00 175.76 174.23 1bvz s VAL 94 N 1.07 4.29 -0.12 0.00 1.01 -0.56 -4.68 120.40 121.41 1bvz s VAL 94 Ca 0.26 -0.61 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 1bvz s VAL 94 Cb -0.01 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1bvz s VAL 94 CO -0.06 0.33 0.14 -0.31 0.00 0.00 0.00 175.10 175.19 1bvz s TYR 95 N -1.15 3.59 -0.08 5.22 1.51 0.48 -0.42 117.35 126.50 1bvz s TYR 95 Ca 0.22 0.52 0.01 0.00 -1.01 0.00 0.00 57.07 56.80 1bvz s TYR 95 Cb -0.12 -1.95 0.02 0.00 -0.11 0.00 0.00 41.96 39.80 1bvz s TYR 95 CO 0.13 0.72 -0.09 0.12 -1.11 0.00 0.00 175.55 175.31 1bvz s PHE 96 N -0.96 1.35 0.00 2.71 5.36 -0.24 -2.64 117.98 123.56 1bvz s PHE 96 Ca 0.15 -0.54 0.00 0.00 -0.96 0.00 0.00 56.93 55.57 1bvz s PHE 96 Cb -0.12 -1.06 0.00 0.00 -0.34 0.00 0.00 43.02 41.50 1bvz s PHE 96 CO 0.04 -0.34 0.00 0.41 -1.46 0.00 0.00 175.22 173.87 1bvz n GLY 97 N 4.23 1.98 0.21 13.12 0.00 -1.12 -0.99 105.19 122.62 1bvz n GLY 97 Ca -0.20 -0.92 0.07 0.00 0.00 0.00 0.00 46.02 44.97 1bvz n GLY 97 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1bvz h GLU 98 N 0.00 0.00 -0.05 1.61 4.81 -1.49 -1.60 114.58 117.86 1bvz h GLU 98 Ca 0.00 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.98 1bvz h GLU 98 Cb 0.00 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.40 1bvz h GLU 98 CO 0.00 0.31 -0.96 1.15 -0.73 0.00 0.00 179.01 178.77 1bvz h THR 99 N 0.00 1.28 0.00 0.32 2.02 -0.91 -3.49 112.91 112.13 1bvz h THR 99 Ca -0.00 -2.16 0.00 0.00 0.77 0.00 0.00 66.41 65.02 1bvz h THR 99 Cb 0.69 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 69.36 1bvz h THR 99 CO 0.04 0.67 0.00 0.61 0.37 0.00 0.00 175.52 177.21 1bvz n GLY 100 N 0.97 -0.40 2.91 2.16 0.00 -0.60 -4.98 105.19 105.25 1bvz n GLY 100 Ca -0.10 -0.17 -0.16 0.00 0.00 0.00 0.00 46.02 45.60 1bvz n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bvz s PHE 101 N 0.00 0.36 -0.00 1.61 0.08 -1.26 -2.80 117.98 115.97 1bvz s PHE 101 Ca 0.00 -0.06 -0.28 0.00 0.12 0.00 0.00 56.93 56.71 1bvz s PHE 101 Cb 0.00 -0.29 0.09 0.00 -0.57 0.00 0.00 43.02 42.25 1bvz s PHE 101 CO 0.00 -0.04 0.75 0.45 -0.10 0.00 0.00 175.22 176.27 1bvz s SER 102 N 0.20 -0.53 0.00 1.36 0.15 -1.08 -4.87 113.70 108.93 1bvz s SER 102 Ca -0.02 0.34 0.28 0.00 0.70 0.00 0.00 55.95 57.25 1bvz s SER 102 Cb -0.05 0.49 1.07 0.00 -1.71 0.00 0.00 66.02 65.82 1bvz s SER 102 CO -0.00 -0.67 1.80 0.00 1.20 0.00 0.00 173.24 175.57 1bvz n ALA 103 N 0.31 2.68 -2.72 5.45 0.00 -1.26 -0.39 120.51 124.59 1bvz n ALA 103 Ca -0.15 -0.18 -0.37 0.00 0.00 0.00 0.00 53.44 52.74 1bvz n ALA 103 Cb 0.60 -1.37 -0.07 0.00 0.00 0.00 0.00 19.45 18.61 1bvz n ALA 103 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1bvz s GLU 104 N -2.94 4.26 0.20 0.00 2.02 -1.26 -4.77 118.70 116.21 1bvz s GLU 104 Ca 0.15 0.13 -0.12 0.00 0.02 0.00 0.00 54.97 55.15 1bvz s GLU 104 Cb 0.19 -3.44 0.24 0.00 0.10 0.00 0.00 34.13 31.22 1bvz s GLU 104 CO 0.57 0.21 1.67 -0.09 0.02 0.00 0.00 175.26 177.64 1bvz h ARG 105 N 6.75 0.11 -0.93 1.61 2.43 -1.96 -2.29 114.38 120.11 1bvz h ARG 105 Ca -0.41 -0.01 0.27 0.00 -0.81 0.00 0.00 59.98 59.03 1bvz h ARG 105 Cb 1.16 -0.03 -0.15 0.00 -0.42 0.00 0.00 29.97 30.54 1bvz h ARG 105 CO 0.75 0.07 0.31 0.77 -1.51 0.00 0.00 179.97 180.37 1bvz h SER 106 N 0.12 0.09 0.16 -3.80 0.02 -1.93 -1.10 113.55 107.11 1bvz h SER 106 Ca 0.29 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 1bvz h SER 106 Cb 0.45 0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.25 1bvz h SER 106 CO -0.47 -0.19 -0.70 0.29 -1.14 0.00 0.00 176.83 174.61 1bvz n LYS 107 N -5.22 0.28 0.15 3.45 5.02 -0.87 -3.61 118.16 117.36 1bvz n LYS 107 Ca 0.25 -0.21 0.11 0.00 -2.02 0.00 0.00 58.31 56.44 1bvz n LYS 107 Cb 0.80 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.38 1bvz n LYS 107 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1bvz h ALA 108 N 3.21 0.70 0.00 7.82 0.00 -1.13 -3.39 119.26 126.47 1bvz h ALA 108 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1bvz h ALA 108 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1bvz h ALA 108 CO 0.00 0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1bvz n GLY 109 N 1.15 -0.38 3.54 0.00 0.00 -1.18 -0.25 105.19 108.07 1bvz n GLY 109 Ca 0.01 -1.54 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 1bvz n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bvz s VAL 110 N 0.00 -0.00 0.51 1.61 0.11 -1.26 -4.56 120.40 116.80 1bvz s VAL 110 Ca 0.00 0.01 -0.06 0.00 -2.93 0.00 0.00 61.98 58.99 1bvz s VAL 110 Cb 0.00 -0.89 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1bvz s VAL 110 CO 0.00 0.00 0.83 -0.36 -3.33 0.00 0.00 175.10 172.24 1bvz s PHE 111 N 0.71 3.57 -0.03 1.54 0.08 0.42 -3.80 117.98 120.46 1bvz s PHE 111 Ca -0.03 0.91 0.03 0.00 0.12 0.00 0.00 56.93 57.96 1bvz s PHE 111 Cb -0.05 -2.38 0.00 0.00 -0.57 0.00 0.00 43.02 40.02 1bvz s PHE 111 CO -0.05 -0.35 -0.12 -0.65 -0.10 0.00 0.00 175.22 173.95 1bvz s GLN 112 N -4.81 1.27 -0.38 0.44 -0.21 -1.26 -0.75 119.66 113.97 1bvz s GLN 112 Ca 0.49 -0.42 -0.08 0.00 0.02 0.00 0.00 55.36 55.37 1bvz s GLN 112 Cb -0.10 -1.15 0.05 0.00 1.00 0.00 0.00 33.01 32.81 1bvz s GLN 112 CO 0.46 0.16 0.18 -0.47 -2.12 0.00 0.00 175.29 173.50 1bvz s TYR 113 N 0.15 3.30 0.14 0.91 5.04 0.20 -4.91 117.35 122.17 1bvz s TYR 113 Ca -0.04 -1.43 -0.24 0.00 -2.44 0.00 0.00 57.07 52.93 1bvz s TYR 113 Cb -0.10 -2.59 0.01 0.00 0.35 0.00 0.00 41.96 39.63 1bvz s TYR 113 CO 0.01 -0.77 1.62 0.00 -1.34 0.00 0.00 175.55 175.07 1bvz h ALA 114 N 8.32 -0.25 -1.83 3.97 0.00 -1.89 -2.34 119.26 125.24 1bvz h ALA 114 Ca -0.23 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.76 1bvz h ALA 114 Cb 1.08 0.57 -0.23 0.00 0.00 0.00 0.00 17.79 19.22 1bvz h ALA 114 CO 0.67 -0.74 0.21 -0.47 0.00 0.00 0.00 179.25 178.93 1bvz s TYR 115 N -6.03 -0.77 -0.36 0.00 6.14 -1.23 -4.42 117.35 110.67 1bvz s TYR 115 Ca -0.15 1.68 -0.12 0.00 0.64 0.00 0.00 57.07 59.12 1bvz s TYR 115 Cb 0.11 0.42 0.01 0.00 0.42 0.00 0.00 41.96 42.93 1bvz s TYR 115 CO 0.67 -0.38 0.23 0.42 0.64 0.00 0.00 175.55 177.13 1bvz s ILE 116 N 0.94 4.87 -0.22 3.14 1.01 0.20 -4.96 121.20 126.18 1bvz s ILE 116 Ca -0.04 -0.61 -0.11 0.00 0.00 0.00 0.00 60.65 59.88 1bvz s ILE 116 Cb -0.05 -3.64 -0.05 0.00 0.01 0.00 0.00 42.46 38.74 1bvz s ILE 116 CO -0.10 -0.16 0.18 -1.00 0.00 0.00 0.00 174.94 173.86 1bvz s HIS 117 N 1.63 3.36 0.01 3.97 3.76 -1.26 -4.88 115.29 121.87 1bvz s HIS 117 Ca 0.04 0.32 -0.01 0.00 -0.15 0.00 0.00 55.06 55.26 1bvz s HIS 117 Cb -0.18 -2.27 -0.00 0.00 1.11 0.00 0.00 32.58 31.24 1bvz s HIS 117 CO 0.08 0.14 0.08 -2.13 -0.85 0.00 0.00 174.74 172.05 1bvz n ARG 118 N 4.03 -0.01 0.00 1.40 3.00 -1.26 -0.44 116.66 123.38 1bvz n ARG 118 Ca -0.14 0.08 0.09 0.00 -0.00 0.00 0.00 57.85 57.87 1bvz n ARG 118 Cb 0.52 -0.11 0.48 0.00 0.00 0.00 0.00 32.46 33.35 1bvz n ARG 118 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 1bvz n SER 119 N -3.21 0.00 -0.00 6.15 3.41 -1.26 -2.37 113.62 116.34 1bvz n SER 119 Ca 0.00 -0.12 0.10 0.00 -0.26 0.00 0.00 58.87 58.60 1bvz n SER 119 Cb 0.01 -0.22 -0.14 0.00 -0.26 0.00 0.00 64.21 63.60 1bvz n SER 119 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1bvz n GLU 120 N -1.22 0.30 -2.04 4.33 1.02 0.42 -4.86 120.64 118.58 1bvz n GLU 120 Ca 0.10 -0.09 -0.43 0.00 -0.02 0.00 0.00 57.16 56.73 1bvz n GLU 120 Cb 0.13 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 30.01 1bvz n GLU 120 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1bvz s VAL 121 N -3.23 3.62 -0.22 2.62 1.01 -1.00 -4.88 120.40 118.31 1bvz s VAL 121 Ca 0.01 0.72 -0.28 0.00 0.00 0.00 0.00 61.98 62.43 1bvz s VAL 121 Cb 0.15 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 1bvz s VAL 121 CO 0.88 -0.14 1.99 0.12 0.00 0.00 0.00 175.10 177.95 1bvz s PHE 122 N 4.61 1.49 -0.01 5.22 2.19 -1.26 -4.96 117.98 125.27 1bvz s PHE 122 Ca 0.73 0.45 0.02 0.00 0.33 0.00 0.00 56.93 58.47 1bvz s PHE 122 Cb -0.30 -4.03 -0.03 0.00 -1.31 0.00 0.00 43.02 37.35 1bvz s PHE 122 CO 0.29 -3.76 -0.03 0.99 1.83 0.00 0.00 175.22 174.53 1bvz s THR 123 N 7.05 3.91 -0.04 0.12 2.01 -1.26 -4.96 115.64 122.47 1bvz s THR 123 Ca 0.89 -0.64 -0.02 0.00 0.31 0.00 0.00 61.69 62.23 1bvz s THR 123 Cb -0.30 -2.71 0.02 0.00 0.01 0.00 0.00 72.50 69.53 1bvz s THR 123 CO 0.35 0.42 0.09 -0.89 -0.69 0.00 0.00 174.62 173.90 1bvz s THR 124 N -1.01 -0.03 0.46 -0.82 2.01 -1.26 -4.98 115.64 110.01 1bvz s THR 124 Ca 0.17 0.09 -0.23 0.00 0.31 0.00 0.00 61.69 62.04 1bvz s THR 124 Cb -0.11 -0.15 -0.09 0.00 0.01 0.00 0.00 72.50 72.15 1bvz s THR 124 CO 0.08 0.04 1.00 -2.65 -0.69 0.00 0.00 174.62 172.40 1bvz n PRO 125 N 3.59 1.28 -0.14 4.92 -0.02 -1.26 -4.91 135.00 138.45 1bvz n PRO 125 Ca -0.19 0.46 -0.10 0.00 -2.02 0.00 0.00 63.50 61.65 1bvz n PRO 125 Cb 0.55 -2.08 -0.01 0.00 -0.02 0.00 0.00 33.50 31.95 1bvz n PRO 125 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1bvz h GLU 126 N 1.35 0.71 -0.51 -0.52 4.39 -1.94 -2.18 114.58 115.88 1bvz h GLU 126 Ca -0.45 -0.22 0.07 0.00 0.34 0.00 0.00 59.36 59.09 1bvz h GLU 126 Cb 1.34 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.89 1bvz h GLU 126 CO 0.56 0.79 0.34 0.11 -1.16 0.00 0.00 179.01 179.64 1bvz h TRP 127 N 0.55 0.41 0.00 4.33 5.08 -1.95 -1.01 115.95 123.36 1bvz h TRP 127 Ca 0.12 0.01 0.00 0.00 1.08 0.00 0.00 58.89 60.10 1bvz h TRP 127 Cb 0.46 -0.14 0.00 0.00 -3.00 0.00 0.00 29.16 26.48 1bvz h TRP 127 CO 0.04 0.22 0.00 0.00 -1.28 0.00 0.00 178.44 177.41 1bvz h ALA 128 N 1.73 1.00 0.00 0.11 0.00 -1.75 -2.30 119.26 118.05 1bvz h ALA 128 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1bvz h ALA 128 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1bvz h ALA 128 CO -0.06 0.00 0.00 0.87 0.00 0.00 0.00 179.25 180.06 1bvz h LYS 129 N 0.00 0.00 -0.07 0.00 1.57 -1.16 -3.29 116.57 113.61 1bvz h LYS 129 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1bvz h LYS 129 Cb 0.27 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 32.26 1bvz h LYS 129 CO 0.00 0.00 -0.94 -0.85 -0.57 0.00 0.00 179.45 177.09 1bvz n GLU 130 N -2.74 0.61 -2.39 3.15 0.28 -0.90 -4.61 120.64 114.05 1bvz n GLU 130 Ca 0.04 -2.49 -0.39 0.00 -0.16 0.00 0.00 57.16 54.16 1bvz n GLU 130 Cb 0.44 -0.56 -0.03 0.00 1.43 0.00 0.00 31.44 32.72 1bvz n GLU 130 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1bvz s ALA 131 N -1.16 3.25 -0.15 -1.84 0.00 -1.04 -4.99 121.76 115.84 1bvz s ALA 131 Ca 0.34 0.91 0.02 0.00 0.00 0.00 0.00 51.96 53.23 1bvz s ALA 131 Cb 0.38 -3.35 0.01 0.00 0.00 0.00 0.00 23.12 20.16 1bvz s ALA 131 CO -0.13 -0.35 -0.19 0.08 0.00 0.00 0.00 175.76 175.16 1bvz s VAL 132 N -1.36 2.29 0.27 0.00 1.01 -1.26 -4.28 120.40 117.07 1bvz s VAL 132 Ca 0.52 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.67 1bvz s VAL 132 Cb -0.30 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1bvz s VAL 132 CO 0.38 0.54 0.32 -0.63 0.00 0.00 0.00 175.10 175.70 1bvz s ILE 133 N 0.83 4.66 -0.19 2.22 -1.09 -0.58 -1.09 121.20 125.96 1bvz s ILE 133 Ca -0.06 -1.16 -0.04 0.00 -2.23 0.00 0.00 60.65 57.16 1bvz s ILE 133 Cb -0.15 -3.58 0.06 0.00 -1.58 0.00 0.00 42.46 37.21 1bvz s ILE 133 CO -0.02 -0.30 0.07 -0.47 -1.23 0.00 0.00 174.94 173.00 1bvz s TYR 134 N -2.09 0.53 -0.44 3.97 6.14 -0.72 -1.21 117.35 123.53 1bvz s TYR 134 Ca 0.36 -0.56 -0.28 0.00 0.64 0.00 0.00 57.07 57.23 1bvz s TYR 134 Cb -0.08 -0.84 -0.02 0.00 0.42 0.00 0.00 41.96 41.44 1bvz s TYR 134 CO 0.28 -0.57 1.77 -1.14 0.64 0.00 0.00 175.55 176.52 1bvz s GLN 135 N 2.03 3.13 -0.37 4.97 0.74 0.27 -2.12 119.66 128.31 1bvz s GLN 135 Ca 0.01 1.09 -0.16 0.00 0.05 0.00 0.00 55.36 56.35 1bvz s GLN 135 Cb -0.16 -4.24 0.00 0.00 1.10 0.00 0.00 33.01 29.71 1bvz s GLN 135 CO -0.10 -2.11 0.40 0.42 -0.55 0.00 0.00 175.29 173.35 1bvz s ILE 136 N 7.42 5.13 -0.38 -2.34 1.01 0.72 -3.07 121.20 129.69 1bvz s ILE 136 Ca 0.73 -0.07 -0.21 0.00 0.00 0.00 0.00 60.65 61.10 1bvz s ILE 136 Cb -0.18 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.39 1bvz s ILE 136 CO 0.29 -0.22 0.66 0.12 0.00 0.00 0.00 174.94 175.79 1bvz s PHE 137 N 2.09 3.12 0.05 3.97 2.19 -1.26 -3.17 117.98 124.96 1bvz s PHE 137 Ca 0.12 0.27 -0.28 0.00 0.33 0.00 0.00 56.93 57.38 1bvz s PHE 137 Cb -0.17 -3.24 -0.17 0.00 -1.31 0.00 0.00 43.02 38.14 1bvz s PHE 137 CO 0.12 -0.71 1.49 -1.35 1.83 0.00 0.00 175.22 176.60 1bvz h PRO 138 N 8.58 -0.51 -0.11 10.12 0.11 -1.90 -2.57 132.00 145.72 1bvz h PRO 138 Ca -0.26 0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.92 1bvz h PRO 138 Cb 1.10 0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1bvz h PRO 138 CO 0.86 -0.26 0.22 1.49 -0.21 0.00 0.00 178.00 180.10 1bvz h GLU 139 N -0.67 0.00 -0.19 1.05 4.22 -1.93 0.21 114.58 117.27 1bvz h GLU 139 Ca -0.05 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.39 1bvz h GLU 139 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1bvz h GLU 139 CO 0.09 0.00 0.00 0.54 -2.18 0.00 0.00 179.01 177.46 1bvz n ARG 140 N -3.39 2.89 -0.07 1.92 3.00 -1.13 -2.50 116.66 117.39 1bvz n ARG 140 Ca 0.00 -1.80 -0.06 0.00 -0.01 0.00 0.00 57.85 55.99 1bvz n ARG 140 Cb 0.31 -1.15 -0.03 0.00 0.00 0.00 0.00 32.46 31.59 1bvz n ARG 140 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 1bvz h PHE 141 N 1.13 0.00 -2.03 -1.55 3.57 -0.54 -0.42 116.94 117.11 1bvz h PHE 141 Ca 0.00 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.51 1bvz h PHE 141 Cb 0.63 0.00 -0.21 0.00 2.79 0.00 0.00 35.95 39.15 1bvz h PHE 141 CO 0.13 0.24 0.02 0.00 -2.23 0.00 0.00 178.31 176.47 1bvz s ALA 142 N -2.58 -1.84 -0.13 2.41 0.00 -1.26 -4.27 121.76 114.09 1bvz s ALA 142 Ca -0.11 2.36 -0.29 0.00 0.00 0.00 0.00 51.96 53.92 1bvz s ALA 142 Cb 0.01 -1.39 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 1bvz s ALA 142 CO 0.22 -0.37 0.98 1.21 0.00 0.00 0.00 175.76 177.79 1bvz s ASN 143 N 1.51 7.18 0.00 0.00 3.84 -1.26 -1.07 114.94 125.13 1bvz s ASN 143 Ca -0.09 1.45 0.00 0.00 0.21 0.00 0.00 52.86 54.43 1bvz s ASN 143 Cb -0.05 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.11 1bvz s ASN 143 CO -0.18 -0.46 0.19 0.61 -2.79 0.00 0.00 177.10 174.47 1bvz n GLY 144 N 3.18 0.05 2.59 1.21 0.00 -1.26 -4.71 105.19 106.25 1bvz n GLY 144 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 1bvz n GLY 144 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bvz s ASP 145 N -0.36 2.71 -0.05 1.61 -1.08 -1.26 -4.58 116.67 113.66 1bvz s ASP 145 Ca 0.00 -0.81 0.01 0.00 -0.52 0.00 0.00 52.55 51.23 1bvz s ASP 145 Cb 0.00 -0.28 0.10 0.00 -1.46 0.00 0.00 42.92 41.28 1bvz s ASP 145 CO 0.00 -0.37 0.88 -0.81 0.52 0.00 0.00 175.17 175.39 1bvz n PRO 146 N 5.26 1.37 0.03 4.34 -0.04 -1.26 -3.70 135.00 141.01 1bvz n PRO 146 Ca -0.07 -0.43 -0.00 0.00 -0.04 0.00 0.00 63.50 62.96 1bvz n PRO 146 Cb 0.47 -1.40 -0.08 0.00 -0.04 0.00 0.00 33.50 32.44 1bvz n PRO 146 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1bvz h SER 147 N 0.36 0.00 0.91 3.54 0.02 -1.98 -3.37 113.55 113.04 1bvz h SER 147 Ca 0.04 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.77 1bvz h SER 147 Cb 0.96 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.47 1bvz h SER 147 CO 0.11 0.60 -1.02 -0.55 -1.14 0.00 0.00 176.83 174.83 1bvz h ASN 148 N 0.00 0.08 -1.24 3.07 7.08 -1.88 -3.48 115.58 119.21 1bvz h ASN 148 Ca -0.17 -0.08 -0.81 0.00 -3.08 0.00 0.00 56.30 52.16 1bvz h ASN 148 Cb 1.60 -0.03 0.01 0.00 -2.08 0.00 0.00 38.32 37.83 1bvz h ASN 148 CO 0.05 1.04 0.74 0.47 -2.08 0.00 0.00 177.43 177.65 1bvz n ASP 149 N -3.41 1.65 -4.75 6.14 9.92 -1.26 -4.56 116.55 120.27 1bvz n ASP 149 Ca -0.02 1.14 -0.32 0.00 -0.53 0.00 0.00 54.79 55.07 1bvz n ASP 149 Cb 0.94 -1.00 0.09 0.00 -0.64 0.00 0.00 41.12 40.51 1bvz n ASP 149 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1bvz s PRO 150 N 3.03 2.17 -0.43 -0.24 0.04 -1.26 -4.88 135.00 133.42 1bvz s PRO 150 Ca 1.01 1.32 -0.28 0.00 0.04 0.00 0.00 61.00 63.10 1bvz s PRO 150 Cb -1.30 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 31.35 1bvz s PRO 150 CO 0.73 -1.73 1.77 -1.25 0.04 0.00 0.00 177.00 176.56 1bvz s PRO 151 N -4.61 3.13 0.00 0.56 0.04 -1.26 -2.56 135.00 130.30 1bvz s PRO 151 Ca 0.64 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.77 1bvz s PRO 151 Cb -0.20 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.11 1bvz s PRO 151 CO 0.52 -2.11 0.00 0.41 0.04 0.00 0.00 177.00 175.87 1bvz n GLY 152 N 5.47 1.92 3.67 0.56 0.00 -1.26 -5.06 105.19 110.49 1bvz n GLY 152 Ca 0.21 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.75 1bvz n GLY 152 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bvz n THR 153 N -0.18 0.27 -1.74 2.61 -1.04 -1.06 -4.31 114.28 108.83 1bvz n THR 153 Ca 0.00 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.05 61.67 1bvz n THR 153 Cb 0.00 -1.57 0.16 0.00 -1.82 0.00 0.00 70.33 67.10 1bvz n THR 153 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1bvz s GLU 154 N 2.41 0.80 0.59 -2.82 2.02 -0.18 -4.97 118.70 116.55 1bvz s GLU 154 Ca 0.87 -0.12 -0.09 0.00 0.02 0.00 0.00 54.97 55.65 1bvz s GLU 154 Cb -0.75 -1.84 -0.03 0.00 0.10 0.00 0.00 34.13 31.62 1bvz s GLU 154 CO 0.47 -2.35 0.95 -0.65 0.02 0.00 0.00 175.26 173.70 1bvz s GLN 155 N -5.65 3.43 -0.55 1.61 -0.21 -1.26 -4.68 119.66 112.35 1bvz s GLN 155 Ca 0.69 0.48 -0.26 0.00 0.02 0.00 0.00 55.36 56.29 1bvz s GLN 155 Cb -0.08 -2.18 0.04 0.00 1.00 0.00 0.00 33.01 31.78 1bvz s GLN 155 CO 0.52 -0.53 1.03 -0.46 -2.12 0.00 0.00 175.29 173.74 1bvz s TRP 156 N -3.05 2.74 -0.13 0.91 -0.11 -1.26 -4.98 118.94 113.06 1bvz s TRP 156 Ca 0.53 0.20 -0.13 0.00 1.22 0.00 0.00 56.10 57.92 1bvz s TRP 156 Cb -0.11 -4.23 0.04 0.00 -1.50 0.00 0.00 33.47 27.67 1bvz s TRP 156 CO 0.50 -1.40 0.37 0.00 -4.62 0.00 0.00 176.95 171.80 1bvz s ALA 157 N 4.29 -0.91 0.27 5.86 0.00 -1.26 -5.05 121.76 124.96 1bvz s ALA 157 Ca 0.36 1.01 0.05 0.00 0.00 0.00 0.00 51.96 53.38 1bvz s ALA 157 Cb -0.10 -0.58 0.37 0.00 0.00 0.00 0.00 23.12 22.81 1bvz s ALA 157 CO 0.23 -0.18 1.65 -0.22 0.00 0.00 0.00 175.76 177.24 1bvz h LYS 158 N 5.49 0.30 0.00 0.00 3.64 -1.93 -2.22 116.57 121.85 1bvz h LYS 158 Ca -0.27 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 58.95 1bvz h LYS 158 Cb 1.18 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1bvz h LYS 158 CO 0.28 0.69 -0.03 0.38 -2.27 0.00 0.00 179.45 178.51 1bvz h ASP 159 N 0.24 0.00 -3.28 4.20 2.03 -2.00 -3.47 116.42 114.15 1bvz h ASP 159 Ca 0.02 0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 55.74 1bvz h ASP 159 Cb 0.89 0.00 0.16 0.00 -0.83 0.00 0.00 39.33 39.55 1bvz h ASP 159 CO 0.07 0.03 0.00 0.00 -1.03 0.00 0.00 179.24 178.31 1bvz n ALA 160 N -2.20 -0.16 -4.04 4.15 0.00 -0.84 -5.02 120.51 112.40 1bvz n ALA 160 Ca -0.02 0.06 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 1bvz n ALA 160 Cb 0.13 -2.03 -0.16 0.00 0.00 0.00 0.00 19.45 17.40 1bvz n ALA 160 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1bvz s ARG 161 N -2.39 2.24 -0.35 0.00 1.81 -1.26 -4.99 118.95 114.02 1bvz s ARG 161 Ca 0.71 -1.04 -0.29 0.00 -1.72 0.00 0.00 55.73 53.39 1bvz s ARG 161 Cb -0.46 -2.63 -0.00 0.00 -0.45 0.00 0.00 34.95 31.40 1bvz s ARG 161 CO 0.51 -0.45 1.55 -2.14 -0.68 0.00 0.00 175.30 174.09 1bvz s PRO 162 N 1.27 3.55 0.96 3.54 0.02 -1.26 -5.04 135.00 138.04 1bvz s PRO 162 Ca -0.03 1.21 -0.12 0.00 0.02 0.00 0.00 61.00 62.07 1bvz s PRO 162 Cb -0.17 -4.07 0.16 0.00 0.02 0.00 0.00 34.50 30.44 1bvz s PRO 162 CO -0.08 -1.59 1.10 1.03 -0.33 0.00 0.00 177.00 177.13 1bvz s ARG 163 N 5.08 0.76 0.47 5.54 0.52 -1.26 -4.50 118.95 125.55 1bvz s ARG 163 Ca 0.68 0.53 0.21 0.00 -0.52 0.00 0.00 55.73 56.63 1bvz s ARG 163 Cb -0.18 -1.77 1.15 0.00 0.52 0.00 0.00 34.95 34.67 1bvz s ARG 163 CO 0.32 -2.51 1.98 0.45 0.02 0.00 0.00 175.30 175.56 1bvz h HIS 164 N -1.73 0.00 -0.71 -0.53 3.86 -1.99 -1.42 115.15 112.64 1bvz h HIS 164 Ca -0.53 0.00 -0.41 0.00 -1.16 0.00 0.00 60.37 58.27 1bvz h HIS 164 Cb 1.32 0.00 -0.24 0.00 1.06 0.00 0.00 27.41 29.55 1bvz h HIS 164 CO 0.32 0.20 0.23 -0.25 0.86 0.00 0.00 177.93 179.29 1bvz n ASP 165 N -3.89 4.05 -4.66 2.45 9.92 -1.26 -4.94 116.55 118.21 1bvz n ASP 165 Ca -0.02 -3.74 -0.41 0.00 -0.53 0.00 0.00 54.79 50.09 1bvz n ASP 165 Cb 0.29 -0.73 -0.04 0.00 -0.64 0.00 0.00 41.12 39.99 1bvz n ASP 165 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1bvz s SER 166 N -2.16 6.88 0.03 -2.24 0.01 -0.54 -4.99 113.70 110.70 1bvz s SER 166 Ca 0.53 1.08 0.03 0.00 1.31 0.00 0.00 55.95 58.89 1bvz s SER 166 Cb 0.45 -2.43 -0.04 0.00 0.21 0.00 0.00 66.02 64.21 1bvz s SER 166 CO 0.03 -0.38 0.00 -0.36 0.41 0.00 0.00 173.24 172.94 1bvz s PHE 167 N 2.18 3.05 -0.01 2.43 0.08 -1.26 -4.91 117.98 119.54 1bvz s PHE 167 Ca 0.36 0.04 0.02 0.00 0.12 0.00 0.00 56.93 57.47 1bvz s PHE 167 Cb -0.16 -1.63 0.03 0.00 -0.57 0.00 0.00 43.02 40.69 1bvz s PHE 167 CO 0.11 0.47 0.96 0.66 -0.10 0.00 0.00 175.22 177.32 1bvz n TYR 168 N 1.11 0.00 -1.24 0.36 4.01 -1.26 -1.01 117.16 119.13 1bvz n TYR 168 Ca -0.13 -0.49 -0.08 0.00 -0.16 0.00 0.00 57.90 57.04 1bvz n TYR 168 Cb 0.52 -0.05 -0.04 0.00 -0.31 0.00 0.00 39.34 39.46 1bvz n TYR 168 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1bvz n GLY 169 N -0.53 0.99 3.77 2.72 0.00 -1.26 -4.67 105.19 106.21 1bvz n GLY 169 Ca 0.01 -0.47 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 1bvz n GLY 169 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bvz s GLY 170 N -2.73 2.91 0.07 -0.02 0.00 -1.04 -4.48 107.32 102.03 1bvz s GLY 170 Ca 0.00 0.83 -0.01 0.00 0.00 0.00 0.00 44.72 45.54 1bvz s GLY 170 CO 0.00 1.35 0.10 2.09 0.00 0.00 0.00 173.10 176.65 1bvz n ASP 171 N 0.56 -0.29 0.05 1.64 5.75 -0.24 -3.62 116.55 120.40 1bvz n ASP 171 Ca 0.02 -1.38 -0.14 0.00 -0.01 0.00 0.00 54.79 53.28 1bvz n ASP 171 Cb 0.47 0.54 -0.04 0.00 -1.03 0.00 0.00 41.12 41.05 1bvz n ASP 171 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1bvz h LEU 172 N 0.00 0.65 -0.85 -2.12 3.38 -1.64 -2.56 115.31 112.17 1bvz h LEU 172 Ca -0.06 -0.48 -0.11 0.00 0.09 0.00 0.00 57.88 57.32 1bvz h LEU 172 Cb 0.24 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1bvz h LEU 172 CO 0.08 1.27 -0.29 0.50 0.09 0.00 0.00 178.44 180.09 1bvz h LYS 173 N 0.32 0.53 -0.46 1.13 3.64 -1.91 -0.11 116.57 119.71 1bvz h LYS 173 Ca -0.07 -0.22 0.09 0.00 -1.27 0.00 0.00 60.65 59.18 1bvz h LYS 173 Cb 1.51 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 33.24 1bvz h LYS 173 CO 0.16 0.76 0.01 0.78 -2.27 0.00 0.00 179.45 178.90 1bvz h GLY 174 N 1.03 0.48 0.99 5.01 0.00 -1.68 -0.59 103.07 108.31 1bvz h GLY 174 Ca 0.06 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.43 1bvz h GLY 174 CO 0.06 -0.11 0.27 -2.08 0.00 0.00 0.00 176.54 174.68 1bvz h VAL 175 N 0.13 1.14 -0.04 4.60 2.07 -0.75 -1.98 116.25 121.42 1bvz h VAL 175 Ca 0.23 -0.30 0.03 0.00 0.82 0.00 0.00 66.70 67.48 1bvz h VAL 175 Cb 0.33 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 1bvz h VAL 175 CO -0.37 0.14 -0.15 0.40 0.02 0.00 0.00 177.57 177.61 1bvz h ILE 176 N 0.59 0.62 -0.92 4.57 2.04 -0.18 -0.41 117.51 123.82 1bvz h ILE 176 Ca 0.16 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.24 1bvz h ILE 176 Cb -0.02 0.62 -0.07 0.00 -0.74 0.00 0.00 36.82 36.62 1bvz h ILE 176 CO -0.03 0.00 0.61 0.44 0.00 0.00 0.00 178.15 179.17 1bvz h ASP 177 N -0.23 0.37 -0.22 1.72 3.32 -0.90 -1.26 116.42 119.21 1bvz h ASP 177 Ca 0.06 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1bvz h ASP 177 Cb 0.32 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1bvz h ASP 177 CO -0.17 0.14 0.00 0.54 -1.72 0.00 0.00 179.24 178.02 1bvz n ARG 178 N -4.50 2.05 0.12 3.56 5.12 -0.21 -4.50 116.66 118.30 1bvz n ARG 178 Ca 0.20 -1.58 0.05 0.00 -1.93 0.00 0.00 57.85 54.59 1bvz n ARG 178 Cb 0.75 -1.45 0.49 0.00 -1.16 0.00 0.00 32.46 31.09 1bvz n ARG 178 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 1bvz h LEU 179 N 3.24 0.25 -1.54 0.55 3.38 -0.75 -1.90 115.31 118.54 1bvz h LEU 179 Ca 0.00 -0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.08 1bvz h LEU 179 Cb 0.71 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.34 1bvz h LEU 179 CO 0.00 0.24 0.49 -0.65 0.09 0.00 0.00 178.44 178.61 1bvz h PRO 180 N 0.29 0.46 -0.16 1.13 0.11 -1.82 -0.12 132.00 131.89 1bvz h PRO 180 Ca 0.07 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.08 1bvz h PRO 180 Cb 0.07 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.08 1bvz h PRO 180 CO -0.01 0.31 -0.20 -0.92 -0.21 0.00 0.00 178.00 176.97 1bvz h TYR 181 N 0.48 0.51 -0.30 0.65 3.20 -1.68 0.28 116.97 120.10 1bvz h TYR 181 Ca 0.36 -0.16 -0.13 0.00 3.14 0.00 0.00 58.73 61.93 1bvz h TYR 181 Cb 0.72 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.88 1bvz h TYR 181 CO -0.00 0.82 -0.32 -0.07 -1.64 0.00 0.00 178.16 176.95 1bvz h LEU 182 N 0.06 0.81 -0.37 2.82 3.38 -1.47 -0.52 115.31 120.02 1bvz h LEU 182 Ca 0.02 -0.48 0.02 0.00 0.09 0.00 0.00 57.88 57.53 1bvz h LEU 182 Cb 0.75 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1bvz h LEU 182 CO 0.05 1.12 0.21 -0.08 0.09 0.00 0.00 178.44 179.83 1bvz h GLU 183 N 0.51 0.42 -0.20 1.13 4.81 -0.90 -0.82 114.58 119.53 1bvz h GLU 183 Ca 0.05 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.31 1bvz h GLU 183 Cb 0.90 -0.09 -0.07 0.00 0.63 0.00 0.00 28.75 30.12 1bvz h GLU 183 CO 0.08 0.28 -0.33 1.49 -0.73 0.00 0.00 179.01 179.79 1bvz h GLU 184 N 0.43 -0.35 -0.71 1.92 4.81 -0.17 0.15 114.58 120.66 1bvz h GLU 184 Ca 0.15 0.02 0.14 0.00 -0.13 0.00 0.00 59.36 59.54 1bvz h GLU 184 Cb 0.01 0.08 -0.10 0.00 0.63 0.00 0.00 28.75 29.37 1bvz h GLU 184 CO -0.07 -0.24 0.23 1.25 -0.73 0.00 0.00 179.01 179.45 1bvz h LEU 185 N -0.37 0.15 0.00 1.64 5.85 -0.81 -3.47 115.31 118.30 1bvz h LEU 185 Ca 0.11 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1bvz h LEU 185 Cb 0.55 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.71 1bvz h LEU 185 CO -0.41 0.05 0.00 0.61 -0.34 0.00 0.00 178.44 178.35 1bvz n GLY 186 N -1.33 1.97 3.81 3.75 0.00 0.51 -4.58 105.19 109.32 1bvz n GLY 186 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1bvz n GLY 186 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1bvz s VAL 187 N -2.00 3.95 -0.06 1.61 -7.23 -1.05 -4.80 120.40 110.83 1bvz s VAL 187 Ca 0.00 0.95 0.05 0.00 -1.81 0.00 0.00 61.98 61.17 1bvz s VAL 187 Cb 0.00 -3.46 -0.07 0.00 0.56 0.00 0.00 36.38 33.41 1bvz s VAL 187 CO 0.00 -0.52 0.13 0.41 -0.31 0.00 0.00 175.10 174.81 1bvz n THR 188 N -1.85 0.00 -3.49 5.32 -1.04 -0.25 -4.62 114.28 108.35 1bvz n THR 188 Ca 0.08 -0.18 -0.12 0.00 -2.04 0.00 0.00 64.05 61.80 1bvz n THR 188 Cb 0.53 0.53 -0.03 0.00 -1.82 0.00 0.00 70.33 69.54 1bvz n THR 188 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1bvz s ALA 189 N -2.12 -1.75 0.09 2.41 0.00 -1.18 -1.22 121.76 117.98 1bvz s ALA 189 Ca -0.01 0.99 0.09 0.00 0.00 0.00 0.00 51.96 53.03 1bvz s ALA 189 Cb 0.03 0.32 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 1bvz s ALA 189 CO 0.20 -0.59 -0.23 -0.51 0.00 0.00 0.00 175.76 174.63 1bvz s LEU 190 N -2.09 2.43 -0.08 0.00 1.02 0.20 -1.76 118.68 118.39 1bvz s LEU 190 Ca -0.01 -0.59 -0.01 0.00 0.02 0.00 0.00 54.13 53.54 1bvz s LEU 190 Cb -0.01 -1.37 0.03 0.00 0.02 0.00 0.00 46.19 44.85 1bvz s LEU 190 CO -0.05 0.22 -0.03 -0.47 0.02 0.00 0.00 176.35 176.04 1bvz s TYR 191 N -0.98 0.93 -0.10 0.29 5.04 -0.90 -0.64 117.35 120.99 1bvz s TYR 191 Ca 0.14 -0.35 -0.05 0.00 -2.44 0.00 0.00 57.07 54.38 1bvz s TYR 191 Cb -0.10 -0.92 -0.04 0.00 0.35 0.00 0.00 41.96 41.25 1bvz s TYR 191 CO 0.06 -0.37 0.09 -0.06 -1.34 0.00 0.00 175.55 173.93 1bvz s PHE 192 N 1.77 3.44 1.30 4.97 0.40 -1.19 -0.20 117.98 128.46 1bvz s PHE 192 Ca 0.03 0.40 -0.21 0.00 -0.60 0.00 0.00 56.93 56.55 1bvz s PHE 192 Cb -0.13 -1.88 0.32 0.00 0.51 0.00 0.00 43.02 41.85 1bvz s PHE 192 CO -0.05 0.64 1.05 0.95 0.70 0.00 0.00 175.22 178.51 1bvz s THR 193 N -1.00 1.42 -0.05 0.64 -4.23 -1.19 -3.15 115.64 108.07 1bvz s THR 193 Ca 0.15 0.00 -0.35 0.00 -1.18 0.00 0.00 61.69 60.31 1bvz s THR 193 Cb -0.12 -2.35 -0.13 0.00 1.34 0.00 0.00 72.50 71.24 1bvz s THR 193 CO 0.04 0.00 1.75 -2.65 -0.54 0.00 0.00 174.62 173.22 1bvz n PRO 194 N -5.11 1.90 -0.31 3.99 -0.02 -1.26 -4.67 135.00 129.52 1bvz n PRO 194 Ca 0.14 0.69 0.08 0.00 -2.02 0.00 0.00 63.50 62.39 1bvz n PRO 194 Cb 0.60 -2.48 0.20 0.00 -0.02 0.00 0.00 33.50 31.80 1bvz n PRO 194 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1bvz n ILE 195 N 4.45 2.13 -3.87 4.25 -5.35 -1.26 -4.50 119.36 115.20 1bvz n ILE 195 Ca 0.22 -2.20 -0.21 0.00 -0.27 0.00 0.00 62.75 60.29 1bvz n ILE 195 Cb 0.25 -0.25 -0.02 0.00 -1.74 0.00 0.00 39.64 37.88 1bvz n ILE 195 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1bvz s PHE 196 N -2.91 3.34 -0.19 4.28 0.08 -1.26 -1.01 117.98 120.31 1bvz s PHE 196 Ca 0.38 -0.07 -0.28 0.00 0.12 0.00 0.00 56.93 57.07 1bvz s PHE 196 Cb 0.32 -1.65 -0.05 0.00 -0.57 0.00 0.00 43.02 41.07 1bvz s PHE 196 CO 0.05 0.34 2.10 0.00 -0.10 0.00 0.00 175.22 177.61 1bvz s ALA 197 N -2.04 2.91 0.01 5.36 0.00 -0.96 -4.43 121.76 122.61 1bvz s ALA 197 Ca 0.36 0.79 0.02 0.00 0.00 0.00 0.00 51.96 53.14 1bvz s ALA 197 Cb -0.09 -4.02 -0.01 0.00 0.00 0.00 0.00 23.12 19.00 1bvz s ALA 197 CO 0.29 -2.54 -0.07 0.45 0.00 0.00 0.00 175.76 173.89 1bvz s SER 198 N 7.22 0.86 0.48 0.00 0.15 -1.26 -0.59 113.70 120.56 1bvz s SER 198 Ca 0.95 -0.27 0.27 0.00 0.70 0.00 0.00 55.95 57.60 1bvz s SER 198 Cb -0.33 -0.05 1.14 0.00 -1.71 0.00 0.00 66.02 65.07 1bvz s SER 198 CO 0.36 -0.01 1.91 1.55 1.20 0.00 0.00 173.24 178.25 1bvz h PRO 199 N 5.46 0.00 0.00 5.44 0.13 -1.91 -3.46 132.00 137.66 1bvz h PRO 199 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1bvz h PRO 199 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1bvz h PRO 199 CO 0.47 0.16 0.00 -1.13 -0.23 0.00 0.00 178.00 177.26 1bvz n SER 200 N -3.36 0.00 -0.08 1.44 3.41 -1.26 -5.05 113.62 108.72 1bvz n SER 200 Ca -0.00 -0.92 -0.22 0.00 -0.26 0.00 0.00 58.87 57.47 1bvz n SER 200 Cb 0.36 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.19 1bvz n SER 200 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1bvz n HIS 201 N -0.94 0.98 -2.14 7.33 8.25 -1.26 -4.57 115.22 122.88 1bvz n HIS 201 Ca 0.00 0.35 -0.38 0.00 -0.26 0.00 0.00 57.72 57.43 1bvz n HIS 201 Cb 0.00 -1.11 0.00 0.00 1.12 0.00 0.00 29.99 30.00 1bvz n HIS 201 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 1bvz s HIS 202 N -2.43 2.75 -0.79 4.41 0.00 -1.26 -5.00 115.29 112.97 1bvz s HIS 202 Ca -0.28 1.49 0.02 0.00 -3.00 0.00 0.00 55.06 53.29 1bvz s HIS 202 Cb 0.07 -3.49 0.33 0.00 -4.00 0.00 0.00 32.58 25.48 1bvz s HIS 202 CO 0.63 -1.85 1.32 1.63 -1.00 0.00 0.00 174.74 175.48 1bvz n LYS 203 N -0.55 4.17 -0.03 -0.38 4.76 -1.26 -4.69 118.16 120.18 1bvz n LYS 203 Ca 0.08 -4.77 0.11 0.00 -2.87 0.00 0.00 58.31 50.86 1bvz n LYS 203 Cb 0.47 -2.35 0.11 0.00 -1.84 0.00 0.00 35.03 31.43 1bvz n LYS 203 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1bvz n TYR 204 N -0.06 0.09 -3.11 2.13 4.01 -1.26 -4.61 117.16 114.35 1bvz n TYR 204 Ca 0.37 -0.05 -0.26 0.00 -0.16 0.00 0.00 57.90 57.80 1bvz n TYR 204 Cb 0.34 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.31 1bvz n TYR 204 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1bvz n ASP 205 N 1.29 3.97 -4.73 7.72 5.75 -1.26 -4.73 116.55 124.56 1bvz n ASP 205 Ca 0.14 -3.55 -0.42 0.00 -0.01 0.00 0.00 54.79 50.95 1bvz n ASP 205 Cb 0.57 -0.60 -0.03 0.00 -1.03 0.00 0.00 41.12 40.02 1bvz n ASP 205 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1bvz s THR 206 N -3.65 3.85 -0.16 2.12 -4.23 -1.26 -4.22 115.64 108.08 1bvz s THR 206 Ca 0.45 1.45 -0.13 0.00 -1.18 0.00 0.00 61.69 62.28 1bvz s THR 206 Cb 0.24 -3.93 -0.09 0.00 1.34 0.00 0.00 72.50 70.06 1bvz s THR 206 CO -0.09 0.18 -0.01 0.00 -0.54 0.00 0.00 174.62 174.15 1bvz h ALA 207 N 5.94 0.09 -3.16 3.99 0.00 -1.13 -1.11 119.26 123.88 1bvz h ALA 207 Ca -0.43 -0.71 -0.63 0.00 0.00 0.00 0.00 54.91 53.14 1bvz h ALA 207 Cb 1.21 0.54 -0.35 0.00 0.00 0.00 0.00 17.79 19.20 1bvz h ALA 207 CO 0.77 0.53 -0.85 0.34 0.00 0.00 0.00 179.25 180.05 1bvz s ASP 208 N -6.11 2.80 0.17 0.00 -1.08 -0.90 -4.19 116.67 107.36 1bvz s ASP 208 Ca -0.19 -0.53 0.25 0.00 -0.52 0.00 0.00 52.55 51.57 1bvz s ASP 208 Cb 0.03 -1.27 0.60 0.00 -1.46 0.00 0.00 42.92 40.82 1bvz s ASP 208 CO 0.34 -0.00 1.57 -1.22 0.52 0.00 0.00 175.17 176.38 1bvz n TYR 209 N 4.47 0.76 -0.67 -5.34 4.01 -1.26 -3.44 117.16 115.69 1bvz n TYR 209 Ca -0.19 0.22 0.08 0.00 -0.16 0.00 0.00 57.90 57.85 1bvz n TYR 209 Cb 0.51 -0.81 0.24 0.00 -0.31 0.00 0.00 39.34 38.97 1bvz n TYR 209 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1bvz n LEU 210 N -2.19 3.74 -3.92 7.72 7.99 -1.26 -4.94 117.00 124.14 1bvz n LEU 210 Ca 0.05 -2.61 -0.11 0.00 -0.01 0.00 0.00 56.01 53.33 1bvz n LEU 210 Cb 0.43 -0.45 -0.13 0.00 -0.11 0.00 0.00 43.42 43.17 1bvz n LEU 210 CO 0.33 0.71 -0.35 0.00 -1.51 0.00 0.00 177.39 176.56 1bvz s ALA 211 N -2.10 0.04 0.34 -1.18 0.00 -1.25 -5.10 121.76 112.52 1bvz s ALA 211 Ca 0.37 -0.25 -0.27 0.00 0.00 0.00 0.00 51.96 51.81 1bvz s ALA 211 Cb 0.27 0.06 -0.09 0.00 0.00 0.00 0.00 23.12 23.36 1bvz s ALA 211 CO 0.13 -0.07 1.15 0.42 0.00 0.00 0.00 175.76 177.39 1bvz s ILE 212 N -0.64 3.26 0.19 0.00 -1.09 -1.26 -2.26 121.20 119.40 1bvz s ILE 212 Ca -0.07 1.16 -0.33 0.00 -2.23 0.00 0.00 60.65 59.18 1bvz s ILE 212 Cb -0.04 -3.69 -0.12 0.00 -1.58 0.00 0.00 42.46 37.02 1bvz s ILE 212 CO -0.00 0.19 1.70 -0.67 -1.23 0.00 0.00 174.94 174.92 1bvz n ASP 213 N 0.59 3.75 0.15 3.58 2.03 -0.18 -4.51 116.55 121.97 1bvz n ASP 213 Ca 0.02 1.06 0.13 0.00 0.52 0.00 0.00 54.79 56.52 1bvz n ASP 213 Cb 0.45 -1.53 0.67 0.00 -0.72 0.00 0.00 41.12 40.00 1bvz n ASP 213 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1bvz h PRO 214 N 6.70 0.00 0.00 -0.67 0.13 -1.92 0.31 132.00 136.55 1bvz h PRO 214 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.64 1bvz h PRO 214 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1bvz h PRO 214 CO 0.94 0.00 -0.26 0.37 -0.23 0.00 0.00 178.00 178.82 1bvz h GLN 215 N 0.00 0.00 0.00 0.86 4.15 -1.90 -3.19 115.11 115.03 1bvz h GLN 215 Ca 0.11 0.00 -0.29 0.00 0.77 0.00 0.00 58.65 59.24 1bvz h GLN 215 Cb 0.43 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.07 1bvz h GLN 215 CO -0.00 0.26 -1.94 1.19 -1.93 0.00 0.00 178.83 176.41 1bvz n PHE 216 N -3.62 0.56 0.00 3.99 3.72 0.97 -4.66 117.46 118.42 1bvz n PHE 216 Ca -0.01 0.20 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 1bvz n PHE 216 Cb 0.39 -1.06 0.00 0.00 -0.94 0.00 0.00 39.48 37.87 1bvz n PHE 216 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bvz n GLY 217 N 1.59 -0.59 0.08 1.37 0.00 -0.39 -1.69 105.19 105.56 1bvz n GLY 217 Ca -0.21 -0.21 -0.00 0.00 0.00 0.00 0.00 46.02 45.60 1bvz n GLY 217 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bvz n ASP 218 N 0.00 -0.04 0.12 1.61 5.68 -1.26 -3.86 116.55 118.80 1bvz n ASP 218 Ca 0.00 -1.04 -0.24 0.00 -0.50 0.00 0.00 54.79 53.02 1bvz n ASP 218 Cb 0.00 0.08 -0.15 0.00 -1.14 0.00 0.00 41.12 39.91 1bvz n ASP 218 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 1bvz h LEU 219 N 0.00 0.84 -0.88 -2.12 4.07 -1.98 0.62 115.31 115.87 1bvz h LEU 219 Ca -0.01 -0.89 0.22 0.00 0.08 0.00 0.00 57.88 57.28 1bvz h LEU 219 Cb 0.03 -0.27 -0.13 0.00 1.08 0.00 0.00 40.66 41.37 1bvz h LEU 219 CO 0.01 1.66 0.36 -0.65 -1.08 0.00 0.00 178.44 178.74 1bvz h PRO 220 N 0.16 0.36 -0.33 1.13 0.11 -1.99 0.10 132.00 131.55 1bvz h PRO 220 Ca -0.23 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.71 1bvz h PRO 220 Cb 2.05 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 33.08 1bvz h PRO 220 CO 0.26 0.24 -0.37 1.15 -0.21 0.00 0.00 178.00 179.06 1bvz h THR 221 N 0.37 1.29 -0.49 -1.15 2.02 -1.87 -1.99 112.91 111.07 1bvz h THR 221 Ca 0.55 -1.55 0.02 0.00 0.77 0.00 0.00 66.41 66.20 1bvz h THR 221 Cb 1.05 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.94 1bvz h THR 221 CO -0.54 0.51 0.30 0.15 0.37 0.00 0.00 175.52 176.30 1bvz h PHE 222 N 0.61 0.56 -0.58 3.16 3.57 0.09 0.70 116.94 125.05 1bvz h PHE 222 Ca 0.05 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.48 1bvz h PHE 222 Cb 0.96 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.50 1bvz h PHE 222 CO 0.07 0.32 0.04 -0.09 -2.23 0.00 0.00 178.31 176.42 1bvz h ARG 223 N 0.59 0.98 -0.87 1.11 1.12 -0.78 -0.91 114.38 115.63 1bvz h ARG 223 Ca 0.20 -0.27 -0.01 0.00 -1.11 0.00 0.00 59.98 58.78 1bvz h ARG 223 Cb 0.01 -0.11 -0.04 0.00 -0.01 0.00 0.00 29.97 29.82 1bvz h ARG 223 CO -0.09 0.94 0.49 0.00 -3.11 0.00 0.00 179.97 178.20 1bvz h ARG 224 N 0.91 1.20 -0.50 0.20 2.47 -0.47 0.19 114.38 118.38 1bvz h ARG 224 Ca 0.17 -0.13 -0.02 0.00 -1.26 0.00 0.00 59.98 58.75 1bvz h ARG 224 Cb 0.47 -0.24 -0.02 0.00 -1.65 0.00 0.00 29.97 28.53 1bvz h ARG 224 CO 0.02 0.87 0.24 1.25 0.56 0.00 0.00 179.97 182.91 1bvz h LEU 225 N 1.21 0.66 -0.65 3.04 5.85 0.03 0.36 115.31 125.82 1bvz h LEU 225 Ca 0.31 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 1bvz h LEU 225 Cb 0.01 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 1bvz h LEU 225 CO -0.05 0.60 0.24 0.58 -0.34 0.00 0.00 178.44 179.47 1bvz h VAL 226 N 0.67 1.24 -0.02 1.05 2.07 -0.97 0.13 116.25 120.43 1bvz h VAL 226 Ca 0.17 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 1bvz h VAL 226 Cb 0.12 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1bvz h VAL 226 CO -0.02 0.31 -0.01 0.44 0.02 0.00 0.00 177.57 178.31 1bvz h ASP 227 N 0.93 0.04 0.59 0.57 3.32 -0.17 -2.75 116.42 118.95 1bvz h ASP 227 Ca 0.22 -0.40 -0.13 0.00 0.02 0.00 0.00 57.03 56.74 1bvz h ASP 227 Cb 0.24 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1bvz h ASP 227 CO -0.01 0.43 -0.61 -0.33 -1.72 0.00 0.00 179.24 177.00 1bvz h GLU 228 N -0.35 0.02 0.01 3.56 4.39 -0.17 -2.54 114.58 119.51 1bvz h GLU 228 Ca 0.00 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1bvz h GLU 228 Cb 0.41 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 1bvz h GLU 228 CO 0.00 0.62 -0.01 0.00 -1.16 0.00 0.00 179.01 178.46 1bvz h ALA 229 N 1.38 -0.02 -0.72 3.43 0.00 -0.82 -3.23 119.26 119.29 1bvz h ALA 229 Ca -0.01 -0.34 0.11 0.00 0.00 0.00 0.00 54.91 54.68 1bvz h ALA 229 Cb 1.08 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.82 1bvz h ALA 229 CO 0.08 -0.16 0.48 0.45 0.00 0.00 0.00 179.25 180.10 1bvz h HIS 230 N -0.73 0.58 0.00 0.00 3.86 -1.14 0.12 115.15 117.84 1bvz h HIS 230 Ca -0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1bvz h HIS 230 Cb 0.69 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.98 1bvz h HIS 230 CO 0.17 0.25 0.00 -0.09 0.86 0.00 0.00 177.93 179.12 1bvz h ARG 231 N 0.52 0.00 -0.51 2.45 1.12 -1.50 -0.86 114.38 115.61 1bvz h ARG 231 Ca 0.34 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 59.21 1bvz h ARG 231 Cb 0.61 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.57 1bvz h ARG 231 CO -0.12 0.00 0.00 0.54 -3.11 0.00 0.00 179.97 177.28 1bvz n ARG 232 N -2.83 3.10 -0.44 0.20 1.74 0.29 -4.95 116.66 113.77 1bvz n ARG 232 Ca 0.02 -2.53 0.00 0.00 -0.77 0.00 0.00 57.85 54.57 1bvz n ARG 232 Cb 0.33 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 1bvz n ARG 232 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bvz n GLY 233 N 0.80 1.16 3.84 -0.13 0.00 -0.33 -4.92 105.19 105.61 1bvz n GLY 233 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1bvz n GLY 233 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bvz s ILE 234 N -3.07 4.69 0.39 -0.61 1.01 -0.41 -4.76 121.20 118.43 1bvz s ILE 234 Ca 0.00 0.96 0.08 0.00 0.00 0.00 0.00 60.65 61.69 1bvz s ILE 234 Cb 0.00 -3.67 -0.06 0.00 0.01 0.00 0.00 42.46 38.74 1bvz s ILE 234 CO 0.00 -0.08 0.05 -0.54 0.00 0.00 0.00 174.94 174.38 1bvz s LYS 235 N -2.72 2.06 -0.22 2.79 1.02 -0.36 -2.33 119.74 119.99 1bvz s LYS 235 Ca 0.50 -1.92 -0.02 0.00 0.02 0.00 0.00 55.97 54.56 1bvz s LYS 235 Cb -0.12 -1.82 0.06 0.00 -0.52 0.00 0.00 37.83 35.43 1bvz s LYS 235 CO 0.19 -0.00 0.02 0.42 -0.92 0.00 0.00 175.35 175.05 1bvz s ILE 236 N -2.62 0.81 -0.01 2.17 -1.09 -1.26 -0.63 121.20 118.57 1bvz s ILE 236 Ca 0.37 -0.81 -0.11 0.00 -2.23 0.00 0.00 60.65 57.87 1bvz s ILE 236 Cb 0.05 -1.29 -0.05 0.00 -1.58 0.00 0.00 42.46 39.59 1bvz s ILE 236 CO 0.20 -0.23 0.33 -0.63 -1.23 0.00 0.00 174.94 173.37 1bvz s ILE 237 N 1.72 5.19 0.01 2.92 1.09 0.19 -0.33 121.20 131.98 1bvz s ILE 237 Ca -0.01 0.52 0.05 0.00 -1.10 0.00 0.00 60.65 60.12 1bvz s ILE 237 Cb -0.18 -3.61 -0.02 0.00 -1.06 0.00 0.00 42.46 37.60 1bvz s ILE 237 CO -0.09 0.50 -0.16 -0.22 -0.10 0.00 0.00 174.94 174.87 1bvz s LEU 238 N -1.33 2.09 0.52 2.97 2.96 -0.66 -3.16 118.68 122.07 1bvz s LEU 238 Ca 0.24 -0.37 -0.19 0.00 -0.22 0.00 0.00 54.13 53.59 1bvz s LEU 238 Cb -0.15 -0.80 -0.07 0.00 0.50 0.00 0.00 46.19 45.68 1bvz s LEU 238 CO 0.13 0.15 1.04 -0.62 -1.32 0.00 0.00 176.35 175.73 1bvz s ASP 239 N -0.71 6.19 -0.25 3.68 2.15 -1.19 -1.43 116.67 125.12 1bvz s ASP 239 Ca 0.05 1.87 -0.03 0.00 0.43 0.00 0.00 52.55 54.87 1bvz s ASP 239 Cb -0.07 -2.55 0.08 0.00 -0.30 0.00 0.00 42.92 40.08 1bvz s ASP 239 CO 0.00 -0.88 0.09 0.00 -0.17 0.00 0.00 175.17 174.21 1bvz s ALA 240 N -2.17 0.99 -1.19 3.66 0.00 0.53 -4.81 121.76 118.76 1bvz s ALA 240 Ca 0.66 -1.05 -0.18 0.00 0.00 0.00 0.00 51.96 51.39 1bvz s ALA 240 Cb -0.16 -1.35 0.09 0.00 0.00 0.00 0.00 23.12 21.70 1bvz s ALA 240 CO 0.26 -1.45 1.56 0.08 0.00 0.00 0.00 175.76 176.21 1bvz s VAL 241 N 1.89 4.34 -0.96 0.00 1.01 -1.26 -2.53 120.40 122.87 1bvz s VAL 241 Ca 0.05 -1.82 0.25 0.00 0.00 0.00 0.00 61.98 60.47 1bvz s VAL 241 Cb -0.17 -5.07 0.03 0.00 0.00 0.00 0.00 36.38 31.17 1bvz s VAL 241 CO -0.21 -1.88 1.45 0.49 0.00 0.00 0.00 175.10 174.95 1bvz n PHE 242 N 7.72 0.05 0.04 5.22 3.72 -1.26 -4.27 117.46 128.68 1bvz n PHE 242 Ca 0.41 0.02 -0.02 0.00 -0.05 0.00 0.00 57.45 57.80 1bvz n PHE 242 Cb 0.47 -0.31 0.23 0.00 -0.94 0.00 0.00 39.48 38.92 1bvz n PHE 242 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 1bvz h ASN 243 N 0.00 0.42 -4.08 4.37 -1.24 -1.85 -3.45 115.58 109.74 1bvz h ASN 243 Ca 0.00 -0.14 -0.12 0.00 0.71 0.00 0.00 56.30 56.75 1bvz h ASN 243 Cb 0.52 -0.11 -0.23 0.00 0.73 0.00 0.00 38.32 39.23 1bvz h ASN 243 CO 0.00 0.67 -0.24 -1.38 -1.29 0.00 0.00 177.43 175.19 1bvz s HIS 244 N -4.48 -0.40 0.48 0.67 -3.43 -1.26 -2.04 115.29 104.82 1bvz s HIS 244 Ca -0.06 0.94 -0.00 0.00 -0.80 0.00 0.00 55.06 55.14 1bvz s HIS 244 Cb 0.14 0.15 0.00 0.00 -1.43 0.00 0.00 32.58 31.44 1bvz s HIS 244 CO 0.78 -0.25 0.71 0.00 -2.00 0.00 0.00 174.74 173.98 1bvz s ALA 245 N -0.06 3.74 0.27 -1.38 0.00 0.60 -4.72 121.76 120.20 1bvz s ALA 245 Ca -0.02 -1.07 -0.06 0.00 0.00 0.00 0.00 51.96 50.81 1bvz s ALA 245 Cb -0.03 -2.17 -0.06 0.00 0.00 0.00 0.00 23.12 20.86 1bvz s ALA 245 CO 0.01 -0.48 0.54 0.20 0.00 0.00 0.00 175.76 176.03 1bvz s GLY 246 N -4.26 1.95 0.24 0.00 0.00 -0.42 -2.31 107.32 102.52 1bvz s GLY 246 Ca 0.50 -0.51 0.21 0.00 0.00 0.00 0.00 44.72 44.93 1bvz s GLY 246 CO 0.39 -0.40 1.65 2.09 0.00 0.00 0.00 173.10 176.83 1bvz n ASP 247 N -0.74 0.56 -1.09 1.64 5.75 0.56 -1.39 116.55 121.84 1bvz n ASP 247 Ca -0.01 0.66 0.10 0.00 -0.01 0.00 0.00 54.79 55.53 1bvz n ASP 247 Cb 0.53 -0.77 0.27 0.00 -1.03 0.00 0.00 41.12 40.12 1bvz n ASP 247 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1bvz n GLN 248 N -2.15 2.38 -1.59 0.11 6.02 -1.26 -3.96 117.38 116.93 1bvz n GLN 248 Ca 0.01 -2.13 -0.33 0.00 -0.01 0.00 0.00 57.00 54.54 1bvz n GLN 248 Cb 0.18 -1.48 0.07 0.00 1.02 0.00 0.00 30.24 30.03 1bvz n GLN 248 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 1bvz s PHE 249 N -1.29 2.47 0.17 1.08 5.36 -0.49 -4.69 117.98 120.60 1bvz s PHE 249 Ca 0.40 1.57 -0.14 0.00 -0.96 0.00 0.00 56.93 57.80 1bvz s PHE 249 Cb 0.21 -3.21 0.06 0.00 -0.34 0.00 0.00 43.02 39.74 1bvz s PHE 249 CO 0.28 -1.91 1.81 0.27 -1.46 0.00 0.00 175.22 174.21 1bvz h PHE 250 N -0.25 0.69 0.00 10.12 -5.15 -1.89 -0.99 116.94 119.47 1bvz h PHE 250 Ca -0.46 0.00 -0.08 0.00 -0.20 0.00 0.00 57.97 57.23 1bvz h PHE 250 Cb 1.25 -0.23 -0.01 0.00 0.22 0.00 0.00 35.95 37.19 1bvz h PHE 250 CO 0.53 0.47 -0.37 0.00 -2.00 0.00 0.00 178.31 176.94 1bvz h ALA 251 N 1.16 1.05 0.06 12.09 0.00 -1.94 -1.44 119.26 130.23 1bvz h ALA 251 Ca 0.19 -0.34 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 1bvz h ALA 251 Cb -0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1bvz h ALA 251 CO -0.04 0.46 -0.81 0.35 0.00 0.00 0.00 179.25 179.22 1bvz h PHE 252 N 0.00 0.24 -0.96 0.00 3.57 -1.51 -2.81 116.94 115.46 1bvz h PHE 252 Ca -0.00 -0.17 0.19 0.00 3.53 0.00 0.00 57.97 61.52 1bvz h PHE 252 Cb 0.85 -0.01 -0.11 0.00 2.79 0.00 0.00 35.95 39.47 1bvz h PHE 252 CO 0.00 1.32 0.55 0.00 -2.23 0.00 0.00 178.31 177.95 1bvz h ARG 253 N -0.68 0.66 -0.50 1.11 2.47 -0.98 0.48 114.38 116.93 1bvz h ARG 253 Ca -0.18 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.48 1bvz h ARG 253 Cb 1.40 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 29.55 1bvz h ARG 253 CO 0.01 0.43 0.26 0.22 0.56 0.00 0.00 179.97 181.45 1bvz h ASP 254 N 0.68 0.62 -0.62 7.04 3.58 -1.29 0.65 116.42 127.08 1bvz h ASP 254 Ca 0.56 -0.05 -0.07 0.00 0.42 0.00 0.00 57.03 57.90 1bvz h ASP 254 Cb 0.91 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 1bvz h ASP 254 CO -0.41 0.52 0.12 0.58 -2.88 0.00 0.00 179.24 177.17 1bvz h VAL 255 N 0.70 1.26 -0.81 2.25 2.07 0.10 0.40 116.25 122.21 1bvz h VAL 255 Ca 0.18 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.69 1bvz h VAL 255 Cb 0.05 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 1bvz h VAL 255 CO -0.03 0.36 0.36 -0.07 0.02 0.00 0.00 177.57 178.22 1bvz h LEU 256 N 0.92 1.08 0.00 2.57 3.38 -0.31 -0.93 115.31 122.02 1bvz h LEU 256 Ca 0.19 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1bvz h LEU 256 Cb 0.40 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1bvz h LEU 256 CO 0.01 0.93 0.00 0.00 0.09 0.00 0.00 178.44 179.47 1bvz n GLN 257 N -4.32 0.00 0.04 1.13 6.02 0.17 -4.58 117.38 115.85 1bvz n GLN 257 Ca 0.07 0.31 0.09 0.00 -0.01 0.00 0.00 57.00 57.47 1bvz n GLN 257 Cb 0.16 -0.80 0.39 0.00 1.02 0.00 0.00 30.24 31.01 1bvz n GLN 257 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1bvz n LYS 258 N -2.03 0.06 0.00 -1.09 5.02 0.14 -4.97 118.16 115.29 1bvz n LYS 258 Ca 0.00 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 1bvz n LYS 258 Cb 0.00 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 1bvz n LYS 258 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1bvz n GLY 259 N 0.19 0.51 0.00 0.72 0.00 -0.35 -2.50 105.19 103.75 1bvz n GLY 259 Ca 0.04 -0.87 0.06 0.00 0.00 0.00 0.00 46.02 45.24 1bvz n GLY 259 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1bvz n GLU 260 N 5.28 0.04 0.23 1.61 0.28 -1.26 -1.04 120.64 125.77 1bvz n GLU 260 Ca 0.00 0.26 0.12 0.00 -0.16 0.00 0.00 57.16 57.38 1bvz n GLU 260 Cb 0.00 -1.50 0.38 0.00 1.43 0.00 0.00 31.44 31.75 1bvz n GLU 260 CO 0.00 0.00 0.00 1.96 -0.16 0.00 0.00 177.13 178.93 1bvz h GLN 261 N 0.00 0.00 -6.49 3.44 7.50 -1.89 -3.47 115.11 114.20 1bvz h GLN 261 Ca 0.00 0.00 -0.53 0.00 0.50 0.00 0.00 58.65 58.62 1bvz h GLN 261 Cb 0.19 0.00 0.04 0.00 0.05 0.00 0.00 27.48 27.75 1bvz h GLN 261 CO 0.00 0.13 1.12 0.45 -1.50 0.00 0.00 178.83 179.03 1bvz s SER 262 N -6.09 6.43 0.00 1.46 0.15 -0.21 -4.85 113.70 110.59 1bvz s SER 262 Ca 0.03 2.74 0.04 0.00 0.70 0.00 0.00 55.95 59.46 1bvz s SER 262 Cb 0.08 -2.56 0.25 0.00 -1.71 0.00 0.00 66.02 62.08 1bvz s SER 262 CO 0.63 -1.01 0.89 -1.14 1.20 0.00 0.00 173.24 173.82 1bvz n ARG 263 N 5.87 0.70 -0.05 5.44 0.00 -1.26 -2.36 116.66 125.00 1bvz n ARG 263 Ca 0.18 0.00 0.02 0.00 -0.00 0.00 0.00 57.85 58.05 1bvz n ARG 263 Cb 0.39 -1.09 0.05 0.00 0.00 0.00 0.00 32.46 31.80 1bvz n ARG 263 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1bvz n TYR 264 N -0.59 0.10 0.03 -0.14 4.01 -1.26 -4.78 117.16 114.53 1bvz n TYR 264 Ca 0.03 -0.57 -0.10 0.00 -0.16 0.00 0.00 57.90 57.10 1bvz n TYR 264 Cb 0.01 -0.07 0.04 0.00 -0.31 0.00 0.00 39.34 39.02 1bvz n TYR 264 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 1bvz h LYS 265 N 0.38 0.49 0.00 -0.72 2.10 -1.77 -2.86 116.57 114.19 1bvz h LYS 265 Ca 0.00 -0.35 0.00 0.00 -2.00 0.00 0.00 60.65 58.30 1bvz h LYS 265 Cb 0.62 0.06 0.00 0.00 -0.90 0.00 0.00 32.23 32.01 1bvz h LYS 265 CO 0.01 0.97 0.00 -0.25 -2.00 0.00 0.00 179.45 178.18 1bvz n ASP 266 N -3.90 0.00 0.00 7.07 8.00 -1.26 -1.93 116.55 124.52 1bvz n ASP 266 Ca -0.04 0.09 0.15 0.00 0.71 0.00 0.00 54.79 55.70 1bvz n ASP 266 Cb 0.66 -0.32 0.83 0.00 -0.02 0.00 0.00 41.12 42.27 1bvz n ASP 266 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1bvz n TRP 267 N -1.32 0.00 -4.20 1.24 7.02 -1.08 -4.78 117.44 114.33 1bvz n TRP 267 Ca 0.08 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.45 1bvz n TRP 267 Cb 0.16 -0.16 -0.10 0.00 -2.42 0.00 0.00 31.31 28.79 1bvz n TRP 267 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 1bvz s PHE 268 N -2.32 1.05 -0.61 -5.99 0.08 -0.81 -0.66 117.98 108.72 1bvz s PHE 268 Ca 0.37 -1.17 -0.20 0.00 0.12 0.00 0.00 56.93 56.05 1bvz s PHE 268 Cb 0.21 -0.59 0.09 0.00 -0.57 0.00 0.00 43.02 42.16 1bvz s PHE 268 CO 0.41 -0.41 0.78 -0.06 -0.10 0.00 0.00 175.22 175.85 1bvz s PHE 269 N -3.90 2.89 -0.16 0.36 0.40 -1.24 -4.81 117.98 111.53 1bvz s PHE 269 Ca 0.26 -0.79 -0.06 0.00 -0.60 0.00 0.00 56.93 55.75 1bvz s PHE 269 Cb 0.07 -4.07 -0.04 0.00 0.51 0.00 0.00 43.02 39.49 1bvz s PHE 269 CO 0.04 -1.39 0.03 0.42 0.70 0.00 0.00 175.22 175.02 1bvz s ILE 270 N 3.14 4.53 -0.06 0.64 -1.09 -1.26 -0.99 121.20 126.11 1bvz s ILE 270 Ca 0.15 -0.13 -0.24 0.00 -2.23 0.00 0.00 60.65 58.20 1bvz s ILE 270 Cb -0.21 -3.00 -0.25 0.00 -1.58 0.00 0.00 42.46 37.42 1bvz s ILE 270 CO 0.08 0.50 0.99 -0.33 -1.23 0.00 0.00 174.94 174.95 1bvz h GLU 271 N 6.34 0.19 -3.26 2.79 3.07 -0.82 -3.47 114.58 119.42 1bvz h GLU 271 Ca -0.39 -0.22 -0.04 0.00 -0.50 0.00 0.00 59.36 58.22 1bvz h GLU 271 Cb 1.18 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 29.12 1bvz h GLU 271 CO 0.65 0.98 0.14 0.16 -1.40 0.00 0.00 179.01 179.54 1bvz s ASP 272 N -6.41 0.05 0.03 1.42 1.47 -1.23 -5.05 116.67 106.95 1bvz s ASP 272 Ca -0.16 -1.01 0.06 0.00 1.18 0.00 0.00 52.55 52.62 1bvz s ASP 272 Cb 0.01 0.75 -0.02 0.00 -0.34 0.00 0.00 42.92 43.32 1bvz s ASP 272 CO 0.75 -1.46 -0.17 -0.36 0.68 0.00 0.00 175.17 174.61 1bvz s PHE 273 N -3.12 1.53 0.57 2.11 0.08 -1.26 -4.17 117.98 113.71 1bvz s PHE 273 Ca 0.17 -0.34 -0.17 0.00 0.12 0.00 0.00 56.93 56.72 1bvz s PHE 273 Cb -0.04 -0.93 -0.05 0.00 -0.57 0.00 0.00 43.02 41.43 1bvz s PHE 273 CO 0.11 0.04 1.05 -2.14 -0.10 0.00 0.00 175.22 174.18 1bvz s PRO 274 N -0.95 3.46 -0.52 0.24 0.02 -1.26 -5.08 135.00 130.90 1bvz s PRO 274 Ca 0.05 1.22 -0.27 0.00 0.02 0.00 0.00 61.00 62.02 1bvz s PRO 274 Cb -0.08 -2.05 -0.01 0.00 0.02 0.00 0.00 34.50 32.38 1bvz s PRO 274 CO 0.01 -0.70 1.73 0.14 -0.33 0.00 0.00 177.00 177.85 1bvz s VAL 275 N -2.37 3.50 -0.80 3.83 -7.23 -1.26 -4.87 120.40 111.20 1bvz s VAL 275 Ca 0.64 0.40 -0.24 0.00 -1.81 0.00 0.00 61.98 60.97 1bvz s VAL 275 Cb -0.16 -3.99 -0.18 0.00 0.56 0.00 0.00 36.38 32.61 1bvz s VAL 275 CO 0.33 -0.84 1.89 -0.24 -0.31 0.00 0.00 175.10 175.93 1bvz n SER 276 N 11.27 2.34 -4.56 4.85 2.88 -1.26 -4.83 113.62 124.31 1bvz n SER 276 Ca 0.19 -2.64 -0.32 0.00 -1.33 0.00 0.00 58.87 54.77 1bvz n SER 276 Cb 0.50 -1.26 -0.04 0.00 -0.75 0.00 0.00 64.21 62.66 1bvz n SER 276 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1bvz s LYS 277 N 6.07 2.73 0.34 -1.46 1.02 -1.26 -3.98 119.74 123.20 1bvz s LYS 277 Ca 0.65 -0.18 -0.17 0.00 0.02 0.00 0.00 55.97 56.28 1bvz s LYS 277 Cb 0.08 -4.90 0.04 0.00 -0.52 0.00 0.00 37.83 32.53 1bvz s LYS 277 CO 0.17 -3.02 0.73 0.95 -0.92 0.00 0.00 175.35 173.26 1bvz s THR 278 N 8.99 0.00 0.12 2.17 -4.23 -1.26 -5.04 115.64 116.39 1bvz s THR 278 Ca 0.65 -1.05 -0.13 0.00 -1.18 0.00 0.00 61.69 59.97 1bvz s THR 278 Cb -0.07 -2.52 0.07 0.00 1.34 0.00 0.00 72.50 71.32 1bvz s THR 278 CO 0.04 0.00 0.91 -1.54 -0.54 0.00 0.00 174.62 173.49 1bvz n SER 279 N -1.02 -0.48 -4.32 3.99 3.41 -1.26 -4.39 113.62 109.56 1bvz n SER 279 Ca -0.06 1.04 -0.39 0.00 -0.26 0.00 0.00 58.87 59.20 1bvz n SER 279 Cb 0.60 -0.20 -0.12 0.00 -0.26 0.00 0.00 64.21 64.23 1bvz n SER 279 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1bvz s ARG 280 N -5.45 2.73 0.41 4.33 3.52 -1.26 -4.92 118.95 118.30 1bvz s ARG 280 Ca -0.08 -1.12 -0.01 0.00 -0.13 0.00 0.00 55.73 54.39 1bvz s ARG 280 Cb 0.10 -3.55 0.08 0.00 -1.56 0.00 0.00 34.95 30.02 1bvz s ARG 280 CO 0.40 -0.66 0.55 0.25 -0.81 0.00 0.00 175.30 175.03 1bvz n THR 281 N 4.88 0.00 -2.74 4.11 -2.24 -1.26 -4.78 114.28 112.26 1bvz n THR 281 Ca -0.12 -0.79 -0.03 0.00 -2.27 0.00 0.00 64.05 60.84 1bvz n THR 281 Cb 0.45 -1.21 0.08 0.00 -2.10 0.00 0.00 70.33 67.55 1bvz n THR 281 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1bvz n ASN 282 N -3.02 0.29 -3.63 3.42 6.94 -1.26 -4.94 115.26 113.06 1bvz n ASN 282 Ca 0.09 -2.25 -0.08 0.00 -0.02 0.00 0.00 54.58 52.32 1bvz n ASN 282 Cb 0.31 0.01 -0.06 0.00 -2.36 0.00 0.00 39.78 37.68 1bvz n ASN 282 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 1bvz s TYR 283 N -2.12 -0.37 0.32 -2.53 -0.85 -1.26 -0.04 117.35 110.51 1bvz s TYR 283 Ca 0.21 0.83 -0.29 0.00 -0.52 0.00 0.00 57.07 57.31 1bvz s TYR 283 Cb 0.39 0.41 -0.11 0.00 0.38 0.00 0.00 41.96 43.03 1bvz s TYR 283 CO -0.06 -0.22 1.53 -1.21 -1.52 0.00 0.00 175.55 174.08 1bvz s GLU 284 N -0.16 4.14 0.03 -3.49 2.02 -0.16 -4.94 118.70 116.14 1bvz s GLU 284 Ca 0.03 2.54 0.00 0.00 0.02 0.00 0.00 54.97 57.56 1bvz s GLU 284 Cb -0.04 -3.01 -0.00 0.00 0.10 0.00 0.00 34.13 31.18 1bvz s GLU 284 CO -0.06 -0.57 0.00 0.25 0.02 0.00 0.00 175.26 174.91 1bvz n THR 285 N 1.51 0.00 0.11 3.63 -2.24 -1.26 -0.82 114.28 115.21 1bvz n THR 285 Ca 0.05 -0.15 -0.12 0.00 -2.27 0.00 0.00 64.05 61.57 1bvz n THR 285 Cb 0.38 0.04 -0.08 0.00 -2.10 0.00 0.00 70.33 68.58 1bvz n THR 285 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1bvz h PHE 286 N 1.03 -0.30 0.00 4.78 3.57 -0.85 -3.40 116.94 121.76 1bvz h PHE 286 Ca -0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1bvz h PHE 286 Cb 0.08 0.10 0.00 0.00 2.79 0.00 0.00 35.95 38.92 1bvz h PHE 286 CO 0.00 0.07 -0.58 0.00 -2.23 0.00 0.00 178.31 175.57 1bvz n ALA 287 N -2.53 3.00 -0.11 2.41 0.00 -1.26 -5.01 120.51 117.01 1bvz n ALA 287 Ca -0.08 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.16 1bvz n ALA 287 Cb 0.26 0.35 -0.06 0.00 0.00 0.00 0.00 19.45 20.00 1bvz n ALA 287 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1bvz n VAL 288 N -3.08 1.50 -3.72 0.00 0.31 -1.26 -5.01 118.33 107.07 1bvz n VAL 288 Ca 0.00 -0.13 -0.14 0.00 -0.01 0.00 0.00 64.34 64.07 1bvz n VAL 288 Cb 0.29 -2.10 -0.14 0.00 -0.91 0.00 0.00 33.84 30.98 1bvz n VAL 288 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1bvz s GLN 289 N -2.69 0.13 -0.42 5.55 -1.52 -1.26 -4.79 119.66 114.66 1bvz s GLN 289 Ca -0.34 0.51 0.06 0.00 -1.95 0.00 0.00 55.36 53.65 1bvz s GLN 289 Cb 0.09 -0.16 0.17 0.00 -0.22 0.00 0.00 33.01 32.90 1bvz s GLN 289 CO 0.45 -0.21 0.56 0.08 -0.25 0.00 0.00 175.29 175.92 1bvz s VAL 290 N 1.57 -0.74 0.53 1.09 1.01 -1.26 -4.88 120.40 117.72 1bvz s VAL 290 Ca -0.06 -0.59 0.22 0.00 0.00 0.00 0.00 61.98 61.55 1bvz s VAL 290 Cb -0.11 -0.25 0.34 0.00 0.00 0.00 0.00 36.38 36.36 1bvz s VAL 290 CO -0.07 -0.23 2.06 -0.65 0.00 0.00 0.00 175.10 176.21 1bvz h PRO 291 N 6.62 0.00 0.00 2.72 0.11 -1.91 -1.10 132.00 138.43 1bvz h PRO 291 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1bvz h PRO 291 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1bvz h PRO 291 CO 0.13 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.92 1bvz n ALA 292 N -2.59 1.81 -3.52 -0.75 0.00 -1.26 -4.04 120.51 110.16 1bvz n ALA 292 Ca 0.04 0.06 -0.27 0.00 0.00 0.00 0.00 53.44 53.27 1bvz n ALA 292 Cb 0.39 -1.41 -0.09 0.00 0.00 0.00 0.00 19.45 18.34 1bvz n ALA 292 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1bvz n MET 293 N -2.25 1.97 -2.22 0.00 2.81 -0.42 -0.32 117.12 116.69 1bvz n MET 293 Ca 0.03 -4.35 -0.38 0.00 -1.81 0.00 0.00 57.70 51.19 1bvz n MET 293 Cb 0.28 -2.10 -0.01 0.00 -0.71 0.00 0.00 33.22 30.68 1bvz n MET 293 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1bvz s PRO 294 N -1.89 3.86 -0.01 0.03 0.04 -0.98 -0.37 135.00 135.68 1bvz s PRO 294 Ca 0.35 1.87 -0.30 0.00 0.04 0.00 0.00 61.00 62.95 1bvz s PRO 294 Cb 0.09 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 1bvz s PRO 294 CO -0.08 -0.49 1.22 0.21 0.04 0.00 0.00 177.00 177.90 1bvz s LYS 295 N -2.51 4.37 -0.13 4.56 2.20 -0.00 -0.29 119.74 127.94 1bvz s LYS 295 Ca 0.61 1.74 -0.27 0.00 -0.36 0.00 0.00 55.97 57.69 1bvz s LYS 295 Cb -0.31 -3.49 -0.02 0.00 -1.51 0.00 0.00 37.83 32.51 1bvz s LYS 295 CO 0.38 -0.39 0.87 -1.17 -0.36 0.00 0.00 175.35 174.68 1bvz s LEU 296 N 1.83 4.23 -1.08 5.43 2.96 -0.87 -3.68 118.68 127.50 1bvz s LEU 296 Ca 0.58 1.31 -0.20 0.00 -0.22 0.00 0.00 54.13 55.60 1bvz s LEU 296 Cb -0.27 -3.33 -0.07 0.00 0.50 0.00 0.00 46.19 43.03 1bvz s LEU 296 CO 0.25 -0.37 1.97 -1.14 -1.32 0.00 0.00 176.35 175.75 1bvz n ARG 297 N 4.89 2.05 -0.37 1.98 0.63 0.16 -4.76 116.66 121.26 1bvz n ARG 297 Ca 0.05 -2.33 0.38 0.00 -0.92 0.00 0.00 57.85 55.03 1bvz n ARG 297 Cb 0.49 -3.24 0.75 0.00 0.45 0.00 0.00 32.46 30.91 1bvz n ARG 297 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1bvz h THR 298 N 4.84 0.32 -0.99 5.15 1.35 -1.90 -1.17 112.91 120.52 1bvz h THR 298 Ca 0.42 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 66.36 1bvz h THR 298 Cb 0.74 0.33 -0.07 0.00 -1.73 0.00 0.00 68.15 67.43 1bvz h THR 298 CO 1.73 0.00 0.64 -0.33 -0.25 0.00 0.00 175.52 177.31 1bvz h GLU 299 N 0.00 1.08 -6.29 4.72 5.08 -1.97 -3.32 114.58 113.88 1bvz h GLU 299 Ca 0.61 -0.06 -0.54 0.00 -1.00 0.00 0.00 59.36 58.36 1bvz h GLU 299 Cb 2.51 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 31.51 1bvz h GLU 299 CO -0.01 0.71 1.15 1.21 -1.00 0.00 0.00 179.01 181.08 1bvz s ASN 300 N -5.88 6.54 0.61 1.42 3.84 -0.44 -4.83 114.94 116.20 1bvz s ASN 300 Ca -0.12 2.35 0.31 0.00 0.21 0.00 0.00 52.86 55.62 1bvz s ASN 300 Cb 0.21 -2.53 1.81 0.00 -0.55 0.00 0.00 41.25 40.18 1bvz s ASN 300 CO 0.81 -1.02 2.17 -0.65 -2.79 0.00 0.00 177.10 175.62 1bvz h PRO 301 N 10.15 0.00 -0.28 0.43 0.11 -1.87 0.13 132.00 140.65 1bvz h PRO 301 Ca -0.43 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 1bvz h PRO 301 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1bvz h PRO 301 CO 0.95 0.00 0.10 0.93 -0.21 0.00 0.00 178.00 179.78 1bvz h GLU 302 N 0.00 0.43 -0.48 1.05 5.08 -1.93 -0.29 114.58 118.45 1bvz h GLU 302 Ca 0.05 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1bvz h GLU 302 Cb 0.31 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1bvz h GLU 302 CO -0.00 0.47 0.28 0.28 -1.00 0.00 0.00 179.01 179.03 1bvz h VAL 303 N 0.31 1.16 -0.48 3.13 2.07 -1.38 -2.01 116.25 119.04 1bvz h VAL 303 Ca 0.09 -0.38 0.01 0.00 0.82 0.00 0.00 66.70 67.25 1bvz h VAL 303 Cb 0.20 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 1bvz h VAL 303 CO -0.01 0.16 0.31 0.50 0.02 0.00 0.00 177.57 178.55 1bvz h LYS 304 N 0.63 0.60 0.25 1.57 3.64 -0.70 -1.86 116.57 120.71 1bvz h LYS 304 Ca 0.17 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1bvz h LYS 304 Cb 0.02 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1bvz h LYS 304 CO -0.03 0.40 -0.12 0.93 -2.27 0.00 0.00 179.45 178.36 1bvz h GLU 305 N 0.62 -0.32 -0.59 1.90 4.39 -0.99 -2.45 114.58 117.14 1bvz h GLU 305 Ca 0.18 0.02 0.09 0.00 0.34 0.00 0.00 59.36 60.00 1bvz h GLU 305 Cb -0.04 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 28.61 1bvz h GLU 305 CO -0.06 0.02 0.19 -0.92 -1.16 0.00 0.00 179.01 177.09 1bvz h TYR 306 N -0.72 0.33 -0.50 4.33 3.20 -1.33 0.28 116.97 122.57 1bvz h TYR 306 Ca -0.03 0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.90 1bvz h TYR 306 Cb 0.49 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 1bvz h TYR 306 CO 0.04 0.07 0.33 -0.07 -1.64 0.00 0.00 178.16 176.88 1bvz h LEU 307 N 0.36 0.49 -1.02 2.82 3.38 -1.39 0.14 115.31 120.09 1bvz h LEU 307 Ca 0.30 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.16 1bvz h LEU 307 Cb 0.38 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1bvz h LEU 307 CO -0.32 0.34 -0.38 -0.26 0.09 0.00 0.00 178.44 177.91 1bvz h PHE 308 N 0.57 0.24 -0.17 1.13 -1.00 -0.26 -2.10 116.94 115.36 1bvz h PHE 308 Ca 0.20 -0.06 -0.14 0.00 2.81 0.00 0.00 57.97 60.77 1bvz h PHE 308 Cb 0.09 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 39.60 1bvz h PHE 308 CO -0.00 0.57 -0.46 -0.44 -1.61 0.00 0.00 178.31 176.37 1bvz h ASP 309 N 0.18 0.70 -0.71 2.17 3.32 0.19 -0.84 116.42 121.44 1bvz h ASP 309 Ca 0.02 -0.58 0.16 0.00 0.02 0.00 0.00 57.03 56.65 1bvz h ASP 309 Cb 0.76 -0.20 -0.12 0.00 0.22 0.00 0.00 39.33 39.98 1bvz h ASP 309 CO 0.06 1.16 0.05 0.58 -1.72 0.00 0.00 179.24 179.36 1bvz h VAL 310 N 0.28 0.43 -0.37 -1.35 2.07 -0.84 -0.55 116.25 115.92 1bvz h VAL 310 Ca -0.01 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 1bvz h VAL 310 Cb 1.07 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1bvz h VAL 310 CO 0.10 0.03 0.06 0.00 0.02 0.00 0.00 177.57 177.78 1bvz h ALA 311 N 1.64 0.49 -0.45 1.67 0.00 -1.19 -1.92 119.26 119.50 1bvz h ALA 311 Ca 0.39 -0.21 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1bvz h ALA 311 Cb 0.66 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1bvz h ALA 311 CO -0.59 0.19 0.27 0.00 0.00 0.00 0.00 179.25 179.12 1bvz h ARG 312 N 0.45 0.53 0.30 0.00 3.08 -0.73 -1.35 114.38 116.65 1bvz h ARG 312 Ca 0.11 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1bvz h ARG 312 Cb 0.36 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1bvz h ARG 312 CO 0.01 0.35 -0.29 0.35 -1.07 0.00 0.00 179.97 179.32 1bvz h PHE 313 N 0.54 -0.76 -0.43 3.04 3.57 -0.99 0.23 116.94 122.14 1bvz h PHE 313 Ca 0.18 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 1bvz h PHE 313 Cb 0.01 0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 1bvz h PHE 313 CO -0.07 -0.42 0.03 -1.49 -2.23 0.00 0.00 178.31 174.14 1bvz h TRP 314 N -0.61 0.71 -0.01 0.41 4.06 -1.33 -1.68 115.95 117.49 1bvz h TRP 314 Ca -0.01 -0.08 -0.08 0.00 2.06 0.00 0.00 58.89 60.78 1bvz h TRP 314 Cb 0.56 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.50 1bvz h TRP 314 CO -0.17 0.65 -0.35 0.52 -3.56 0.00 0.00 178.44 175.53 1bvz h MET 315 N 0.64 0.02 -0.92 0.49 2.86 -0.56 -1.46 114.93 116.01 1bvz h MET 315 Ca 0.14 -0.01 0.18 0.00 -2.06 0.00 0.00 59.70 57.95 1bvz h MET 315 Cb 0.36 -0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.94 1bvz h MET 315 CO 0.01 0.37 0.59 0.93 1.06 0.00 0.00 176.91 179.88 1bvz h GLU 316 N 0.02 0.56 0.00 1.72 3.07 0.39 -1.02 114.58 119.32 1bvz h GLU 316 Ca -0.00 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 1bvz h GLU 316 Cb 0.64 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 28.42 1bvz h GLU 316 CO 0.05 0.37 -0.01 1.96 -1.40 0.00 0.00 179.01 179.98 1bvz h GLN 317 N 0.57 0.00 -0.00 2.33 7.50 -1.06 -3.46 115.11 121.00 1bvz h GLN 317 Ca 0.49 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.64 1bvz h GLN 317 Cb 0.97 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.50 1bvz h GLN 317 CO -0.23 0.01 0.00 0.41 -1.50 0.00 0.00 178.83 177.52 1bvz n GLY 318 N -1.15 1.94 1.84 3.46 0.00 -0.38 -4.89 105.19 106.00 1bvz n GLY 318 Ca -0.03 -0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.84 1bvz n GLY 318 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1bvz n ILE 319 N -0.95 0.00 -0.09 -0.61 -5.35 -1.26 -4.89 119.36 106.23 1bvz n ILE 319 Ca 0.00 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.13 1bvz n ILE 319 Cb 0.00 -1.39 0.00 0.00 -1.74 0.00 0.00 39.64 36.52 1bvz n ILE 319 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1bvz n ASP 320 N -3.72 0.10 0.00 7.28 8.00 0.55 -4.90 116.55 123.86 1bvz n ASP 320 Ca 0.08 -0.40 0.00 0.00 0.71 0.00 0.00 54.79 55.18 1bvz n ASP 320 Cb 0.29 0.43 0.00 0.00 -0.02 0.00 0.00 41.12 41.83 1bvz n ASP 320 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bvz n GLY 321 N 0.43 1.16 3.44 0.44 0.00 -1.21 -0.55 105.19 108.90 1bvz n GLY 321 Ca 0.00 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 1bvz n GLY 321 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1bvz s TRP 322 N -2.00 2.55 -0.07 1.61 0.52 -0.91 -1.66 118.94 118.98 1bvz s TRP 322 Ca 0.00 -0.26 0.03 0.00 0.02 0.00 0.00 56.10 55.89 1bvz s TRP 322 Cb 0.00 -1.50 -0.02 0.00 -1.15 0.00 0.00 33.47 30.80 1bvz s TRP 322 CO 0.00 0.20 -0.16 0.50 0.02 0.00 0.00 176.95 177.51 1bvz s ARG 323 N -1.18 2.73 -0.18 4.98 3.00 -0.51 -1.96 118.95 125.83 1bvz s ARG 323 Ca 0.13 -0.74 -0.02 0.00 -1.00 0.00 0.00 55.73 54.11 1bvz s ARG 323 Cb -0.10 -2.40 -0.01 0.00 0.00 0.00 0.00 34.95 32.44 1bvz s ARG 323 CO 0.03 0.47 -0.10 -0.51 0.00 0.00 0.00 175.30 175.19 1bvz s LEU 324 N -0.34 2.72 -0.13 -0.88 1.43 0.62 -0.35 118.68 121.75 1bvz s LEU 324 Ca 0.03 -0.40 -0.15 0.00 -1.03 0.00 0.00 54.13 52.58 1bvz s LEU 324 Cb -0.13 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.40 1bvz s LEU 324 CO 0.02 0.06 0.37 -0.62 0.23 0.00 0.00 176.35 176.42 1bvz s ASP 325 N 0.95 6.56 -1.46 2.29 2.15 -1.05 -1.78 116.67 124.33 1bvz s ASP 325 Ca -0.02 0.67 -0.08 0.00 0.43 0.00 0.00 52.55 53.55 1bvz s ASP 325 Cb -0.15 -2.23 0.05 0.00 -0.30 0.00 0.00 42.92 40.30 1bvz s ASP 325 CO -0.01 0.09 0.76 0.52 -0.17 0.00 0.00 175.17 176.36 1bvz n VAL 326 N 3.41 -2.83 -0.03 1.11 0.31 -1.26 -4.29 118.33 114.76 1bvz n VAL 326 Ca -0.10 -0.25 -0.02 0.00 -0.01 0.00 0.00 64.34 63.95 1bvz n VAL 326 Cb 0.52 -2.93 0.24 0.00 -0.91 0.00 0.00 33.84 30.76 1bvz n VAL 326 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bvz h ALA 327 N 0.90 1.23 0.00 3.52 0.00 -1.71 -2.32 119.26 120.88 1bvz h ALA 327 Ca -0.60 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1bvz h ALA 327 Cb 1.37 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1bvz h ALA 327 CO 0.65 0.50 0.00 0.27 0.00 0.00 0.00 179.25 180.67 1bvz n ASN 328 N -4.23 0.42 -0.94 0.00 2.04 -1.26 -1.70 115.26 109.59 1bvz n ASN 328 Ca 0.01 0.64 0.06 0.00 -0.44 0.00 0.00 54.58 54.85 1bvz n ASN 328 Cb 0.29 -0.71 0.21 0.00 -2.53 0.00 0.00 39.78 37.04 1bvz n ASN 328 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1bvz n GLU 329 N -2.00 2.33 -4.17 -3.83 1.02 -0.87 -4.90 120.64 108.22 1bvz n GLU 329 Ca 0.01 -1.65 -0.16 0.00 -0.02 0.00 0.00 57.16 55.34 1bvz n GLU 329 Cb 0.14 -1.49 -0.13 0.00 -0.02 0.00 0.00 31.44 29.94 1bvz n GLU 329 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1bvz s VAL 330 N -1.56 0.71 0.66 2.62 0.11 -0.69 -5.07 120.40 117.17 1bvz s VAL 330 Ca 0.30 -0.88 -0.16 0.00 -2.93 0.00 0.00 61.98 58.31 1bvz s VAL 330 Cb 0.18 -0.69 -0.00 0.00 -1.53 0.00 0.00 36.38 34.33 1bvz s VAL 330 CO 0.17 -0.15 1.14 1.51 -3.33 0.00 0.00 175.10 174.44 1bvz s ASP 331 N -1.14 5.00 0.33 3.54 -4.77 -1.26 -4.83 116.67 113.53 1bvz s ASP 331 Ca -0.04 2.12 0.13 0.00 -3.30 0.00 0.00 52.55 51.47 1bvz s ASP 331 Cb -0.08 -2.57 0.55 0.00 -1.09 0.00 0.00 42.92 39.74 1bvz s ASP 331 CO 0.01 -1.71 1.70 0.45 0.70 0.00 0.00 175.17 176.32 1bvz h HIS 332 N 0.16 0.00 -0.15 2.11 3.86 -1.97 -1.50 115.15 117.67 1bvz h HIS 332 Ca -0.48 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 58.73 1bvz h HIS 332 Cb 1.26 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.72 1bvz h HIS 332 CO 0.52 0.49 0.06 0.00 0.86 0.00 0.00 177.93 179.86 1bvz h ALA 333 N 1.51 0.19 0.22 2.45 0.00 -1.99 0.50 119.26 122.15 1bvz h ALA 333 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1bvz h ALA 333 Cb 0.92 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1bvz h ALA 333 CO 0.06 -0.23 -0.42 0.35 0.00 0.00 0.00 179.25 179.01 1bvz h PHE 334 N 0.09 -1.21 -0.02 0.00 3.04 -1.78 -2.14 116.94 114.93 1bvz h PHE 334 Ca 0.05 0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.03 1bvz h PHE 334 Cb 0.15 0.50 -0.00 0.00 2.56 0.00 0.00 35.95 39.16 1bvz h PHE 334 CO -0.02 -0.51 0.02 -1.49 -2.02 0.00 0.00 178.31 174.29 1bvz h TRP 335 N -0.70 0.00 0.12 0.41 -0.00 -1.07 0.15 115.95 114.86 1bvz h TRP 335 Ca -0.02 0.00 -0.21 0.00 -0.00 0.00 0.00 58.89 58.66 1bvz h TRP 335 Cb 0.66 0.00 0.01 0.00 -0.00 0.00 0.00 29.16 29.83 1bvz h TRP 335 CO -0.34 0.00 -1.00 -0.09 -0.00 0.00 0.00 178.44 177.00 1bvz h ARG 336 N 0.00 0.25 -0.08 0.49 2.43 -0.71 -2.46 114.38 114.29 1bvz h ARG 336 Ca 0.01 -0.43 -0.11 0.00 -0.81 0.00 0.00 59.98 58.64 1bvz h ARG 336 Cb 0.06 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1bvz h ARG 336 CO -0.00 1.20 -0.45 0.93 -1.51 0.00 0.00 179.97 180.15 1bvz h GLU 337 N -0.41 0.20 -0.61 0.20 5.08 -0.86 -2.93 114.58 115.25 1bvz h GLU 337 Ca -0.20 -0.10 0.10 0.00 -1.00 0.00 0.00 59.36 58.16 1bvz h GLU 337 Cb 1.63 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.81 1bvz h GLU 337 CO 0.09 0.61 0.21 0.35 -1.00 0.00 0.00 179.01 179.27 1bvz h PHE 338 N 0.16 0.36 0.00 4.33 3.57 -0.75 0.04 116.94 124.65 1bvz h PHE 338 Ca 0.01 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 1bvz h PHE 338 Cb 0.86 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.51 1bvz h PHE 338 CO 0.01 0.08 -0.43 -0.09 -2.23 0.00 0.00 178.31 175.65 1bvz h ARG 339 N 0.38 0.00 -0.15 1.11 2.43 -1.31 -1.50 114.38 115.34 1bvz h ARG 339 Ca 0.31 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.39 1bvz h ARG 339 Cb 0.40 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1bvz h ARG 339 CO -0.32 0.43 -0.24 -0.09 -1.51 0.00 0.00 179.97 178.24 1bvz h ARG 340 N 0.00 0.43 0.11 0.20 2.43 -0.88 -1.46 114.38 115.20 1bvz h ARG 340 Ca -0.00 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 1bvz h ARG 340 Cb 0.79 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.34 1bvz h ARG 340 CO 0.06 0.85 -0.27 1.25 -1.51 0.00 0.00 179.97 180.35 1bvz h LEU 341 N 0.04 -0.79 -0.56 3.80 5.85 -1.01 -0.35 115.31 122.29 1bvz h LEU 341 Ca 0.01 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.90 1bvz h LEU 341 Cb 0.82 0.29 -0.07 0.00 0.37 0.00 0.00 40.66 42.06 1bvz h LEU 341 CO 0.06 -0.30 0.17 0.58 -0.34 0.00 0.00 178.44 178.61 1bvz h VAL 342 N -0.41 0.75 0.00 1.05 2.07 -1.34 -0.86 116.25 117.50 1bvz h VAL 342 Ca -0.01 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1bvz h VAL 342 Cb 0.40 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1bvz h VAL 342 CO -0.12 0.06 -0.07 0.29 0.02 0.00 0.00 177.57 177.75 1bvz n LYS 343 N -5.05 0.27 -0.04 1.57 4.76 -0.55 -0.30 118.16 118.83 1bvz n LYS 343 Ca 0.07 0.21 -0.14 0.00 -2.87 0.00 0.00 58.31 55.58 1bvz n LYS 343 Cb 0.26 -1.80 -0.11 0.00 -1.84 0.00 0.00 35.03 31.54 1bvz n LYS 343 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1bvz h SER 344 N 0.00 0.09 0.00 4.39 4.64 0.13 -3.24 113.55 119.56 1bvz h SER 344 Ca 0.00 -0.76 0.00 0.00 -0.47 0.00 0.00 61.79 60.56 1bvz h SER 344 Cb 0.75 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1bvz h SER 344 CO 0.00 0.83 0.00 0.18 -0.87 0.00 0.00 176.83 176.97 1bvz n LEU 345 N -4.64 0.00 -4.09 5.97 4.77 -0.45 -4.64 117.00 113.92 1bvz n LEU 345 Ca -0.09 0.70 -0.33 0.00 -0.03 0.00 0.00 56.01 56.26 1bvz n LEU 345 Cb 0.42 -0.20 -0.15 0.00 -2.33 0.00 0.00 43.42 41.16 1bvz n LEU 345 CO 0.36 -0.20 -0.45 0.21 -1.33 0.00 0.00 177.39 175.98 1bvz s ASN 346 N -2.34 4.44 0.48 -1.43 2.47 0.59 -4.99 114.94 114.17 1bvz s ASN 346 Ca 0.00 -1.33 0.21 0.00 0.42 0.00 0.00 52.86 52.17 1bvz s ASN 346 Cb 0.00 -1.57 1.22 0.00 -1.45 0.00 0.00 41.25 39.45 1bvz s ASN 346 CO 0.00 -0.19 2.02 1.55 -3.72 0.00 0.00 177.10 176.76 1bvz h PRO 347 N 7.82 0.00 -0.25 0.43 0.13 -1.80 -0.44 132.00 137.88 1bvz h PRO 347 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1bvz h PRO 347 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1bvz h PRO 347 CO 0.48 0.17 0.00 -0.25 -0.23 0.00 0.00 178.00 178.17 1bvz n ASP 348 N -3.92 1.34 -4.70 1.44 9.92 -1.26 -4.72 116.55 114.65 1bvz n ASP 348 Ca -0.02 -2.00 -0.42 0.00 -0.53 0.00 0.00 54.79 51.82 1bvz n ASP 348 Cb 0.26 -0.17 -0.03 0.00 -0.64 0.00 0.00 41.12 40.54 1bvz n ASP 348 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bvz s ALA 349 N -1.67 3.51 0.56 2.24 0.00 -0.18 -4.84 121.76 121.40 1bvz s ALA 349 Ca 0.17 0.84 -0.15 0.00 0.00 0.00 0.00 51.96 52.82 1bvz s ALA 349 Cb 0.09 -3.53 -0.06 0.00 0.00 0.00 0.00 23.12 19.62 1bvz s ALA 349 CO 0.11 -0.72 1.01 -1.17 0.00 0.00 0.00 175.76 175.00 1bvz s LEU 350 N 1.87 3.49 -0.19 0.00 2.96 0.29 -4.86 118.68 122.24 1bvz s LEU 350 Ca 0.61 1.60 -0.03 0.00 -0.22 0.00 0.00 54.13 56.09 1bvz s LEU 350 Cb -0.30 -4.51 0.06 0.00 0.50 0.00 0.00 46.19 41.94 1bvz s LEU 350 CO 0.26 -0.83 0.05 -0.63 -1.32 0.00 0.00 176.35 173.88 1bvz s ILE 351 N -2.71 0.41 -0.08 6.68 1.01 -1.26 -2.13 121.20 123.11 1bvz s ILE 351 Ca 0.59 -0.48 0.03 0.00 0.00 0.00 0.00 60.65 60.79 1bvz s ILE 351 Cb -0.12 -0.94 -0.02 0.00 0.01 0.00 0.00 42.46 41.39 1bvz s ILE 351 CO 0.38 -0.22 -0.16 -0.69 0.00 0.00 0.00 174.94 174.25 1bvz s VAL 352 N 1.91 2.89 0.51 2.92 1.01 -0.83 -0.31 120.40 128.50 1bvz s VAL 352 Ca -0.00 -0.76 0.08 0.00 0.00 0.00 0.00 61.98 61.30 1bvz s VAL 352 Cb -0.17 -2.15 0.05 0.00 0.00 0.00 0.00 36.38 34.11 1bvz s VAL 352 CO -0.08 0.56 0.64 -0.83 0.00 0.00 0.00 175.10 175.39 1bvz s GLY 353 N -0.24 1.92 -0.35 4.51 0.00 -0.67 -0.27 107.32 112.21 1bvz s GLY 353 Ca 0.01 -1.88 0.02 0.00 0.00 0.00 0.00 44.72 42.86 1bvz s GLY 353 CO 0.03 -1.67 0.11 1.85 0.00 0.00 0.00 173.10 173.42 1bvz s GLU 354 N -4.48 1.13 -0.12 2.90 2.12 -0.73 -2.15 118.70 117.37 1bvz s GLU 354 Ca 0.55 -1.58 0.03 0.00 0.36 0.00 0.00 54.97 54.33 1bvz s GLU 354 Cb -0.06 -2.53 0.00 0.00 0.26 0.00 0.00 34.13 31.81 1bvz s GLU 354 CO 0.34 -1.00 -0.22 0.42 -0.54 0.00 0.00 175.26 174.25 1bvz s ILE 355 N 1.07 2.15 -0.66 -3.70 1.09 -1.26 -3.81 121.20 116.08 1bvz s ILE 355 Ca 0.12 -0.97 -0.02 0.00 -1.10 0.00 0.00 60.65 58.68 1bvz s ILE 355 Cb -0.19 -1.85 0.36 0.00 -1.06 0.00 0.00 42.46 39.72 1bvz s ILE 355 CO -0.14 0.55 2.09 0.79 -0.10 0.00 0.00 174.94 178.13 1bvz n TRP 356 N 3.79 2.82 -3.20 3.97 5.03 -1.26 -4.85 117.44 123.73 1bvz n TRP 356 Ca -0.19 -2.61 -0.01 0.00 3.03 0.00 0.00 57.50 57.71 1bvz n TRP 356 Cb 0.52 -1.31 0.01 0.00 -1.03 0.00 0.00 31.31 29.49 1bvz n TRP 356 CO 0.00 0.00 0.00 -2.39 -0.03 0.00 0.00 177.69 175.27 1bvz n HIS 357 N -0.51 -1.15 -1.68 -5.99 1.44 -1.26 -5.12 115.22 100.95 1bvz n HIS 357 Ca 0.55 -0.31 -0.44 0.00 -2.01 0.00 0.00 57.72 55.50 1bvz n HIS 357 Cb 0.52 0.16 -0.04 0.00 0.12 0.00 0.00 29.99 30.75 1bvz n HIS 357 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1bvz n ASP 358 N -1.03 3.75 -0.33 4.39 2.03 -1.26 -4.87 116.55 119.23 1bvz n ASP 358 Ca -0.01 0.99 0.09 0.00 0.52 0.00 0.00 54.79 56.38 1bvz n ASP 358 Cb 0.11 -1.48 0.18 0.00 -0.72 0.00 0.00 41.12 39.20 1bvz n ASP 358 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bvz n ALA 359 N 5.65 2.55 -0.34 -1.67 0.00 -1.26 -4.76 120.51 120.67 1bvz n ALA 359 Ca 0.19 -2.58 0.19 0.00 0.00 0.00 0.00 53.44 51.25 1bvz n ALA 359 Cb 0.34 -0.48 0.42 0.00 0.00 0.00 0.00 19.45 19.73 1bvz n ALA 359 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1bvz h SER 360 N 0.54 0.62 -0.05 0.00 4.64 -1.89 0.55 113.55 117.96 1bvz h SER 360 Ca 0.00 0.14 -0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1bvz h SER 360 Cb 1.13 0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1bvz h SER 360 CO 0.07 0.06 0.01 0.61 -0.87 0.00 0.00 176.83 176.70 1bvz n GLY 361 N -1.33 1.68 0.00 -0.77 0.00 -1.26 -0.37 105.19 103.14 1bvz n GLY 361 Ca 0.28 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1bvz n GLY 361 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1bvz n TRP 362 N 0.08 0.00 -1.40 1.61 8.01 0.12 -4.91 117.44 120.96 1bvz n TRP 362 Ca 0.02 0.00 -0.14 0.00 -1.31 0.00 0.00 57.50 56.08 1bvz n TRP 362 Cb 0.35 0.00 0.18 0.00 -2.01 0.00 0.00 31.31 29.83 1bvz n TRP 362 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1bvz n LEU 363 N -0.44 5.25 -0.33 -0.99 7.99 0.50 -2.96 117.00 126.01 1bvz n LEU 363 Ca 0.00 -3.80 0.09 0.00 -0.01 0.00 0.00 56.01 52.29 1bvz n LEU 363 Cb 0.02 -0.71 -0.02 0.00 -0.11 0.00 0.00 43.42 42.59 1bvz n LEU 363 CO 0.00 1.25 0.21 0.23 -1.51 0.00 0.00 177.39 177.57 1bvz n MET 364 N -1.11 1.43 0.00 3.23 2.81 -1.21 -4.54 117.12 117.74 1bvz n MET 364 Ca 0.44 -0.71 0.00 0.00 -1.81 0.00 0.00 57.70 55.63 1bvz n MET 364 Cb 1.23 -1.35 0.00 0.00 -0.71 0.00 0.00 33.22 32.39 1bvz n MET 364 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bvz n GLY 365 N 1.29 0.92 0.07 3.03 0.00 -1.26 -4.85 105.19 104.39 1bvz n GLY 365 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.01 1bvz n GLY 365 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bvz n ASP 366 N 0.00 2.20 -0.07 1.61 5.75 -1.26 -4.75 116.55 120.03 1bvz n ASP 366 Ca 0.00 -0.02 -0.07 0.00 -0.01 0.00 0.00 54.79 54.68 1bvz n ASP 366 Cb 0.00 0.50 -0.04 0.00 -1.03 0.00 0.00 41.12 40.55 1bvz n ASP 366 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 1bvz h GLN 367 N 0.00 0.00 -5.61 0.11 4.20 -1.79 -3.41 115.11 108.60 1bvz h GLN 367 Ca -0.34 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 57.88 1bvz h GLN 367 Cb 1.70 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 29.34 1bvz h GLN 367 CO -0.00 0.26 -0.71 -0.06 -0.67 0.00 0.00 178.83 177.65 1bvz s PHE 368 N -2.10 1.90 -0.20 2.96 0.40 -1.16 -4.65 117.98 115.13 1bvz s PHE 368 Ca -0.14 -0.61 0.14 0.00 -0.60 0.00 0.00 56.93 55.73 1bvz s PHE 368 Cb 0.02 -0.98 -0.22 0.00 0.51 0.00 0.00 43.02 42.35 1bvz s PHE 368 CO 0.27 0.36 0.01 -0.25 0.70 0.00 0.00 175.22 176.32 1bvz n ASP 369 N -0.51 0.57 -3.93 1.36 8.00 0.57 -4.61 116.55 118.00 1bvz n ASP 369 Ca -0.06 -0.02 -0.12 0.00 0.71 0.00 0.00 54.79 55.29 1bvz n ASP 369 Cb 0.62 0.72 -0.07 0.00 -0.02 0.00 0.00 41.12 42.37 1bvz n ASP 369 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1bvz s SER 370 N -5.57 0.30 0.40 -2.24 0.01 -1.11 -4.50 113.70 100.99 1bvz s SER 370 Ca -0.14 -1.28 0.04 0.00 1.31 0.00 0.00 55.95 55.88 1bvz s SER 370 Cb 0.06 0.50 -0.05 0.00 0.21 0.00 0.00 66.02 66.74 1bvz s SER 370 CO 0.75 -1.02 0.05 0.68 0.41 0.00 0.00 173.24 174.11 1bvz s VAL 371 N -3.90 1.29 -0.03 3.43 -7.23 -1.26 -1.66 120.40 111.03 1bvz s VAL 371 Ca 0.32 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.20 1bvz s VAL 371 Cb 0.03 -2.64 -0.05 0.00 0.56 0.00 0.00 36.38 34.28 1bvz s VAL 371 CO 0.13 0.00 1.50 -0.04 -0.31 0.00 0.00 175.10 176.39 1bvz s MET 372 N -3.81 4.23 -1.35 4.82 -1.94 -0.91 -1.70 119.30 118.65 1bvz s MET 372 Ca 0.28 2.05 -0.16 0.00 -1.71 0.00 0.00 55.69 56.15 1bvz s MET 372 Cb 0.07 -3.75 0.07 0.00 2.01 0.00 0.00 34.83 33.23 1bvz s MET 372 CO 0.14 -0.71 1.89 -1.71 -0.01 0.00 0.00 175.02 174.62 1bvz n ASN 373 N 6.18 4.61 0.09 3.03 2.85 0.02 -4.79 115.26 127.25 1bvz n ASN 373 Ca 0.15 -2.90 0.04 0.00 -0.11 0.00 0.00 54.58 51.76 1bvz n ASN 373 Cb 0.43 -1.70 0.46 0.00 1.24 0.00 0.00 39.78 40.21 1bvz n ASN 373 CO 0.00 0.00 0.00 0.10 -2.11 0.00 0.00 177.26 175.25 1bvz h TYR 374 N 6.97 0.32 -0.41 1.20 -0.00 -1.92 -2.47 116.97 120.67 1bvz h TYR 374 Ca 0.48 -0.01 -0.04 0.00 -0.00 0.00 0.00 58.73 59.16 1bvz h TYR 374 Cb 0.79 -0.10 -0.02 0.00 -0.00 0.00 0.00 36.73 37.39 1bvz h TYR 374 CO 1.42 0.27 0.07 -0.07 -0.00 0.00 0.00 178.16 179.85 1bvz h LEU 375 N 0.33 0.57 -0.21 0.10 4.07 -1.98 -0.94 115.31 117.26 1bvz h LEU 375 Ca 0.08 -0.09 0.03 0.00 0.08 0.00 0.00 57.88 57.98 1bvz h LEU 375 Cb 0.08 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.65 1bvz h LEU 375 CO -0.01 0.59 0.03 0.15 -1.08 0.00 0.00 178.44 178.12 1bvz h PHE 376 N 0.60 0.05 0.30 1.13 3.57 -1.80 -2.56 116.94 118.21 1bvz h PHE 376 Ca 0.13 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1bvz h PHE 376 Cb 0.27 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1bvz h PHE 376 CO 0.01 0.01 -0.14 -0.09 -2.23 0.00 0.00 178.31 175.86 1bvz h ARG 377 N 0.11 -0.38 -0.16 1.11 2.43 -1.25 -0.79 114.38 115.43 1bvz h ARG 377 Ca 0.10 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.34 1bvz h ARG 377 Cb 0.10 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1bvz h ARG 377 CO -0.14 -0.13 0.20 0.93 -1.51 0.00 0.00 179.97 179.32 1bvz h GLU 378 N -0.59 0.00 0.22 0.20 5.08 -1.22 0.19 114.58 118.46 1bvz h GLU 378 Ca -0.04 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.98 1bvz h GLU 378 Cb 0.43 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.70 1bvz h GLU 378 CO 0.07 0.00 -1.57 0.77 -1.00 0.00 0.00 179.01 177.28 1bvz h SER 379 N 0.00 0.72 0.13 1.42 0.02 -1.06 -3.10 113.55 111.67 1bvz h SER 379 Ca 0.08 -0.87 -0.19 0.00 -0.84 0.00 0.00 61.79 59.97 1bvz h SER 379 Cb 0.48 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.79 1bvz h SER 379 CO -0.00 1.70 -0.72 -0.37 -1.14 0.00 0.00 176.83 176.29 1bvz h VAL 380 N 0.13 1.35 -0.40 2.27 -1.51 0.69 -0.01 116.25 118.76 1bvz h VAL 380 Ca -0.28 -2.06 0.05 0.00 -1.23 0.00 0.00 66.70 63.18 1bvz h VAL 380 Cb 2.13 2.04 -0.04 0.00 -2.13 0.00 0.00 31.29 33.28 1bvz h VAL 380 CO 0.23 0.63 0.15 0.40 -1.23 0.00 0.00 177.57 177.75 1bvz h ILE 381 N 0.36 0.89 0.09 7.19 1.08 -0.90 -1.30 117.51 124.93 1bvz h ILE 381 Ca -0.03 -0.11 -0.30 0.00 -0.39 0.00 0.00 64.86 64.03 1bvz h ILE 381 Cb 1.31 0.55 -0.01 0.00 -3.07 0.00 0.00 36.82 35.59 1bvz h ILE 381 CO 0.13 0.06 -1.53 0.03 -0.69 0.00 0.00 178.15 176.15 1bvz h ARG 382 N 0.32 0.20 0.22 2.37 3.08 -1.40 -1.30 114.38 117.88 1bvz h ARG 382 Ca 0.19 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 1bvz h ARG 382 Cb 0.16 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1bvz h ARG 382 CO -0.18 1.04 -0.11 0.35 -1.07 0.00 0.00 179.97 180.00 1bvz h PHE 383 N 0.05 -0.28 0.15 3.04 3.57 -0.99 0.10 116.94 122.59 1bvz h PHE 383 Ca -0.24 -0.01 -0.35 0.00 3.53 0.00 0.00 57.97 60.90 1bvz h PHE 383 Cb 2.00 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 40.82 1bvz h PHE 383 CO 0.05 0.11 -1.85 0.74 -2.23 0.00 0.00 178.31 175.12 1bvz h PHE 384 N -0.81 0.57 0.00 0.41 0.04 -1.38 -3.34 116.94 112.43 1bvz h PHE 384 Ca -0.03 -0.41 -0.01 0.00 2.80 0.00 0.00 57.97 60.32 1bvz h PHE 384 Cb 0.51 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.64 1bvz h PHE 384 CO 0.06 1.73 -0.14 0.00 -0.60 0.00 0.00 178.31 179.35 1bvz h ALA 385 N 0.07 0.01 0.00 2.45 0.00 -1.22 -3.44 119.26 117.13 1bvz h ALA 385 Ca -0.39 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1bvz h ALA 385 Cb 2.03 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.95 1bvz h ALA 385 CO 0.12 0.13 -0.13 1.79 0.00 0.00 0.00 179.25 181.15 1bvz h THR 386 N -1.00 0.00 0.00 0.00 1.35 -1.52 -3.43 112.91 108.31 1bvz h THR 386 Ca -0.01 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 1bvz h THR 386 Cb 0.22 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.64 1bvz h THR 386 CO -0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 1bvz n GLY 387 N 1.78 1.17 0.34 5.82 0.00 0.34 -4.99 105.19 109.65 1bvz n GLY 387 Ca -0.02 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.18 1bvz n GLY 387 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1bvz h GLU 388 N 0.64 0.00 -5.95 1.61 5.08 -1.84 -3.41 114.58 110.71 1bvz h GLU 388 Ca 0.00 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.82 1bvz h GLU 388 Cb 0.00 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.01 1bvz h GLU 388 CO 0.00 0.00 -0.83 0.96 -1.00 0.00 0.00 179.01 178.14 1bvz s ILE 389 N -4.45 1.57 0.51 3.13 -4.36 -1.19 -5.01 121.20 111.39 1bvz s ILE 389 Ca -0.04 -1.29 0.08 0.00 -0.26 0.00 0.00 60.65 59.14 1bvz s ILE 389 Cb 0.14 -1.40 0.04 0.00 1.25 0.00 0.00 42.46 42.49 1bvz s ILE 389 CO 0.47 0.07 0.57 -1.38 0.24 0.00 0.00 174.94 174.91 1bvz s HIS 390 N -0.95 1.92 0.12 1.37 -3.43 -1.26 -4.31 115.29 108.75 1bvz s HIS 390 Ca 0.06 -0.67 -0.32 0.00 -0.80 0.00 0.00 55.06 53.33 1bvz s HIS 390 Cb -0.09 -2.14 -0.11 0.00 -1.43 0.00 0.00 32.58 28.80 1bvz s HIS 390 CO 0.03 -0.66 1.52 0.00 -2.00 0.00 0.00 174.74 173.63 1bvz h ALA 391 N 0.57 -0.81 -1.03 -1.38 0.00 -1.82 0.08 119.26 114.87 1bvz h ALA 391 Ca -0.35 -0.03 0.26 0.00 0.00 0.00 0.00 54.91 54.79 1bvz h ALA 391 Cb 1.29 1.06 -0.09 0.00 0.00 0.00 0.00 17.79 20.05 1bvz h ALA 391 CO 0.49 -1.04 0.66 0.93 0.00 0.00 0.00 179.25 180.29 1bvz h GLU 392 N -0.45 0.41 -0.06 0.00 5.08 -1.85 -0.34 114.58 117.38 1bvz h GLU 392 Ca 0.05 -0.02 -0.20 0.00 -1.00 0.00 0.00 59.36 58.19 1bvz h GLU 392 Cb 0.60 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1bvz h GLU 392 CO -0.51 0.27 -0.80 -0.09 -1.00 0.00 0.00 179.01 176.88 1bvz h ARG 393 N 0.42 0.44 -0.39 2.33 1.12 -1.40 -0.42 114.38 116.47 1bvz h ARG 393 Ca 0.59 -0.39 -0.01 0.00 -1.11 0.00 0.00 59.98 59.05 1bvz h ARG 393 Cb 1.44 0.09 -0.02 0.00 -0.01 0.00 0.00 29.97 31.47 1bvz h ARG 393 CO -0.30 1.04 0.20 0.35 -3.11 0.00 0.00 179.97 178.14 1bvz h PHE 394 N 0.28 0.56 0.05 2.20 3.57 -0.31 -1.23 116.94 122.07 1bvz h PHE 394 Ca -0.05 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.43 1bvz h PHE 394 Cb 1.40 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.97 1bvz h PHE 394 CO 0.05 0.46 -0.02 0.22 -2.23 0.00 0.00 178.31 176.79 1bvz h ASP 395 N 0.50 -0.06 -0.84 0.41 3.58 -0.91 -1.43 116.42 117.67 1bvz h ASP 395 Ca 0.14 -0.00 0.08 0.00 0.42 0.00 0.00 57.03 57.66 1bvz h ASP 395 Cb 0.10 0.01 -0.07 0.00 1.72 0.00 0.00 39.33 41.10 1bvz h ASP 395 CO -0.02 -0.04 0.51 0.00 -2.88 0.00 0.00 179.24 176.81 1bvz h ALA 396 N 0.88 1.18 -0.11 -0.78 0.00 -1.02 -0.29 119.26 119.11 1bvz h ALA 396 Ca -0.01 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1bvz h ALA 396 Cb 0.06 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1bvz h ALA 396 CO 0.01 0.19 -0.08 0.93 0.00 0.00 0.00 179.25 180.31 1bvz h GLU 397 N 0.89 0.25 -0.39 0.00 5.08 -1.06 -1.48 114.58 117.86 1bvz h GLU 397 Ca 0.39 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.68 1bvz h GLU 397 Cb 0.26 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.43 1bvz h GLU 397 CO -0.21 0.62 -0.54 -0.07 -1.00 0.00 0.00 179.01 177.81 1bvz h LEU 398 N -0.13 -1.81 -0.50 1.33 4.07 -1.11 -1.61 115.31 115.55 1bvz h LEU 398 Ca 0.02 0.24 -0.03 0.00 0.08 0.00 0.00 57.88 58.19 1bvz h LEU 398 Cb 0.56 0.74 -0.02 0.00 1.08 0.00 0.00 40.66 43.03 1bvz h LEU 398 CO 0.02 -0.41 0.20 0.74 -1.08 0.00 0.00 178.44 177.92 1bvz h THR 399 N -0.40 1.21 -1.01 0.22 2.02 -1.03 -1.02 112.91 112.90 1bvz h THR 399 Ca 0.08 -0.65 0.15 0.00 0.77 0.00 0.00 66.41 66.75 1bvz h THR 399 Cb 0.60 0.71 -0.09 0.00 -1.74 0.00 0.00 68.15 67.62 1bvz h THR 399 CO -0.59 0.25 0.63 -0.09 0.37 0.00 0.00 175.52 176.09 1bvz h ARG 400 N 0.67 0.89 -0.18 6.66 2.43 -1.09 -2.82 114.38 120.94 1bvz h ARG 400 Ca 0.17 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.23 1bvz h ARG 400 Cb 0.19 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1bvz h ARG 400 CO -0.01 0.59 -0.09 0.00 -1.51 0.00 0.00 179.97 178.95 1bvz h ALA 401 N 1.58 0.25 0.00 2.80 0.00 -0.22 -3.06 119.26 120.61 1bvz h ALA 401 Ca 0.53 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1bvz h ALA 401 Cb 0.64 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1bvz h ALA 401 CO -0.31 0.07 -0.00 -0.09 0.00 0.00 0.00 179.25 178.92 1bvz h ARG 402 N 0.06 0.00 0.00 0.00 2.43 -1.00 -2.23 114.38 113.64 1bvz h ARG 402 Ca 0.04 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1bvz h ARG 402 Cb 0.56 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 1bvz h ARG 402 CO 0.03 0.00 -1.89 -1.33 -1.51 0.00 0.00 179.97 175.27 1bvz n MET 403 N -3.16 0.61 0.01 0.20 2.81 -1.15 -4.46 117.12 111.98 1bvz n MET 403 Ca -0.03 -0.18 0.20 0.00 -1.81 0.00 0.00 57.70 55.89 1bvz n MET 403 Cb 0.08 -1.49 0.70 0.00 -0.71 0.00 0.00 33.22 31.81 1bvz n MET 403 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1bvz h LEU 404 N 0.00 0.00 -8.20 4.03 3.38 -1.40 -3.45 115.31 109.67 1bvz h LEU 404 Ca 0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1bvz h LEU 404 Cb 0.92 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.50 1bvz h LEU 404 CO 0.00 0.00 -0.69 -0.31 0.09 0.00 0.00 178.44 177.53 1bvz s TYR 405 N -4.96 0.50 0.95 1.13 2.02 -1.26 -4.78 117.35 110.94 1bvz s TYR 405 Ca -0.05 -0.96 -0.11 0.00 -0.37 0.00 0.00 57.07 55.58 1bvz s TYR 405 Cb 0.19 -0.36 0.16 0.00 -0.40 0.00 0.00 41.96 41.55 1bvz s TYR 405 CO 0.71 -0.33 1.12 -2.14 -1.57 0.00 0.00 175.55 173.33 1bvz s PRO 406 N -3.46 0.77 0.35 -1.71 0.02 -1.26 -4.67 135.00 125.04 1bvz s PRO 406 Ca 0.03 1.35 0.03 0.00 0.02 0.00 0.00 61.00 62.43 1bvz s PRO 406 Cb 0.04 -1.71 0.63 0.00 0.02 0.00 0.00 34.50 33.48 1bvz s PRO 406 CO -0.08 -2.74 1.98 1.05 -0.33 0.00 0.00 177.00 176.88 1bvz h GLU 407 N -1.94 0.75 0.00 5.54 4.11 -1.93 -1.99 114.58 119.14 1bvz h GLU 407 Ca -0.47 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 58.89 1bvz h GLU 407 Cb 1.28 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.37 1bvz h GLU 407 CO 0.45 0.55 0.00 1.96 0.07 0.00 0.00 179.01 182.04 1bvz h GLN 408 N 0.77 0.00 0.04 1.06 7.50 -1.92 0.38 115.11 122.94 1bvz h GLN 408 Ca 0.20 0.00 -0.38 0.00 0.50 0.00 0.00 58.65 58.97 1bvz h GLN 408 Cb 0.01 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 27.49 1bvz h GLN 408 CO -0.03 0.00 -2.27 0.00 -1.50 0.00 0.00 178.83 175.03 1bvz n ALA 409 N -2.03 1.25 0.30 3.87 0.00 -0.94 -4.29 120.51 118.68 1bvz n ALA 409 Ca 0.00 -0.93 0.19 0.00 0.00 0.00 0.00 53.44 52.71 1bvz n ALA 409 Cb 0.24 -0.35 0.92 0.00 0.00 0.00 0.00 19.45 20.26 1bvz n ALA 409 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bvz h ALA 410 N 0.14 1.02 -0.00 0.00 0.00 -0.59 -0.11 119.26 119.72 1bvz h ALA 410 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1bvz h ALA 410 Cb 1.98 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.77 1bvz h ALA 410 CO -0.01 0.01 -0.07 1.04 0.00 0.00 0.00 179.25 180.22 1bvz n GLN 411 N -3.13 0.26 0.00 0.00 6.02 0.13 -4.17 117.38 116.48 1bvz n GLN 411 Ca -0.01 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 56.94 1bvz n GLN 411 Cb 0.20 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.96 1bvz n GLN 411 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1bvz n GLY 412 N 1.39 -0.24 3.62 1.08 0.00 -0.19 -3.56 105.19 107.30 1bvz n GLY 412 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1bvz n GLY 412 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bvz n LEU 413 N -0.09 3.92 -4.41 0.99 4.77 -0.41 -4.43 117.00 117.34 1bvz n LEU 413 Ca 0.00 0.77 -0.44 0.00 -0.03 0.00 0.00 56.01 56.31 1bvz n LEU 413 Cb 0.25 -1.41 -0.04 0.00 -2.33 0.00 0.00 43.42 39.89 1bvz n LEU 413 CO 0.00 -1.84 0.55 0.26 -1.33 0.00 0.00 177.39 175.03 1bvz s TRP 414 N -1.56 2.87 -0.85 -1.77 0.52 -0.69 -0.29 118.94 117.18 1bvz s TRP 414 Ca 0.77 -0.74 -0.25 0.00 0.02 0.00 0.00 56.10 55.89 1bvz s TRP 414 Cb -0.40 -4.09 0.02 0.00 -1.15 0.00 0.00 33.47 27.85 1bvz s TRP 414 CO 0.46 -1.42 1.47 -0.80 0.02 0.00 0.00 176.95 176.69 1bvz s ASN 415 N 3.57 6.09 0.03 2.95 0.01 0.95 -0.80 114.94 127.74 1bvz s ASN 415 Ca 0.16 -0.77 0.02 0.00 -0.71 0.00 0.00 52.86 51.57 1bvz s ASN 415 Cb -0.21 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 38.86 1bvz s ASN 415 CO 0.09 -1.86 0.04 -1.48 -1.51 0.00 0.00 177.10 172.37 1bvz s LEU 416 N 6.24 3.66 -0.09 0.60 2.34 -1.26 -1.74 118.68 128.44 1bvz s LEU 416 Ca 0.46 0.00 0.19 0.00 0.06 0.00 0.00 54.13 54.84 1bvz s LEU 416 Cb -0.05 -2.22 -0.26 0.00 -0.56 0.00 0.00 46.19 43.10 1bvz s LEU 416 CO 0.05 0.24 0.36 0.18 -1.06 0.00 0.00 176.35 176.12 1bvz n LEU 417 N 0.99 0.18 0.00 1.48 4.77 -1.26 -4.07 117.00 119.09 1bvz n LEU 417 Ca -0.12 0.08 -0.03 0.00 -0.03 0.00 0.00 56.01 55.90 1bvz n LEU 417 Cb 0.52 0.24 0.02 0.00 -2.33 0.00 0.00 43.42 41.87 1bvz n LEU 417 CO 0.38 0.25 0.45 -0.90 -1.33 0.00 0.00 177.39 176.24 1bvz n ASP 418 N -2.61 -1.25 -3.81 -1.43 5.68 -1.26 -4.73 116.55 107.14 1bvz n ASP 418 Ca -0.18 -1.76 -0.08 0.00 -0.50 0.00 0.00 54.79 52.27 1bvz n ASP 418 Cb 0.89 2.06 -0.03 0.00 -1.14 0.00 0.00 41.12 42.91 1bvz n ASP 418 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1bvz s SER 419 N -2.46 -0.17 0.00 -1.12 0.15 -1.26 -4.82 113.70 104.01 1bvz s SER 419 Ca 0.13 -0.75 0.12 0.00 0.70 0.00 0.00 55.95 56.15 1bvz s SER 419 Cb -0.02 0.70 0.73 0.00 -1.71 0.00 0.00 66.02 65.72 1bvz s SER 419 CO 0.05 -1.32 1.15 0.00 1.20 0.00 0.00 173.24 174.32 1bvz n HIS 420 N -0.45 0.00 -0.47 3.44 1.44 -1.26 -2.29 115.22 115.62 1bvz n HIS 420 Ca -0.04 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.67 1bvz n HIS 420 Cb 0.60 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.71 1bvz n HIS 420 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1bvz n ASP 421 N -0.95 0.63 -4.87 4.39 9.92 -1.26 -4.63 116.55 119.76 1bvz n ASP 421 Ca 0.09 -1.10 -0.21 0.00 -0.53 0.00 0.00 54.79 53.04 1bvz n ASP 421 Cb 0.04 0.00 0.07 0.00 -0.64 0.00 0.00 41.12 40.59 1bvz n ASP 421 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1bvz s THR 422 N -0.10 2.33 0.99 -3.53 -4.23 -0.97 -4.59 115.64 105.54 1bvz s THR 422 Ca 0.00 -0.77 -0.16 0.00 -1.18 0.00 0.00 61.69 59.58 1bvz s THR 422 Cb 0.00 -2.56 0.19 0.00 1.34 0.00 0.00 72.50 71.47 1bvz s THR 422 CO 0.00 0.00 1.22 -1.83 -0.54 0.00 0.00 174.62 173.47 1bvz s GLU 423 N -4.84 0.48 0.51 3.99 -1.05 -1.26 -4.16 118.70 112.37 1bvz s GLU 423 Ca 0.62 -0.14 -0.06 0.00 -0.15 0.00 0.00 54.97 55.24 1bvz s GLU 423 Cb -0.07 -1.80 -0.03 0.00 -0.44 0.00 0.00 34.13 31.79 1bvz s GLU 423 CO 0.40 -2.56 0.83 1.03 0.95 0.00 0.00 175.26 175.91 1bvz s ARG 424 N -5.63 3.46 -0.00 -4.83 0.52 -1.03 -4.55 118.95 106.90 1bvz s ARG 424 Ca 0.70 0.23 -0.23 0.00 -0.52 0.00 0.00 55.73 55.90 1bvz s ARG 424 Cb -0.08 -2.33 -0.18 0.00 0.52 0.00 0.00 34.95 32.88 1bvz s ARG 424 CO 0.53 -0.31 1.27 0.35 0.02 0.00 0.00 175.30 177.16 1bvz h PHE 425 N 0.11 0.20 -0.85 -0.53 3.57 -1.90 -1.94 116.94 115.61 1bvz h PHE 425 Ca -0.46 -0.07 0.24 0.00 3.53 0.00 0.00 57.97 61.21 1bvz h PHE 425 Cb 1.21 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.87 1bvz h PHE 425 CO 0.58 0.65 0.60 1.25 -2.23 0.00 0.00 178.31 179.16 1bvz h LEU 426 N -0.30 0.08 0.93 0.59 5.85 -1.94 0.19 115.31 120.71 1bvz h LEU 426 Ca 0.01 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1bvz h LEU 426 Cb 0.62 -0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.66 1bvz h LEU 426 CO 0.02 0.03 -0.45 0.74 -0.34 0.00 0.00 178.44 178.44 1bvz h THR 427 N 0.08 0.01 -0.97 1.05 2.02 -1.65 -0.44 112.91 113.00 1bvz h THR 427 Ca 0.41 -0.08 0.28 0.00 0.77 0.00 0.00 66.41 67.79 1bvz h THR 427 Cb 1.52 0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.90 1bvz h THR 427 CO -0.04 0.00 0.83 0.28 0.37 0.00 0.00 175.52 176.96 1bvz h SER 428 N -1.33 0.00 -0.17 4.18 0.02 -0.29 0.51 113.55 116.45 1bvz h SER 428 Ca -0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1bvz h SER 428 Cb 0.96 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.50 1bvz h SER 428 CO 0.21 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.90 1bvz n GLY 430 N 0.90 -0.48 3.27 0.00 0.00 0.17 -1.42 105.19 107.62 1bvz n GLY 430 Ca 0.10 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1bvz n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bvz n GLY 431 N -1.72 0.05 3.55 -0.02 0.00 -0.20 -4.92 105.19 101.92 1bvz n GLY 431 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1bvz n GLY 431 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1bvz s ASN 432 N -2.03 5.48 0.47 1.61 3.84 -0.51 -4.82 114.94 118.98 1bvz s ASN 432 Ca 0.00 0.06 0.21 0.00 0.21 0.00 0.00 52.86 53.35 1bvz s ASN 432 Cb 0.00 -2.54 1.22 0.00 -0.55 0.00 0.00 41.25 39.38 1bvz s ASN 432 CO 0.00 -2.26 1.90 -0.08 -2.79 0.00 0.00 177.10 173.87 1bvz h GLU 433 N 13.54 0.24 -0.14 0.43 4.81 -1.91 -2.67 114.58 128.88 1bvz h GLU 433 Ca -0.23 -0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 58.81 1bvz h GLU 433 Cb 1.12 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 1bvz h GLU 433 CO 1.24 0.16 -0.62 0.00 -0.73 0.00 0.00 179.01 179.06 1bvz h ALA 434 N 1.63 0.67 -0.06 2.92 0.00 -1.96 -0.15 119.26 122.30 1bvz h ALA 434 Ca 0.40 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1bvz h ALA 434 Cb 1.18 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 1bvz h ALA 434 CO -0.09 0.71 -0.03 0.87 0.00 0.00 0.00 179.25 180.71 1bvz h LYS 435 N 0.36 0.13 0.03 0.00 1.57 -1.86 -3.08 116.57 113.71 1bvz h LYS 435 Ca -0.01 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1bvz h LYS 435 Cb 1.17 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.43 1bvz h LYS 435 CO 0.11 0.49 -0.48 0.35 -0.57 0.00 0.00 179.45 179.35 1bvz h PHE 436 N -0.25 -1.42 0.00 -1.35 3.57 -1.04 0.85 116.94 117.30 1bvz h PHE 436 Ca 0.01 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1bvz h PHE 436 Cb 0.45 0.62 0.00 0.00 2.79 0.00 0.00 35.95 39.81 1bvz h PHE 436 CO 0.06 -0.52 0.31 0.00 -2.23 0.00 0.00 178.31 175.93 1bvz h ARG 437 N -0.63 0.00 0.23 1.11 3.08 -1.15 0.15 114.38 117.16 1bvz h ARG 437 Ca 0.01 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.75 1bvz h ARG 437 Cb 0.66 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.75 1bvz h ARG 437 CO -0.31 0.00 -1.33 -0.07 -1.07 0.00 0.00 179.97 177.19 1bvz h LEU 438 N 0.00 0.75 -1.28 3.04 3.38 -0.76 -2.64 115.31 117.80 1bvz h LEU 438 Ca 0.00 -0.93 -0.05 0.00 0.09 0.00 0.00 57.88 57.00 1bvz h LEU 438 Cb 0.63 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1bvz h LEU 438 CO 0.00 1.64 -0.00 0.00 0.09 0.00 0.00 178.44 180.17 1bvz h ALA 439 N 0.13 1.42 0.00 1.53 0.00 -0.10 -0.77 119.26 121.47 1bvz h ALA 439 Ca -0.23 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 1bvz h ALA 439 Cb 2.04 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.67 1bvz h ALA 439 CO 0.24 0.41 -0.95 -0.39 0.00 0.00 0.00 179.25 178.56 1bvz h VAL 440 N 0.46 1.07 -0.40 0.00 -1.51 -1.43 -0.04 116.25 114.39 1bvz h VAL 440 Ca 0.10 -2.61 0.03 0.00 -1.23 0.00 0.00 66.70 62.99 1bvz h VAL 440 Cb 0.31 2.49 -0.04 0.00 -2.13 0.00 0.00 31.29 31.92 1bvz h VAL 440 CO 0.01 0.61 0.19 0.25 -1.23 0.00 0.00 177.57 177.39 1bvz h LEU 441 N 0.00 0.26 0.80 4.19 6.46 -1.04 -1.06 115.31 124.93 1bvz h LEU 441 Ca -0.06 0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 57.68 1bvz h LEU 441 Cb 1.61 -0.02 0.01 0.00 -0.73 0.00 0.00 40.66 41.52 1bvz h LEU 441 CO 0.08 0.19 -0.38 0.15 -0.62 0.00 0.00 178.44 177.86 1bvz h PHE 442 N 0.38 -1.00 -0.88 1.25 3.57 -1.10 -1.53 116.94 117.64 1bvz h PHE 442 Ca 0.17 -0.02 0.22 0.00 3.53 0.00 0.00 57.97 61.87 1bvz h PHE 442 Cb 0.10 0.33 -0.16 0.00 2.79 0.00 0.00 35.95 39.00 1bvz h PHE 442 CO -0.11 -0.62 -0.05 0.94 -2.23 0.00 0.00 178.31 176.24 1bvz n GLN 443 N -5.02 -0.07 0.00 1.11 7.27 -0.04 -0.15 117.38 120.48 1bvz n GLN 443 Ca -0.13 1.33 0.13 0.00 0.07 0.00 0.00 57.00 58.39 1bvz n GLN 443 Cb 0.42 -2.08 0.33 0.00 2.41 0.00 0.00 30.24 31.33 1bvz n GLN 443 CO 0.00 0.00 0.00 -1.33 0.07 0.00 0.00 177.06 175.80 1bvz n MET 444 N -5.32 0.54 -0.01 3.69 2.81 -0.41 -3.90 117.12 114.51 1bvz n MET 444 Ca 0.19 -0.31 0.06 0.00 -1.81 0.00 0.00 57.70 55.82 1bvz n MET 444 Cb 0.61 -1.49 -0.11 0.00 -0.71 0.00 0.00 33.22 31.51 1bvz n MET 444 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1bvz n THR 445 N -0.96 0.11 -0.58 2.03 -2.24 0.79 -4.72 114.28 108.71 1bvz n THR 445 Ca 0.10 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1bvz n THR 445 Cb 0.34 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 1bvz n THR 445 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bvz n TYR 446 N -2.08 -0.55 -4.01 4.78 9.36 0.61 -4.75 117.16 120.53 1bvz n TYR 446 Ca -0.05 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.85 1bvz n TYR 446 Cb 0.45 0.00 -0.15 0.00 -0.63 0.00 0.00 39.34 39.02 1bvz n TYR 446 CO 0.00 0.00 0.00 -1.17 0.22 0.00 0.00 176.86 175.91 1bvz s LEU 447 N 0.00 4.17 0.00 2.98 2.96 -1.26 -4.87 118.68 122.66 1bvz s LEU 447 Ca 0.00 -1.74 0.00 0.00 -0.22 0.00 0.00 54.13 52.17 1bvz s LEU 447 Cb 0.00 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 45.07 1bvz s LEU 447 CO 0.00 -0.30 0.00 0.61 -1.32 0.00 0.00 176.35 175.34 1bvz n GLY 448 N 4.40 0.80 3.30 7.98 0.00 -1.23 -4.83 105.19 115.60 1bvz n GLY 448 Ca -0.06 -1.88 -0.34 0.00 0.00 0.00 0.00 46.02 43.75 1bvz n GLY 448 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1bvz s THR 449 N -1.67 3.00 0.10 2.61 -4.23 0.61 -4.85 115.64 111.21 1bvz s THR 449 Ca 0.00 -0.65 -0.35 0.00 -1.18 0.00 0.00 61.69 59.51 1bvz s THR 449 Cb 0.00 -2.30 -0.15 0.00 1.34 0.00 0.00 72.50 71.39 1bvz s THR 449 CO 0.00 0.49 1.54 -2.65 -0.54 0.00 0.00 174.62 173.46 1bvz n PRO 450 N 4.20 1.80 -3.95 3.99 -0.02 -1.26 -0.03 135.00 139.73 1bvz n PRO 450 Ca -0.19 0.65 -0.33 0.00 -2.02 0.00 0.00 63.50 61.61 1bvz n PRO 450 Cb 0.52 -2.38 -0.14 0.00 -0.02 0.00 0.00 33.50 31.47 1bvz n PRO 450 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1bvz s LEU 451 N 1.17 4.35 0.13 2.45 2.96 -0.71 -1.53 118.68 127.50 1bvz s LEU 451 Ca 0.83 -1.72 -0.23 0.00 -0.22 0.00 0.00 54.13 52.79 1bvz s LEU 451 Cb -0.78 -1.68 -0.07 0.00 0.50 0.00 0.00 46.19 44.15 1bvz s LEU 451 CO 0.43 -0.34 0.70 -0.63 -1.32 0.00 0.00 176.35 175.19 1bvz s ILE 452 N 1.10 4.51 -0.01 6.68 1.01 -0.35 -4.33 121.20 129.81 1bvz s ILE 452 Ca 0.02 1.52 -0.01 0.00 0.00 0.00 0.00 60.65 62.18 1bvz s ILE 452 Cb -0.20 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 1bvz s ILE 452 CO -0.05 0.53 0.10 -0.47 0.00 0.00 0.00 174.94 175.06 1bvz s TYR 453 N -1.10 3.35 -0.14 3.97 5.04 -1.26 -0.56 117.35 126.65 1bvz s TYR 453 Ca 0.33 0.25 -0.29 0.00 -2.44 0.00 0.00 57.07 54.92 1bvz s TYR 453 Cb -0.22 -1.76 -0.06 0.00 0.35 0.00 0.00 41.96 40.27 1bvz s TYR 453 CO 0.23 0.58 1.96 1.52 -1.34 0.00 0.00 175.55 178.50 1bvz s TYR 454 N -1.21 1.48 0.00 4.97 1.13 -1.17 -2.42 117.35 120.12 1bvz s TYR 454 Ca 0.23 0.21 0.00 0.00 -1.41 0.00 0.00 57.07 56.11 1bvz s TYR 454 Cb -0.12 -4.05 0.00 0.00 -1.10 0.00 0.00 41.96 36.69 1bvz s TYR 454 CO 0.15 -4.23 0.00 0.41 -2.51 0.00 0.00 175.55 169.36 1bvz n GLY 455 N 5.05 1.97 0.00 5.49 0.00 -1.26 -4.93 105.19 111.50 1bvz n GLY 455 Ca 0.23 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.33 1bvz n GLY 455 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bvz n ASP 456 N 0.00 0.00 0.11 1.61 9.92 -1.01 -1.14 116.55 126.03 1bvz n ASP 456 Ca 0.00 0.36 0.05 0.00 -0.53 0.00 0.00 54.79 54.67 1bvz n ASP 456 Cb 0.00 -0.43 0.00 0.00 -0.64 0.00 0.00 41.12 40.05 1bvz n ASP 456 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1bvz h GLU 457 N 0.00 0.00 -0.73 -1.24 3.07 -1.92 -3.30 114.58 110.46 1bvz h GLU 457 Ca 0.00 0.00 -0.46 0.00 -0.50 0.00 0.00 59.36 58.40 1bvz h GLU 457 Cb 0.24 0.00 -0.27 0.00 -0.84 0.00 0.00 28.75 27.89 1bvz h GLU 457 CO 0.00 0.24 0.15 0.44 -1.40 0.00 0.00 179.01 178.44 1bvz n ILE 458 N -2.96 2.97 -3.07 3.13 -6.64 -0.91 -1.45 119.36 110.43 1bvz n ILE 458 Ca -0.02 -3.01 -0.13 0.00 -1.77 0.00 0.00 62.75 57.82 1bvz n ILE 458 Cb 0.70 -0.77 0.06 0.00 -1.44 0.00 0.00 39.64 38.19 1bvz n ILE 458 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1bvz n GLY 459 N -0.98 -0.13 3.95 3.28 0.00 -1.17 -0.99 105.19 109.15 1bvz n GLY 459 Ca 0.49 -0.06 -0.26 0.00 0.00 0.00 0.00 46.02 46.19 1bvz n GLY 459 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bvz s MET 460 N -5.14 1.83 0.18 1.61 -1.94 -0.29 -4.78 119.30 110.77 1bvz s MET 460 Ca 0.07 -0.51 -0.24 0.00 -1.71 0.00 0.00 55.69 53.31 1bvz s MET 460 Cb -0.03 -2.17 0.06 0.00 2.01 0.00 0.00 34.83 34.70 1bvz s MET 460 CO 0.52 -1.46 0.95 0.00 -0.01 0.00 0.00 175.02 175.02 1bvz s ALA 461 N -3.31 -1.57 0.00 3.03 0.00 -1.26 -4.67 121.76 113.98 1bvz s ALA 461 Ca 0.64 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.57 1bvz s ALA 461 Cb -0.08 0.67 0.00 0.00 0.00 0.00 0.00 23.12 23.71 1bvz s ALA 461 CO 0.46 -1.05 0.00 0.41 0.00 0.00 0.00 175.76 175.58 1bvz n GLY 462 N -0.51 3.31 0.59 0.00 0.00 -1.26 -4.76 105.19 102.56 1bvz n GLY 462 Ca -0.06 -0.80 -0.05 0.00 0.00 0.00 0.00 46.02 45.12 1bvz n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bvz n ALA 463 N -1.02 -0.54 -0.55 4.61 0.00 -1.26 -2.46 120.51 119.29 1bvz n ALA 463 Ca 0.00 -0.27 -0.29 0.00 0.00 0.00 0.00 53.44 52.88 1bvz n ALA 463 Cb 0.00 -0.02 0.26 0.00 0.00 0.00 0.00 19.45 19.69 1bvz n ALA 463 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1bvz s THR 464 N -1.34 1.70 0.06 0.00 2.01 -1.26 -1.03 115.64 115.78 1bvz s THR 464 Ca 0.12 0.00 -0.36 0.00 0.31 0.00 0.00 61.69 61.76 1bvz s THR 464 Cb -0.01 -2.11 -0.16 0.00 0.01 0.00 0.00 72.50 70.23 1bvz s THR 464 CO 0.09 0.00 1.46 -0.67 -0.69 0.00 0.00 174.62 174.81 1bvz n ASP 465 N -5.16 2.15 -0.53 3.53 2.03 -1.26 -0.80 116.55 116.51 1bvz n ASP 465 Ca 0.07 1.10 0.13 0.00 0.52 0.00 0.00 54.79 56.60 1bvz n ASP 465 Cb 0.57 -1.25 0.27 0.00 -0.72 0.00 0.00 41.12 39.98 1bvz n ASP 465 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1bvz n PRO 466 N 3.18 1.50 0.15 -0.67 -0.05 -1.26 -4.93 135.00 132.91 1bvz n PRO 466 Ca 0.19 -1.07 0.13 0.00 -0.05 0.00 0.00 63.50 62.70 1bvz n PRO 466 Cb 0.21 -1.48 0.49 0.00 -0.05 0.00 0.00 33.50 32.67 1bvz n PRO 466 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 175.50 175.67 1bvz h ASP 467 N 2.62 0.00 -0.45 3.54 3.58 -1.10 0.94 116.42 125.54 1bvz h ASP 467 Ca 0.00 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.32 1bvz h ASP 467 Cb 0.68 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.71 1bvz h ASP 467 CO 0.00 0.00 -0.20 0.00 -2.88 0.00 0.00 179.24 176.16 1bvz n ARG 469 N -4.11 2.95 -3.59 0.00 1.74 0.32 -4.91 116.66 109.06 1bvz n ARG 469 Ca 0.00 -2.27 -0.34 0.00 -0.77 0.00 0.00 57.85 54.47 1bvz n ARG 469 Cb 0.45 -2.29 -0.05 0.00 -1.02 0.00 0.00 32.46 29.54 1bvz n ARG 469 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1bvz s ARG 470 N -0.54 3.73 0.67 5.56 3.52 -1.25 -4.80 118.95 125.83 1bvz s ARG 470 Ca 0.61 0.13 -0.17 0.00 -0.13 0.00 0.00 55.73 56.17 1bvz s ARG 470 Cb 0.30 -2.96 -0.02 0.00 -1.56 0.00 0.00 34.95 30.71 1bvz s ARG 470 CO -0.13 0.54 0.91 -0.35 -0.81 0.00 0.00 175.30 175.46 1bvz n PRO 471 N 0.72 0.65 -2.18 5.12 -0.04 -1.26 -4.91 135.00 133.10 1bvz n PRO 471 Ca -0.07 0.27 -0.42 0.00 -0.04 0.00 0.00 63.50 63.24 1bvz n PRO 471 Cb 0.52 -2.15 -0.03 0.00 -0.04 0.00 0.00 33.50 31.81 1bvz n PRO 471 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1bvz s MET 472 N -3.00 4.30 -0.86 0.54 1.75 -0.17 -4.90 119.30 116.96 1bvz s MET 472 Ca 0.74 2.05 -0.25 0.00 -1.25 0.00 0.00 55.69 56.98 1bvz s MET 472 Cb -0.38 -3.39 0.02 0.00 2.84 0.00 0.00 34.83 33.93 1bvz s MET 472 CO 0.49 -0.50 1.50 0.42 -0.65 0.00 0.00 175.02 176.28 1bvz s ILE 473 N 1.64 3.72 -2.35 10.11 1.01 -1.26 -4.80 121.20 129.28 1bvz s ILE 473 Ca 0.65 -0.18 0.29 0.00 0.00 0.00 0.00 60.65 61.41 1bvz s ILE 473 Cb -0.35 -4.75 0.63 0.00 0.01 0.00 0.00 42.46 38.01 1bvz s ILE 473 CO 0.29 -1.67 1.87 0.79 0.00 0.00 0.00 174.94 176.22 1bvz n TRP 474 N 10.16 0.00 -3.38 3.97 7.02 -1.26 -4.76 117.44 129.19 1bvz n TRP 474 Ca 0.22 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.29 1bvz n TRP 474 Cb 0.50 -0.01 -0.09 0.00 -2.42 0.00 0.00 31.31 29.29 1bvz n TRP 474 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 1bvz s GLU 475 N -2.02 3.75 0.30 -0.99 2.56 -1.26 -4.97 118.70 116.08 1bvz s GLU 475 Ca 0.40 -0.22 0.06 0.00 0.00 0.00 0.00 54.97 55.22 1bvz s GLU 475 Cb 0.21 -3.75 0.81 0.00 2.00 0.00 0.00 34.13 33.41 1bvz s GLU 475 CO 0.35 -0.44 1.68 0.93 -0.56 0.00 0.00 175.26 177.22 1bvz h GLU 476 N 8.36 0.36 -0.84 4.30 5.08 -1.93 0.12 114.58 130.03 1bvz h GLU 476 Ca -0.30 -0.02 0.14 0.00 -1.00 0.00 0.00 59.36 58.17 1bvz h GLU 476 Cb 1.15 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 30.26 1bvz h GLU 476 CO 0.68 0.24 0.55 -0.22 -1.00 0.00 0.00 179.01 179.26 1bvz h LYS 477 N 0.37 0.61 -0.34 2.33 3.64 -2.00 -2.75 116.57 118.44 1bvz h LYS 477 Ca 0.60 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.95 1bvz h LYS 477 Cb 1.21 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1bvz h LYS 477 CO -0.56 0.41 0.00 0.39 -2.27 0.00 0.00 179.45 177.42 1bvz n GLU 478 N -4.53 2.53 -3.39 1.90 1.02 0.34 -4.92 120.64 113.60 1bvz n GLU 478 Ca 0.16 -2.00 -0.38 0.00 -0.02 0.00 0.00 57.16 54.91 1bvz n GLU 478 Cb 0.46 -1.30 -0.06 0.00 -0.02 0.00 0.00 31.44 30.52 1bvz n GLU 478 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1bvz s GLN 479 N -1.01 4.09 -1.01 3.49 -0.21 -0.84 -4.95 119.66 119.22 1bvz s GLN 479 Ca 0.25 0.53 -0.23 0.00 0.02 0.00 0.00 55.36 55.92 1bvz s GLN 479 Cb 0.13 -3.27 -0.02 0.00 1.00 0.00 0.00 33.01 30.85 1bvz s GLN 479 CO 0.18 0.57 1.81 1.21 -2.12 0.00 0.00 175.29 176.94 1bvz s ASN 480 N -0.75 5.57 -0.00 5.90 3.84 -0.16 -4.77 114.94 124.57 1bvz s ASN 480 Ca 0.26 -1.17 0.02 0.00 0.21 0.00 0.00 52.86 52.18 1bvz s ASN 480 Cb -0.17 -2.57 0.06 0.00 -0.55 0.00 0.00 41.25 38.02 1bvz s ASN 480 CO 0.15 -2.40 0.97 0.54 -2.79 0.00 0.00 177.10 173.57 1bvz n ARG 481 N 8.73 1.17 0.04 0.43 1.74 -1.26 -2.50 116.66 125.01 1bvz n ARG 481 Ca 0.40 -0.23 -0.21 0.00 -0.77 0.00 0.00 57.85 57.04 1bvz n ARG 481 Cb 0.48 -1.14 -0.14 0.00 -1.02 0.00 0.00 32.46 30.64 1bvz n ARG 481 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1bvz h GLY 482 N 5.70 0.33 0.73 -0.13 0.00 -1.92 -3.13 103.07 104.66 1bvz h GLY 482 Ca 0.00 -0.85 -0.01 0.00 0.00 0.00 0.00 47.33 46.47 1bvz h GLY 482 CO 0.01 0.75 -0.08 1.41 0.00 0.00 0.00 176.54 178.62 1bvz h LEU 483 N -0.32 -0.19 -0.72 3.11 3.38 -1.75 -3.00 115.31 115.82 1bvz h LEU 483 Ca -0.22 -0.21 0.15 0.00 0.09 0.00 0.00 57.88 57.70 1bvz h LEU 483 Cb 1.72 0.05 -0.13 0.00 0.09 0.00 0.00 40.66 42.39 1bvz h LEU 483 CO 0.12 0.11 -0.09 0.15 0.09 0.00 0.00 178.44 178.82 1bvz h PHE 484 N -0.50 -0.21 0.00 1.13 3.57 -0.94 0.25 116.94 120.23 1bvz h PHE 484 Ca -0.02 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1bvz h PHE 484 Cb 0.39 0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.33 1bvz h PHE 484 CO 0.01 -0.27 0.00 0.93 -2.23 0.00 0.00 178.31 176.75 1bvz h GLU 485 N 0.05 0.00 0.08 1.11 4.39 -1.50 -1.19 114.58 117.52 1bvz h GLU 485 Ca 0.37 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.07 1bvz h GLU 485 Cb 0.61 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1bvz h GLU 485 CO -0.69 0.00 -0.04 0.35 -1.16 0.00 0.00 179.01 177.47 1bvz h PHE 486 N 0.00 -0.10 -0.55 4.33 3.57 -0.48 -2.88 116.94 120.83 1bvz h PHE 486 Ca 0.00 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.61 1bvz h PHE 486 Cb 0.43 0.03 -0.11 0.00 2.79 0.00 0.00 35.95 39.09 1bvz h PHE 486 CO 0.00 0.21 -0.23 1.88 -2.23 0.00 0.00 178.31 177.95 1bvz h TYR 487 N -0.99 -0.57 -0.08 0.41 -1.99 -0.33 -0.47 116.97 112.93 1bvz h TYR 487 Ca -0.01 0.06 -0.08 0.00 2.00 0.00 0.00 58.73 60.69 1bvz h TYR 487 Cb 0.35 0.34 -0.01 0.00 2.00 0.00 0.00 36.73 39.41 1bvz h TYR 487 CO 0.07 -0.32 -0.34 0.87 -0.00 0.00 0.00 178.16 178.45 1bvz h LYS 488 N -0.09 0.16 -0.14 4.88 1.57 -1.38 -0.39 116.57 121.18 1bvz h LYS 488 Ca 0.25 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.93 1bvz h LYS 488 Cb 0.49 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 1bvz h LYS 488 CO -0.62 0.48 -0.07 1.49 -0.57 0.00 0.00 179.45 180.16 1bvz h GLU 489 N 0.14 0.29 -0.92 3.15 4.81 -0.89 -1.68 114.58 119.49 1bvz h GLU 489 Ca 0.02 -0.13 0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1bvz h GLU 489 Cb 0.67 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.00 1bvz h GLU 489 CO 0.05 0.63 0.61 -0.07 -0.73 0.00 0.00 179.01 179.50 1bvz h LEU 490 N -0.05 1.05 -0.98 1.64 3.38 -0.86 -0.67 115.31 118.82 1bvz h LEU 490 Ca 0.03 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 1bvz h LEU 490 Cb 0.55 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1bvz h LEU 490 CO 0.02 0.75 -0.08 0.40 0.09 0.00 0.00 178.44 179.63 1bvz h ILE 491 N 1.23 1.24 -0.28 1.22 2.04 -0.93 0.95 117.51 122.97 1bvz h ILE 491 Ca 0.34 -1.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.12 1bvz h ILE 491 Cb -0.13 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1bvz h ILE 491 CO -0.08 0.35 0.04 0.03 0.00 0.00 0.00 178.15 178.49 1bvz h ARG 492 N 0.60 0.48 -0.48 2.37 3.08 -0.64 -1.97 114.38 117.82 1bvz h ARG 492 Ca 0.11 -0.13 0.02 0.00 0.07 0.00 0.00 59.98 60.05 1bvz h ARG 492 Cb 0.50 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1bvz h ARG 492 CO 0.03 0.60 0.29 -0.07 -1.07 0.00 0.00 179.97 179.74 1bvz h LEU 493 N 0.29 0.46 -1.78 3.04 3.38 -0.68 -1.20 115.31 118.82 1bvz h LEU 493 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1bvz h LEU 493 Cb 0.36 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1bvz h LEU 493 CO 0.01 0.33 0.14 -0.09 0.09 0.00 0.00 178.44 178.92 1bvz h ARG 494 N 0.57 0.29 0.00 1.13 2.43 -0.80 0.11 114.38 118.11 1bvz h ARG 494 Ca 0.19 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 1bvz h ARG 494 Cb 0.01 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1bvz h ARG 494 CO -0.08 0.19 -0.45 0.45 -1.51 0.00 0.00 179.97 178.57 1bvz h HIS 495 N 0.30 0.00 0.00 2.20 3.86 -0.45 -3.33 115.15 117.73 1bvz h HIS 495 Ca 0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1bvz h HIS 495 Cb -0.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.44 1bvz h HIS 495 CO 0.00 0.19 -1.50 2.89 0.86 0.00 0.00 177.93 180.37 1bvz n ARG 496 N -3.04 0.47 -3.50 2.45 1.85 -0.68 -4.81 116.66 109.40 1bvz n ARG 496 Ca 0.01 -0.08 -0.42 0.00 -1.00 0.00 0.00 57.85 56.36 1bvz n ARG 496 Cb 0.62 -1.58 -0.09 0.00 -1.05 0.00 0.00 32.46 30.36 1bvz n ARG 496 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1bvz s LEU 497 N -4.28 5.28 0.47 2.89 1.43 -0.04 -4.96 118.68 119.48 1bvz s LEU 497 Ca -0.02 -1.31 0.19 0.00 -1.03 0.00 0.00 54.13 51.96 1bvz s LEU 497 Cb 0.14 -2.09 1.19 0.00 0.03 0.00 0.00 46.19 45.46 1bvz s LEU 497 CO 0.86 -0.55 1.98 0.00 0.23 0.00 0.00 176.35 178.87 1bvz h ALA 498 N 8.57 2.22 -1.00 4.21 0.00 -1.87 -0.70 119.26 130.69 1bvz h ALA 498 Ca -0.26 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 54.85 1bvz h ALA 498 Cb 1.10 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.75 1bvz h ALA 498 CO 0.79 -0.37 0.60 0.77 0.00 0.00 0.00 179.25 181.04 1bvz h SER 499 N 0.23 0.74 1.04 0.00 0.02 -1.89 0.18 113.55 113.87 1bvz h SER 499 Ca 0.27 0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 61.33 1bvz h SER 499 Cb 0.75 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 1bvz h SER 499 CO -0.05 0.21 -0.02 -0.07 -1.14 0.00 0.00 176.83 175.76 1bvz h LEU 500 N 0.70 0.00 0.00 5.07 3.38 -1.41 -2.19 115.31 120.85 1bvz h LEU 500 Ca 0.60 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.49 1bvz h LEU 500 Cb 1.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1bvz h LEU 500 CO -0.42 0.02 -0.99 0.35 0.09 0.00 0.00 178.44 177.50 1bvz n THR 501 N -3.12 1.26 1.08 0.22 -2.24 -0.51 -4.75 114.28 106.21 1bvz n THR 501 Ca 0.01 0.11 0.12 0.00 -2.27 0.00 0.00 64.05 62.02 1bvz n THR 501 Cb 0.32 -1.95 0.16 0.00 -2.10 0.00 0.00 70.33 66.76 1bvz n THR 501 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1bvz n ARG 502 N -3.98 2.08 -1.85 -0.78 1.74 0.53 -4.89 116.66 109.51 1bvz n ARG 502 Ca -0.16 -1.65 -0.31 0.00 -0.77 0.00 0.00 57.85 54.96 1bvz n ARG 502 Cb 0.43 -1.47 0.01 0.00 -1.02 0.00 0.00 32.46 30.42 1bvz n ARG 502 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1bvz s GLY 503 N -2.06 1.66 0.04 -0.13 0.00 -0.82 -4.85 107.32 101.16 1bvz s GLY 503 Ca 0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 44.72 44.92 1bvz s GLY 503 CO 0.34 0.19 0.06 1.16 0.00 0.00 0.00 173.10 174.85 1bvz n ASN 504 N -2.78 0.02 -3.79 1.64 2.04 0.98 -4.76 115.26 108.61 1bvz n ASN 504 Ca 0.06 -1.03 -0.24 0.00 -0.44 0.00 0.00 54.58 52.93 1bvz n ASN 504 Cb 0.54 -0.04 -0.17 0.00 -2.53 0.00 0.00 39.78 37.57 1bvz n ASN 504 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 1bvz s VAL 505 N -0.85 0.50 -0.11 3.53 1.01 -1.26 -2.86 120.40 120.37 1bvz s VAL 505 Ca 0.03 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 61.99 1bvz s VAL 505 Cb -0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1bvz s VAL 505 CO 0.02 0.21 -0.16 -0.13 0.00 0.00 0.00 175.10 175.05 1bvz s ARG 506 N 1.91 3.13 0.82 2.72 1.81 -0.74 -4.97 118.95 123.64 1bvz s ARG 506 Ca 0.04 -0.73 -0.11 0.00 -1.72 0.00 0.00 55.73 53.21 1bvz s ARG 506 Cb -0.13 -2.50 0.09 0.00 -0.45 0.00 0.00 34.95 31.96 1bvz s ARG 506 CO -0.06 0.29 1.12 -1.12 -0.68 0.00 0.00 175.30 174.84 1bvz s SER 507 N 0.14 3.87 0.00 0.23 0.01 -1.26 -0.03 113.70 116.66 1bvz s SER 507 Ca -0.08 2.00 0.00 0.00 1.31 0.00 0.00 55.95 59.18 1bvz s SER 507 Cb -0.15 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.53 1bvz s SER 507 CO 0.05 -2.46 0.00 1.87 0.41 0.00 0.00 173.24 173.11 1bvz n TRP 508 N -3.75 0.00 -3.64 2.43 -0.00 0.20 -4.74 117.44 107.94 1bvz n TRP 508 Ca 0.10 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.54 1bvz n TRP 508 Cb 0.52 0.00 -0.07 0.00 -0.00 0.00 0.00 31.31 31.77 1bvz n TRP 508 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 177.69 176.11 1bvz s HIS 509 N -1.26 -1.08 -0.06 5.87 2.46 -0.77 -4.89 115.29 115.56 1bvz s HIS 509 Ca 0.00 2.14 0.00 0.00 0.47 0.00 0.00 55.06 57.67 1bvz s HIS 509 Cb 0.00 0.65 0.02 0.00 -0.13 0.00 0.00 32.58 33.12 1bvz s HIS 509 CO 0.00 -0.54 -0.03 0.00 -2.47 0.00 0.00 174.74 171.70 1bvz s ALA 510 N 1.74 0.79 -0.17 1.58 0.00 -1.26 -0.39 121.76 124.05 1bvz s ALA 510 Ca -0.10 -0.16 0.01 0.00 0.00 0.00 0.00 51.96 51.72 1bvz s ALA 510 Cb -0.06 -0.61 0.02 0.00 0.00 0.00 0.00 23.12 22.47 1bvz s ALA 510 CO -0.20 -0.22 -0.20 0.34 0.00 0.00 0.00 175.76 175.48 1bvz s ASP 511 N 1.40 3.09 0.13 0.00 -1.08 -0.78 -4.72 116.67 114.70 1bvz s ASP 511 Ca -0.03 -0.63 -0.19 0.00 -0.52 0.00 0.00 52.55 51.18 1bvz s ASP 511 Cb -0.13 -1.45 -0.03 0.00 -1.46 0.00 0.00 42.92 39.85 1bvz s ASP 511 CO -0.03 0.00 1.76 0.50 0.52 0.00 0.00 175.17 177.92 1bvz h LYS 512 N 7.90 0.20 0.00 4.34 3.64 -1.95 -2.16 116.57 128.56 1bvz h LYS 512 Ca -0.44 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 58.92 1bvz h LYS 512 Cb 1.14 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1bvz h LYS 512 CO 0.62 0.14 -0.00 0.37 -2.27 0.00 0.00 179.45 178.31 1bvz h GLN 513 N 0.21 -0.01 0.00 1.90 5.75 -1.97 -3.30 115.11 117.69 1bvz h GLN 513 Ca 0.10 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.58 1bvz h GLN 513 Cb 0.05 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.60 1bvz h GLN 513 CO -0.09 0.75 -0.10 0.00 -2.65 0.00 0.00 178.83 176.74 1bvz h ALA 514 N -0.22 1.41 -5.47 3.38 0.00 -2.01 -3.47 119.26 112.88 1bvz h ALA 514 Ca -0.00 -0.09 -0.41 0.00 0.00 0.00 0.00 54.91 54.40 1bvz h ALA 514 Cb 0.75 -0.02 0.08 0.00 0.00 0.00 0.00 17.79 18.61 1bvz h ALA 514 CO 0.00 0.13 -0.66 -1.71 0.00 0.00 0.00 179.25 177.01 1bvz n ASN 515 N -3.80 -5.98 -4.63 0.00 5.15 -0.81 -4.54 115.26 100.65 1bvz n ASN 515 Ca -0.02 -0.49 -0.33 0.00 -0.60 0.00 0.00 54.58 53.14 1bvz n ASN 515 Cb 0.20 -4.76 -0.10 0.00 -0.53 0.00 0.00 39.78 34.60 1bvz n ASN 515 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1bvz s LEU 516 N -7.08 3.31 0.02 1.20 0.20 -1.25 -1.65 118.68 113.43 1bvz s LEU 516 Ca 0.50 -0.06 0.03 0.00 0.69 0.00 0.00 54.13 55.30 1bvz s LEU 516 Cb -0.23 -1.86 -0.01 0.00 -0.43 0.00 0.00 46.19 43.65 1bvz s LEU 516 CO 0.62 0.30 -0.10 -0.47 -0.29 0.00 0.00 176.35 176.41 1bvz s TYR 517 N -0.99 0.92 -0.13 5.38 5.04 -0.40 -1.86 117.35 125.31 1bvz s TYR 517 Ca 0.17 -0.28 -0.11 0.00 -2.44 0.00 0.00 57.07 54.41 1bvz s TYR 517 Cb -0.11 -0.57 0.03 0.00 0.35 0.00 0.00 41.96 41.67 1bvz s TYR 517 CO 0.07 -0.01 0.33 0.00 -1.34 0.00 0.00 175.55 174.61 1bvz s ALA 518 N -0.63 -0.82 0.28 3.97 0.00 0.48 -0.53 121.76 124.51 1bvz s ALA 518 Ca 0.01 0.98 0.02 0.00 0.00 0.00 0.00 51.96 52.97 1bvz s ALA 518 Cb -0.06 -0.58 -0.05 0.00 0.00 0.00 0.00 23.12 22.43 1bvz s ALA 518 CO 0.00 -0.17 0.10 -0.59 0.00 0.00 0.00 175.76 175.10 1bvz s PHE 519 N 0.31 1.65 0.06 0.00 -0.71 -0.96 0.60 117.98 118.94 1bvz s PHE 519 Ca -0.01 -1.16 0.09 0.00 -1.04 0.00 0.00 56.93 54.81 1bvz s PHE 519 Cb -0.03 -0.99 -0.03 0.00 -1.21 0.00 0.00 43.02 40.76 1bvz s PHE 519 CO -0.01 -0.28 -0.25 0.08 -1.34 0.00 0.00 175.22 173.41 1bvz s VAL 520 N -3.62 2.07 -0.16 -2.49 1.01 0.96 -1.11 120.40 117.07 1bvz s VAL 520 Ca 0.37 -1.43 -0.01 0.00 0.00 0.00 0.00 61.98 60.90 1bvz s VAL 520 Cb 0.07 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 1bvz s VAL 520 CO 0.15 0.28 -0.10 -0.13 0.00 0.00 0.00 175.10 175.29 1bvz s ARG 521 N -1.40 3.38 0.01 2.72 1.81 0.23 -1.79 118.95 123.93 1bvz s ARG 521 Ca 0.11 -0.66 0.05 0.00 -1.72 0.00 0.00 55.73 53.51 1bvz s ARG 521 Cb -0.10 -2.75 -0.02 0.00 -0.45 0.00 0.00 34.95 31.63 1bvz s ARG 521 CO 0.03 0.08 -0.16 0.99 -0.68 0.00 0.00 175.30 175.56 1bvz s THR 522 N 0.70 1.24 0.25 0.02 2.01 -1.13 -1.78 115.64 116.95 1bvz s THR 522 Ca -0.05 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.12 1bvz s THR 522 Cb -0.15 -1.07 -0.05 0.00 0.01 0.00 0.00 72.50 71.24 1bvz s THR 522 CO 0.02 0.21 0.12 0.54 -0.69 0.00 0.00 174.62 174.82 1bvz s VAL 523 N -0.58 0.34 0.05 3.82 0.11 -1.12 -0.02 120.40 123.01 1bvz s VAL 523 Ca 0.05 -2.00 -0.28 0.00 -2.93 0.00 0.00 61.98 56.82 1bvz s VAL 523 Cb -0.07 -2.57 -0.17 0.00 -1.53 0.00 0.00 36.38 32.03 1bvz s VAL 523 CO 0.00 0.00 1.51 1.56 -3.33 0.00 0.00 175.10 174.84 1bvz h GLN 524 N 2.42 -0.50 -0.75 1.54 4.20 -1.99 0.25 115.11 120.27 1bvz h GLN 524 Ca -0.37 0.03 -0.54 0.00 0.06 0.00 0.00 58.65 57.84 1bvz h GLN 524 Cb 1.25 0.11 -0.38 0.00 0.30 0.00 0.00 27.48 28.77 1bvz h GLN 524 CO 0.57 -0.27 -0.47 -0.25 -0.67 0.00 0.00 178.83 177.74 1bvz n ASP 525 N -5.26 5.23 -4.13 1.46 8.00 -1.26 -4.91 116.55 115.68 1bvz n ASP 525 Ca -0.11 -3.76 -0.32 0.00 0.71 0.00 0.00 54.79 51.31 1bvz n ASP 525 Cb 0.26 -0.47 -0.16 0.00 -0.02 0.00 0.00 41.12 40.72 1bvz n ASP 525 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1bvz s GLN 526 N -3.62 2.79 -0.10 -1.24 0.74 0.87 -4.59 119.66 114.51 1bvz s GLN 526 Ca 0.53 -0.77 0.04 0.00 0.05 0.00 0.00 55.36 55.21 1bvz s GLN 526 Cb 0.43 -2.32 -0.00 0.00 1.10 0.00 0.00 33.01 32.21 1bvz s GLN 526 CO 0.03 -0.08 -0.24 -1.01 -0.55 0.00 0.00 175.29 173.44 1bvz s HIS 527 N 1.00 2.56 -0.14 1.67 3.76 -1.26 -2.81 115.29 120.07 1bvz s HIS 527 Ca -0.04 -1.04 0.03 0.00 -0.15 0.00 0.00 55.06 53.86 1bvz s HIS 527 Cb -0.15 -1.71 0.01 0.00 1.11 0.00 0.00 32.58 31.84 1bvz s HIS 527 CO -0.05 -0.41 -0.22 0.14 -0.85 0.00 0.00 174.74 173.35 1bvz s VAL 528 N 0.33 2.08 -0.07 -0.90 -7.23 -0.74 -1.47 120.40 112.40 1bvz s VAL 528 Ca -0.19 -0.97 -0.02 0.00 -1.81 0.00 0.00 61.98 58.99 1bvz s VAL 528 Cb -0.18 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.90 1bvz s VAL 528 CO 0.09 0.55 0.03 -0.83 -0.31 0.00 0.00 175.10 174.62 1bvz s GLY 529 N 0.79 1.91 -0.26 2.32 0.00 0.41 -0.60 107.32 111.89 1bvz s GLY 529 Ca -0.08 -0.81 0.02 0.00 0.00 0.00 0.00 44.72 43.85 1bvz s GLY 529 CO -0.01 -0.60 -0.07 0.14 0.00 0.00 0.00 173.10 172.56 1bvz s VAL 530 N -0.96 1.90 -0.26 1.40 1.01 -0.26 -0.91 120.40 122.32 1bvz s VAL 530 Ca 0.15 -1.54 -0.08 0.00 0.00 0.00 0.00 61.98 60.51 1bvz s VAL 530 Cb -0.11 -2.12 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 1bvz s VAL 530 CO 0.05 -0.13 0.10 -0.69 0.00 0.00 0.00 175.10 174.43 1bvz s VAL 531 N 1.21 4.53 -0.21 2.92 1.01 -1.05 -2.26 120.40 126.55 1bvz s VAL 531 Ca -0.05 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1bvz s VAL 531 Cb -0.19 -3.13 0.04 0.00 0.00 0.00 0.00 36.38 33.10 1bvz s VAL 531 CO -0.06 0.32 -0.11 -0.76 0.00 0.00 0.00 175.10 174.48 1bvz s LEU 532 N 1.63 2.53 -1.08 3.92 1.43 0.31 -0.70 118.68 126.72 1bvz s LEU 532 Ca 0.06 -0.98 -0.16 0.00 -1.03 0.00 0.00 54.13 52.02 1bvz s LEU 532 Cb -0.15 -1.33 0.15 0.00 0.03 0.00 0.00 46.19 44.88 1bvz s LEU 532 CO 0.05 -0.14 1.30 0.21 0.23 0.00 0.00 176.35 178.00 1bvz s ASN 533 N 1.32 6.85 -0.10 2.29 2.47 -0.51 -1.27 114.94 125.99 1bvz s ASN 533 Ca -0.02 -2.50 -0.03 0.00 0.42 0.00 0.00 52.86 50.73 1bvz s ASN 533 Cb -0.17 -2.41 -0.06 0.00 -1.45 0.00 0.00 41.25 37.16 1bvz s ASN 533 CO -0.08 -0.93 2.70 -3.20 -3.72 0.00 0.00 177.10 171.87 1bvz n ASN 534 N 6.24 5.61 -4.27 -4.21 5.15 -0.66 -2.69 115.26 120.43 1bvz n ASN 534 Ca 0.31 -2.63 -0.25 0.00 -0.60 0.00 0.00 54.58 51.41 1bvz n ASN 534 Cb 0.46 -1.24 -0.14 0.00 -0.53 0.00 0.00 39.78 38.33 1bvz n ASN 534 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1bvz s ARG 535 N -0.10 1.33 0.62 1.20 6.06 -1.25 -4.87 118.95 121.93 1bvz s ARG 535 Ca 0.36 -1.02 0.28 0.00 -2.50 0.00 0.00 55.73 52.86 1bvz s ARG 535 Cb 0.20 -1.50 1.50 0.00 0.06 0.00 0.00 34.95 35.20 1bvz s ARG 535 CO -0.03 0.37 1.88 0.78 -2.50 0.00 0.00 175.30 175.81 1bvz h GLY 536 N 4.63 0.00 -0.24 8.12 0.00 -1.94 -2.83 103.07 110.81 1bvz h GLY 536 Ca -0.44 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.21 1bvz h GLY 536 CO 0.43 0.00 -0.51 -1.83 0.00 0.00 0.00 176.54 174.63 1bvz s GLU 537 N -4.43 2.22 -0.43 4.80 4.04 -1.26 -4.69 118.70 118.95 1bvz s GLU 537 Ca -0.04 -2.43 -0.11 0.00 0.04 0.00 0.00 54.97 52.43 1bvz s GLU 537 Cb 0.13 -1.53 0.07 0.00 0.02 0.00 0.00 34.13 32.82 1bvz s GLU 537 CO 0.44 -0.39 0.30 0.21 -1.84 0.00 0.00 175.26 173.98 1bvz s LYS 538 N -3.90 2.73 0.06 -4.83 2.36 -1.26 -4.12 119.74 110.78 1bvz s LYS 538 Ca 0.03 -1.40 0.05 0.00 -2.55 0.00 0.00 55.97 52.10 1bvz s LYS 538 Cb 0.01 -3.89 -0.04 0.00 -1.05 0.00 0.00 37.83 32.86 1bvz s LYS 538 CO 0.02 -0.96 -0.05 -0.65 1.55 0.00 0.00 175.35 175.26 1bvz s GLN 539 N 1.50 2.46 0.26 4.03 -0.21 -0.92 -4.90 119.66 121.88 1bvz s GLN 539 Ca 0.03 -0.83 -0.06 0.00 0.02 0.00 0.00 55.36 54.53 1bvz s GLN 539 Cb -0.23 -2.48 -0.06 0.00 1.00 0.00 0.00 33.01 31.24 1bvz s GLN 539 CO 0.04 0.56 0.53 0.99 -2.12 0.00 0.00 175.29 175.29 1bvz s THR 540 N -1.16 5.02 0.00 -0.19 2.01 -1.26 -0.40 115.64 119.66 1bvz s THR 540 Ca 0.21 0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.37 1bvz s THR 540 Cb -0.11 -3.69 -0.01 0.00 0.01 0.00 0.00 72.50 68.70 1bvz s THR 540 CO 0.13 -0.22 -0.03 0.54 -0.69 0.00 0.00 174.62 174.34 1bvz s VAL 541 N -1.98 0.24 -0.12 3.82 0.11 -1.01 -4.97 120.40 116.49 1bvz s VAL 541 Ca 0.44 -0.25 -0.10 0.00 -2.93 0.00 0.00 61.98 59.14 1bvz s VAL 541 Cb -0.11 -0.23 -0.05 0.00 -1.53 0.00 0.00 36.38 34.47 1bvz s VAL 541 CO 0.27 -0.02 0.20 -0.76 -3.33 0.00 0.00 175.10 171.47 1bvz s LEU 542 N -0.29 4.36 0.08 2.54 1.43 -1.26 -2.50 118.68 123.04 1bvz s LEU 542 Ca -0.01 0.52 0.02 0.00 -1.03 0.00 0.00 54.13 53.63 1bvz s LEU 542 Cb -0.02 -2.20 -0.03 0.00 0.03 0.00 0.00 46.19 43.96 1bvz s LEU 542 CO -0.00 0.32 -0.08 -0.76 0.23 0.00 0.00 176.35 176.06 1bvz s LEU 543 N -0.62 2.40 -0.22 1.79 1.43 -1.14 -4.96 118.68 117.36 1bvz s LEU 543 Ca 0.15 -0.81 -0.06 0.00 -1.03 0.00 0.00 54.13 52.38 1bvz s LEU 543 Cb -0.13 -0.14 -0.02 0.00 0.03 0.00 0.00 46.19 45.93 1bvz s LEU 543 CO 0.05 -0.34 0.02 -1.10 0.23 0.00 0.00 176.35 175.20 1bvz s GLN 544 N -2.87 3.60 0.42 1.70 1.11 -1.26 -0.17 119.66 122.18 1bvz s GLN 544 Ca 0.03 -0.52 -0.26 0.00 0.01 0.00 0.00 55.36 54.62 1bvz s GLN 544 Cb -0.01 -3.16 -0.09 0.00 -1.01 0.00 0.00 33.01 28.74 1bvz s GLN 544 CO -0.02 -0.09 1.32 0.14 0.01 0.00 0.00 175.29 176.65 1bvz s VAL 545 N 1.30 2.52 0.81 1.09 -7.23 -1.24 -4.97 120.40 112.68 1bvz s VAL 545 Ca 0.04 0.47 -0.13 0.00 -1.81 0.00 0.00 61.98 60.55 1bvz s VAL 545 Cb -0.15 -3.27 0.08 0.00 0.56 0.00 0.00 36.38 33.60 1bvz s VAL 545 CO 0.01 0.07 1.17 -2.84 -0.31 0.00 0.00 175.10 173.21 1bvz s PRO 546 N -2.29 1.71 0.08 4.82 0.02 -1.26 -4.94 135.00 133.13 1bvz s PRO 546 Ca 0.58 1.63 -0.30 0.00 0.02 0.00 0.00 61.00 62.93 1bvz s PRO 546 Cb -0.39 -1.80 -0.16 0.00 0.02 0.00 0.00 34.50 32.17 1bvz s PRO 546 CO 0.50 -2.13 1.66 1.05 -0.33 0.00 0.00 177.00 177.74 1bvz h GLU 547 N -0.98 -0.59 0.00 5.54 4.11 -1.97 -1.86 114.58 118.82 1bvz h GLU 547 Ca -0.45 0.04 0.00 0.00 0.07 0.00 0.00 59.36 59.02 1bvz h GLU 547 Cb 1.28 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.66 1bvz h GLU 547 CO 0.47 -0.40 0.00 -1.13 0.07 0.00 0.00 179.01 178.02 1bvz n SER 548 N -5.37 0.46 0.00 3.06 3.41 -1.26 -4.91 113.62 109.02 1bvz n SER 548 Ca -0.11 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.12 1bvz n SER 548 Cb 0.27 -0.72 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 1bvz n SER 548 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bvz n GLY 549 N -0.15 4.61 0.00 5.00 0.00 -0.70 -4.98 105.19 108.97 1bvz n GLY 549 Ca 0.02 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1bvz n GLY 549 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bvz n GLY 550 N -1.94 1.83 0.00 -0.02 0.00 -1.24 -4.77 105.19 99.05 1bvz n GLY 550 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1bvz n GLY 550 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1bvz n LYS 551 N -0.36 0.00 -3.68 1.61 3.00 -1.26 -4.87 118.16 112.60 1bvz n LYS 551 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 1bvz n LYS 551 Cb 0.00 -0.08 -0.09 0.00 0.00 0.00 0.00 35.03 34.86 1bvz n LYS 551 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1bvz s THR 552 N -1.00 -0.00 -0.01 3.15 2.01 -1.26 -2.54 115.64 115.99 1bvz s THR 552 Ca 0.00 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.01 1bvz s THR 552 Cb 0.00 -0.78 0.01 0.00 0.01 0.00 0.00 72.50 71.74 1bvz s THR 552 CO 0.00 0.00 -0.00 0.26 -0.69 0.00 0.00 174.62 174.19 1bvz s TRP 553 N 0.53 0.13 -0.09 4.92 0.52 -1.20 -4.74 118.94 119.01 1bvz s TRP 553 Ca -0.02 0.01 -0.16 0.00 0.02 0.00 0.00 56.10 55.95 1bvz s TRP 553 Cb -0.04 -0.15 -0.05 0.00 -1.15 0.00 0.00 33.47 32.08 1bvz s TRP 553 CO -0.02 -0.04 0.41 -1.17 0.02 0.00 0.00 176.95 176.15 1bvz s LEU 554 N 0.32 4.34 0.01 2.99 2.96 0.02 -1.50 118.68 127.81 1bvz s LEU 554 Ca -0.03 0.79 -0.29 0.00 -0.22 0.00 0.00 54.13 54.38 1bvz s LEU 554 Cb -0.05 -2.58 -0.04 0.00 0.50 0.00 0.00 46.19 44.03 1bvz s LEU 554 CO -0.01 0.14 0.94 -0.62 -1.32 0.00 0.00 176.35 175.48 1bvz s ASP 555 N 0.01 7.35 0.00 3.68 2.15 -1.23 -0.64 116.67 127.98 1bvz s ASP 555 Ca 0.23 1.63 0.27 0.00 0.43 0.00 0.00 52.55 55.10 1bvz s ASP 555 Cb -0.15 -2.55 0.85 0.00 -0.30 0.00 0.00 42.92 40.77 1bvz s ASP 555 CO 0.10 -0.20 1.65 0.00 -0.17 0.00 0.00 175.17 176.54 1bvz n LEU 557 N -1.37 1.74 -0.06 0.00 4.77 -1.26 -4.96 117.00 115.85 1bvz n LEU 557 Ca 0.08 0.59 -0.21 0.00 -0.03 0.00 0.00 56.01 56.44 1bvz n LEU 557 Cb 0.33 -0.84 -0.12 0.00 -2.33 0.00 0.00 43.42 40.45 1bvz n LEU 557 CO 0.30 -0.46 -0.46 0.00 -1.33 0.00 0.00 177.39 175.45 1bvz h THR 558 N -0.95 0.98 0.00 -5.08 1.03 -1.96 -3.52 112.91 103.41 1bvz h THR 558 Ca 0.00 -2.26 0.00 0.00 -0.01 0.00 0.00 66.41 64.14 1bvz h THR 558 Cb 0.53 2.47 0.00 0.00 -1.07 0.00 0.00 68.15 70.07 1bvz h THR 558 CO 0.00 0.50 0.00 0.61 -0.01 0.00 0.00 175.52 176.62 1bvz n GLY 559 N 1.59 3.98 3.65 2.99 0.00 -0.72 -4.97 105.19 111.71 1bvz n GLY 559 Ca -0.29 -1.49 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1bvz n GLY 559 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1bvz s GLU 560 N -2.67 4.05 -1.08 1.61 2.12 -1.26 -3.54 118.70 117.93 1bvz s GLU 560 Ca 0.00 1.65 -0.07 0.00 0.36 0.00 0.00 54.97 56.90 1bvz s GLU 560 Cb 0.00 -3.89 0.27 0.00 0.26 0.00 0.00 34.13 30.78 1bvz s GLU 560 CO 0.00 -0.96 1.11 0.39 -0.54 0.00 0.00 175.26 175.26 1bvz n GLU 561 N 7.10 3.51 -0.22 4.30 4.71 -0.57 -4.87 120.64 134.61 1bvz n GLU 561 Ca 0.16 -4.48 0.00 0.00 -0.01 0.00 0.00 57.16 52.83 1bvz n GLU 561 Cb 0.45 -2.52 0.00 0.00 -1.01 0.00 0.00 31.44 28.36 1bvz n GLU 561 CO 0.00 0.00 0.00 1.55 0.09 0.00 0.00 177.13 178.77 1bvz n VAL 562 N 2.43 0.99 -1.75 2.62 3.14 -1.26 -3.21 118.33 121.29 1bvz n VAL 562 Ca 0.24 -0.22 -0.33 0.00 -2.96 0.00 0.00 64.34 61.08 1bvz n VAL 562 Cb 0.38 -1.17 0.05 0.00 -1.06 0.00 0.00 33.84 32.04 1bvz n VAL 562 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 1bvz n HIS 563 N 1.50 3.09 -3.15 1.45 8.25 -1.26 -4.82 115.22 120.28 1bvz n HIS 563 Ca 0.00 -2.70 -0.45 0.00 -0.26 0.00 0.00 57.72 54.31 1bvz n HIS 563 Cb 0.28 -0.98 -0.01 0.00 1.12 0.00 0.00 29.99 30.40 1bvz n HIS 563 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1bvz s GLY 564 N -2.28 2.62 -0.25 -1.41 0.00 -1.05 -3.33 107.32 101.61 1bvz s GLY 564 Ca 0.57 -3.38 -0.02 0.00 0.00 0.00 0.00 44.72 41.89 1bvz s GLY 564 CO -0.11 1.64 -0.04 1.25 0.00 0.00 0.00 173.10 175.83 1bvz s LYS 565 N 0.61 2.84 -1.40 2.90 2.20 -0.93 -4.65 119.74 121.31 1bvz s LYS 565 Ca 0.31 -0.98 -0.08 0.00 -0.36 0.00 0.00 55.97 54.87 1bvz s LYS 565 Cb -0.07 -3.03 0.04 0.00 -1.51 0.00 0.00 37.83 33.25 1bvz s LYS 565 CO -0.06 -0.41 0.97 1.04 -0.36 0.00 0.00 175.35 176.52 1bvz n GLN 566 N 4.69 -6.12 -2.80 4.03 6.02 -1.26 -2.28 117.38 119.66 1bvz n GLN 566 Ca -0.16 0.69 -0.11 0.00 -0.01 0.00 0.00 57.00 57.41 1bvz n GLN 566 Cb 0.47 -5.56 0.03 0.00 1.02 0.00 0.00 30.24 26.20 1bvz n GLN 566 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1bvz n GLY 567 N -1.68 0.14 3.29 1.08 0.00 -1.26 -5.05 105.19 101.71 1bvz n GLY 567 Ca -0.09 -0.28 -0.16 0.00 0.00 0.00 0.00 46.02 45.49 1bvz n GLY 567 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bvz s GLN 568 N -5.33 1.23 -0.18 1.61 -1.52 -0.96 -3.62 119.66 110.89 1bvz s GLN 568 Ca 0.21 -1.60 -0.03 0.00 -1.95 0.00 0.00 55.36 51.98 1bvz s GLN 568 Cb -0.09 -0.50 0.06 0.00 -0.22 0.00 0.00 33.01 32.26 1bvz s GLN 568 CO 0.26 -0.09 0.05 -1.17 -0.25 0.00 0.00 175.29 174.09 1bvz s LEU 569 N -3.24 0.82 -0.07 2.90 2.96 0.76 -2.19 118.68 120.62 1bvz s LEU 569 Ca 0.26 -0.68 -0.21 0.00 -0.22 0.00 0.00 54.13 53.27 1bvz s LEU 569 Cb 0.05 -0.45 -0.04 0.00 0.50 0.00 0.00 46.19 46.25 1bvz s LEU 569 CO 0.06 -0.31 0.61 -0.75 -1.32 0.00 0.00 176.35 174.64 1bvz s LYS 570 N 1.97 4.39 0.11 1.98 2.20 -1.21 -2.89 119.74 126.28 1bvz s LYS 570 Ca 0.01 0.73 0.04 0.00 -0.36 0.00 0.00 55.97 56.38 1bvz s LYS 570 Cb -0.16 -3.42 -0.04 0.00 -1.51 0.00 0.00 37.83 32.70 1bvz s LYS 570 CO -0.08 0.16 -0.10 -0.51 -0.36 0.00 0.00 175.35 174.46 1bvz s LEU 571 N 0.53 2.45 -0.09 5.43 1.43 -1.04 -4.79 118.68 122.59 1bvz s LEU 571 Ca 0.33 -0.88 -0.00 0.00 -1.03 0.00 0.00 54.13 52.55 1bvz s LEU 571 Cb -0.17 -0.29 0.02 0.00 0.03 0.00 0.00 46.19 45.78 1bvz s LEU 571 CO 0.16 -0.30 -0.07 -0.89 0.23 0.00 0.00 176.35 175.48 1bvz s THR 572 N -2.78 0.89 -0.17 5.49 2.01 -1.26 -2.41 115.64 117.40 1bvz s THR 572 Ca 0.09 -0.23 -0.01 0.00 0.31 0.00 0.00 61.69 61.84 1bvz s THR 572 Cb -0.01 -0.92 -0.01 0.00 0.01 0.00 0.00 72.50 71.58 1bvz s THR 572 CO -0.00 0.34 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.39 1bvz s LEU 573 N 1.52 2.65 1.06 4.42 1.02 0.46 -4.99 118.68 124.83 1bvz s LEU 573 Ca 0.01 -0.42 -0.12 0.00 0.02 0.00 0.00 54.13 53.62 1bvz s LEU 573 Cb -0.13 -1.63 0.23 0.00 0.02 0.00 0.00 46.19 44.68 1bvz s LEU 573 CO -0.05 0.06 1.07 -0.13 0.02 0.00 0.00 176.35 177.32 1bvz s ARG 574 N 0.97 -0.14 0.16 1.70 0.52 -1.26 -2.16 118.95 118.74 1bvz s ARG 574 Ca -0.02 1.10 -0.33 0.00 -0.52 0.00 0.00 55.73 55.96 1bvz s ARG 574 Cb -0.15 -1.63 -0.13 0.00 0.52 0.00 0.00 34.95 33.56 1bvz s ARG 574 CO -0.01 -3.28 1.62 -2.30 0.02 0.00 0.00 175.30 171.35 1bvz n PRO 575 N -4.63 2.30 -2.61 3.54 -0.02 -1.26 -1.15 135.00 131.17 1bvz n PRO 575 Ca 0.06 0.83 -0.15 0.00 -2.02 0.00 0.00 63.50 62.22 1bvz n PRO 575 Cb 0.53 -2.62 -0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1bvz n PRO 575 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1bvz n TYR 576 N 3.67 -1.47 -3.37 6.00 4.01 -1.07 -4.95 117.16 119.98 1bvz n TYR 576 Ca 0.17 0.10 -0.38 0.00 -0.16 0.00 0.00 57.90 57.63 1bvz n TYR 576 Cb 0.30 -2.99 -0.06 0.00 -0.31 0.00 0.00 39.34 36.28 1bvz n TYR 576 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1bvz s GLN 577 N -5.22 4.17 -0.04 -0.72 0.74 -0.30 -4.77 119.66 113.52 1bvz s GLN 577 Ca 0.08 0.49 0.01 0.00 0.05 0.00 0.00 55.36 55.99 1bvz s GLN 577 Cb -0.04 -3.32 -0.03 0.00 1.10 0.00 0.00 33.01 30.71 1bvz s GLN 577 CO 0.10 0.44 -0.03 0.20 -0.55 0.00 0.00 175.29 175.44 1bvz s GLY 578 N -0.30 1.79 0.27 2.59 0.00 -1.26 -1.42 107.32 108.99 1bvz s GLY 578 Ca 0.26 -0.91 0.10 0.00 0.00 0.00 0.00 44.72 44.16 1bvz s GLY 578 CO 0.13 -0.73 -0.04 1.06 0.00 0.00 0.00 173.10 173.52 1bvz s MET 579 N -1.15 2.18 -0.45 2.90 1.00 0.12 -4.98 119.30 118.92 1bvz s MET 579 Ca 0.15 -1.50 0.03 0.00 0.00 0.00 0.00 55.69 54.38 1bvz s MET 579 Cb -0.11 -2.08 0.15 0.00 0.00 0.00 0.00 34.83 32.79 1bvz s MET 579 CO 0.05 0.34 0.31 0.42 0.00 0.00 0.00 175.02 176.15 1bvz s ILE 580 N -2.37 1.02 -0.24 2.53 1.01 -1.26 -2.52 121.20 119.37 1bvz s ILE 580 Ca 0.31 -2.70 -0.20 0.00 0.00 0.00 0.00 60.65 58.07 1bvz s ILE 580 Cb -0.06 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.69 1bvz s ILE 580 CO 0.19 -1.05 0.61 -0.76 0.00 0.00 0.00 174.94 173.93 1bvz s LEU 581 N 0.10 4.08 -0.08 2.97 1.43 -0.08 -0.79 118.68 126.31 1bvz s LEU 581 Ca 0.24 0.71 0.01 0.00 -1.03 0.00 0.00 54.13 54.06 1bvz s LEU 581 Cb -0.11 -2.83 -0.03 0.00 0.03 0.00 0.00 46.19 43.25 1bvz s LEU 581 CO -0.09 -0.33 -0.09 0.86 0.23 0.00 0.00 176.35 176.93 1bvz s TRP 582 N 2.31 2.87 -0.47 0.29 -0.00 0.18 -0.44 118.94 123.68 1bvz s TRP 582 Ca 0.26 -0.17 0.26 0.00 -0.00 0.00 0.00 56.10 56.45 1bvz s TRP 582 Cb -0.16 -1.75 0.95 0.00 -0.00 0.00 0.00 33.47 32.52 1bvz s TRP 582 CO 0.09 0.16 1.76 -2.95 -0.00 0.00 0.00 176.95 176.01 1bvz h ASN 583 N 5.69 0.00 0.00 5.86 -1.07 -1.55 0.09 115.58 124.60 1bvz h ASN 583 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.95 1bvz h ASN 583 Cb 1.18 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.43 1bvz h ASN 583 CO 0.54 0.00 0.00 0.61 0.07 0.00 0.00 177.43 178.65 1bvz n GLY 584 N 0.42 0.77 0.36 9.14 0.00 -1.26 -4.79 105.19 109.83 1bvz n GLY 584 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.09 1bvz n GLY 584 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86