#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m83 s MET 1 N 0.00 4.25 0.46 -1.40 -2.45 -1.26 -5.08 119.30 113.82 3m83 s MET 1 Ca 0.00 0.09 -0.23 0.00 -1.25 0.00 0.00 55.69 54.30 3m83 s MET 1 Cb 0.00 -3.44 -0.07 0.00 1.25 0.00 0.00 34.83 32.57 3m83 s MET 1 CO 0.00 0.20 1.22 0.00 1.05 0.00 0.00 175.02 177.49 3m83 s ALA 2 N 0.58 3.01 0.30 4.11 0.00 -1.26 -4.96 121.76 123.54 3m83 s ALA 2 Ca 0.16 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.88 3m83 s ALA 2 Cb -0.13 -3.43 -0.12 0.00 0.00 0.00 0.00 23.12 19.44 3m83 s ALA 2 CO 0.04 -0.79 1.41 0.34 0.00 0.00 0.00 175.76 176.76 3m83 n PHE 3 N -0.43 2.42 -3.66 0.00 7.35 -1.26 -5.02 117.46 116.86 3m83 n PHE 3 Ca 0.07 0.44 -0.14 0.00 -0.76 0.00 0.00 57.45 57.06 3m83 n PHE 3 Cb 0.47 -2.48 -0.08 0.00 0.35 0.00 0.00 39.48 37.74 3m83 n PHE 3 CO 0.00 0.00 0.00 -0.59 -0.76 0.00 0.00 176.76 175.41 3m83 s PHE 4 N -0.52 -0.57 0.00 -5.13 -0.71 -1.26 -4.95 117.98 104.84 3m83 s PHE 4 Ca 0.61 1.29 0.00 0.00 -1.04 0.00 0.00 56.93 57.79 3m83 s PHE 4 Cb -0.57 0.23 0.00 0.00 -1.21 0.00 0.00 43.02 41.47 3m83 s PHE 4 CO 0.55 -0.36 0.00 -3.47 -1.34 0.00 0.00 175.22 170.60 3m83 n ASP 5 N 2.27 1.44 -4.68 1.98 -0.08 -1.26 -5.09 116.55 111.13 3m83 n ASP 5 Ca -0.15 -0.49 -0.40 0.00 -1.51 0.00 0.00 54.79 52.24 3m83 n ASP 5 Cb 0.56 0.00 0.03 0.00 2.34 0.00 0.00 41.12 44.05 3m83 n ASP 5 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 3m83 n LEU 6 N 0.00 4.11 -4.59 -2.67 4.77 -1.26 -4.95 117.00 112.41 3m83 n LEU 6 Ca 0.00 0.99 -0.37 0.00 -0.03 0.00 0.00 56.01 56.59 3m83 n LEU 6 Cb 0.00 -1.47 0.06 0.00 -2.33 0.00 0.00 43.42 39.68 3m83 n LEU 6 CO 0.00 -1.07 0.45 -2.65 -1.33 0.00 0.00 177.39 172.79 3m83 n PRO 7 N -0.48 0.76 -0.32 3.23 -0.02 -1.26 -4.65 135.00 132.27 3m83 n PRO 7 Ca 0.10 0.30 0.07 0.00 -2.02 0.00 0.00 63.50 61.96 3m83 n PRO 7 Cb 0.43 -2.09 0.28 0.00 -0.02 0.00 0.00 33.50 32.09 3m83 n PRO 7 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3m83 h LEU 8 N 0.31 0.85 -1.04 2.45 5.85 -1.99 -0.41 115.31 121.33 3m83 h LEU 8 Ca -0.48 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.27 3m83 h LEU 8 Cb 1.37 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 3m83 h LEU 8 CO 0.49 0.48 0.57 -0.33 -0.34 0.00 0.00 178.44 179.31 3m83 h GLU 9 N 0.92 1.22 -0.21 1.25 3.07 -2.00 -1.31 114.58 117.52 3m83 h GLU 9 Ca 0.45 -0.10 -0.19 0.00 -0.50 0.00 0.00 59.36 59.02 3m83 h GLU 9 Cb 0.46 -0.26 0.01 0.00 -0.84 0.00 0.00 28.75 28.11 3m83 h GLU 9 CO -0.21 0.83 -0.61 0.93 -1.40 0.00 0.00 179.01 178.55 3m83 h GLU 10 N 1.24 0.78 -0.72 2.33 5.08 -1.55 -3.24 114.58 118.49 3m83 h GLU 10 Ca 0.33 -0.56 0.12 0.00 -1.00 0.00 0.00 59.36 58.24 3m83 h GLU 10 Cb -0.09 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.17 3m83 h GLU 10 CO -0.06 1.18 0.31 -0.07 -1.00 0.00 0.00 179.01 179.37 3m83 h LEU 11 N 0.52 0.34 -2.36 1.33 3.38 -0.79 -1.24 115.31 116.49 3m83 h LEU 11 Ca -0.02 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3m83 h LEU 11 Cb 1.24 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 3m83 h LEU 11 CO 0.13 0.16 -0.01 0.11 0.09 0.00 0.00 178.44 178.93 3m83 h LYS 12 N 0.50 0.00 -0.04 1.13 1.57 -1.27 -2.30 116.57 116.16 3m83 h LYS 12 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 3m83 h LYS 12 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3m83 h LYS 12 CO -0.34 0.01 0.00 1.63 -0.57 0.00 0.00 179.45 180.17 3m83 n LYS 13 N -3.11 0.81 -2.27 3.15 5.02 -0.87 -5.00 118.16 115.88 3m83 n LYS 13 Ca -0.02 -1.27 -0.43 0.00 -2.02 0.00 0.00 58.31 54.57 3m83 n LYS 13 Cb 0.17 -1.23 -0.02 0.00 -0.02 0.00 0.00 35.03 33.93 3m83 n LYS 13 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 3m83 s TYR 14 N -0.98 2.26 -0.45 2.13 5.04 -0.52 -4.90 117.35 119.93 3m83 s TYR 14 Ca 0.15 0.66 0.07 0.00 -2.44 0.00 0.00 57.07 55.51 3m83 s TYR 14 Cb 0.10 -4.27 0.24 0.00 0.35 0.00 0.00 41.96 38.38 3m83 s TYR 14 CO 0.15 -2.21 0.55 0.54 -1.34 0.00 0.00 175.55 173.24 3m83 n ARG 15 N 8.16 1.04 -1.51 4.97 1.74 -1.26 -4.35 116.66 125.46 3m83 n ARG 15 Ca 0.18 -3.52 -0.33 0.00 -0.77 0.00 0.00 57.85 53.41 3m83 n ARG 15 Cb 0.48 -1.47 0.08 0.00 -1.02 0.00 0.00 32.46 30.53 3m83 n ARG 15 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3m83 s PRO 16 N -1.34 2.33 0.18 5.56 0.04 -1.26 -4.91 135.00 135.60 3m83 s PRO 16 Ca 0.36 1.57 -0.33 0.00 0.04 0.00 0.00 61.00 62.64 3m83 s PRO 16 Cb 0.15 -1.88 -0.13 0.00 0.04 0.00 0.00 34.50 32.69 3m83 s PRO 16 CO -0.10 -1.65 1.66 -1.91 0.04 0.00 0.00 177.00 175.05 3m83 n GLU 17 N -2.73 2.49 -2.99 4.56 2.13 -1.26 -4.96 120.64 117.88 3m83 n GLU 17 Ca 0.12 0.90 -0.38 0.00 0.66 0.00 0.00 57.16 58.46 3m83 n GLU 17 Cb 0.51 -2.71 -0.06 0.00 0.27 0.00 0.00 31.44 29.45 3m83 n GLU 17 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3m83 s ARG 18 N 1.11 4.45 -0.17 5.31 0.52 -1.26 -5.06 118.95 123.84 3m83 s ARG 18 Ca 0.77 1.07 0.01 0.00 -0.52 0.00 0.00 55.73 57.06 3m83 s ARG 18 Cb -0.58 -3.03 0.02 0.00 0.52 0.00 0.00 34.95 31.88 3m83 s ARG 18 CO 0.35 0.45 -0.17 -0.47 0.02 0.00 0.00 175.30 175.48 3m83 s TYR 19 N -1.38 2.52 0.06 -0.53 5.04 -1.26 -5.12 117.35 116.68 3m83 s TYR 19 Ca 0.41 -1.49 -0.09 0.00 -2.44 0.00 0.00 57.07 53.46 3m83 s TYR 19 Cb -0.20 -1.77 0.00 0.00 0.35 0.00 0.00 41.96 40.34 3m83 s TYR 19 CO 0.24 -0.75 0.19 -1.83 -1.34 0.00 0.00 175.55 172.06 3m83 s GLU 20 N 1.37 0.75 0.59 4.97 -1.05 -1.26 -4.81 118.70 119.26 3m83 s GLU 20 Ca 0.04 -0.76 -0.13 0.00 -0.15 0.00 0.00 54.97 53.97 3m83 s GLU 20 Cb -0.13 0.31 -0.05 0.00 -0.44 0.00 0.00 34.13 33.82 3m83 s GLU 20 CO -0.12 -0.23 1.02 -1.21 0.95 0.00 0.00 175.26 175.68 3m83 s GLU 21 N -3.06 3.61 0.57 -4.83 0.41 -1.26 -4.96 118.70 109.17 3m83 s GLU 21 Ca -0.01 0.89 0.35 0.00 -0.41 0.00 0.00 54.97 55.79 3m83 s GLU 21 Cb 0.01 -2.08 1.61 0.00 -1.78 0.00 0.00 34.13 31.89 3m83 s GLU 21 CO -0.07 -0.56 2.08 0.87 -0.49 0.00 0.00 175.26 177.10 3m83 h LYS 22 N 0.14 0.00 -0.68 1.61 1.57 -2.03 -2.52 116.57 114.65 3m83 h LYS 22 Ca -0.45 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.30 3m83 h LYS 22 Cb 1.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 3m83 h LYS 22 CO 0.61 0.03 0.04 -0.40 -0.57 0.00 0.00 179.45 179.16 3m83 n ASP 23 N -3.19 4.80 -0.03 0.86 5.75 -1.26 -4.60 116.55 118.89 3m83 n ASP 23 Ca -0.01 -2.80 -0.10 0.00 -0.01 0.00 0.00 54.79 51.88 3m83 n ASP 23 Cb 0.25 -0.66 -0.03 0.00 -1.03 0.00 0.00 41.12 39.65 3m83 n ASP 23 CO 0.00 0.00 0.00 0.15 -0.11 0.00 0.00 177.20 177.24 3m83 h PHE 24 N 3.11 -0.80 -0.55 2.11 3.04 -1.84 0.25 116.94 122.26 3m83 h PHE 24 Ca 0.03 0.04 -0.07 0.00 3.98 0.00 0.00 57.97 61.95 3m83 h PHE 24 Cb 1.77 0.38 -0.02 0.00 2.56 0.00 0.00 35.95 40.64 3m83 h PHE 24 CO 0.93 -0.37 0.05 -0.44 -2.02 0.00 0.00 178.31 176.46 3m83 h ASP 25 N -0.33 0.90 -0.73 0.41 3.32 -1.86 -2.62 116.42 115.51 3m83 h ASP 25 Ca 0.12 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 56.82 3m83 h ASP 25 Cb 0.52 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.79 3m83 h ASP 25 CO -0.38 0.96 0.22 -0.33 -1.72 0.00 0.00 179.24 177.99 3m83 h GLU 26 N 0.82 1.15 -0.37 3.56 3.07 -1.80 0.24 114.58 121.25 3m83 h GLU 26 Ca 0.16 -0.25 0.07 0.00 -0.50 0.00 0.00 59.36 58.84 3m83 h GLU 26 Cb 0.47 -0.16 -0.06 0.00 -0.84 0.00 0.00 28.75 28.15 3m83 h GLU 26 CO 0.02 0.98 -0.03 0.35 -1.40 0.00 0.00 179.01 178.93 3m83 h PHE 27 N 1.10 -0.08 -0.13 4.33 3.57 -0.34 -1.57 116.94 123.82 3m83 h PHE 27 Ca 0.24 0.03 -0.21 0.00 3.53 0.00 0.00 57.97 61.56 3m83 h PHE 27 Cb 0.32 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.16 3m83 h PHE 27 CO 0.03 -0.10 -0.75 -1.49 -2.23 0.00 0.00 178.31 173.76 3m83 h TRP 28 N 0.06 0.86 -0.40 0.41 4.06 -1.15 -1.23 115.95 118.57 3m83 h TRP 28 Ca 0.18 -0.38 0.03 0.00 2.06 0.00 0.00 58.89 60.79 3m83 h TRP 28 Cb 0.26 -0.13 -0.03 0.00 -1.00 0.00 0.00 29.16 28.25 3m83 h TRP 28 CO -0.28 1.18 0.20 0.93 -3.56 0.00 0.00 178.44 176.90 3m83 h GLU 29 N 0.44 0.39 -0.34 0.49 5.08 -0.86 -0.56 114.58 119.21 3m83 h GLU 29 Ca -0.04 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 3m83 h GLU 29 Cb 1.36 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 3m83 h GLU 29 CO 0.14 0.26 -0.00 0.93 -1.00 0.00 0.00 179.01 179.34 3m83 h GLU 30 N 0.40 0.61 -0.11 2.33 5.08 -1.26 -0.99 114.58 120.63 3m83 h GLU 30 Ca 0.17 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 3m83 h GLU 30 Cb 0.09 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 3m83 h GLU 30 CO -0.12 0.73 -0.08 1.15 -1.00 0.00 0.00 179.01 179.69 3m83 h THR 31 N 0.42 0.77 -0.43 1.13 2.02 -1.06 -0.81 112.91 114.94 3m83 h THR 31 Ca 0.10 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.16 3m83 h THR 31 Cb 0.46 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 3m83 h THR 31 CO 0.02 0.00 -0.18 -0.07 0.37 0.00 0.00 175.52 175.66 3m83 h LEU 32 N -0.08 0.91 -0.51 2.58 3.38 -1.05 -2.78 115.31 117.77 3m83 h LEU 32 Ca 0.07 -0.39 0.03 0.00 0.09 0.00 0.00 57.88 57.67 3m83 h LEU 32 Cb 0.18 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 3m83 h LEU 32 CO -0.16 1.10 0.29 0.00 0.09 0.00 0.00 178.44 179.76 3m83 h ALA 33 N 0.84 0.65 -0.73 1.53 0.00 -1.05 -0.83 119.26 119.67 3m83 h ALA 33 Ca 0.10 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.04 3m83 h ALA 33 Cb 0.74 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 3m83 h ALA 33 CO 0.06 -0.01 0.46 0.93 0.00 0.00 0.00 179.25 180.68 3m83 h GLU 34 N 0.59 0.87 -0.01 0.00 5.08 -1.08 -2.77 114.58 117.26 3m83 h GLU 34 Ca 0.21 -0.05 -0.16 0.00 -1.00 0.00 0.00 59.36 58.36 3m83 h GLU 34 Cb 0.04 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 3m83 h GLU 34 CO -0.10 0.57 -0.73 0.77 -1.00 0.00 0.00 179.01 178.52 3m83 h SER 35 N 0.89 0.06 0.71 1.42 0.02 -1.18 -3.12 113.55 112.36 3m83 h SER 35 Ca 0.29 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 3m83 h SER 35 Cb 0.03 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.55 3m83 h SER 35 CO -0.11 0.77 0.00 -0.33 -1.14 0.00 0.00 176.83 176.02 3m83 h GLU 36 N 0.03 0.00 0.00 3.45 5.08 -0.88 -2.64 114.58 119.62 3m83 h GLU 36 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3m83 h GLU 36 Cb 1.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 3m83 h GLU 36 CO 0.10 0.00 0.00 0.87 -1.00 0.00 0.00 179.01 178.98 3m83 h LYS 37 N 0.00 0.00 -5.88 2.33 1.57 -1.46 -3.42 116.57 109.72 3m83 h LYS 37 Ca 0.00 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.16 3m83 h LYS 37 Cb 0.36 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.60 3m83 h LYS 37 CO 0.00 0.00 -0.26 -0.06 -0.57 0.00 0.00 179.45 178.56 3m83 s PHE 38 N -3.74 3.67 0.43 -1.35 0.40 -1.00 -5.06 117.98 111.33 3m83 s PHE 38 Ca -0.01 0.87 -0.26 0.00 -0.60 0.00 0.00 56.93 56.93 3m83 s PHE 38 Cb 0.10 -2.25 -0.08 0.00 0.51 0.00 0.00 43.02 41.30 3m83 s PHE 38 CO 0.43 0.60 1.36 -1.25 0.70 0.00 0.00 175.22 177.06 3m83 s PRO 39 N -0.83 3.84 0.23 0.24 0.04 -1.26 -4.90 135.00 132.36 3m83 s PRO 39 Ca 0.22 2.27 -0.07 0.00 0.04 0.00 0.00 61.00 63.45 3m83 s PRO 39 Cb -0.15 -2.71 0.26 0.00 0.04 0.00 0.00 34.50 31.94 3m83 s PRO 39 CO 0.11 -0.64 1.88 1.25 0.04 0.00 0.00 177.00 179.64 3m83 h LEU 40 N 2.51 0.93 -3.26 -3.56 5.85 -1.91 -3.42 115.31 112.45 3m83 h LEU 40 Ca -0.50 -0.01 -0.50 0.00 0.84 0.00 0.00 57.88 57.71 3m83 h LEU 40 Cb 1.25 -0.21 0.03 0.00 0.37 0.00 0.00 40.66 42.10 3m83 h LEU 40 CO 0.62 0.65 -0.96 0.47 -0.34 0.00 0.00 178.44 178.87 3m83 n ASP 41 N -4.54 -4.11 -4.75 1.25 8.00 -1.26 -1.01 116.55 110.12 3m83 n ASP 41 Ca 0.11 -1.12 -0.41 0.00 0.71 0.00 0.00 54.79 54.08 3m83 n ASP 41 Cb 0.08 -2.71 -0.03 0.00 -0.02 0.00 0.00 41.12 38.44 3m83 n ASP 41 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3m83 s PRO 42 N -6.59 4.49 -0.10 -0.24 0.04 -1.26 -4.50 135.00 126.85 3m83 s PRO 42 Ca 0.41 1.97 0.01 0.00 0.04 0.00 0.00 61.00 63.43 3m83 s PRO 42 Cb -0.18 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.22 3m83 s PRO 42 CO 0.91 -0.03 -0.10 0.08 0.04 0.00 0.00 177.00 177.89 3m83 s VAL 43 N -0.74 1.15 -0.17 -0.36 1.01 0.25 -5.00 120.40 116.54 3m83 s VAL 43 Ca 0.49 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.06 3m83 s VAL 43 Cb -0.35 -1.11 0.01 0.00 0.00 0.00 0.00 36.38 34.93 3m83 s VAL 43 CO 0.43 0.38 -0.16 -0.36 0.00 0.00 0.00 175.10 175.39 3m83 s PHE 44 N 1.28 2.78 -0.14 5.22 0.08 -1.26 -1.57 117.98 124.37 3m83 s PHE 44 Ca -0.03 -1.26 0.00 0.00 0.12 0.00 0.00 56.93 55.77 3m83 s PHE 44 Cb -0.14 -1.91 0.02 0.00 -0.57 0.00 0.00 43.02 40.42 3m83 s PHE 44 CO -0.04 -0.61 -0.13 -2.00 -0.10 0.00 0.00 175.22 172.34 3m83 s GLU 45 N 1.05 2.17 0.20 0.44 2.56 -0.22 -4.95 118.70 119.95 3m83 s GLU 45 Ca -0.01 -0.52 -0.30 0.00 0.00 0.00 0.00 54.97 54.14 3m83 s GLU 45 Cb -0.15 -1.99 -0.09 0.00 2.00 0.00 0.00 34.13 33.91 3m83 s GLU 45 CO -0.05 -0.21 1.32 0.50 -0.56 0.00 0.00 175.26 176.27 3m83 s ARG 46 N 1.42 4.38 -0.01 4.30 3.52 -1.26 -0.37 118.95 130.93 3m83 s ARG 46 Ca 0.03 2.07 -0.06 0.00 -0.13 0.00 0.00 55.73 57.64 3m83 s ARG 46 Cb -0.13 -3.19 -0.05 0.00 -1.56 0.00 0.00 34.95 30.03 3m83 s ARG 46 CO -0.09 -0.27 0.24 -1.64 -0.81 0.00 0.00 175.30 172.74 3m83 s MET 47 N -0.13 3.54 -0.16 5.12 -1.94 -0.29 -4.89 119.30 120.55 3m83 s MET 47 Ca 0.57 -0.13 -0.29 0.00 -1.71 0.00 0.00 55.69 54.13 3m83 s MET 47 Cb -0.37 -3.09 -0.01 0.00 2.01 0.00 0.00 34.83 33.36 3m83 s MET 47 CO 0.39 0.67 1.25 -2.00 -0.01 0.00 0.00 175.02 175.32 3m83 s GLU 48 N -1.73 4.24 0.04 2.03 2.56 -1.26 -4.74 118.70 119.84 3m83 s GLU 48 Ca 0.26 1.66 -0.04 0.00 0.00 0.00 0.00 54.97 56.85 3m83 s GLU 48 Cb -0.13 -3.75 -0.02 0.00 2.00 0.00 0.00 34.13 32.23 3m83 s GLU 48 CO 0.16 -0.69 0.06 0.45 -0.56 0.00 0.00 175.26 174.67 3m83 s SER 49 N 1.93 0.26 0.02 -1.70 0.15 -1.26 -5.03 113.70 108.07 3m83 s SER 49 Ca 0.55 -0.67 0.28 0.00 0.70 0.00 0.00 55.95 56.81 3m83 s SER 49 Cb -0.22 0.22 0.98 0.00 -1.71 0.00 0.00 66.02 65.29 3m83 s SER 49 CO 0.15 -0.53 1.76 1.41 1.20 0.00 0.00 173.24 177.23 3m83 n HIS 50 N 0.61 0.08 -1.74 3.44 8.25 -1.26 -4.90 115.22 119.70 3m83 n HIS 50 Ca -0.18 0.02 -0.42 0.00 -0.26 0.00 0.00 57.72 56.89 3m83 n HIS 50 Cb 0.59 -0.46 -0.01 0.00 1.12 0.00 0.00 29.99 31.22 3m83 n HIS 50 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3m83 n LEU 51 N -1.57 4.35 -0.02 2.41 4.77 -1.26 -4.94 117.00 120.75 3m83 n LEU 51 Ca 0.06 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.20 3m83 n LEU 51 Cb 0.35 -1.59 -0.05 0.00 -2.33 0.00 0.00 43.42 39.80 3m83 n LEU 51 CO 0.30 0.13 -0.64 0.29 -1.33 0.00 0.00 177.39 176.14 3m83 n LYS 52 N 2.03 1.60 0.00 3.23 4.76 -1.26 -4.68 118.16 123.84 3m83 n LYS 52 Ca 0.08 -0.03 0.11 0.00 -2.87 0.00 0.00 58.31 55.60 3m83 n LYS 52 Cb 0.37 -1.16 0.03 0.00 -1.84 0.00 0.00 35.03 32.43 3m83 n LYS 52 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3m83 n THR 53 N -1.98 0.00 -4.09 -0.18 -2.24 -1.26 -4.93 114.28 99.61 3m83 n THR 53 Ca -0.06 -0.19 -0.14 0.00 -2.27 0.00 0.00 64.05 61.39 3m83 n THR 53 Cb 0.43 1.08 -0.13 0.00 -2.10 0.00 0.00 70.33 69.61 3m83 n THR 53 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3m83 s VAL 54 N -2.58 0.37 -0.16 2.28 1.01 -1.26 -1.32 120.40 118.74 3m83 s VAL 54 Ca 0.17 -0.42 -0.15 0.00 0.00 0.00 0.00 61.98 61.58 3m83 s VAL 54 Cb 0.18 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 3m83 s VAL 54 CO 0.62 -0.05 0.36 -1.61 0.00 0.00 0.00 175.10 174.42 3m83 s GLU 55 N -0.51 4.27 -0.13 2.72 2.02 0.59 -4.82 118.70 122.85 3m83 s GLU 55 Ca -0.02 0.21 -0.03 0.00 0.02 0.00 0.00 54.97 55.15 3m83 s GLU 55 Cb -0.04 -3.45 -0.03 0.00 0.10 0.00 0.00 34.13 30.71 3m83 s GLU 55 CO -0.00 0.17 -0.02 0.00 0.02 0.00 0.00 175.26 175.43 3m83 s ALA 56 N 0.65 3.11 -0.07 5.21 0.00 -1.26 -0.71 121.76 128.69 3m83 s ALA 56 Ca 0.20 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.39 3m83 s ALA 56 Cb -0.14 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.45 3m83 s ALA 56 CO 0.06 0.36 -0.24 0.71 0.00 0.00 0.00 175.76 176.65 3m83 s TYR 57 N -0.12 2.41 -0.02 0.00 1.51 0.14 -1.14 117.35 120.13 3m83 s TYR 57 Ca 0.03 -0.83 -0.30 0.00 -1.01 0.00 0.00 57.07 54.96 3m83 s TYR 57 Cb -0.13 -1.60 -0.05 0.00 -0.11 0.00 0.00 41.96 40.08 3m83 s TYR 57 CO 0.02 -0.29 1.35 0.34 -1.11 0.00 0.00 175.55 175.86 3m83 s ASP 58 N 0.06 6.90 -0.07 2.29 2.15 0.50 -1.18 116.67 127.32 3m83 s ASP 58 Ca -0.10 2.03 0.00 0.00 0.43 0.00 0.00 52.55 54.91 3m83 s ASP 58 Cb -0.15 -2.56 -0.03 0.00 -0.30 0.00 0.00 42.92 39.88 3m83 s ASP 58 CO 0.06 -0.69 -0.06 -0.69 -0.17 0.00 0.00 175.17 173.62 3m83 s VAL 59 N 2.39 3.76 -0.02 1.11 1.01 -0.48 -1.06 120.40 127.11 3m83 s VAL 59 Ca 0.62 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 62.16 3m83 s VAL 59 Cb -0.29 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.55 3m83 s VAL 59 CO 0.25 0.60 -0.05 -0.89 0.00 0.00 0.00 175.10 175.00 3m83 s THR 60 N -0.79 0.52 0.15 3.92 2.01 -0.61 -1.64 115.64 119.20 3m83 s THR 60 Ca 0.12 -0.20 -0.10 0.00 0.31 0.00 0.00 61.69 61.82 3m83 s THR 60 Cb -0.11 -0.49 -0.00 0.00 0.01 0.00 0.00 72.50 71.90 3m83 s THR 60 CO 0.02 0.18 0.29 0.72 -0.69 0.00 0.00 174.62 175.14 3m83 s PHE 61 N 0.37 0.25 -0.23 4.92 -0.71 -0.74 -0.59 117.98 121.25 3m83 s PHE 61 Ca -0.05 -0.63 -0.19 0.00 -1.04 0.00 0.00 56.93 55.03 3m83 s PHE 61 Cb -0.09 0.01 -0.03 0.00 -1.21 0.00 0.00 43.02 41.70 3m83 s PHE 61 CO -0.00 -0.70 0.54 -1.12 -1.34 0.00 0.00 175.22 172.60 3m83 s SER 62 N -2.92 6.52 0.00 1.98 0.01 -0.18 -0.54 113.70 118.56 3m83 s SER 62 Ca 0.13 0.62 0.00 0.00 1.31 0.00 0.00 55.95 58.01 3m83 s SER 62 Cb 0.03 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.96 3m83 s SER 62 CO -0.03 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 173.96 3m83 n GLY 63 N 4.14 0.49 3.70 3.44 0.00 0.51 -4.78 105.19 112.68 3m83 n GLY 63 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 3m83 n GLY 63 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3m83 s TYR 64 N 3.31 2.55 -1.60 1.61 5.04 -1.26 -3.49 117.35 123.51 3m83 s TYR 64 Ca 0.00 0.33 -0.10 0.00 -2.44 0.00 0.00 57.07 54.87 3m83 s TYR 64 Cb 0.00 -4.00 0.09 0.00 0.35 0.00 0.00 41.96 38.40 3m83 s TYR 64 CO 0.00 -3.96 0.51 0.54 -1.34 0.00 0.00 175.55 171.30 3m83 n ARG 65 N 5.14 -2.59 -0.95 4.97 1.74 -1.26 -0.85 116.66 122.86 3m83 n ARG 65 Ca 0.16 0.31 0.00 0.00 -0.77 0.00 0.00 57.85 57.55 3m83 n ARG 65 Cb 0.39 -4.61 0.00 0.00 -1.02 0.00 0.00 32.46 27.22 3m83 n ARG 65 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3m83 n GLY 66 N -1.76 0.41 3.76 -0.13 0.00 -1.23 -4.99 105.19 101.25 3m83 n GLY 66 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 3m83 n GLY 66 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m83 s GLN 67 N -0.61 4.61 -0.30 1.61 -0.21 -0.03 -4.62 119.66 120.12 3m83 s GLN 67 Ca 0.00 1.67 -0.19 0.00 0.02 0.00 0.00 55.36 56.86 3m83 s GLN 67 Cb 0.00 -3.09 -0.01 0.00 1.00 0.00 0.00 33.01 30.91 3m83 s GLN 67 CO 0.00 0.23 0.57 1.03 -2.12 0.00 0.00 175.29 175.00 3m83 s ARG 68 N -1.58 3.92 -0.11 2.91 1.81 -1.26 -0.36 118.95 124.27 3m83 s ARG 68 Ca 0.46 0.24 -0.03 0.00 -1.72 0.00 0.00 55.73 54.69 3m83 s ARG 68 Cb -0.28 -3.71 -0.03 0.00 -0.45 0.00 0.00 34.95 30.47 3m83 s ARG 68 CO 0.36 -0.50 -0.02 0.42 -0.68 0.00 0.00 175.30 174.88 3m83 s ILE 69 N 2.47 4.14 0.56 1.52 -1.09 0.30 -4.85 121.20 124.25 3m83 s ILE 69 Ca 0.23 -0.30 -0.07 0.00 -2.23 0.00 0.00 60.65 58.28 3m83 s ILE 69 Cb -0.15 -2.77 -0.02 0.00 -1.58 0.00 0.00 42.46 37.94 3m83 s ILE 69 CO 0.11 0.56 0.89 -0.54 -1.23 0.00 0.00 174.94 174.72 3m83 s LYS 70 N -0.36 3.32 0.13 2.79 -0.14 -1.26 -1.79 119.74 122.42 3m83 s LYS 70 Ca 0.07 0.26 -0.16 0.00 -1.36 0.00 0.00 55.97 54.78 3m83 s LYS 70 Cb -0.12 -2.26 0.06 0.00 -1.68 0.00 0.00 37.83 33.82 3m83 s LYS 70 CO 0.02 -0.48 0.76 0.41 -0.76 0.00 0.00 175.35 175.29 3m83 n GLY 71 N -2.51 0.77 3.29 -3.33 0.00 -0.65 -1.70 105.19 101.06 3m83 n GLY 71 Ca 0.03 -1.08 -0.26 0.00 0.00 0.00 0.00 46.02 44.71 3m83 n GLY 71 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3m83 s TRP 72 N -3.14 1.95 -0.18 1.61 0.23 -0.64 -1.39 118.94 117.38 3m83 s TRP 72 Ca 0.17 -0.39 0.01 0.00 -2.03 0.00 0.00 56.10 53.86 3m83 s TRP 72 Cb -0.02 -1.13 0.02 0.00 0.03 0.00 0.00 33.47 32.38 3m83 s TRP 72 CO 0.04 0.15 -0.17 -1.17 0.96 0.00 0.00 176.95 176.76 3m83 s LEU 73 N -1.46 2.13 -0.25 2.99 2.96 -0.33 -0.85 118.68 123.86 3m83 s LEU 73 Ca 0.09 -0.68 -0.07 0.00 -0.22 0.00 0.00 54.13 53.25 3m83 s LEU 73 Cb -0.09 -1.40 -0.02 0.00 0.50 0.00 0.00 46.19 45.17 3m83 s LEU 73 CO 0.03 -0.03 0.07 -0.76 -1.32 0.00 0.00 176.35 174.33 3m83 s LEU 74 N 1.33 3.47 -0.26 -0.68 2.01 -0.11 -0.69 118.68 123.75 3m83 s LEU 74 Ca 0.04 -0.27 -0.01 0.00 0.01 0.00 0.00 54.13 53.90 3m83 s LEU 74 Cb -0.14 -1.91 0.03 0.00 0.01 0.00 0.00 46.19 44.19 3m83 s LEU 74 CO -0.12 -0.05 -0.06 -0.69 1.01 0.00 0.00 176.35 176.44 3m83 s VAL 75 N 1.60 2.75 0.35 -1.59 1.01 0.12 -1.35 120.40 123.29 3m83 s VAL 75 Ca 0.06 -1.17 -0.27 0.00 0.00 0.00 0.00 61.98 60.59 3m83 s VAL 75 Cb -0.15 -2.45 -0.09 0.00 0.00 0.00 0.00 36.38 33.68 3m83 s VAL 75 CO 0.03 0.13 1.23 -2.16 0.00 0.00 0.00 175.10 174.33 3m83 s PRO 76 N 1.28 4.25 -0.91 2.72 0.04 -1.26 -0.30 135.00 140.82 3m83 s PRO 76 Ca -0.02 2.02 -0.24 0.00 0.04 0.00 0.00 61.00 62.81 3m83 s PRO 76 Cb -0.17 -2.92 0.05 0.00 0.04 0.00 0.00 34.50 31.49 3m83 s PRO 76 CO -0.04 -0.21 1.36 0.15 0.04 0.00 0.00 177.00 178.30 3m83 s LYS 77 N -1.95 3.44 0.14 4.56 1.02 -0.44 -4.87 119.74 121.65 3m83 s LYS 77 Ca 0.52 -0.86 0.04 0.00 0.02 0.00 0.00 55.97 55.69 3m83 s LYS 77 Cb -0.35 -4.91 -0.04 0.00 -0.52 0.00 0.00 37.83 32.00 3m83 s LYS 77 CO 0.46 -2.15 -0.10 -0.51 -0.92 0.00 0.00 175.35 172.13 3m83 s LEU 78 N 5.07 2.53 0.27 3.17 1.43 -1.26 -5.00 118.68 124.88 3m83 s LEU 78 Ca 0.41 -1.01 0.02 0.00 -1.03 0.00 0.00 54.13 52.52 3m83 s LEU 78 Cb -0.03 -0.32 0.37 0.00 0.03 0.00 0.00 46.19 46.24 3m83 s LEU 78 CO -0.01 -0.34 1.69 -0.33 0.23 0.00 0.00 176.35 177.58 3m83 h GLU 79 N 2.80 0.45 -6.58 1.70 3.07 -2.03 -3.45 114.58 110.53 3m83 h GLU 79 Ca -0.36 -0.19 -0.59 0.00 -0.50 0.00 0.00 59.36 57.72 3m83 h GLU 79 Cb 1.19 -0.02 0.08 0.00 -0.84 0.00 0.00 28.75 29.17 3m83 h GLU 79 CO 0.64 0.72 0.60 -1.91 -1.40 0.00 0.00 179.01 177.65 3m83 n GLU 80 N -4.08 2.00 0.09 2.33 2.13 -1.26 -4.93 120.64 116.92 3m83 n GLU 80 Ca -0.01 0.71 -0.14 0.00 0.66 0.00 0.00 57.16 58.38 3m83 n GLU 80 Cb 0.45 -2.36 -0.14 0.00 0.27 0.00 0.00 31.44 29.66 3m83 n GLU 80 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 3m83 h GLU 81 N 4.15 0.21 -5.30 5.31 3.07 -1.94 -3.43 114.58 116.64 3m83 h GLU 81 Ca -0.45 -0.36 -0.66 0.00 -0.50 0.00 0.00 59.36 57.40 3m83 h GLU 81 Cb 1.28 0.13 -0.33 0.00 -0.84 0.00 0.00 28.75 28.99 3m83 h GLU 81 CO 0.75 1.15 -0.87 0.15 -1.40 0.00 0.00 179.01 178.79 3m83 s LYS 82 N -2.66 2.81 0.20 2.33 -0.14 -1.26 -4.62 119.74 116.40 3m83 s LYS 82 Ca -0.04 -0.82 0.11 0.00 -1.36 0.00 0.00 55.97 53.87 3m83 s LYS 82 Cb 0.08 -2.16 -0.04 0.00 -1.68 0.00 0.00 37.83 34.02 3m83 s LYS 82 CO 0.87 0.18 -0.24 -0.51 -0.76 0.00 0.00 175.35 174.89 3m83 s LEU 83 N 0.33 2.44 0.84 3.17 1.43 0.23 -4.77 118.68 122.34 3m83 s LEU 83 Ca -0.17 -0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 51.94 3m83 s LEU 83 Cb -0.17 -1.15 0.09 0.00 0.03 0.00 0.00 46.19 44.99 3m83 s LEU 83 CO 0.08 0.11 1.10 -2.16 0.23 0.00 0.00 176.35 175.71 3m83 s PRO 84 N -2.70 1.74 -0.02 1.29 0.04 -1.26 -0.12 135.00 133.97 3m83 s PRO 84 Ca 0.21 0.67 0.00 0.00 0.04 0.00 0.00 61.00 61.92 3m83 s PRO 84 Cb -0.08 -1.88 0.02 0.00 0.04 0.00 0.00 34.50 32.60 3m83 s PRO 84 CO 0.10 -1.87 -0.00 0.00 0.04 0.00 0.00 177.00 175.27 3m83 s VAL 86 N 0.66 4.49 -0.38 0.00 1.01 0.40 -0.07 120.40 126.52 3m83 s VAL 86 Ca -0.06 -0.11 -0.20 0.00 0.00 0.00 0.00 61.98 61.60 3m83 s VAL 86 Cb -0.09 -3.09 0.01 0.00 0.00 0.00 0.00 36.38 33.20 3m83 s VAL 86 CO -0.01 0.35 0.62 -0.69 0.00 0.00 0.00 175.10 175.36 3m83 s VAL 87 N 1.44 4.89 -0.24 2.92 1.01 0.14 -0.56 120.40 130.00 3m83 s VAL 87 Ca 0.06 0.38 -0.07 0.00 0.00 0.00 0.00 61.98 62.34 3m83 s VAL 87 Cb -0.15 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 3m83 s VAL 87 CO 0.04 -0.39 0.08 -1.58 0.00 0.00 0.00 175.10 173.25 3m83 s GLN 88 N 2.69 3.70 0.13 2.72 2.00 0.99 -0.66 119.66 131.22 3m83 s GLN 88 Ca 0.23 -0.46 0.02 0.00 -2.00 0.00 0.00 55.36 53.15 3m83 s GLN 88 Cb -0.15 -3.33 -0.04 0.00 0.80 0.00 0.00 33.01 30.30 3m83 s GLN 88 CO 0.16 -0.14 0.25 0.71 -0.50 0.00 0.00 175.29 175.76 3m83 s TYR 89 N 1.50 3.45 0.03 1.67 2.02 -0.33 -1.81 117.35 123.88 3m83 s TYR 89 Ca 0.06 0.13 0.04 0.00 -0.37 0.00 0.00 57.07 56.93 3m83 s TYR 89 Cb -0.15 -1.67 -0.04 0.00 -0.40 0.00 0.00 41.96 39.70 3m83 s TYR 89 CO 0.04 0.53 -0.06 0.42 -1.57 0.00 0.00 175.55 174.91 3m83 s ILE 90 N -1.68 3.65 0.89 2.71 1.01 -1.26 -4.45 121.20 122.07 3m83 s ILE 90 Ca 0.34 -0.86 -0.11 0.00 0.00 0.00 0.00 60.65 60.02 3m83 s ILE 90 Cb -0.11 -2.62 0.13 0.00 0.01 0.00 0.00 42.46 39.87 3m83 s ILE 90 CO 0.28 0.33 1.10 -0.83 0.00 0.00 0.00 174.94 175.81 3m83 s GLY 91 N -1.62 1.65 0.19 6.18 0.00 -1.26 -3.16 107.32 109.30 3m83 s GLY 91 Ca 0.19 0.21 -0.33 0.00 0.00 0.00 0.00 44.72 44.79 3m83 s GLY 91 CO 0.09 0.66 1.49 2.98 0.00 0.00 0.00 173.10 178.33 3m83 n TYR 92 N -3.99 2.18 -1.14 1.90 9.36 -1.26 -1.72 117.16 122.50 3m83 n TYR 92 Ca 0.09 0.36 -0.05 0.00 3.32 0.00 0.00 57.90 61.61 3m83 n TYR 92 Cb 0.54 -2.50 -0.02 0.00 -0.63 0.00 0.00 39.34 36.73 3m83 n TYR 92 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 3m83 n ASN 93 N 2.84 -4.34 -4.87 2.98 3.02 -1.26 -4.86 115.26 108.78 3m83 n ASN 93 Ca 0.15 0.12 -0.22 0.00 -0.03 0.00 0.00 54.58 54.60 3m83 n ASN 93 Cb 0.29 -2.26 -0.03 0.00 -0.61 0.00 0.00 39.78 37.17 3m83 n ASN 93 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3m83 s GLY 94 N -2.43 2.19 0.07 7.41 0.00 -0.70 -0.65 107.32 113.21 3m83 s GLY 94 Ca 0.00 -1.83 -0.01 0.00 0.00 0.00 0.00 44.72 42.88 3m83 s GLY 94 CO 0.00 -1.77 0.11 0.61 0.00 0.00 0.00 173.10 172.05 3m83 n GLY 95 N -1.57 2.66 0.15 0.20 0.00 -0.93 -1.79 105.19 103.91 3m83 n GLY 95 Ca 0.02 -1.34 0.12 0.00 0.00 0.00 0.00 46.02 44.83 3m83 n GLY 95 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3m83 n ARG 96 N -0.11 0.20 0.00 1.61 1.85 -1.14 -4.66 116.66 114.41 3m83 n ARG 96 Ca -0.00 0.48 0.00 0.00 -1.00 0.00 0.00 57.85 57.32 3m83 n ARG 96 Cb 0.11 -1.91 0.00 0.00 -1.05 0.00 0.00 32.46 29.61 3m83 n ARG 96 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3m83 n GLY 97 N -0.25 2.99 3.80 2.89 0.00 0.35 -4.61 105.19 110.36 3m83 n GLY 97 Ca 0.01 -0.24 -0.25 0.00 0.00 0.00 0.00 46.02 45.54 3m83 n GLY 97 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3m83 s PHE 98 N 0.00 3.13 0.30 1.61 0.40 -1.26 -4.95 117.98 117.22 3m83 s PHE 98 Ca 0.00 -0.04 0.05 0.00 -0.60 0.00 0.00 56.93 56.34 3m83 s PHE 98 Cb 0.00 -1.48 0.70 0.00 0.51 0.00 0.00 43.02 42.75 3m83 s PHE 98 CO 0.00 0.52 1.80 -1.35 0.70 0.00 0.00 175.22 176.89 3m83 h PRO 99 N 2.20 0.80 0.00 0.24 0.11 -2.00 -1.85 132.00 131.49 3m83 h PRO 99 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3m83 h PRO 99 Cb 1.21 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.14 3m83 h PRO 99 CO 0.62 0.53 0.00 -2.39 -0.21 0.00 0.00 178.00 176.55 3m83 n HIS 100 N -4.70 0.00 1.36 0.65 1.44 -1.26 -2.19 115.22 110.51 3m83 n HIS 100 Ca 0.22 0.00 0.15 0.00 -2.01 0.00 0.00 57.72 56.07 3m83 n HIS 100 Cb 0.51 -0.15 0.72 0.00 0.12 0.00 0.00 29.99 31.20 3m83 n HIS 100 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 3m83 n ASP 101 N -1.15 0.04 -2.53 4.39 8.00 -0.70 -4.23 116.55 120.38 3m83 n ASP 101 Ca 0.09 -0.07 -0.10 0.00 0.71 0.00 0.00 54.79 55.41 3m83 n ASP 101 Cb 0.08 -0.30 0.04 0.00 -0.02 0.00 0.00 41.12 40.92 3m83 n ASP 101 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 3m83 n TRP 102 N -1.30 1.86 0.95 1.24 7.02 -0.93 -4.90 117.44 121.38 3m83 n TRP 102 Ca 0.13 -2.23 0.14 0.00 -1.02 0.00 0.00 57.50 54.52 3m83 n TRP 102 Cb 0.26 -0.27 0.58 0.00 -2.42 0.00 0.00 31.31 29.46 3m83 n TRP 102 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3m83 n LEU 103 N -0.61 0.11 0.43 -0.99 4.77 -1.26 -4.32 117.00 115.14 3m83 n LEU 103 Ca 0.21 0.50 -0.17 0.00 -0.03 0.00 0.00 56.01 56.52 3m83 n LEU 103 Cb 0.86 -0.47 -0.08 0.00 -2.33 0.00 0.00 43.42 41.40 3m83 n LEU 103 CO 0.21 -0.02 0.51 0.15 -1.33 0.00 0.00 177.39 176.91 3m83 h PHE 104 N 0.00 -1.02 -0.52 -1.77 3.57 -1.95 -1.86 116.94 113.40 3m83 h PHE 104 Ca 0.00 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 3m83 h PHE 104 Cb 0.53 0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 3m83 h PHE 104 CO 0.00 -0.63 0.31 -1.49 -2.23 0.00 0.00 178.31 174.27 3m83 h TRP 105 N -1.14 0.68 -0.90 0.41 4.06 -1.88 -2.37 115.95 114.81 3m83 h TRP 105 Ca -0.11 -0.00 0.06 0.00 2.06 0.00 0.00 58.89 60.89 3m83 h TRP 105 Cb 0.84 -0.22 -0.06 0.00 -1.00 0.00 0.00 29.16 28.72 3m83 h TRP 105 CO 0.03 0.47 0.59 -1.35 -3.56 0.00 0.00 178.44 174.63 3m83 h PRO 106 N 0.69 1.02 0.00 0.49 0.11 -1.54 -0.47 132.00 132.30 3m83 h PRO 106 Ca 0.18 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.20 3m83 h PRO 106 Cb -0.01 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.87 3m83 h PRO 106 CO -0.03 0.68 -0.17 0.77 -0.21 0.00 0.00 178.00 179.04 3m83 h SER 107 N 1.05 0.00 -0.21 -2.05 0.02 -0.84 -1.14 113.55 110.38 3m83 h SER 107 Ca 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 3m83 h SER 107 Cb 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 3m83 h SER 107 CO -0.14 0.17 0.00 0.23 -1.14 0.00 0.00 176.83 175.95 3m83 n MET 108 N -3.84 1.61 -0.74 3.45 2.81 -0.76 -4.93 117.12 114.71 3m83 n MET 108 Ca -0.02 -0.94 0.00 0.00 -1.81 0.00 0.00 57.70 54.93 3m83 n MET 108 Cb 0.27 -1.29 0.00 0.00 -0.71 0.00 0.00 33.22 31.48 3m83 n MET 108 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3m83 n GLY 109 N 1.00 0.54 3.57 3.03 0.00 -0.43 -5.06 105.19 107.84 3m83 n GLY 109 Ca 0.12 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 45.02 3m83 n GLY 109 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3m83 s TYR 110 N -2.00 3.03 0.34 1.61 1.51 -0.26 -4.47 117.35 117.11 3m83 s TYR 110 Ca 0.00 -0.08 -0.29 0.00 -1.01 0.00 0.00 57.07 55.70 3m83 s TYR 110 Cb 0.00 -1.84 -0.11 0.00 -0.11 0.00 0.00 41.96 39.90 3m83 s TYR 110 CO 0.00 0.20 1.46 0.42 -1.11 0.00 0.00 175.55 176.52 3m83 s ILE 111 N -0.30 2.27 -0.16 2.71 1.01 0.22 -2.45 121.20 124.50 3m83 s ILE 111 Ca 0.05 0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.96 3m83 s ILE 111 Cb -0.12 -3.16 0.02 0.00 0.01 0.00 0.00 42.46 39.20 3m83 s ILE 111 CO 0.02 0.06 -0.16 0.00 0.00 0.00 0.00 174.94 174.86 3m83 s PHE 113 N 1.41 3.23 -0.34 0.00 2.19 0.28 -0.94 117.98 123.81 3m83 s PHE 113 Ca 0.05 -0.73 -0.12 0.00 0.33 0.00 0.00 56.93 56.46 3m83 s PHE 113 Cb -0.13 -2.47 -0.01 0.00 -1.31 0.00 0.00 43.02 39.10 3m83 s PHE 113 CO -0.11 -0.57 0.22 0.08 1.83 0.00 0.00 175.22 176.66 3m83 s VAL 114 N 1.61 5.00 -0.23 3.12 1.01 -0.03 -0.01 120.40 130.88 3m83 s VAL 114 Ca 0.04 -0.39 -0.22 0.00 0.00 0.00 0.00 61.98 61.41 3m83 s VAL 114 Cb -0.19 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 3m83 s VAL 114 CO 0.08 -0.04 0.69 -0.32 0.00 0.00 0.00 175.10 175.51 3m83 s MET 115 N 1.67 4.17 0.43 2.72 1.75 -0.75 -1.62 119.30 127.68 3m83 s MET 115 Ca 0.05 0.70 -0.25 0.00 -1.25 0.00 0.00 55.69 54.94 3m83 s MET 115 Cb -0.18 -3.62 -0.08 0.00 2.84 0.00 0.00 34.83 33.79 3m83 s MET 115 CO 0.09 -0.38 1.32 0.34 -0.65 0.00 0.00 175.02 175.74 3m83 s ASP 116 N 1.34 6.11 -0.35 1.11 2.15 -0.69 -4.45 116.67 121.89 3m83 s ASP 116 Ca 0.30 2.69 -0.13 0.00 0.43 0.00 0.00 52.55 55.84 3m83 s ASP 116 Cb -0.16 -2.64 -0.01 0.00 -0.30 0.00 0.00 42.92 39.82 3m83 s ASP 116 CO 0.09 -0.99 0.24 -0.89 -0.17 0.00 0.00 175.17 173.44 3m83 s THR 117 N -1.28 5.17 -0.21 1.71 2.01 -1.26 -4.79 115.64 116.99 3m83 s THR 117 Ca 0.60 -0.32 -0.40 0.00 0.31 0.00 0.00 61.69 61.88 3m83 s THR 117 Cb -0.39 -3.69 -0.16 0.00 0.01 0.00 0.00 72.50 68.27 3m83 s THR 117 CO 0.49 -0.05 1.65 -2.11 -0.69 0.00 0.00 174.62 173.91 3m83 n ARG 118 N 5.09 1.07 -0.49 4.92 1.85 -1.26 -2.61 116.66 125.23 3m83 n ARG 118 Ca -0.13 0.39 0.00 0.00 -1.00 0.00 0.00 57.85 57.12 3m83 n ARG 118 Cb 0.49 -2.05 0.00 0.00 -1.05 0.00 0.00 32.46 29.85 3m83 n ARG 118 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3m83 n GLY 119 N 3.81 1.69 0.00 2.89 0.00 0.98 -4.59 105.19 109.97 3m83 n GLY 119 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 3m83 n GLY 119 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m83 n GLN 120 N -2.00 0.00 -3.63 1.61 6.02 -1.07 -4.88 117.38 113.43 3m83 n GLN 120 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.72 3m83 n GLN 120 Cb 0.00 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.27 3m83 n GLN 120 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3m83 n GLY 121 N 5.00 -0.49 0.00 1.08 0.00 -0.74 -4.69 105.19 105.35 3m83 n GLY 121 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3m83 n GLY 121 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3m83 n SER 122 N -2.57 0.19 -0.08 1.61 7.64 -1.19 -1.55 113.62 117.66 3m83 n SER 122 Ca 0.01 -1.05 -0.08 0.00 1.01 0.00 0.00 58.87 58.76 3m83 n SER 122 Cb 0.54 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.71 3m83 n SER 122 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3m83 n GLY 123 N -0.02 -0.57 0.00 0.23 0.00 0.17 -4.91 105.19 100.09 3m83 n GLY 123 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 3m83 n GLY 123 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 3m83 n TRP 124 N -4.40 0.00 -3.72 1.61 4.27 -1.09 -5.04 117.44 109.07 3m83 n TRP 124 Ca -0.13 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.35 3m83 n TRP 124 Cb 0.48 0.00 -0.10 0.00 -1.36 0.00 0.00 31.31 30.33 3m83 n TRP 124 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 3m83 s LEU 125 N -1.53 0.33 0.48 5.67 2.96 -1.26 -5.03 118.68 120.30 3m83 s LEU 125 Ca 0.00 0.86 -0.22 0.00 -0.22 0.00 0.00 54.13 54.55 3m83 s LEU 125 Cb 0.00 1.44 -0.07 0.00 0.50 0.00 0.00 46.19 48.06 3m83 s LEU 125 CO 0.00 -0.15 1.14 -1.59 -1.32 0.00 0.00 176.35 174.43 3m83 s LYS 126 N 0.36 3.69 0.26 1.98 -2.85 -1.26 -2.20 119.74 119.72 3m83 s LYS 126 Ca -0.01 1.69 0.05 0.00 -1.00 0.00 0.00 55.97 56.70 3m83 s LYS 126 Cb -0.04 -2.30 -0.06 0.00 -2.06 0.00 0.00 37.83 33.38 3m83 s LYS 126 CO -0.01 -0.59 -0.03 0.20 0.10 0.00 0.00 175.35 175.02 3m83 s GLY 127 N -1.51 1.71 0.00 0.59 0.00 -0.60 -0.50 107.32 107.01 3m83 s GLY 127 Ca 0.66 -1.84 0.00 0.00 0.00 0.00 0.00 44.72 43.53 3m83 s GLY 127 CO 0.31 -1.76 0.39 1.22 0.00 0.00 0.00 173.10 173.27 3m83 n ASP 128 N -0.51 0.67 -4.39 1.64 8.00 -1.26 -4.88 116.55 115.82 3m83 n ASP 128 Ca -0.05 -1.13 -0.34 0.00 0.71 0.00 0.00 54.79 53.97 3m83 n ASP 128 Cb 0.64 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.60 3m83 n ASP 128 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3m83 s THR 129 N -0.13 3.56 0.70 -3.53 2.01 -1.26 -4.90 115.64 112.08 3m83 s THR 129 Ca 0.00 -0.45 -0.11 0.00 0.31 0.00 0.00 61.69 61.44 3m83 s THR 129 Cb 0.00 -2.59 0.01 0.00 0.01 0.00 0.00 72.50 69.94 3m83 s THR 129 CO 0.00 0.45 1.08 -2.16 -0.69 0.00 0.00 174.62 173.30 3m83 s PRO 130 N 0.96 2.90 0.45 4.92 0.04 -1.26 -0.01 135.00 143.00 3m83 s PRO 130 Ca -0.00 0.58 -0.05 0.00 0.04 0.00 0.00 61.00 61.57 3m83 s PRO 130 Cb -0.15 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 3m83 s PRO 130 CO 0.01 -1.03 0.74 0.34 0.04 0.00 0.00 177.00 177.10 3m83 s ASP 131 N -4.21 6.31 -0.33 6.66 2.15 -1.26 -3.98 116.67 122.00 3m83 s ASP 131 Ca 0.58 0.89 -0.01 0.00 0.43 0.00 0.00 52.55 54.44 3m83 s ASP 131 Cb -0.12 -2.23 0.11 0.00 -0.30 0.00 0.00 42.92 40.39 3m83 s ASP 131 CO 0.53 -0.50 0.15 -0.31 -0.17 0.00 0.00 175.17 174.86 3m83 s TYR 132 N -2.61 1.13 0.70 -5.34 1.51 -1.26 -4.94 117.35 106.53 3m83 s TYR 132 Ca 0.47 -1.54 -0.14 0.00 -1.01 0.00 0.00 57.07 54.84 3m83 s TYR 132 Cb -0.10 -1.33 0.02 0.00 -0.11 0.00 0.00 41.96 40.44 3m83 s TYR 132 CO 0.41 -0.84 1.13 -1.25 -1.11 0.00 0.00 175.55 173.89 3m83 s PRO 133 N 1.49 2.52 -1.10 -1.71 0.04 -1.26 -4.93 135.00 130.05 3m83 s PRO 133 Ca 0.12 1.45 -0.23 0.00 0.04 0.00 0.00 61.00 62.38 3m83 s PRO 133 Cb -0.19 -1.91 -0.11 0.00 0.04 0.00 0.00 34.50 32.33 3m83 s PRO 133 CO -0.20 -1.48 1.93 0.39 0.04 0.00 0.00 177.00 177.68 3m83 n GLU 134 N -2.68 1.51 0.00 4.56 -0.58 -1.26 -4.89 120.64 117.29 3m83 n GLU 134 Ca 0.11 -2.33 0.00 0.00 -0.42 0.00 0.00 57.16 54.52 3m83 n GLU 134 Cb 0.52 -3.60 0.00 0.00 -0.57 0.00 0.00 31.44 27.79 3m83 n GLU 134 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3m83 n GLY 135 N 5.59 2.60 3.76 0.62 0.00 -1.26 -4.79 105.19 111.71 3m83 n GLY 135 Ca 0.45 0.13 -0.41 0.00 0.00 0.00 0.00 46.02 46.20 3m83 n GLY 135 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3m83 s PRO 136 N 0.00 4.48 -0.73 1.61 0.04 -1.26 -4.99 135.00 134.16 3m83 s PRO 136 Ca 0.00 2.02 -0.16 0.00 0.04 0.00 0.00 61.00 62.89 3m83 s PRO 136 Cb 0.00 -3.14 0.16 0.00 0.04 0.00 0.00 34.50 31.57 3m83 s PRO 136 CO 0.00 -0.02 0.74 0.08 0.04 0.00 0.00 177.00 177.85 3m83 s VAL 137 N -1.00 5.24 0.91 -0.36 1.01 -1.26 -5.02 120.40 119.92 3m83 s VAL 137 Ca 0.48 -1.83 -0.12 0.00 0.00 0.00 0.00 61.98 60.50 3m83 s VAL 137 Cb -0.36 -4.49 0.07 0.00 0.00 0.00 0.00 36.38 31.61 3m83 s VAL 137 CO 0.46 -1.08 0.73 0.47 0.00 0.00 0.00 175.10 175.68 3m83 n ASP 138 N 5.09 -0.94 -4.52 3.32 8.00 -1.26 -4.88 116.55 121.36 3m83 n ASP 138 Ca 0.04 0.40 -0.52 0.00 0.71 0.00 0.00 54.79 55.42 3m83 n ASP 138 Cb 0.45 -1.33 -0.05 0.00 -0.02 0.00 0.00 41.12 40.17 3m83 n ASP 138 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3m83 n PRO 139 N -2.61 0.56 -3.83 -0.24 -0.02 -1.26 -4.80 135.00 122.80 3m83 n PRO 139 Ca 0.09 0.20 -0.09 0.00 -2.02 0.00 0.00 63.50 61.68 3m83 n PRO 139 Cb 0.52 -1.61 -0.06 0.00 -0.02 0.00 0.00 33.50 32.33 3m83 n PRO 139 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 3m83 s GLN 140 N -0.30 1.08 0.28 -0.52 -2.07 -1.26 -4.85 119.66 112.01 3m83 s GLN 140 Ca 0.78 -0.97 -0.24 0.00 -1.82 0.00 0.00 55.36 53.11 3m83 s GLN 140 Cb -1.01 0.41 -0.09 0.00 -1.09 0.00 0.00 33.01 31.22 3m83 s GLN 140 CO 0.54 -0.40 0.87 -0.47 -1.32 0.00 0.00 175.29 174.51 3m83 s TYR 141 N -3.89 3.71 -0.10 9.60 5.04 -1.26 -4.99 117.35 125.46 3m83 s TYR 141 Ca 0.10 1.66 -0.41 0.00 -2.44 0.00 0.00 57.07 55.98 3m83 s TYR 141 Cb 0.03 -2.82 -0.19 0.00 0.35 0.00 0.00 41.96 39.33 3m83 s TYR 141 CO -0.06 0.29 1.30 -2.30 -1.34 0.00 0.00 175.55 173.43 3m83 n PRO 142 N 0.74 0.38 0.00 4.97 -0.02 -1.26 -4.70 135.00 135.12 3m83 n PRO 142 Ca -0.00 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 3m83 n PRO 142 Cb 0.50 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 3m83 n PRO 142 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m83 n GLY 143 N 2.46 0.48 0.01 -1.23 0.00 -1.26 -4.87 105.19 100.77 3m83 n GLY 143 Ca 0.22 -2.25 0.07 0.00 0.00 0.00 0.00 46.02 44.06 3m83 n GLY 143 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3m83 n PHE 144 N 1.04 0.00 0.22 1.61 3.72 -1.26 -4.51 117.46 118.28 3m83 n PHE 144 Ca 0.00 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.45 3m83 n PHE 144 Cb 0.00 -0.28 0.48 0.00 -0.94 0.00 0.00 39.48 38.74 3m83 n PHE 144 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 3m83 h MET 145 N 0.00 0.00 -0.17 -1.08 2.86 -1.90 -2.90 114.93 111.73 3m83 h MET 145 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3m83 h MET 145 Cb 0.58 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.24 3m83 h MET 145 CO 0.00 0.22 0.00 0.25 1.06 0.00 0.00 176.91 178.44 3m83 n THR 146 N -4.28 0.53 -1.95 2.22 -2.24 -1.26 -4.84 114.28 102.46 3m83 n THR 146 Ca -0.02 -0.77 -0.40 0.00 -2.27 0.00 0.00 64.05 60.59 3m83 n THR 146 Cb 0.27 0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 69.31 3m83 n THR 146 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3m83 s ARG 147 N -0.92 2.91 -0.36 -0.78 3.52 -1.10 -2.50 118.95 119.73 3m83 s ARG 147 Ca 0.17 1.14 0.00 0.00 -0.13 0.00 0.00 55.73 56.91 3m83 s ARG 147 Cb 0.10 -4.32 0.00 0.00 -1.56 0.00 0.00 34.95 29.17 3m83 s ARG 147 CO 0.13 -2.37 0.00 0.41 -0.81 0.00 0.00 175.30 172.67 3m83 n GLY 148 N 5.61 0.58 0.17 8.12 0.00 -1.26 -1.44 105.19 116.97 3m83 n GLY 148 Ca 0.24 -0.89 0.13 0.00 0.00 0.00 0.00 46.02 45.50 3m83 n GLY 148 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3m83 h ILE 149 N 0.00 0.00 0.00 -0.61 2.10 -1.78 -3.00 117.51 114.22 3m83 h ILE 149 Ca -0.07 -0.19 0.00 0.00 1.08 0.00 0.00 64.86 65.68 3m83 h ILE 149 Cb 0.37 0.90 0.00 0.00 -1.09 0.00 0.00 36.82 37.00 3m83 h ILE 149 CO 0.10 0.00 0.00 0.18 -1.08 0.00 0.00 178.15 177.35 3m83 n LEU 150 N -2.42 0.00 -3.65 2.19 4.77 -1.26 -4.62 117.00 112.01 3m83 n LEU 150 Ca 0.01 0.12 -0.06 0.00 -0.03 0.00 0.00 56.01 56.04 3m83 n LEU 150 Cb 0.17 -0.12 -0.07 0.00 -2.33 0.00 0.00 43.42 41.07 3m83 n LEU 150 CO 0.18 -0.01 0.27 -0.62 -1.33 0.00 0.00 177.39 175.88 3m83 s ASP 151 N -2.24 -0.89 0.49 -1.43 -1.08 -1.14 -4.96 116.67 105.42 3m83 s ASP 151 Ca 0.37 1.41 0.17 0.00 -0.52 0.00 0.00 52.55 53.98 3m83 s ASP 151 Cb 0.20 1.49 1.21 0.00 -1.46 0.00 0.00 42.92 44.35 3m83 s ASP 151 CO 0.38 -0.23 2.08 1.55 0.52 0.00 0.00 175.17 179.47 3m83 h PRO 152 N 7.29 0.13 -0.62 4.34 0.13 -1.84 -1.47 132.00 139.97 3m83 h PRO 152 Ca -0.28 -0.01 0.05 0.00 -0.87 0.00 0.00 66.00 64.89 3m83 h PRO 152 Cb 1.19 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 3m83 h PRO 152 CO 0.16 0.09 0.41 0.00 -0.23 0.00 0.00 178.00 178.43 3m83 h ARG 153 N 0.14 0.65 -0.02 0.86 -0.00 -1.96 -2.94 114.38 111.10 3m83 h ARG 153 Ca 0.12 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.56 3m83 h ARG 153 Cb 0.30 -0.15 0.00 0.00 0.00 0.00 0.00 29.97 30.12 3m83 h ARG 153 CO -0.02 0.43 -0.19 0.25 0.00 0.00 0.00 179.97 180.44 3m83 n THR 154 N -4.47 0.00 -2.37 2.04 -2.24 -0.61 -4.97 114.28 101.66 3m83 n THR 154 Ca 0.08 -0.41 -0.41 0.00 -2.27 0.00 0.00 64.05 61.05 3m83 n THR 154 Cb 0.18 1.40 -0.03 0.00 -2.10 0.00 0.00 70.33 69.78 3m83 n THR 154 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3m83 s TYR 155 N -2.16 3.43 0.22 4.78 5.04 -0.89 -4.32 117.35 123.46 3m83 s TYR 155 Ca 0.24 1.47 -0.11 0.00 -2.44 0.00 0.00 57.07 56.23 3m83 s TYR 155 Cb 0.19 -3.42 0.32 0.00 0.35 0.00 0.00 41.96 39.39 3m83 s TYR 155 CO 0.40 -1.14 1.64 -0.92 -1.34 0.00 0.00 175.55 174.20 3m83 h TYR 156 N 4.87 -0.13 0.00 4.97 3.20 -1.52 -1.55 116.97 126.81 3m83 h TYR 156 Ca -0.45 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.47 3m83 h TYR 156 Cb 1.21 0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.65 3m83 h TYR 156 CO 0.61 -0.22 0.00 0.66 -1.64 0.00 0.00 178.16 177.57 3m83 n TYR 157 N -5.35 0.59 -0.25 -3.82 4.01 -1.26 -1.84 117.16 109.25 3m83 n TYR 157 Ca 0.10 0.23 -0.02 0.00 -0.16 0.00 0.00 57.90 58.05 3m83 n TYR 157 Cb 0.38 -0.87 0.09 0.00 -0.31 0.00 0.00 39.34 38.63 3m83 n TYR 157 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3m83 h ARG 158 N 0.00 0.79 -0.07 -0.72 2.43 -1.57 -1.23 114.38 114.01 3m83 h ARG 158 Ca 0.00 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.01 3m83 h ARG 158 Cb 0.35 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 29.73 3m83 h ARG 158 CO 0.00 0.52 -0.41 0.00 -1.51 0.00 0.00 179.97 178.57 3m83 h ARG 159 N 0.81 0.40 -0.17 0.20 3.08 -1.47 -2.60 114.38 114.64 3m83 h ARG 159 Ca 0.30 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3m83 h ARG 159 Cb 0.10 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 3m83 h ARG 159 CO -0.14 0.98 0.11 0.28 -1.07 0.00 0.00 179.97 180.13 3m83 h VAL 160 N -0.07 1.06 -0.58 2.04 2.07 -1.47 -0.68 116.25 118.63 3m83 h VAL 160 Ca -0.03 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.28 3m83 h VAL 160 Cb 1.07 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 3m83 h VAL 160 CO 0.09 0.06 0.12 -0.26 0.02 0.00 0.00 177.57 177.60 3m83 h PHE 161 N 0.22 0.95 -0.18 1.57 0.04 -1.31 -0.84 116.94 117.39 3m83 h PHE 161 Ca 0.06 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 3m83 h PHE 161 Cb 0.00 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 37.88 3m83 h PHE 161 CO -0.06 0.80 0.04 1.15 -0.60 0.00 0.00 178.31 179.64 3m83 h THR 162 N 0.87 1.21 -0.68 -1.55 2.02 -1.36 -1.33 112.91 112.08 3m83 h THR 162 Ca 0.18 -0.66 0.15 0.00 0.77 0.00 0.00 66.41 66.85 3m83 h THR 162 Cb 0.34 1.30 -0.12 0.00 -1.74 0.00 0.00 68.15 67.94 3m83 h THR 162 CO 0.00 0.20 0.01 0.44 0.37 0.00 0.00 175.52 176.55 3m83 h ASP 163 N 0.10 -0.29 -0.27 4.18 3.32 -0.77 -2.12 116.42 120.57 3m83 h ASP 163 Ca 0.06 0.17 -0.11 0.00 0.02 0.00 0.00 57.03 57.17 3m83 h ASP 163 Cb 0.27 0.30 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 3m83 h ASP 163 CO 0.00 -0.14 -0.22 0.00 -1.72 0.00 0.00 179.24 177.17 3m83 h ALA 164 N 1.63 0.91 -0.58 3.45 0.00 -0.80 0.13 119.26 124.00 3m83 h ALA 164 Ca 0.37 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 3m83 h ALA 164 Cb 0.62 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3m83 h ALA 164 CO -0.59 0.62 -0.06 0.28 0.00 0.00 0.00 179.25 179.50 3m83 h VAL 165 N 0.64 1.27 -0.02 0.00 2.07 -1.00 -2.99 116.25 116.22 3m83 h VAL 165 Ca 0.09 -1.22 -0.10 0.00 0.82 0.00 0.00 66.70 66.28 3m83 h VAL 165 Cb 0.71 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3m83 h VAL 165 CO 0.05 0.44 -0.48 0.03 0.02 0.00 0.00 177.57 177.64 3m83 h ARG 166 N 0.95 0.05 -0.75 1.57 2.47 -0.90 -2.86 114.38 114.90 3m83 h ARG 166 Ca 0.16 -0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.86 3m83 h ARG 166 Cb 0.63 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.92 3m83 h ARG 166 CO 0.04 0.51 0.50 0.00 0.56 0.00 0.00 179.97 181.58 3m83 h ALA 167 N 1.48 1.47 -0.64 0.04 0.00 -0.61 -0.61 119.26 120.39 3m83 h ALA 167 Ca -0.00 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3m83 h ALA 167 Cb 0.86 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3m83 h ALA 167 CO 0.06 0.49 0.11 0.28 0.00 0.00 0.00 179.25 180.19 3m83 h VAL 168 N 1.01 1.26 -0.56 0.00 2.07 -1.48 0.17 116.25 118.72 3m83 h VAL 168 Ca 0.28 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.78 3m83 h VAL 168 Cb -0.10 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3m83 h VAL 168 CO -0.06 0.38 0.29 -0.33 0.02 0.00 0.00 177.57 177.86 3m83 h GLU 169 N 0.99 0.80 -0.39 1.57 4.39 -1.36 -1.13 114.58 119.44 3m83 h GLU 169 Ca 0.20 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.76 3m83 h GLU 169 Cb 0.42 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 3m83 h GLU 169 CO 0.01 0.63 0.12 0.00 -1.16 0.00 0.00 179.01 178.62 3m83 h ALA 170 N 1.12 0.51 -0.37 3.43 0.00 -0.72 -2.44 119.26 120.80 3m83 h ALA 170 Ca 0.19 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.98 3m83 h ALA 170 Cb 0.09 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 3m83 h ALA 170 CO -0.03 0.15 0.15 0.00 0.00 0.00 0.00 179.25 179.53 3m83 h ALA 171 N 0.97 0.44 0.00 0.00 0.00 -0.87 -2.69 119.26 117.11 3m83 h ALA 171 Ca 0.13 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3m83 h ALA 171 Cb 0.26 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3m83 h ALA 171 CO -0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 179.25 179.00 3m83 h ALA 172 N 1.22 1.49 0.00 0.00 0.00 -1.05 -2.11 119.26 118.81 3m83 h ALA 172 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3m83 h ALA 172 Cb 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3m83 h ALA 172 CO -0.15 0.02 0.00 0.66 0.00 0.00 0.00 179.25 179.78 3m83 h SER 173 N 0.00 0.00 -3.04 0.00 4.64 -1.09 -3.45 113.55 110.62 3m83 h SER 173 Ca -0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 3m83 h SER 173 Cb 0.05 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.15 3m83 h SER 173 CO 0.00 0.00 0.70 0.12 -0.87 0.00 0.00 176.83 176.79 3m83 s PHE 174 N -3.26 3.19 0.40 4.77 5.36 -0.80 -4.91 117.98 122.73 3m83 s PHE 174 Ca 0.07 1.03 0.26 0.00 -0.96 0.00 0.00 56.93 57.34 3m83 s PHE 174 Cb 0.09 -3.59 1.39 0.00 -0.34 0.00 0.00 43.02 40.58 3m83 s PHE 174 CO 0.57 -2.02 2.05 -1.35 -1.46 0.00 0.00 175.22 173.01 3m83 h PRO 175 N 7.13 0.00 -0.01 10.12 0.11 -1.89 -2.10 132.00 145.36 3m83 h PRO 175 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 3m83 h PRO 175 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3m83 h PRO 175 CO 0.86 0.13 -0.04 1.04 -0.21 0.00 0.00 178.00 179.78 3m83 n GLN 176 N -3.66 1.27 -2.76 1.05 6.02 -1.26 -4.87 117.38 113.16 3m83 n GLN 176 Ca -0.02 -0.56 -0.42 0.00 -0.01 0.00 0.00 57.00 55.99 3m83 n GLN 176 Cb 0.25 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.99 3m83 n GLN 176 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3m83 s VAL 177 N -2.12 4.82 -0.50 5.09 1.01 -0.79 -0.60 120.40 127.31 3m83 s VAL 177 Ca 0.38 1.89 -0.29 0.00 0.00 0.00 0.00 61.98 63.97 3m83 s VAL 177 Cb 0.21 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 32.36 3m83 s VAL 177 CO 0.38 0.01 1.28 -0.62 0.00 0.00 0.00 175.10 176.16 3m83 s ASP 178 N 1.11 6.41 0.23 3.32 -1.08 0.83 -4.80 116.67 122.69 3m83 s ASP 178 Ca 0.45 0.45 0.22 0.00 -0.52 0.00 0.00 52.55 53.15 3m83 s ASP 178 Cb -0.18 -2.55 0.94 0.00 -1.46 0.00 0.00 42.92 39.68 3m83 s ASP 178 CO 0.16 -1.44 1.67 0.00 0.52 0.00 0.00 175.17 176.07 3m83 n GLN 179 N 8.20 0.16 0.00 4.34 6.02 -1.26 -1.40 117.38 133.45 3m83 n GLN 179 Ca 0.13 0.43 0.14 0.00 -0.01 0.00 0.00 57.00 57.68 3m83 n GLN 179 Cb 0.49 -1.83 0.56 0.00 1.02 0.00 0.00 30.24 30.48 3m83 n GLN 179 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3m83 n GLU 180 N -2.15 0.21 -2.70 -1.09 -0.58 -1.26 -4.11 120.64 108.97 3m83 n GLU 180 Ca 0.02 -0.05 -0.17 0.00 -0.42 0.00 0.00 57.16 56.54 3m83 n GLU 180 Cb 0.20 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.58 3m83 n GLU 180 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3m83 n ARG 181 N -1.35 1.96 -3.48 3.49 1.74 -0.49 -4.91 116.66 113.62 3m83 n ARG 181 Ca 0.09 -3.77 -0.38 0.00 -0.77 0.00 0.00 57.85 53.03 3m83 n ARG 181 Cb 0.31 -1.68 -0.09 0.00 -1.02 0.00 0.00 32.46 29.98 3m83 n ARG 181 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3m83 s ILE 182 N -3.86 5.24 -0.10 0.55 1.01 -1.24 -1.10 121.20 121.71 3m83 s ILE 182 Ca 0.37 0.45 -0.00 0.00 0.00 0.00 0.00 60.65 61.46 3m83 s ILE 182 Cb 0.41 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 3m83 s ILE 182 CO -0.06 0.23 -0.07 -0.69 0.00 0.00 0.00 174.94 174.36 3m83 s VAL 183 N 1.66 3.70 -0.16 2.92 1.01 0.91 -0.55 120.40 129.87 3m83 s VAL 183 Ca 0.13 -0.46 -0.07 0.00 0.00 0.00 0.00 61.98 61.58 3m83 s VAL 183 Cb -0.15 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 3m83 s VAL 183 CO 0.09 0.57 0.07 0.27 0.00 0.00 0.00 175.10 176.09 3m83 s ILE 184 N -0.40 4.86 -0.02 2.22 -4.36 -0.37 0.26 121.20 123.38 3m83 s ILE 184 Ca 0.06 -0.02 -0.02 0.00 -0.26 0.00 0.00 60.65 60.41 3m83 s ILE 184 Cb -0.12 -3.16 0.00 0.00 1.25 0.00 0.00 42.46 40.43 3m83 s ILE 184 CO 0.02 0.50 0.05 0.00 0.24 0.00 0.00 174.94 175.75 3m83 s ALA 185 N 0.03 -0.13 -0.12 2.27 0.00 0.17 -0.73 121.76 123.25 3m83 s ALA 185 Ca 0.06 0.11 -0.32 0.00 0.00 0.00 0.00 51.96 51.81 3m83 s ALA 185 Cb -0.12 -0.07 0.13 0.00 0.00 0.00 0.00 23.12 23.05 3m83 s ALA 185 CO 0.01 -0.04 1.07 0.20 0.00 0.00 0.00 175.76 177.01 3m83 s GLY 186 N -0.07 -0.33 -0.39 0.00 0.00 -0.65 -1.18 107.32 104.70 3m83 s GLY 186 Ca -0.01 1.50 0.05 0.00 0.00 0.00 0.00 44.72 46.27 3m83 s GLY 186 CO 0.00 0.55 1.23 0.61 0.00 0.00 0.00 173.10 175.49 3m83 n GLY 187 N -0.02 6.20 0.00 0.20 0.00 -1.26 -1.43 105.19 108.88 3m83 n GLY 187 Ca -0.04 -2.69 0.00 0.00 0.00 0.00 0.00 46.02 43.29 3m83 n GLY 187 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3m83 n GLN 189 N -0.62 0.00 -0.16 1.61 7.27 -1.26 -3.18 117.38 121.03 3m83 n GLN 189 Ca 0.43 0.00 0.09 0.00 0.07 0.00 0.00 57.00 57.59 3m83 n GLN 189 Cb 0.81 0.00 0.41 0.00 2.41 0.00 0.00 30.24 33.87 3m83 n GLN 189 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 3m83 h GLY 190 N 0.00 0.86 1.57 1.69 0.00 -1.79 -0.20 103.07 105.19 3m83 h GLY 190 Ca 0.00 -0.25 -0.19 0.00 0.00 0.00 0.00 47.33 46.88 3m83 h GLY 190 CO 0.00 0.16 -0.76 -1.33 0.00 0.00 0.00 176.54 174.61 3m83 h GLY 191 N 0.62 0.46 1.19 4.60 0.00 -1.53 -0.29 103.07 108.13 3m83 h GLY 191 Ca 0.32 -0.68 -0.16 0.00 0.00 0.00 0.00 47.33 46.81 3m83 h GLY 191 CO -0.11 0.60 -0.39 -1.33 0.00 0.00 0.00 176.54 175.31 3m83 h GLY 192 N 1.25 0.97 0.84 4.60 0.00 -1.49 -1.14 103.07 108.09 3m83 h GLY 192 Ca -0.04 -0.99 -0.00 0.00 0.00 0.00 0.00 47.33 46.30 3m83 h GLY 192 CO 0.13 0.89 -0.02 -2.22 0.00 0.00 0.00 176.54 175.32 3m83 h ILE 193 N 0.72 1.08 -0.84 2.60 2.04 -0.99 -2.50 117.51 119.62 3m83 h ILE 193 Ca 0.06 -0.38 0.04 0.00 1.00 0.00 0.00 64.86 65.58 3m83 h ILE 193 Cb 0.97 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 38.33 3m83 h ILE 193 CO 0.09 0.10 0.55 0.00 0.00 0.00 0.00 178.15 178.89 3m83 h ALA 194 N 0.73 1.50 -0.59 1.87 0.00 -1.03 -1.18 119.26 120.56 3m83 h ALA 194 Ca -0.01 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3m83 h ALA 194 Cb 0.20 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3m83 h ALA 194 CO 0.01 0.40 0.17 1.25 0.00 0.00 0.00 179.25 181.08 3m83 h LEU 195 N 1.02 0.88 -0.04 0.00 5.85 -1.13 -0.29 115.31 121.59 3m83 h LEU 195 Ca 0.34 -0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.86 3m83 h LEU 195 Cb 0.07 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 3m83 h LEU 195 CO -0.11 0.86 -0.07 0.00 -0.34 0.00 0.00 178.44 178.78 3m83 h ALA 196 N 1.05 -0.05 -0.30 1.25 0.00 -0.91 -2.95 119.26 117.36 3m83 h ALA 196 Ca 0.19 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3m83 h ALA 196 Cb 0.31 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3m83 h ALA 196 CO -0.00 -0.55 0.20 0.28 0.00 0.00 0.00 179.25 179.17 3m83 h VAL 197 N -0.11 1.08 0.00 0.00 2.07 -0.85 -1.43 116.25 117.01 3m83 h VAL 197 Ca 0.04 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 3m83 h VAL 197 Cb 0.17 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 3m83 h VAL 197 CO -0.10 0.07 -0.17 0.77 0.02 0.00 0.00 177.57 178.17 3m83 h SER 198 N 0.40 0.00 0.43 0.57 4.64 -0.88 0.11 113.55 118.82 3m83 h SER 198 Ca 0.11 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.13 3m83 h SER 198 Cb -0.05 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.00 3m83 h SER 198 CO -0.02 0.17 -1.77 0.00 -0.87 0.00 0.00 176.83 174.33 3m83 n ALA 199 N -2.39 1.42 -0.05 5.18 0.00 -0.61 -4.40 120.51 119.66 3m83 n ALA 199 Ca -0.02 -0.76 -0.02 0.00 0.00 0.00 0.00 53.44 52.64 3m83 n ALA 199 Cb 0.25 -0.81 -0.15 0.00 0.00 0.00 0.00 19.45 18.75 3m83 n ALA 199 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3m83 n LEU 200 N -3.09 0.17 -4.85 0.00 4.77 -0.77 -4.89 117.00 108.34 3m83 n LEU 200 Ca -0.19 0.07 -0.33 0.00 -0.03 0.00 0.00 56.01 55.53 3m83 n LEU 200 Cb 1.05 0.26 -0.06 0.00 -2.33 0.00 0.00 43.42 42.35 3m83 n LEU 200 CO 0.45 0.28 0.36 -0.55 -1.33 0.00 0.00 177.39 176.59 3m83 s SER 201 N -5.24 6.81 -0.01 -1.43 0.15 0.35 -4.99 113.70 109.35 3m83 s SER 201 Ca -0.08 1.22 0.20 0.00 0.70 0.00 0.00 55.95 57.99 3m83 s SER 201 Cb 0.09 -2.35 -0.24 0.00 -1.71 0.00 0.00 66.02 61.81 3m83 s SER 201 CO 0.85 -0.10 0.76 0.29 1.20 0.00 0.00 173.24 176.25 3m83 n LYS 202 N 0.04 0.43 -0.02 5.44 4.76 -1.26 -4.61 118.16 122.94 3m83 n LYS 202 Ca 0.01 -0.04 0.01 0.00 -2.87 0.00 0.00 58.31 55.42 3m83 n LYS 202 Cb 0.52 -1.46 -0.13 0.00 -1.84 0.00 0.00 35.03 32.13 3m83 n LYS 202 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 3m83 n LYS 203 N -1.64 0.65 -2.14 1.97 4.76 -1.26 -4.95 118.16 115.55 3m83 n LYS 203 Ca 0.02 0.01 -0.41 0.00 -2.87 0.00 0.00 58.31 55.07 3m83 n LYS 203 Cb 0.36 -1.63 -0.02 0.00 -1.84 0.00 0.00 35.03 31.90 3m83 n LYS 203 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3m83 s ALA 204 N -3.01 3.51 -0.04 7.82 0.00 -1.26 -4.74 121.76 124.05 3m83 s ALA 204 Ca -0.07 1.22 0.12 0.00 0.00 0.00 0.00 51.96 53.24 3m83 s ALA 204 Cb 0.10 -3.48 -0.18 0.00 0.00 0.00 0.00 23.12 19.56 3m83 s ALA 204 CO 0.85 -0.61 0.22 1.63 0.00 0.00 0.00 175.76 177.85 3m83 n LYS 205 N 1.31 0.75 -3.66 0.00 4.76 0.29 -4.96 118.16 116.64 3m83 n LYS 205 Ca 0.02 -0.09 -0.12 0.00 -2.87 0.00 0.00 58.31 55.24 3m83 n LYS 205 Cb 0.42 -1.29 -0.06 0.00 -1.84 0.00 0.00 35.03 32.26 3m83 n LYS 205 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3m83 s ALA 206 N -2.72 -1.00 -0.11 7.82 0.00 -1.19 -4.29 121.76 120.27 3m83 s ALA 206 Ca -0.05 0.26 0.03 0.00 0.00 0.00 0.00 51.96 52.21 3m83 s ALA 206 Cb 0.07 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.58 3m83 s ALA 206 CO 0.50 -0.48 -0.23 -1.17 0.00 0.00 0.00 175.76 174.38 3m83 s LEU 207 N -2.11 2.16 -0.27 0.00 2.96 -0.13 -1.24 118.68 120.04 3m83 s LEU 207 Ca -0.04 -0.54 -0.05 0.00 -0.22 0.00 0.00 54.13 53.27 3m83 s LEU 207 Cb -0.00 -1.44 0.01 0.00 0.50 0.00 0.00 46.19 45.26 3m83 s LEU 207 CO -0.04 0.15 0.03 -0.76 -1.32 0.00 0.00 176.35 174.40 3m83 s LEU 208 N 0.43 3.49 -0.35 -0.68 1.43 0.09 -1.32 118.68 121.77 3m83 s LEU 208 Ca -0.16 -0.64 0.01 0.00 -1.03 0.00 0.00 54.13 52.30 3m83 s LEU 208 Cb -0.17 -1.81 0.11 0.00 0.03 0.00 0.00 46.19 44.35 3m83 s LEU 208 CO 0.07 -0.13 0.14 0.00 0.23 0.00 0.00 176.35 176.65 3m83 s ASP 210 N 1.14 6.33 -0.96 0.00 1.01 -0.51 -2.12 116.67 121.56 3m83 s ASP 210 Ca 0.12 0.39 -0.11 0.00 0.71 0.00 0.00 52.55 53.67 3m83 s ASP 210 Cb -0.20 -2.08 0.01 0.00 1.01 0.00 0.00 42.92 41.67 3m83 s ASP 210 CO -0.15 0.32 0.20 1.33 0.21 0.00 0.00 175.17 177.08 3m83 n VAL 211 N 2.58 -1.16 -1.80 -1.27 0.24 -0.63 -4.26 118.33 112.03 3m83 n VAL 211 Ca -0.18 -0.37 -0.42 0.00 -2.04 0.00 0.00 64.34 61.33 3m83 n VAL 211 Cb 0.54 -1.04 -0.02 0.00 -1.47 0.00 0.00 33.84 31.84 3m83 n VAL 211 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3m83 s PRO 212 N -6.32 4.15 0.39 7.34 0.04 -1.26 -4.77 135.00 134.56 3m83 s PRO 212 Ca 0.15 2.54 0.05 0.00 0.04 0.00 0.00 61.00 63.78 3m83 s PRO 212 Cb -0.08 -3.07 -0.00 0.00 0.04 0.00 0.00 34.50 31.38 3m83 s PRO 212 CO 0.68 -0.67 0.55 0.12 0.04 0.00 0.00 177.00 177.72 3m83 s PHE 213 N 0.70 3.07 -0.38 0.56 5.36 -1.26 -4.64 117.98 121.39 3m83 s PHE 213 Ca 0.69 -0.15 -0.01 0.00 -0.96 0.00 0.00 56.93 56.50 3m83 s PHE 213 Cb -0.48 -2.18 0.00 0.00 -0.34 0.00 0.00 43.02 40.03 3m83 s PHE 213 CO 0.38 -0.21 0.17 1.28 -1.46 0.00 0.00 175.22 175.38 3m83 n LEU 214 N -1.81 -1.89 -4.00 6.12 4.77 -1.26 -3.47 117.00 115.45 3m83 n LEU 214 Ca 0.02 -0.08 -0.23 0.00 -0.03 0.00 0.00 56.01 55.69 3m83 n LEU 214 Cb 0.58 -1.12 -0.16 0.00 -2.33 0.00 0.00 43.42 40.39 3m83 n LEU 214 CO 0.43 0.07 -0.45 0.00 -1.33 0.00 0.00 177.39 176.11 3m83 n HIS 216 N 3.62 -1.93 -0.31 0.00 -0.00 -1.26 -4.69 115.22 110.65 3m83 n HIS 216 Ca -0.21 0.47 0.02 0.00 -0.00 0.00 0.00 57.72 58.00 3m83 n HIS 216 Cb 0.52 -3.48 0.16 0.00 -0.00 0.00 0.00 29.99 27.19 3m83 n HIS 216 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.34 177.08 3m83 h PHE 217 N -1.86 0.96 -0.60 1.57 0.04 -1.95 -1.27 116.94 113.82 3m83 h PHE 217 Ca -0.66 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.07 3m83 h PHE 217 Cb 1.36 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 39.18 3m83 h PHE 217 CO 0.34 0.45 0.10 -0.09 -0.60 0.00 0.00 178.31 178.51 3m83 h ARG 218 N 0.92 1.00 -0.27 1.51 9.65 -1.99 -1.72 114.38 123.48 3m83 h ARG 218 Ca 0.39 -0.27 -0.11 0.00 -1.10 0.00 0.00 59.98 58.89 3m83 h ARG 218 Cb 0.25 -0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 28.71 3m83 h ARG 218 CO -0.20 0.94 -0.27 -0.09 2.80 0.00 0.00 179.97 183.15 3m83 h ARG 219 N 0.90 0.65 -0.67 0.20 9.65 -1.83 -3.16 114.38 120.12 3m83 h ARG 219 Ca 0.18 -0.35 0.08 0.00 -1.10 0.00 0.00 59.98 58.79 3m83 h ARG 219 Cb 0.43 0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 28.95 3m83 h ARG 219 CO 0.01 0.95 0.34 0.00 2.80 0.00 0.00 179.97 184.07 3m83 h ALA 220 N 0.69 0.91 0.00 2.80 0.00 -1.03 -1.74 119.26 120.89 3m83 h ALA 220 Ca 0.04 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3m83 h ALA 220 Cb 0.83 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3m83 h ALA 220 CO 0.07 -0.03 -0.37 0.28 0.00 0.00 0.00 179.25 179.20 3m83 h VAL 221 N 0.61 1.27 0.00 0.00 2.07 -1.40 -2.11 116.25 116.69 3m83 h VAL 221 Ca 0.32 -1.28 -0.08 0.00 0.82 0.00 0.00 66.70 66.48 3m83 h VAL 221 Cb 0.29 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 3m83 h VAL 221 CO -0.23 0.36 -0.97 -0.61 0.02 0.00 0.00 177.57 176.14 3m83 h GLN 222 N 0.00 0.00 0.05 1.57 4.15 -1.44 -3.39 115.11 116.04 3m83 h GLN 222 Ca -0.00 0.00 -0.27 0.00 0.77 0.00 0.00 58.65 59.15 3m83 h GLN 222 Cb 0.66 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.32 3m83 h GLN 222 CO 0.05 0.20 -1.47 1.25 -1.93 0.00 0.00 178.83 176.93 3m83 h LEU 223 N 0.00 0.16 -8.96 -2.39 6.46 -1.03 -3.48 115.31 106.07 3m83 h LEU 223 Ca -0.06 -0.68 -0.64 0.00 -0.12 0.00 0.00 57.88 56.38 3m83 h LEU 223 Cb 1.29 -0.05 -0.19 0.00 -0.73 0.00 0.00 40.66 40.98 3m83 h LEU 223 CO 0.03 1.60 -0.83 0.68 -0.62 0.00 0.00 178.44 179.31 3m83 s VAL 224 N -2.43 2.22 -0.53 1.05 -7.23 -0.82 -5.02 120.40 107.63 3m83 s VAL 224 Ca -0.26 -1.94 0.12 0.00 -1.81 0.00 0.00 61.98 58.10 3m83 s VAL 224 Cb 0.06 -2.03 0.35 0.00 0.56 0.00 0.00 36.38 35.33 3m83 s VAL 224 CO 0.66 -0.10 1.28 -0.90 -0.31 0.00 0.00 175.10 175.73 3m83 n ASP 225 N 0.44 3.14 -4.87 4.85 5.75 -1.26 -4.70 116.55 119.90 3m83 n ASP 225 Ca -0.14 -2.41 -0.30 0.00 -0.01 0.00 0.00 54.79 51.92 3m83 n ASP 225 Cb 0.55 -0.33 -0.02 0.00 -1.03 0.00 0.00 41.12 40.30 3m83 n ASP 225 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3m83 s THR 226 N -1.74 4.72 0.46 2.12 -4.23 -1.26 -4.74 115.64 110.97 3m83 s THR 226 Ca 0.28 0.78 -0.19 0.00 -1.18 0.00 0.00 61.69 61.38 3m83 s THR 226 Cb 0.19 -3.78 -0.10 0.00 1.34 0.00 0.00 72.50 70.16 3m83 s THR 226 CO 0.11 -0.74 0.95 -1.00 -0.54 0.00 0.00 174.62 173.40 3m83 s HIS 227 N -2.66 3.37 -1.32 3.99 3.76 -1.26 -1.02 115.29 120.15 3m83 s HIS 227 Ca 0.54 1.53 0.27 0.00 -0.15 0.00 0.00 55.06 57.25 3m83 s HIS 227 Cb -0.10 -2.81 0.95 0.00 1.11 0.00 0.00 32.58 31.72 3m83 s HIS 227 CO 0.38 -0.20 1.70 -0.35 -0.85 0.00 0.00 174.74 175.41 3m83 n PRO 228 N -1.01 0.34 0.04 8.40 -0.05 -1.26 -4.87 135.00 136.59 3m83 n PRO 228 Ca 0.07 -0.14 0.10 0.00 -0.05 0.00 0.00 63.50 63.48 3m83 n PRO 228 Cb 0.54 -1.50 0.55 0.00 -0.05 0.00 0.00 33.50 33.04 3m83 n PRO 228 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 175.50 177.33 3m83 h TYR 229 N 0.34 0.27 0.00 0.54 0.05 -1.86 -1.24 116.97 115.07 3m83 h TYR 229 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 3m83 h TYR 229 Cb 0.45 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.10 3m83 h TYR 229 CO 0.00 0.15 0.00 0.00 -1.05 0.00 0.00 178.16 177.26 3m83 h ALA 230 N 1.80 1.00 -0.84 3.88 0.00 -1.37 -1.94 119.26 121.79 3m83 h ALA 230 Ca 0.17 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.12 3m83 h ALA 230 Cb 0.32 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 3m83 h ALA 230 CO -0.03 0.00 0.54 0.93 0.00 0.00 0.00 179.25 180.68 3m83 h GLU 231 N 0.00 1.00 -0.15 0.00 5.08 -1.50 -0.55 114.58 118.46 3m83 h GLU 231 Ca 0.00 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3m83 h GLU 231 Cb 0.13 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3m83 h GLU 231 CO 0.00 0.66 0.00 0.82 -1.00 0.00 0.00 179.01 179.49 3m83 h ILE 232 N 1.03 1.25 -0.52 3.13 2.04 -1.52 -2.08 117.51 120.83 3m83 h ILE 232 Ca 0.34 -0.81 0.03 0.00 1.00 0.00 0.00 64.86 65.42 3m83 h ILE 232 Cb 0.05 1.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 3m83 h ILE 232 CO -0.13 0.24 0.30 0.74 0.00 0.00 0.00 178.15 179.30 3m83 h THR 233 N 0.00 1.03 -0.40 -0.27 2.02 -1.51 -1.04 112.91 112.75 3m83 h THR 233 Ca 0.04 -0.21 -0.10 0.00 0.77 0.00 0.00 66.41 66.92 3m83 h THR 233 Cb 0.36 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 3m83 h THR 233 CO 0.01 0.11 -0.16 0.78 0.37 0.00 0.00 175.52 176.62 3m83 h ASN 234 N 0.60 0.74 -0.43 4.18 2.35 -1.02 0.17 115.58 122.16 3m83 h ASN 234 Ca 0.22 -0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3m83 h ASN 234 Cb 0.05 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 3m83 h ASN 234 CO -0.11 0.90 0.26 0.15 -1.65 0.00 0.00 177.43 176.99 3m83 h PHE 235 N 0.66 0.56 -0.06 1.19 3.04 -1.12 -2.97 116.94 118.24 3m83 h PHE 235 Ca 0.10 0.00 -0.09 0.00 3.98 0.00 0.00 57.97 61.96 3m83 h PHE 235 Cb 0.64 -0.19 -0.01 0.00 2.56 0.00 0.00 35.95 38.96 3m83 h PHE 235 CO 0.03 0.39 -0.38 -0.07 -2.02 0.00 0.00 178.31 176.27 3m83 h LEU 236 N 0.57 0.13 -1.83 0.59 3.38 -0.71 0.79 115.31 118.23 3m83 h LEU 236 Ca 0.15 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3m83 h LEU 236 Cb -0.01 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3m83 h LEU 236 CO -0.03 0.50 0.04 0.11 0.09 0.00 0.00 178.44 179.15 3m83 h LYS 237 N 0.11 0.15 0.00 1.13 1.57 -0.81 -3.27 116.57 115.44 3m83 h LYS 237 Ca 0.01 -0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 3m83 h LYS 237 Cb 0.72 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.96 3m83 h LYS 237 CO 0.05 0.13 -1.50 2.41 -0.57 0.00 0.00 179.45 179.97 3m83 n THR 238 N -4.49 1.51 -2.38 -0.16 -1.04 -1.06 -4.64 114.28 102.02 3m83 n THR 238 Ca -0.01 -0.08 -0.43 0.00 -2.04 0.00 0.00 64.05 61.49 3m83 n THR 238 Cb 0.11 -2.07 0.00 0.00 -1.82 0.00 0.00 70.33 66.55 3m83 n THR 238 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 3m83 n HIS 239 N -4.41 3.21 0.33 -1.42 8.25 0.25 -4.78 115.22 116.65 3m83 n HIS 239 Ca -0.34 -2.86 0.15 0.00 -0.26 0.00 0.00 57.72 54.41 3m83 n HIS 239 Cb 0.67 -2.00 0.62 0.00 1.12 0.00 0.00 29.99 30.39 3m83 n HIS 239 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3m83 h ARG 240 N 5.92 0.00 -0.01 -0.41 3.08 -1.82 -2.04 114.38 119.11 3m83 h ARG 240 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 3m83 h ARG 240 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.71 3m83 h ARG 240 CO 1.59 0.00 -0.05 -0.40 -1.07 0.00 0.00 179.97 180.04 3m83 n ASP 241 N -2.73 0.94 -0.59 7.04 5.75 -1.26 -4.41 116.55 121.28 3m83 n ASP 241 Ca 0.01 -1.15 0.05 0.00 -0.01 0.00 0.00 54.79 53.69 3m83 n ASP 241 Cb 0.27 0.00 0.15 0.00 -1.03 0.00 0.00 41.12 40.51 3m83 n ASP 241 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3m83 n LYS 242 N -0.38 2.88 -0.06 0.11 4.76 -0.77 -4.74 118.16 119.96 3m83 n LYS 242 Ca 0.18 -2.08 -0.08 0.00 -2.87 0.00 0.00 58.31 53.47 3m83 n LYS 242 Cb 0.29 -1.30 -0.01 0.00 -1.84 0.00 0.00 35.03 32.17 3m83 n LYS 242 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 3m83 h GLU 243 N 1.77 0.13 -0.35 1.97 4.81 -1.77 -0.36 114.58 120.78 3m83 h GLU 243 Ca 0.00 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3m83 h GLU 243 Cb 0.78 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 3m83 h GLU 243 CO 0.02 0.09 0.14 1.49 -0.73 0.00 0.00 179.01 180.02 3m83 h GLU 244 N 0.14 0.52 -0.61 1.92 4.81 -1.95 -2.35 114.58 117.05 3m83 h GLU 244 Ca 0.12 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 3m83 h GLU 244 Cb 0.13 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 3m83 h GLU 244 CO -0.16 0.51 0.35 0.82 -0.73 0.00 0.00 179.01 179.80 3m83 h ILE 245 N 0.42 1.19 -0.07 2.32 2.04 -1.84 -1.42 117.51 120.14 3m83 h ILE 245 Ca 0.12 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.53 3m83 h ILE 245 Cb 0.18 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.64 3m83 h ILE 245 CO -0.01 0.20 0.04 0.58 0.00 0.00 0.00 178.15 178.96 3m83 h VAL 246 N 0.83 1.03 0.00 1.67 2.07 -0.86 -1.60 116.25 119.38 3m83 h VAL 246 Ca 0.22 -0.06 -0.08 0.00 0.82 0.00 0.00 66.70 67.60 3m83 h VAL 246 Cb 0.01 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3m83 h VAL 246 CO -0.04 0.02 -0.38 -0.26 0.02 0.00 0.00 177.57 176.93 3m83 h PHE 247 N 0.08 0.00 0.00 1.57 0.04 -1.37 -1.86 116.94 115.40 3m83 h PHE 247 Ca 0.02 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 3m83 h PHE 247 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 3m83 h PHE 247 CO -0.07 0.38 -0.00 -0.09 -0.60 0.00 0.00 178.31 177.93 3m83 h ARG 248 N 0.00 -0.00 -0.21 1.51 2.43 -1.05 -2.11 114.38 114.95 3m83 h ARG 248 Ca -0.00 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 3m83 h ARG 248 Cb 1.09 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.61 3m83 h ARG 248 CO 0.05 0.13 0.02 1.15 -1.51 0.00 0.00 179.97 179.81 3m83 h THR 249 N -0.14 0.88 0.00 0.20 2.02 -1.15 -3.00 112.91 111.71 3m83 h THR 249 Ca -0.00 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 3m83 h THR 249 Cb 0.14 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.32 3m83 h THR 249 CO 0.00 0.02 -0.13 -0.07 0.37 0.00 0.00 175.52 175.70 3m83 h LEU 250 N 0.10 0.00 -1.97 2.58 3.38 -1.29 -2.40 115.31 115.71 3m83 h LEU 250 Ca 0.10 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.19 3m83 h LEU 250 Cb 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3m83 h LEU 250 CO -0.14 0.13 0.32 0.77 0.09 0.00 0.00 178.44 179.61 3m83 h SER 251 N 0.00 0.03 1.01 -0.43 4.64 -1.23 -0.81 113.55 116.75 3m83 h SER 251 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m83 h SER 251 Cb 0.25 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 3m83 h SER 251 CO 0.02 0.01 0.00 -1.22 -0.87 0.00 0.00 176.83 174.77 3m83 n TYR 252 N -4.41 0.56 -0.08 4.77 4.02 -0.90 -3.59 117.16 117.53 3m83 n TYR 252 Ca 0.08 0.19 0.00 0.00 -0.01 0.00 0.00 57.90 58.15 3m83 n TYR 252 Cb 0.51 -0.80 0.00 0.00 -0.02 0.00 0.00 39.34 39.03 3m83 n TYR 252 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 3m83 n PHE 253 N -1.98 0.00 -2.73 -0.72 3.72 -0.35 -5.03 117.46 110.38 3m83 n PHE 253 Ca 0.05 -0.33 -0.42 0.00 -0.05 0.00 0.00 57.45 56.69 3m83 n PHE 253 Cb 0.31 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.79 3m83 n PHE 253 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3m83 s ASP 254 N -0.65 7.08 0.52 4.37 -1.08 -0.97 -4.87 116.67 121.07 3m83 s ASP 254 Ca 0.00 1.34 0.26 0.00 -0.52 0.00 0.00 52.55 53.63 3m83 s ASP 254 Cb 0.00 -2.52 1.39 0.00 -1.46 0.00 0.00 42.92 40.33 3m83 s ASP 254 CO 0.00 -0.56 1.95 1.23 0.52 0.00 0.00 175.17 178.31 3m83 h GLY 255 N 8.94 0.08 0.95 2.66 0.00 -1.43 -0.01 103.07 114.27 3m83 h GLY 255 Ca -0.24 -0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.09 3m83 h GLY 255 CO 0.92 0.00 0.63 -2.08 0.00 0.00 0.00 176.54 176.01 3m83 h VAL 256 N 0.05 1.21 -0.01 4.60 2.07 -1.90 0.12 116.25 122.38 3m83 h VAL 256 Ca 0.32 -0.43 -0.18 0.00 0.82 0.00 0.00 66.70 67.23 3m83 h VAL 256 Cb 1.22 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 3m83 h VAL 256 CO -0.02 0.23 -0.81 0.78 0.02 0.00 0.00 177.57 177.77 3m83 h ASN 257 N 1.26 0.24 -0.29 0.57 2.35 -1.34 -2.71 115.58 115.67 3m83 h ASN 257 Ca 0.36 -0.18 -0.10 0.00 -0.55 0.00 0.00 56.30 55.83 3m83 h ASN 257 Cb -0.09 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 3m83 h ASN 257 CO -0.09 0.95 -0.23 -0.26 -1.65 0.00 0.00 177.43 176.15 3m83 h PHE 258 N 0.11 0.78 -0.80 1.19 0.04 -1.33 -3.29 116.94 113.65 3m83 h PHE 258 Ca -0.03 -0.22 0.09 0.00 2.80 0.00 0.00 57.97 60.60 3m83 h PHE 258 Cb 1.41 -0.17 -0.07 0.00 2.20 0.00 0.00 35.95 39.32 3m83 h PHE 258 CO 0.03 0.94 0.46 0.00 -0.60 0.00 0.00 178.31 179.13 3m83 h ALA 259 N 0.72 1.13 0.00 2.45 0.00 -0.69 -0.49 119.26 122.37 3m83 h ALA 259 Ca 0.05 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3m83 h ALA 259 Cb 0.79 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3m83 h ALA 259 CO 0.06 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.41 3m83 h ALA 260 N 1.44 1.00 0.00 0.00 0.00 -1.48 -1.74 119.26 118.47 3m83 h ALA 260 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 3m83 h ALA 260 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3m83 h ALA 260 CO -0.24 0.00 -0.75 0.54 0.00 0.00 0.00 179.25 178.81 3m83 n ARG 261 N -2.64 2.14 -2.98 0.00 1.74 -0.25 -4.64 116.66 110.02 3m83 n ARG 261 Ca -0.02 -0.01 -0.39 0.00 -0.77 0.00 0.00 57.85 56.66 3m83 n ARG 261 Cb 0.07 -1.19 -0.06 0.00 -1.02 0.00 0.00 32.46 30.26 3m83 n ARG 261 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3m83 s ALA 262 N -2.40 3.44 0.00 7.54 0.00 -0.86 -4.81 121.76 124.66 3m83 s ALA 262 Ca 0.05 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.36 3m83 s ALA 262 Cb 0.11 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.27 3m83 s ALA 262 CO 0.59 0.29 0.00 1.63 0.00 0.00 0.00 175.76 178.27 3m83 n LYS 263 N 1.48 4.09 -2.31 0.00 4.76 -1.26 -1.43 118.16 123.48 3m83 n LYS 263 Ca -0.05 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.07 3m83 n LYS 263 Cb 0.49 -0.69 -0.02 0.00 -1.84 0.00 0.00 35.03 32.97 3m83 n LYS 263 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 3m83 s ILE 264 N -1.36 4.34 0.33 -0.18 -4.36 -1.26 -4.24 121.20 114.47 3m83 s ILE 264 Ca 0.00 1.13 -0.29 0.00 -0.26 0.00 0.00 60.65 61.23 3m83 s ILE 264 Cb 0.00 -3.63 -0.12 0.00 1.25 0.00 0.00 42.46 39.96 3m83 s ILE 264 CO 0.00 -0.64 1.45 -2.65 0.24 0.00 0.00 174.94 173.34 3m83 n PRO 265 N -1.69 2.46 -4.02 0.37 -0.02 -1.26 -4.19 135.00 126.66 3m83 n PRO 265 Ca 0.07 0.87 -0.14 0.00 -2.02 0.00 0.00 63.50 62.28 3m83 n PRO 265 Cb 0.54 -2.56 -0.14 0.00 -0.02 0.00 0.00 33.50 31.31 3m83 n PRO 265 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m83 s ALA 266 N -0.70 0.23 -0.25 3.55 0.00 0.08 -0.96 121.76 123.71 3m83 s ALA 266 Ca 0.58 -0.10 -0.03 0.00 0.00 0.00 0.00 51.96 52.41 3m83 s ALA 266 Cb -0.53 -0.07 0.01 0.00 0.00 0.00 0.00 23.12 22.53 3m83 s ALA 266 CO 0.58 0.05 -0.03 -1.17 0.00 0.00 0.00 175.76 175.19 3m83 s LEU 267 N -0.01 3.20 0.29 0.00 2.96 -0.43 -1.47 118.68 123.23 3m83 s LEU 267 Ca 0.01 -0.69 0.04 0.00 -0.22 0.00 0.00 54.13 53.27 3m83 s LEU 267 Cb -0.02 -1.73 -0.02 0.00 0.50 0.00 0.00 46.19 44.92 3m83 s LEU 267 CO -0.00 -0.10 0.44 -0.36 -1.32 0.00 0.00 176.35 175.00 3m83 s PHE 268 N 1.41 3.37 0.04 5.38 0.40 -0.00 -1.23 117.98 127.34 3m83 s PHE 268 Ca 0.03 0.01 -0.03 0.00 -0.60 0.00 0.00 56.93 56.34 3m83 s PHE 268 Cb -0.16 -1.77 -0.02 0.00 0.51 0.00 0.00 43.02 41.58 3m83 s PHE 268 CO -0.03 0.23 0.02 -1.54 0.70 0.00 0.00 175.22 174.60 3m83 s SER 269 N -4.05 0.30 -0.15 1.36 1.04 -0.90 -1.28 113.70 110.02 3m83 s SER 269 Ca 0.38 -0.68 -0.14 0.00 0.48 0.00 0.00 55.95 56.00 3m83 s SER 269 Cb -0.09 0.18 0.04 0.00 0.10 0.00 0.00 66.02 66.25 3m83 s SER 269 CO 0.31 -0.48 0.40 0.54 0.98 0.00 0.00 173.24 174.99 3m83 s VAL 270 N -2.73 0.00 -0.23 5.02 0.11 -0.82 -1.61 120.40 120.13 3m83 s VAL 270 Ca -0.04 -0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 58.94 3m83 s VAL 270 Cb -0.01 -0.56 -0.03 0.00 -1.53 0.00 0.00 36.38 34.26 3m83 s VAL 270 CO -0.05 -0.00 0.05 -0.83 -3.33 0.00 0.00 175.10 170.93 3m83 s GLY 271 N 0.20 1.75 0.27 6.54 0.00 -1.26 -0.91 107.32 113.91 3m83 s GLY 271 Ca -0.00 -1.09 0.24 0.00 0.00 0.00 0.00 44.72 43.87 3m83 s GLY 271 CO 0.01 0.45 1.72 1.04 0.00 0.00 0.00 173.10 176.31 3m83 n LEU 272 N 4.72 0.69 -1.13 0.66 4.77 -0.67 -1.68 117.00 124.36 3m83 n LEU 272 Ca -0.16 0.68 0.08 0.00 -0.03 0.00 0.00 56.01 56.57 3m83 n LEU 272 Cb 0.51 -0.60 0.28 0.00 -2.33 0.00 0.00 43.42 41.28 3m83 n LEU 272 CO 0.31 -0.60 0.74 0.23 -1.33 0.00 0.00 177.39 176.74 3m83 n MET 273 N -2.27 3.32 -2.26 3.23 2.81 -0.81 -4.67 117.12 116.48 3m83 n MET 273 Ca 0.02 -2.67 -0.43 0.00 -1.81 0.00 0.00 57.70 52.80 3m83 n MET 273 Cb 0.22 -1.74 -0.02 0.00 -0.71 0.00 0.00 33.22 30.97 3m83 n MET 273 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3m83 s ASP 274 N -1.26 6.25 0.00 7.83 -1.08 -0.67 -4.44 116.67 123.29 3m83 s ASP 274 Ca 0.41 1.01 0.23 0.00 -0.52 0.00 0.00 52.55 53.67 3m83 s ASP 274 Cb 0.28 -2.54 0.52 0.00 -1.46 0.00 0.00 42.92 39.73 3m83 s ASP 274 CO 0.17 -1.47 1.46 -0.46 0.52 0.00 0.00 175.17 175.39 3m83 n ASN 275 N 9.08 3.54 -0.11 -0.34 6.94 -1.26 -3.53 115.26 129.57 3m83 n ASN 275 Ca 0.18 -1.99 -0.21 0.00 -0.02 0.00 0.00 54.58 52.55 3m83 n ASN 275 Cb 0.47 -0.34 -0.08 0.00 -2.36 0.00 0.00 39.78 37.48 3m83 n ASN 275 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 3m83 n ILE 276 N 1.49 1.51 -3.81 1.53 2.08 -1.26 -4.60 119.36 116.30 3m83 n ILE 276 Ca 0.21 -0.11 -0.34 0.00 0.56 0.00 0.00 62.75 63.08 3m83 n ILE 276 Cb 0.60 -2.08 -0.11 0.00 -0.75 0.00 0.00 39.64 37.30 3m83 n ILE 276 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3m83 s PRO 278 N -0.30 3.54 0.44 0.00 0.02 -1.23 -4.73 135.00 132.74 3m83 s PRO 278 Ca 0.18 2.32 0.17 0.00 0.02 0.00 0.00 61.00 63.69 3m83 s PRO 278 Cb -0.21 -2.53 1.10 0.00 0.02 0.00 0.00 34.50 32.87 3m83 s PRO 278 CO -0.03 -0.90 1.93 -1.35 -0.33 0.00 0.00 177.00 176.32 3m83 h PRO 279 N 2.07 0.35 -0.10 5.54 0.11 -1.79 -1.23 132.00 136.95 3m83 h PRO 279 Ca -0.51 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.52 3m83 h PRO 279 Cb 1.27 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3m83 h PRO 279 CO 0.60 0.23 -0.23 0.66 -0.21 0.00 0.00 178.00 179.05 3m83 h SER 280 N 0.36 0.16 -0.11 -2.05 4.64 -1.94 0.93 113.55 115.55 3m83 h SER 280 Ca 0.36 -0.04 -0.24 0.00 -0.47 0.00 0.00 61.79 61.40 3m83 h SER 280 Cb 0.88 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.94 3m83 h SER 280 CO -0.10 0.41 -0.85 0.71 -0.87 0.00 0.00 176.83 176.12 3m83 h THR 281 N 0.16 1.27 -0.18 2.95 1.35 -1.56 -1.93 112.91 114.97 3m83 h THR 281 Ca 0.03 -2.04 -0.03 0.00 -0.55 0.00 0.00 66.41 63.81 3m83 h THR 281 Cb 0.50 2.08 -0.01 0.00 -1.73 0.00 0.00 68.15 69.00 3m83 h THR 281 CO 0.03 0.64 -0.02 0.58 -0.25 0.00 0.00 175.52 176.51 3m83 h VAL 282 N 0.51 1.27 -0.54 6.82 2.07 -1.28 -2.89 116.25 122.21 3m83 h VAL 282 Ca -0.07 -0.92 -0.07 0.00 0.82 0.00 0.00 66.70 66.46 3m83 h VAL 282 Cb 1.49 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.75 3m83 h VAL 282 CO 0.17 0.28 0.06 -0.26 0.02 0.00 0.00 177.57 177.84 3m83 h PHE 283 N 0.07 0.91 -0.35 1.57 0.04 -0.89 0.07 116.94 118.36 3m83 h PHE 283 Ca 0.05 -0.11 0.07 0.00 2.80 0.00 0.00 57.97 60.77 3m83 h PHE 283 Cb 0.43 -0.26 -0.06 0.00 2.20 0.00 0.00 35.95 38.26 3m83 h PHE 283 CO 0.04 0.80 -0.08 0.00 -0.60 0.00 0.00 178.31 178.48 3m83 h ALA 284 N 1.25 0.24 -0.26 2.45 0.00 -1.30 0.18 119.26 121.81 3m83 h ALA 284 Ca 0.17 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 3m83 h ALA 284 Cb 0.40 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3m83 h ALA 284 CO 0.01 -0.45 0.08 0.00 0.00 0.00 0.00 179.25 178.89 3m83 h ALA 285 N 1.34 0.34 -0.75 0.00 0.00 -1.28 -2.56 119.26 116.36 3m83 h ALA 285 Ca 0.17 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3m83 h ALA 285 Cb 0.25 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3m83 h ALA 285 CO -0.35 -0.03 0.36 -0.92 0.00 0.00 0.00 179.25 178.31 3m83 h TYR 286 N 0.26 1.07 -0.05 0.00 3.20 -0.70 -1.80 116.97 118.94 3m83 h TYR 286 Ca 0.08 -0.05 -0.11 0.00 3.14 0.00 0.00 58.73 61.79 3m83 h TYR 286 Cb 0.23 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 3m83 h TYR 286 CO 0.00 0.78 -0.49 -0.91 -1.64 0.00 0.00 178.16 175.91 3m83 h ASN 287 N 1.05 0.14 0.96 -2.11 2.35 -0.62 -2.55 115.58 114.79 3m83 h ASN 287 Ca 0.26 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 3m83 h ASN 287 Cb 0.11 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.44 3m83 h ASN 287 CO -0.03 0.60 -0.36 -1.22 -1.65 0.00 0.00 177.43 174.77 3m83 n TYR 288 N -3.96 0.45 -1.68 1.19 4.01 -0.97 -4.91 117.16 111.29 3m83 n TYR 288 Ca -0.02 0.13 -0.44 0.00 -0.16 0.00 0.00 57.90 57.41 3m83 n TYR 288 Cb 0.52 -0.62 -0.04 0.00 -0.31 0.00 0.00 39.34 38.89 3m83 n TYR 288 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 3m83 n TYR 289 N -1.94 2.50 1.07 -0.72 9.36 -0.69 -3.34 117.16 123.40 3m83 n TYR 289 Ca 0.05 -0.04 0.12 0.00 3.32 0.00 0.00 57.90 61.35 3m83 n TYR 289 Cb 0.40 -2.68 0.15 0.00 -0.63 0.00 0.00 39.34 36.58 3m83 n TYR 289 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3m83 n ALA 290 N 5.37 3.70 -1.97 2.98 0.00 -0.70 -4.92 120.51 124.96 3m83 n ALA 290 Ca 0.19 -0.48 -0.22 0.00 0.00 0.00 0.00 53.44 52.93 3m83 n ALA 290 Cb 0.34 -0.98 0.05 0.00 0.00 0.00 0.00 19.45 18.86 3m83 n ALA 290 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3m83 s GLY 291 N -2.76 1.80 0.30 0.00 0.00 -0.52 -4.76 107.32 101.39 3m83 s GLY 291 Ca 0.16 -1.38 -0.30 0.00 0.00 0.00 0.00 44.72 43.20 3m83 s GLY 291 CO 0.66 -1.03 1.53 -1.05 0.00 0.00 0.00 173.10 173.21 3m83 n PRO 292 N -2.50 2.56 -3.73 2.90 -0.02 -1.26 -4.85 135.00 128.10 3m83 n PRO 292 Ca 0.09 0.91 -0.13 0.00 -2.02 0.00 0.00 63.50 62.35 3m83 n PRO 292 Cb 0.60 -2.65 -0.08 0.00 -0.02 0.00 0.00 33.50 31.35 3m83 n PRO 292 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 3m83 s LYS 293 N -0.89 0.75 0.04 -0.52 -2.85 -1.26 -0.74 119.74 114.26 3m83 s LYS 293 Ca 0.62 -0.24 0.00 0.00 -1.00 0.00 0.00 55.97 55.35 3m83 s LYS 293 Cb -0.52 0.33 -0.03 0.00 -2.06 0.00 0.00 37.83 35.55 3m83 s LYS 293 CO 0.53 -0.22 -0.04 -1.21 0.10 0.00 0.00 175.35 174.50 3m83 s GLU 294 N -1.66 0.49 -0.05 1.78 2.02 -0.54 -4.97 118.70 115.78 3m83 s GLU 294 Ca -0.11 -0.91 0.02 0.00 0.02 0.00 0.00 54.97 54.00 3m83 s GLU 294 Cb -0.04 0.06 0.01 0.00 0.10 0.00 0.00 34.13 34.26 3m83 s GLU 294 CO 0.03 -0.05 -0.10 -1.50 0.02 0.00 0.00 175.26 173.66 3m83 s ILE 295 N -2.48 0.90 -0.24 -1.63 2.07 -1.26 -0.82 121.20 117.73 3m83 s ILE 295 Ca -0.05 -0.37 -0.14 0.00 -1.41 0.00 0.00 60.65 58.68 3m83 s ILE 295 Cb -0.02 -0.83 -0.04 0.00 0.13 0.00 0.00 42.46 41.69 3m83 s ILE 295 CO -0.04 0.29 0.32 -0.13 -1.91 0.00 0.00 174.94 173.47 3m83 s ARG 296 N 0.53 4.07 -0.22 3.50 1.81 -0.41 -4.96 118.95 123.27 3m83 s ARG 296 Ca -0.10 -0.01 -0.07 0.00 -1.72 0.00 0.00 55.73 53.84 3m83 s ARG 296 Cb -0.13 -3.59 -0.03 0.00 -0.45 0.00 0.00 34.95 30.75 3m83 s ARG 296 CO 0.02 -0.12 0.06 0.42 -0.68 0.00 0.00 175.30 175.00 3m83 s ILE 297 N 1.58 4.41 -0.59 1.52 1.01 -1.26 -1.95 121.20 125.92 3m83 s ILE 297 Ca 0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 60.65 60.62 3m83 s ILE 297 Cb -0.15 -3.03 0.15 0.00 0.01 0.00 0.00 42.46 39.44 3m83 s ILE 297 CO 0.08 0.39 0.39 -0.31 0.00 0.00 0.00 174.94 175.49 3m83 s TYR 298 N 1.12 3.40 0.54 3.97 2.02 -0.09 -4.99 117.35 123.32 3m83 s TYR 298 Ca 0.04 -2.76 0.21 0.00 -0.37 0.00 0.00 57.07 54.20 3m83 s TYR 298 Cb -0.14 -3.15 1.39 0.00 -0.40 0.00 0.00 41.96 39.66 3m83 s TYR 298 CO 0.03 -0.84 2.10 -1.35 -1.57 0.00 0.00 175.55 173.92 3m83 h PRO 299 N 7.06 0.00 -0.03 -1.71 0.11 -1.95 -1.72 132.00 133.75 3m83 h PRO 299 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 3m83 h PRO 299 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3m83 h PRO 299 CO 0.71 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.16 3m83 n TYR 300 N -4.36 0.02 -3.67 0.65 4.01 -1.26 -4.05 117.16 108.50 3m83 n TYR 300 Ca 0.02 -0.02 -0.36 0.00 -0.16 0.00 0.00 57.90 57.38 3m83 n TYR 300 Cb 0.28 -0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.26 3m83 n TYR 300 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3m83 s ASN 301 N -1.22 6.59 0.00 7.72 -0.87 -1.09 -4.82 114.94 121.25 3m83 s ASN 301 Ca 0.18 0.70 0.00 0.00 -1.57 0.00 0.00 52.86 52.17 3m83 s ASN 301 Cb 0.12 -2.15 0.00 0.00 -0.02 0.00 0.00 41.25 39.21 3m83 s ASN 301 CO 0.19 0.28 0.00 0.59 -2.57 0.00 0.00 177.10 175.59 3m83 n ASN 302 N 1.42 0.00 0.26 -1.22 3.02 -1.26 -1.92 115.26 115.56 3m83 n ASN 302 Ca -0.13 0.00 0.17 0.00 -0.03 0.00 0.00 54.58 54.60 3m83 n ASN 302 Cb 0.53 0.00 0.79 0.00 -0.61 0.00 0.00 39.78 40.49 3m83 n ASN 302 CO 0.00 0.00 0.00 -0.74 -2.62 0.00 0.00 177.26 173.90 3m83 h HIS 303 N 0.00 0.00 0.00 3.10 2.76 -1.92 -1.63 115.15 117.46 3m83 h HIS 303 Ca 0.00 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3m83 h HIS 303 Cb 0.00 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 28.96 3m83 h HIS 303 CO 0.00 0.00 -0.02 1.05 -1.30 0.00 0.00 177.93 177.66 3m83 h GLU 304 N 0.00 0.00 0.00 5.26 9.09 -2.00 -3.48 114.58 123.45 3m83 h GLU 304 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3m83 h GLU 304 Cb 0.31 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.41 3m83 h GLU 304 CO 0.00 0.02 0.00 0.41 0.05 0.00 0.00 179.01 179.49 3m83 n GLY 305 N -1.09 2.83 0.08 1.06 0.00 -0.61 -2.56 105.19 104.90 3m83 n GLY 305 Ca -0.03 -0.33 0.14 0.00 0.00 0.00 0.00 46.02 45.80 3m83 n GLY 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m83 n GLY 306 N 0.00 -1.07 7.00 -0.02 0.00 -1.26 -4.78 105.19 105.05 3m83 n GLY 306 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.76 3m83 n GLY 306 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m83 n GLY 307 N 1.35 3.15 0.24 -0.02 0.00 -1.06 -1.67 105.19 107.18 3m83 n GLY 307 Ca 0.12 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3m83 n GLY 307 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3m83 h SER 308 N 1.24 0.00 -0.53 1.61 0.02 -1.95 -2.55 113.55 111.39 3m83 h SER 308 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 3m83 h SER 308 Cb 0.00 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 3m83 h SER 308 CO 0.00 0.15 0.28 -0.26 -1.14 0.00 0.00 176.83 175.86 3m83 h PHE 309 N 0.00 0.73 -0.30 3.45 -1.00 -1.74 -2.85 116.94 115.23 3m83 h PHE 309 Ca -0.00 -0.02 -0.12 0.00 2.81 0.00 0.00 57.97 60.64 3m83 h PHE 309 Cb 0.72 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 40.04 3m83 h PHE 309 CO 0.00 0.55 -0.30 0.37 -1.61 0.00 0.00 178.31 177.32 3m83 h GLN 310 N 0.71 0.63 -0.96 1.51 5.75 -1.07 -2.55 115.11 119.13 3m83 h GLN 310 Ca 0.18 -0.28 0.06 0.00 -0.15 0.00 0.00 58.65 58.47 3m83 h GLN 310 Cb 0.07 -0.02 -0.06 0.00 1.07 0.00 0.00 27.48 28.53 3m83 h GLN 310 CO -0.03 0.86 0.61 0.00 -2.65 0.00 0.00 178.83 177.63 3m83 h ALA 311 N 1.13 1.32 -0.33 3.38 0.00 -1.42 -0.46 119.26 122.88 3m83 h ALA 311 Ca 0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3m83 h ALA 311 Cb 0.79 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3m83 h ALA 311 CO 0.06 0.40 0.20 0.28 0.00 0.00 0.00 179.25 180.20 3m83 h VAL 312 N 1.12 1.11 -0.68 0.00 2.07 -1.29 -2.29 116.25 116.29 3m83 h VAL 312 Ca 0.41 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.72 3m83 h VAL 312 Cb 0.15 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 3m83 h VAL 312 CO -0.17 0.11 0.45 -0.33 0.02 0.00 0.00 177.57 177.65 3m83 h GLU 313 N 0.43 0.77 -0.13 1.57 4.39 -0.93 -2.21 114.58 118.47 3m83 h GLU 313 Ca 0.12 -0.05 -0.10 0.00 0.34 0.00 0.00 59.36 59.67 3m83 h GLU 313 Cb 0.00 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.48 3m83 h GLU 313 CO -0.02 0.51 -0.31 1.96 -1.16 0.00 0.00 179.01 179.99 3m83 h GLN 314 N 0.80 0.44 -0.59 2.33 4.20 -0.80 -0.43 115.11 121.05 3m83 h GLN 314 Ca 0.28 -0.30 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 3m83 h GLN 314 Cb 0.11 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.90 3m83 h GLN 314 CO -0.08 0.91 0.36 0.28 -0.67 0.00 0.00 178.83 179.63 3m83 h VAL 315 N 0.03 1.18 -0.58 -0.54 2.07 -1.29 -1.61 116.25 115.51 3m83 h VAL 315 Ca -0.00 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.09 3m83 h VAL 315 Cb 0.92 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 3m83 h VAL 315 CO 0.07 0.18 0.22 0.11 0.02 0.00 0.00 177.57 178.17 3m83 h LYS 316 N 0.80 0.88 -0.66 1.57 1.57 -1.37 -2.16 116.57 117.20 3m83 h LYS 316 Ca 0.21 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3m83 h LYS 316 Cb -0.02 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 3m83 h LYS 316 CO -0.04 0.77 0.41 0.35 -0.57 0.00 0.00 179.45 180.37 3m83 h PHE 317 N 0.81 0.86 -0.03 -1.35 3.57 -0.84 -2.23 116.94 117.72 3m83 h PHE 317 Ca 0.19 0.00 -0.23 0.00 3.53 0.00 0.00 57.97 61.46 3m83 h PHE 317 Cb 0.23 -0.28 0.01 0.00 2.79 0.00 0.00 35.95 38.69 3m83 h PHE 317 CO 0.01 0.57 -0.93 -0.07 -2.23 0.00 0.00 178.31 175.66 3m83 h LEU 318 N 0.89 0.71 -0.14 0.59 3.38 -1.25 -1.40 115.31 118.09 3m83 h LEU 318 Ca 0.24 -0.54 0.01 0.00 0.09 0.00 0.00 57.88 57.68 3m83 h LEU 318 Cb -0.05 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 3m83 h LEU 318 CO -0.05 1.33 0.03 0.50 0.09 0.00 0.00 178.44 180.35 3m83 h LYS 319 N 0.33 0.09 -0.50 1.13 3.64 -1.32 -1.07 116.57 118.87 3m83 h LYS 319 Ca -0.09 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.25 3m83 h LYS 319 Cb 1.57 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.34 3m83 h LYS 319 CO 0.17 0.06 0.17 -0.22 -2.27 0.00 0.00 179.45 177.36 3m83 h LYS 320 N 0.10 0.77 -0.21 1.90 3.64 -1.43 -2.32 116.57 119.02 3m83 h LYS 320 Ca 0.06 -0.16 0.01 0.00 -1.27 0.00 0.00 60.65 59.29 3m83 h LYS 320 Cb 0.04 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 3m83 h LYS 320 CO -0.07 0.71 0.12 1.25 -2.27 0.00 0.00 179.45 179.19 3m83 h LEU 321 N 0.68 0.19 -0.26 5.20 5.85 -1.08 -3.07 115.31 122.82 3m83 h LEU 321 Ca 0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3m83 h LEU 321 Cb 0.25 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.25 3m83 h LEU 321 CO -0.01 0.14 -0.09 0.49 -0.34 0.00 0.00 178.44 178.64 3m83 n PHE 322 N -4.97 0.00 0.72 1.25 3.72 -0.42 -1.70 117.46 116.06 3m83 n PHE 322 Ca -0.03 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.50 3m83 n PHE 322 Cb 0.04 -0.15 0.49 0.00 -0.94 0.00 0.00 39.48 38.92 3m83 n PHE 322 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3m83 n GLU 323 N -0.88 0.11 0.00 -1.08 1.02 -0.88 -5.08 120.64 113.86 3m83 n GLU 323 Ca 0.16 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 3m83 n GLU 323 Cb 0.26 -1.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 3m83 n GLU 323 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67