#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 3.93 0.36 -1.40 1.75 -1.26 -5.09 119.30 117.59 3m83 s MET 1 Ca 0.00 0.43 -0.25 0.00 -1.25 0.00 0.00 55.69 54.62 3m83 s MET 1 Cb 0.00 -3.20 -0.10 0.00 2.84 0.00 0.00 34.83 34.37 3m83 s MET 1 CO 0.00 0.67 0.99 0.00 -0.65 0.00 0.00 175.02 176.03 3m83 s ALA 2 N -1.11 3.15 0.29 4.11 0.00 -1.26 -5.01 121.76 121.93 3m83 s ALA 2 Ca 0.25 0.59 -0.30 0.00 0.00 0.00 0.00 51.96 52.50 3m83 s ALA 2 Cb -0.17 -3.22 -0.12 0.00 0.00 0.00 0.00 23.12 19.62 3m83 s ALA 2 CO 0.14 0.01 1.57 0.34 0.00 0.00 0.00 175.76 177.82 3m83 n PHE 3 N 0.21 2.79 -3.72 0.00 7.35 -1.26 -5.03 117.46 117.80 3m83 n PHE 3 Ca 0.04 0.29 -0.13 0.00 -0.76 0.00 0.00 57.45 56.88 3m83 n PHE 3 Cb 0.50 -2.58 -0.10 0.00 0.35 0.00 0.00 39.48 37.66 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 -0.10 -0.46 0.00 -5.13 -0.71 -1.26 -4.93 117.98 105.38 3m83 s PHE 4 Ca 0.64 1.09 0.00 0.00 -1.04 0.00 0.00 56.93 57.62 3m83 s PHE 4 Cb -0.51 0.17 0.00 0.00 -1.21 0.00 0.00 43.02 41.47 3m83 s PHE 4 CO 0.50 -0.26 0.00 -3.47 -1.34 0.00 0.00 175.22 170.65 3m83 n ASP 5 N 2.64 1.39 -4.63 1.98 -0.08 -1.26 -5.09 116.55 111.49 3m83 n ASP 5 Ca -0.14 -0.40 -0.39 0.00 -1.51 0.00 0.00 54.79 52.35 3m83 n ASP 5 Cb 0.57 0.00 0.04 0.00 2.34 0.00 0.00 41.12 44.06 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 3.54 -4.69 -2.67 4.77 -1.26 -4.95 117.00 111.74 3m83 n LEU 6 Ca 0.00 0.92 -0.35 0.00 -0.03 0.00 0.00 56.01 56.54 3m83 n LEU 6 Cb 0.00 -1.41 0.09 0.00 -2.33 0.00 0.00 43.42 39.78 3m83 n LEU 6 CO 0.00 -1.52 0.78 -2.65 -1.33 0.00 0.00 177.39 172.66 3m83 n PRO 7 N -0.55 0.66 -0.31 3.23 -0.02 -1.26 -4.65 135.00 132.10 3m83 n PRO 7 Ca 0.11 0.29 0.08 0.00 -2.02 0.00 0.00 63.50 61.96 3m83 n PRO 7 Cb 0.44 -2.43 0.29 0.00 -0.02 0.00 0.00 33.50 31.78 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 -0.14 0.83 -0.92 2.45 5.85 -1.99 -0.28 115.31 121.11 3m83 h LEU 8 Ca -0.49 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 3m83 h LEU 8 Cb 1.32 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.18 3m83 h LEU 8 CO 0.49 0.45 0.50 -0.33 -0.34 0.00 0.00 178.44 179.22 3m83 h GLU 9 N 0.89 1.26 -0.24 1.25 3.07 -2.00 -1.33 114.58 117.48 3m83 h GLU 9 Ca 0.46 -0.14 -0.13 0.00 -0.50 0.00 0.00 59.36 59.05 3m83 h GLU 9 Cb 0.50 -0.25 -0.00 0.00 -0.84 0.00 0.00 28.75 28.16 3m83 h GLU 9 CO -0.22 0.92 -0.34 0.93 -1.40 0.00 0.00 179.01 178.90 3m83 h GLU 10 N 1.27 0.66 -0.73 2.33 5.08 -1.60 -3.22 114.58 118.37 3m83 h GLU 10 Ca 0.32 -0.38 0.12 0.00 -1.00 0.00 0.00 59.36 58.42 3m83 h GLU 10 Cb 0.02 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.21 3m83 h GLU 10 CO -0.05 1.00 0.31 -0.07 -1.00 0.00 0.00 179.01 179.19 3m83 h LEU 11 N 0.37 0.33 -2.02 1.33 3.38 -0.79 -1.66 115.31 116.24 3m83 h LEU 11 Ca 0.03 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3m83 h LEU 11 Cb 0.92 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.73 3m83 h LEU 11 CO 0.08 0.15 0.00 0.11 0.09 0.00 0.00 178.44 178.87 3m83 h LYS 12 N 0.48 0.00 -0.28 1.13 1.57 -1.26 -2.26 116.57 115.95 3m83 h LYS 12 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 3m83 h LYS 12 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3m83 h LYS 12 CO -0.36 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.15 3m83 n LYS 13 N -2.96 2.47 -2.51 3.15 5.02 -0.76 -5.00 118.16 117.55 3m83 n LYS 13 Ca -0.01 -1.88 -0.43 0.00 -2.02 0.00 0.00 58.31 53.97 3m83 n LYS 13 Cb 0.19 -1.25 -0.02 0.00 -0.02 0.00 0.00 35.03 33.92 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 2.64 -0.44 2.13 5.04 -0.70 -4.92 117.35 120.11 3m83 s TYR 14 Ca 0.21 0.66 0.07 0.00 -2.44 0.00 0.00 57.07 55.57 3m83 s TYR 14 Cb 0.11 -4.41 0.24 0.00 0.35 0.00 0.00 41.96 38.25 3m83 s TYR 14 CO 0.15 -1.56 0.55 0.54 -1.34 0.00 0.00 175.55 173.89 3m83 n ARG 15 N 8.03 1.01 -1.21 4.97 1.74 -1.26 -4.29 116.66 125.65 3m83 n ARG 15 Ca 0.13 -3.49 -0.33 0.00 -0.77 0.00 0.00 57.85 53.39 3m83 n ARG 15 Cb 0.49 -1.44 0.11 0.00 -1.02 0.00 0.00 32.46 30.60 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 -1.32 1.86 0.23 5.56 0.04 -1.26 -4.88 135.00 135.22 3m83 s PRO 16 Ca 0.36 1.59 -0.32 0.00 0.04 0.00 0.00 61.00 62.67 3m83 s PRO 16 Cb 0.15 -1.82 -0.12 0.00 0.04 0.00 0.00 34.50 32.76 3m83 s PRO 16 CO -0.10 -2.01 1.69 -1.91 0.04 0.00 0.00 177.00 174.70 3m83 n GLU 17 N -3.26 2.72 -3.07 4.56 2.13 -1.26 -4.96 120.64 117.50 3m83 n GLU 17 Ca 0.12 0.98 -0.36 0.00 0.66 0.00 0.00 57.16 58.56 3m83 n GLU 17 Cb 0.51 -2.81 -0.06 0.00 0.27 0.00 0.00 31.44 29.35 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 0.75 4.27 -0.17 5.31 0.52 -1.26 -5.07 118.95 123.30 3m83 s ARG 18 Ca 0.73 0.90 0.01 0.00 -0.52 0.00 0.00 55.73 56.85 3m83 s ARG 18 Cb -0.51 -2.86 0.03 0.00 0.52 0.00 0.00 34.95 32.12 3m83 s ARG 18 CO 0.36 0.38 -0.15 -0.47 0.02 0.00 0.00 175.30 175.44 3m83 s TYR 19 N -1.54 2.47 0.07 -0.53 5.04 -1.26 -5.11 117.35 116.49 3m83 s TYR 19 Ca 0.44 -1.49 -0.09 0.00 -2.44 0.00 0.00 57.07 53.50 3m83 s TYR 19 Cb -0.17 -1.73 -0.00 0.00 0.35 0.00 0.00 41.96 40.41 3m83 s TYR 19 CO 0.21 -0.74 0.19 -1.83 -1.34 0.00 0.00 175.55 172.04 3m83 s GLU 20 N 1.39 0.79 0.55 4.97 -1.05 -1.26 -4.81 118.70 119.28 3m83 s GLU 20 Ca 0.03 -0.85 -0.16 0.00 -0.15 0.00 0.00 54.97 53.84 3m83 s GLU 20 Cb -0.14 0.32 -0.06 0.00 -0.44 0.00 0.00 34.13 33.81 3m83 s GLU 20 CO -0.11 -0.24 1.01 -1.21 0.95 0.00 0.00 175.26 175.67 3m83 s GLU 21 N -3.42 3.69 0.57 -4.83 0.41 -1.26 -4.95 118.70 108.91 3m83 s GLU 21 Ca 0.02 1.01 0.29 0.00 -0.41 0.00 0.00 54.97 55.87 3m83 s GLU 21 Cb 0.03 -2.09 1.70 0.00 -1.78 0.00 0.00 34.13 31.99 3m83 s GLU 21 CO -0.09 -0.49 2.20 0.87 -0.49 0.00 0.00 175.26 177.26 3m83 h LYS 22 N 0.60 0.00 -0.69 1.61 1.57 -2.04 -2.21 116.57 115.42 3m83 h LYS 22 Ca -0.46 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.27 3m83 h LYS 22 Cb 1.20 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.48 3m83 h LYS 22 CO 0.60 0.04 0.06 -0.40 -0.57 0.00 0.00 179.45 179.18 3m83 n ASP 23 N -3.80 4.79 -0.07 0.86 5.75 -1.26 -4.63 116.55 118.18 3m83 n ASP 23 Ca -0.03 -2.84 -0.07 0.00 -0.01 0.00 0.00 54.79 51.85 3m83 n ASP 23 Cb 0.13 -0.67 -0.01 0.00 -1.03 0.00 0.00 41.12 39.54 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 3.03 -0.38 -0.53 2.11 3.04 -1.78 0.19 116.94 122.62 3m83 h PHE 24 Ca 0.06 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 61.96 3m83 h PHE 24 Cb 1.83 0.21 -0.02 0.00 2.56 0.00 0.00 35.95 40.53 3m83 h PHE 24 CO 0.96 -0.23 0.02 -0.44 -2.02 0.00 0.00 178.31 176.60 3m83 h ASP 25 N -0.12 0.90 -0.62 0.41 3.32 -1.86 -2.67 116.42 115.78 3m83 h ASP 25 Ca 0.15 -0.30 -0.07 0.00 0.02 0.00 0.00 57.03 56.83 3m83 h ASP 25 Cb 0.35 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 3m83 h ASP 25 CO -0.36 0.97 0.12 -0.33 -1.72 0.00 0.00 179.24 177.92 3m83 h GLU 26 N 0.79 1.02 -0.45 3.56 3.07 -1.80 0.16 114.58 120.93 3m83 h GLU 26 Ca 0.15 -0.27 0.06 0.00 -0.50 0.00 0.00 59.36 58.81 3m83 h GLU 26 Cb 0.50 -0.12 -0.05 0.00 -0.84 0.00 0.00 28.75 28.23 3m83 h GLU 26 CO 0.02 0.94 0.15 0.35 -1.40 0.00 0.00 179.01 179.08 3m83 h PHE 27 N 0.93 0.27 -0.09 4.33 3.57 -0.55 -0.02 116.94 125.38 3m83 h PHE 27 Ca 0.19 0.02 -0.20 0.00 3.53 0.00 0.00 57.97 61.51 3m83 h PHE 27 Cb 0.41 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.10 3m83 h PHE 27 CO 0.03 0.09 -0.78 -1.49 -2.23 0.00 0.00 178.31 173.93 3m83 h TRP 28 N 0.32 0.73 -0.00 0.41 4.06 -1.16 -1.62 115.95 118.69 3m83 h TRP 28 Ca 0.21 -0.34 0.02 0.00 2.06 0.00 0.00 58.89 60.84 3m83 h TRP 28 Cb 0.22 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 28.25 3m83 h TRP 28 CO -0.16 1.13 -0.08 0.93 -3.56 0.00 0.00 178.44 176.69 3m83 h GLU 29 N 0.36 -0.14 -0.03 0.49 5.08 -0.62 -0.60 114.58 119.12 3m83 h GLU 29 Ca -0.05 0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 3m83 h GLU 29 Cb 1.38 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.64 3m83 h GLU 29 CO 0.14 -0.09 -0.10 1.49 -1.00 0.00 0.00 179.01 179.45 3m83 h GLU 30 N -0.15 -0.16 -0.33 2.33 4.81 -1.00 -1.11 114.58 118.97 3m83 h GLU 30 Ca 0.03 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 3m83 h GLU 30 Cb 0.19 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.57 3m83 h GLU 30 CO -0.09 -0.11 0.10 1.15 -0.73 0.00 0.00 179.01 179.34 3m83 h THR 31 N -0.16 0.89 -0.28 0.32 2.02 -1.13 -0.34 112.91 114.23 3m83 h THR 31 Ca 0.05 -0.08 -0.05 0.00 0.77 0.00 0.00 66.41 67.10 3m83 h THR 31 Cb 0.23 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 3m83 h THR 31 CO -0.13 0.04 -0.03 -0.07 0.37 0.00 0.00 175.52 175.71 3m83 h LEU 32 N 0.23 0.51 -0.82 2.58 3.38 -1.03 -2.60 115.31 117.56 3m83 h LEU 32 Ca 0.15 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.81 3m83 h LEU 32 Cb 0.13 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 3m83 h LEU 32 CO -0.16 0.72 0.53 0.00 0.09 0.00 0.00 178.44 179.62 3m83 h ALA 33 N 0.81 1.08 -0.75 1.53 0.00 -0.87 0.07 119.26 121.12 3m83 h ALA 33 Ca 0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3m83 h ALA 33 Cb 0.48 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 3m83 h ALA 33 CO 0.02 0.37 0.44 0.93 0.00 0.00 0.00 179.25 181.01 3m83 h GLU 34 N 1.04 1.03 0.00 0.00 5.08 -0.98 -2.84 114.58 117.91 3m83 h GLU 34 Ca 0.33 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 58.46 3m83 h GLU 34 Cb -0.01 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.01 3m83 h GLU 34 CO -0.11 0.74 -0.57 0.77 -1.00 0.00 0.00 179.01 178.84 3m83 h SER 35 N 1.04 0.00 0.83 1.42 0.02 -0.99 -3.09 113.55 112.77 3m83 h SER 35 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 3m83 h SER 35 Cb -0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.53 3m83 h SER 35 CO -0.05 0.57 0.00 -0.33 -1.14 0.00 0.00 176.83 175.88 3m83 h GLU 36 N 0.00 0.00 0.00 3.45 5.08 -0.76 -2.82 114.58 119.52 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 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3m83 h GLU 36 CO 0.07 0.00 0.00 0.87 -1.00 0.00 0.00 179.01 178.95 3m83 h LYS 37 N 0.00 0.00 -5.78 2.33 1.57 -1.43 -3.42 116.57 109.84 3m83 h LYS 37 Ca 0.00 0.00 -0.65 0.00 -1.87 0.00 0.00 60.65 58.13 3m83 h LYS 37 Cb 0.41 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.66 3m83 h LYS 37 CO 0.00 0.00 -0.43 -0.06 -0.57 0.00 0.00 179.45 178.39 3m83 s PHE 38 N -3.42 3.60 0.31 -1.35 0.40 -1.07 -5.07 117.98 111.38 3m83 s PHE 38 Ca 0.03 0.56 -0.29 0.00 -0.60 0.00 0.00 56.93 56.62 3m83 s PHE 38 Cb 0.09 -1.97 -0.10 0.00 0.51 0.00 0.00 43.02 41.55 3m83 s PHE 38 CO 0.39 0.68 1.17 -1.25 0.70 0.00 0.00 175.22 176.90 3m83 s PRO 39 N -1.40 4.50 0.32 0.24 0.04 -1.26 -4.92 135.00 132.53 3m83 s PRO 39 Ca 0.21 1.92 0.02 0.00 0.04 0.00 0.00 61.00 63.20 3m83 s PRO 39 Cb -0.13 -3.10 0.57 0.00 0.04 0.00 0.00 34.50 31.88 3m83 s PRO 39 CO 0.11 0.05 1.93 1.25 0.04 0.00 0.00 177.00 180.37 3m83 h LEU 40 N 3.57 0.85 -3.78 -3.56 5.85 -1.91 -3.42 115.31 112.92 3m83 h LEU 40 Ca -0.48 0.00 -0.61 0.00 0.84 0.00 0.00 57.88 57.64 3m83 h LEU 40 Cb 1.22 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.03 3m83 h LEU 40 CO 0.66 0.55 -1.01 -0.67 -0.34 0.00 0.00 178.44 177.63 3m83 n ASP 41 N -4.48 -3.54 -4.73 1.25 2.03 -1.26 -1.18 116.55 104.64 3m83 n ASP 41 Ca 0.13 -1.31 -0.42 0.00 0.52 0.00 0.00 54.79 53.71 3m83 n ASP 41 Cb 0.19 -1.58 -0.03 0.00 -0.72 0.00 0.00 41.12 38.99 3m83 n ASP 41 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3m83 s PRO 42 N -7.51 4.46 -0.11 -0.67 0.04 -1.26 -4.51 135.00 125.45 3m83 s PRO 42 Ca 0.45 1.82 0.02 0.00 0.04 0.00 0.00 61.00 63.33 3m83 s PRO 42 Cb -0.25 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 31.01 3m83 s PRO 42 CO 0.98 -0.17 -0.18 0.08 0.04 0.00 0.00 177.00 177.75 3m83 s VAL 43 N 0.50 1.68 -0.19 -0.36 1.01 0.61 -5.00 120.40 118.65 3m83 s VAL 43 Ca 0.56 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.78 3m83 s VAL 43 Cb -0.31 -1.50 0.03 0.00 0.00 0.00 0.00 36.38 34.60 3m83 s VAL 43 CO 0.33 0.48 -0.16 -0.36 0.00 0.00 0.00 175.10 175.38 3m83 s PHE 44 N 0.75 2.74 -0.23 5.22 0.08 -1.26 -1.56 117.98 123.72 3m83 s PHE 44 Ca -0.11 -1.71 0.02 0.00 0.12 0.00 0.00 56.93 55.25 3m83 s PHE 44 Cb -0.16 -1.84 0.05 0.00 -0.57 0.00 0.00 43.02 40.50 3m83 s PHE 44 CO 0.02 -0.79 -0.11 -2.00 -0.10 0.00 0.00 175.22 172.23 3m83 s GLU 45 N 1.30 2.20 0.33 0.44 2.12 -0.35 -4.94 118.70 119.80 3m83 s GLU 45 Ca 0.02 -1.11 -0.29 0.00 0.36 0.00 0.00 54.97 53.95 3m83 s GLU 45 Cb -0.15 -2.69 -0.11 0.00 0.26 0.00 0.00 34.13 31.44 3m83 s GLU 45 CO -0.11 -0.49 1.52 0.50 -0.54 0.00 0.00 175.26 176.14 3m83 s ARG 46 N 1.24 4.15 0.07 4.30 6.06 -1.26 -0.22 118.95 133.28 3m83 s ARG 46 Ca -0.05 2.52 0.04 0.00 -2.50 0.00 0.00 55.73 55.75 3m83 s ARG 46 Cb -0.18 -3.01 -0.04 0.00 0.06 0.00 0.00 34.95 31.78 3m83 s ARG 46 CO -0.07 -0.54 0.01 -1.64 -2.50 0.00 0.00 175.30 170.56 3m83 s MET 47 N -1.24 2.62 0.13 5.12 -1.94 -0.64 -4.84 119.30 118.52 3m83 s MET 47 Ca 0.58 -0.78 -0.31 0.00 -1.71 0.00 0.00 55.69 53.46 3m83 s MET 47 Cb -0.46 -2.58 -0.08 0.00 2.01 0.00 0.00 34.83 33.72 3m83 s MET 47 CO 0.54 0.56 1.40 -2.00 -0.01 0.00 0.00 175.02 175.51 3m83 s GLU 48 N -2.19 4.32 0.04 2.03 2.56 -1.26 -4.74 118.70 119.45 3m83 s GLU 48 Ca 0.25 2.10 -0.12 0.00 0.00 0.00 0.00 54.97 57.20 3m83 s GLU 48 Cb -0.12 -3.23 0.01 0.00 2.00 0.00 0.00 34.13 32.79 3m83 s GLU 48 CO 0.17 -0.43 0.26 0.45 -0.56 0.00 0.00 175.26 175.15 3m83 s SER 49 N 1.02 -0.06 0.00 -1.70 0.15 -1.26 -5.02 113.70 106.83 3m83 s SER 49 Ca 0.64 -0.25 0.28 0.00 0.70 0.00 0.00 55.95 57.32 3m83 s SER 49 Cb -0.37 0.33 1.03 0.00 -1.71 0.00 0.00 66.02 65.29 3m83 s SER 49 CO 0.31 -0.58 1.76 1.41 1.20 0.00 0.00 173.24 177.34 3m83 n HIS 50 N 0.66 0.00 -1.80 3.44 8.25 -1.26 -4.90 115.22 119.62 3m83 n HIS 50 Ca -0.19 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.86 3m83 n HIS 50 Cb 0.59 -0.31 -0.02 0.00 1.12 0.00 0.00 29.99 31.37 3m83 n HIS 50 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3m83 s LEU 51 N -2.80 4.35 -0.05 2.41 1.43 -1.26 -4.93 118.68 117.83 3m83 s LEU 51 Ca 0.19 2.90 0.07 0.00 -1.03 0.00 0.00 54.13 56.26 3m83 s LEU 51 Cb 0.19 -3.63 -0.10 0.00 0.03 0.00 0.00 46.19 42.68 3m83 s LEU 51 CO 0.56 -0.90 0.07 0.29 0.23 0.00 0.00 176.35 176.60 3m83 n LYS 52 N 2.58 1.98 0.00 1.70 4.76 -1.26 -4.63 118.16 123.29 3m83 n LYS 52 Ca 0.10 -0.03 0.12 0.00 -2.87 0.00 0.00 58.31 55.63 3m83 n LYS 52 Cb 0.37 -1.19 0.13 0.00 -1.84 0.00 0.00 35.03 32.50 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 -2.12 0.00 -3.88 -0.18 -2.24 -1.26 -4.94 114.28 99.66 3m83 n THR 53 Ca -0.09 -0.30 -0.11 0.00 -2.27 0.00 0.00 64.05 61.28 3m83 n THR 53 Cb 0.58 1.11 -0.13 0.00 -2.10 0.00 0.00 70.33 69.79 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 -2.32 0.03 -0.18 2.28 1.01 -1.26 -1.41 120.40 118.55 3m83 s VAL 54 Ca 0.23 -0.23 -0.13 0.00 0.00 0.00 0.00 61.98 61.86 3m83 s VAL 54 Cb 0.19 -0.15 -0.05 0.00 0.00 0.00 0.00 36.38 36.38 3m83 s VAL 54 CO 0.48 -0.12 0.24 -1.61 0.00 0.00 0.00 175.10 174.09 3m83 s GLU 55 N -0.37 4.23 -0.14 2.72 2.02 0.11 -4.83 118.70 122.44 3m83 s GLU 55 Ca -0.04 -0.00 -0.05 0.00 0.02 0.00 0.00 54.97 54.90 3m83 s GLU 55 Cb -0.03 -3.43 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 3m83 s GLU 55 CO 0.00 0.24 0.02 0.00 0.02 0.00 0.00 175.26 175.54 3m83 s ALA 56 N 0.48 3.30 -0.04 5.21 0.00 -1.26 -0.72 121.76 128.73 3m83 s ALA 56 Ca 0.14 -0.77 0.07 0.00 0.00 0.00 0.00 51.96 51.39 3m83 s ALA 56 Cb -0.12 -1.70 -0.01 0.00 0.00 0.00 0.00 23.12 21.28 3m83 s ALA 56 CO 0.02 0.34 -0.24 0.71 0.00 0.00 0.00 175.76 176.58 3m83 s TYR 57 N -0.09 2.31 -0.10 0.00 1.51 0.37 -1.62 117.35 119.73 3m83 s TYR 57 Ca 0.05 -0.59 -0.30 0.00 -1.01 0.00 0.00 57.07 55.22 3m83 s TYR 57 Cb -0.12 -1.50 -0.03 0.00 -0.11 0.00 0.00 41.96 40.19 3m83 s TYR 57 CO 0.02 -0.14 1.29 0.34 -1.11 0.00 0.00 175.55 175.94 3m83 s ASP 58 N -0.31 6.95 -0.09 2.29 -1.08 0.69 -1.18 116.67 123.93 3m83 s ASP 58 Ca 0.02 1.82 -0.03 0.00 -0.52 0.00 0.00 52.55 53.84 3m83 s ASP 58 Cb -0.12 -2.55 -0.03 0.00 -1.46 0.00 0.00 42.92 38.76 3m83 s ASP 58 CO 0.02 -0.71 0.03 -0.69 0.52 0.00 0.00 175.17 174.33 3m83 s VAL 59 N 3.00 4.52 -0.03 1.11 1.01 -0.70 -1.21 120.40 128.11 3m83 s VAL 59 Ca 0.58 -0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.41 3m83 s VAL 59 Cb -0.25 -2.92 0.01 0.00 0.00 0.00 0.00 36.38 33.22 3m83 s VAL 59 CO 0.19 0.60 -0.08 -0.89 0.00 0.00 0.00 175.10 174.93 3m83 s THR 60 N -0.86 0.72 0.18 3.92 2.01 -0.60 -1.62 115.64 119.38 3m83 s THR 60 Ca 0.13 -0.31 -0.08 0.00 0.31 0.00 0.00 61.69 61.74 3m83 s THR 60 Cb -0.11 -0.65 -0.01 0.00 0.01 0.00 0.00 72.50 71.73 3m83 s THR 60 CO 0.03 0.23 0.29 0.72 -0.69 0.00 0.00 174.62 175.20 3m83 s PHE 61 N 0.31 0.51 -0.22 4.92 -0.71 -0.77 -0.29 117.98 121.74 3m83 s PHE 61 Ca -0.05 -0.86 -0.18 0.00 -1.04 0.00 0.00 56.93 54.81 3m83 s PHE 61 Cb -0.09 -0.10 -0.03 0.00 -1.21 0.00 0.00 43.02 41.59 3m83 s PHE 61 CO 0.00 -0.75 0.49 -1.12 -1.34 0.00 0.00 175.22 172.51 3m83 s SER 62 N -3.00 6.49 0.00 1.98 0.01 -0.32 -0.34 113.70 118.51 3m83 s SER 62 Ca 0.21 0.59 0.00 0.00 1.31 0.00 0.00 55.95 58.06 3m83 s SER 62 Cb 0.03 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.99 3m83 s SER 62 CO 0.03 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.09 3m83 n GLY 63 N 4.08 0.55 3.70 3.44 0.00 0.81 -4.80 105.19 112.98 3m83 n GLY 63 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 3.13 2.62 -1.63 1.61 5.04 -1.26 -3.49 117.35 123.38 3m83 s TYR 64 Ca 0.00 0.40 -0.10 0.00 -2.44 0.00 0.00 57.07 54.93 3m83 s TYR 64 Cb 0.00 -3.97 0.10 0.00 0.35 0.00 0.00 41.96 38.44 3m83 s TYR 64 CO 0.00 -3.78 0.47 0.54 -1.34 0.00 0.00 175.55 171.44 3m83 n ARG 65 N 5.05 -2.18 -0.95 4.97 1.74 -1.26 -0.95 116.66 123.09 3m83 n ARG 65 Ca 0.15 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 3m83 n ARG 65 Cb 0.40 -4.51 0.00 0.00 -1.02 0.00 0.00 32.46 27.32 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 -1.77 0.45 3.75 -0.13 0.00 -1.23 -4.99 105.19 101.27 3m83 n GLY 66 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.54 4.70 -0.36 1.61 -0.21 -0.13 -4.67 119.66 120.06 3m83 s GLN 67 Ca 0.00 1.67 -0.21 0.00 0.02 0.00 0.00 55.36 56.84 3m83 s GLN 67 Cb 0.00 -3.25 0.00 0.00 1.00 0.00 0.00 33.01 30.77 3m83 s GLN 67 CO 0.00 0.28 0.68 1.03 -2.12 0.00 0.00 175.29 175.15 3m83 s ARG 68 N -1.05 3.69 -0.12 2.91 1.81 -1.26 -0.13 118.95 124.80 3m83 s ARG 68 Ca 0.45 0.11 -0.06 0.00 -1.72 0.00 0.00 55.73 54.51 3m83 s ARG 68 Cb -0.29 -3.81 -0.04 0.00 -0.45 0.00 0.00 34.95 30.36 3m83 s ARG 68 CO 0.36 -0.77 0.09 0.42 -0.68 0.00 0.00 175.30 174.72 3m83 s ILE 69 N 2.82 5.09 0.50 1.52 -1.09 0.54 -4.85 121.20 125.73 3m83 s ILE 69 Ca 0.26 0.05 -0.04 0.00 -2.23 0.00 0.00 60.65 58.69 3m83 s ILE 69 Cb -0.14 -3.21 -0.02 0.00 -1.58 0.00 0.00 42.46 37.51 3m83 s ILE 69 CO 0.15 0.59 0.78 -0.54 -1.23 0.00 0.00 174.94 174.70 3m83 s LYS 70 N -0.79 3.28 0.18 2.79 -0.14 -1.26 -1.84 119.74 121.95 3m83 s LYS 70 Ca 0.13 -0.02 -0.22 0.00 -1.36 0.00 0.00 55.97 54.50 3m83 s LYS 70 Cb -0.12 -2.40 0.08 0.00 -1.68 0.00 0.00 37.83 33.71 3m83 s LYS 70 CO 0.03 -0.33 1.05 0.20 -0.76 0.00 0.00 175.35 175.54 3m83 s GLY 71 N -4.18 0.12 0.06 -3.33 0.00 -0.64 -1.75 107.32 97.60 3m83 s GLY 71 Ca 0.49 -0.35 0.09 0.00 0.00 0.00 0.00 44.72 44.95 3m83 s GLY 71 CO 0.43 2.74 -0.24 -0.98 0.00 0.00 0.00 173.10 175.05 3m83 s TRP 72 N -2.12 2.10 -0.14 1.90 0.23 -0.72 -1.71 118.94 118.48 3m83 s TRP 72 Ca 0.23 -0.40 0.02 0.00 -2.03 0.00 0.00 56.10 53.92 3m83 s TRP 72 Cb -0.03 -1.23 0.01 0.00 0.03 0.00 0.00 33.47 32.25 3m83 s TRP 72 CO 0.05 0.15 -0.20 -1.17 0.96 0.00 0.00 176.95 176.74 3m83 s LEU 73 N -1.38 2.03 -0.22 2.99 2.96 -0.33 -0.86 118.68 123.87 3m83 s LEU 73 Ca 0.10 -0.58 -0.03 0.00 -0.22 0.00 0.00 54.13 53.40 3m83 s LEU 73 Cb -0.10 -1.38 -0.00 0.00 0.50 0.00 0.00 46.19 45.22 3m83 s LEU 73 CO 0.03 0.05 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.29 3m83 s LEU 74 N 0.96 2.88 -0.24 -0.68 2.01 -0.43 -0.48 118.68 122.71 3m83 s LEU 74 Ca -0.04 -0.49 -0.01 0.00 0.01 0.00 0.00 54.13 53.59 3m83 s LEU 74 Cb -0.15 -1.71 0.03 0.00 0.01 0.00 0.00 46.19 44.37 3m83 s LEU 74 CO -0.04 -0.04 -0.09 -0.69 1.01 0.00 0.00 176.35 176.50 3m83 s VAL 75 N 1.44 2.71 0.38 -1.59 1.01 0.10 -1.24 120.40 123.20 3m83 s VAL 75 Ca 0.05 -1.04 -0.26 0.00 0.00 0.00 0.00 61.98 60.73 3m83 s VAL 75 Cb -0.14 -2.35 -0.09 0.00 0.00 0.00 0.00 36.38 33.79 3m83 s VAL 75 CO -0.04 0.24 1.20 -2.16 0.00 0.00 0.00 175.10 174.34 3m83 s PRO 76 N 1.31 4.16 -1.08 2.72 0.04 -1.26 0.06 135.00 140.94 3m83 s PRO 76 Ca 0.00 1.95 -0.22 0.00 0.04 0.00 0.00 61.00 62.77 3m83 s PRO 76 Cb -0.16 -2.81 0.05 0.00 0.04 0.00 0.00 34.50 31.62 3m83 s PRO 76 CO -0.06 -0.26 1.52 0.15 0.04 0.00 0.00 177.00 178.39 3m83 s LYS 77 N -2.11 3.66 0.16 4.56 1.02 -0.50 -4.86 119.74 121.67 3m83 s LYS 77 Ca 0.54 -1.30 0.07 0.00 0.02 0.00 0.00 55.97 55.31 3m83 s LYS 77 Cb -0.33 -5.39 -0.04 0.00 -0.52 0.00 0.00 37.83 31.54 3m83 s LYS 77 CO 0.43 -2.25 -0.16 -0.51 -0.92 0.00 0.00 175.35 171.94 3m83 s LEU 78 N 4.93 2.45 0.28 3.17 1.43 -1.26 -5.01 118.68 124.68 3m83 s LEU 78 Ca 0.48 -0.88 0.07 0.00 -1.03 0.00 0.00 54.13 52.77 3m83 s LEU 78 Cb 0.01 -0.69 0.40 0.00 0.03 0.00 0.00 46.19 45.94 3m83 s LEU 78 CO -0.06 -0.11 1.66 -0.33 0.23 0.00 0.00 176.35 177.74 3m83 h GLU 79 N 3.18 0.17 -6.44 1.70 3.07 -2.03 -3.45 114.58 110.78 3m83 h GLU 79 Ca -0.40 -0.10 -0.62 0.00 -0.50 0.00 0.00 59.36 57.74 3m83 h GLU 79 Cb 1.21 0.01 0.08 0.00 -0.84 0.00 0.00 28.75 29.20 3m83 h GLU 79 CO 0.54 0.64 0.42 -1.91 -1.40 0.00 0.00 179.01 177.29 3m83 n GLU 80 N -3.95 1.54 0.05 2.33 2.13 -1.26 -4.91 120.64 116.57 3m83 n GLU 80 Ca -0.02 0.55 -0.03 0.00 0.66 0.00 0.00 57.16 58.32 3m83 n GLU 80 Cb 0.54 -2.12 -0.08 0.00 0.27 0.00 0.00 31.44 30.05 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 3.78 0.00 -5.14 5.31 3.07 -1.94 -3.43 114.58 116.22 3m83 h GLU 81 Ca -0.44 0.00 -0.66 0.00 -0.50 0.00 0.00 59.36 57.76 3m83 h GLU 81 Cb 1.31 0.00 -0.34 0.00 -0.84 0.00 0.00 28.75 28.88 3m83 h GLU 81 CO 0.73 0.55 -0.87 0.15 -1.40 0.00 0.00 179.01 178.17 3m83 s LYS 82 N -2.81 2.89 0.16 2.33 -0.14 -1.26 -4.58 119.74 116.32 3m83 s LYS 82 Ca -0.01 -0.81 0.10 0.00 -1.36 0.00 0.00 55.97 53.89 3m83 s LYS 82 Cb 0.09 -2.32 -0.04 0.00 -1.68 0.00 0.00 37.83 33.88 3m83 s LYS 82 CO 0.80 0.01 -0.18 -0.51 -0.76 0.00 0.00 175.35 174.71 3m83 s LEU 83 N 0.77 2.68 0.81 3.17 1.43 0.46 -4.75 118.68 123.25 3m83 s LEU 83 Ca -0.09 -0.66 -0.11 0.00 -1.03 0.00 0.00 54.13 52.24 3m83 s LEU 83 Cb -0.16 -1.45 0.07 0.00 0.03 0.00 0.00 46.19 44.69 3m83 s LEU 83 CO -0.00 0.14 1.09 -2.16 0.23 0.00 0.00 176.35 175.65 3m83 s PRO 84 N -2.47 2.01 -0.02 1.29 0.04 -1.26 0.27 135.00 134.85 3m83 s PRO 84 Ca 0.20 0.71 0.00 0.00 0.04 0.00 0.00 61.00 61.96 3m83 s PRO 84 Cb -0.09 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.56 3m83 s PRO 84 CO 0.11 -1.69 0.01 0.00 0.04 0.00 0.00 177.00 175.47 3m83 s VAL 86 N 0.77 3.86 -0.37 0.00 1.01 0.60 0.27 120.40 126.54 3m83 s VAL 86 Ca -0.07 -0.33 -0.20 0.00 0.00 0.00 0.00 61.98 61.39 3m83 s VAL 86 Cb -0.10 -2.78 0.01 0.00 0.00 0.00 0.00 36.38 33.51 3m83 s VAL 86 CO -0.02 0.39 0.59 -0.69 0.00 0.00 0.00 175.10 175.37 3m83 s VAL 87 N 1.43 4.93 -0.25 2.92 1.01 0.16 -1.04 120.40 129.55 3m83 s VAL 87 Ca 0.05 0.37 -0.08 0.00 0.00 0.00 0.00 61.98 62.32 3m83 s VAL 87 Cb -0.15 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 3m83 s VAL 87 CO 0.01 -0.34 0.09 -1.58 0.00 0.00 0.00 175.10 173.27 3m83 s GLN 88 N 2.60 3.68 0.15 2.72 2.00 0.62 -0.66 119.66 130.76 3m83 s GLN 88 Ca 0.21 -0.47 0.01 0.00 -2.00 0.00 0.00 55.36 53.11 3m83 s GLN 88 Cb -0.15 -3.37 -0.04 0.00 0.80 0.00 0.00 33.01 30.25 3m83 s GLN 88 CO 0.15 -0.20 0.31 0.71 -0.50 0.00 0.00 175.29 175.76 3m83 s TYR 89 N 1.63 3.49 0.08 1.67 2.02 -0.25 -2.01 117.35 123.99 3m83 s TYR 89 Ca 0.06 0.24 0.05 0.00 -0.37 0.00 0.00 57.07 57.05 3m83 s TYR 89 Cb -0.15 -1.76 -0.04 0.00 -0.40 0.00 0.00 41.96 39.60 3m83 s TYR 89 CO 0.05 0.48 -0.01 0.42 -1.57 0.00 0.00 175.55 174.91 3m83 s ILE 90 N -1.73 3.94 0.86 2.71 1.01 -1.26 -4.49 121.20 122.23 3m83 s ILE 90 Ca 0.36 -0.99 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 3m83 s ILE 90 Cb -0.11 -2.86 0.11 0.00 0.01 0.00 0.00 42.46 39.60 3m83 s ILE 90 CO 0.28 0.14 1.09 -0.83 0.00 0.00 0.00 174.94 175.63 3m83 s GLY 91 N -2.23 1.62 0.24 6.18 0.00 -1.26 -3.08 107.32 108.79 3m83 s GLY 91 Ca 0.25 -0.10 -0.31 0.00 0.00 0.00 0.00 44.72 44.55 3m83 s GLY 91 CO 0.17 0.36 1.36 2.98 0.00 0.00 0.00 173.10 177.97 3m83 n TYR 92 N -3.72 2.04 -1.22 1.90 9.36 -1.26 -1.56 117.16 122.69 3m83 n TYR 92 Ca 0.07 0.48 -0.08 0.00 3.32 0.00 0.00 57.90 61.69 3m83 n TYR 92 Cb 0.55 -2.43 -0.03 0.00 -0.63 0.00 0.00 39.34 36.80 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 2.03 -4.59 -4.80 2.98 3.02 -1.26 -4.86 115.26 107.78 3m83 n ASN 93 Ca 0.11 0.19 -0.23 0.00 -0.03 0.00 0.00 54.58 54.63 3m83 n ASN 93 Cb 0.31 -2.77 -0.05 0.00 -0.61 0.00 0.00 39.78 36.66 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 -2.54 2.25 0.03 7.41 0.00 -0.60 -0.82 107.32 113.05 3m83 s GLY 94 Ca 0.00 -2.00 0.00 0.00 0.00 0.00 0.00 44.72 42.72 3m83 s GLY 94 CO 0.00 -1.82 0.04 0.61 0.00 0.00 0.00 173.10 171.92 3m83 n GLY 95 N -1.38 3.28 0.19 0.20 0.00 -0.78 -2.10 105.19 104.59 3m83 n GLY 95 Ca 0.01 -1.47 0.14 0.00 0.00 0.00 0.00 46.02 44.70 3m83 n GLY 95 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3m83 h ARG 96 N 0.00 0.00 0.00 1.61 0.11 -1.83 -3.44 114.38 110.83 3m83 h ARG 96 Ca -0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.06 3m83 h ARG 96 Cb 0.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.18 3m83 h ARG 96 CO 0.03 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.51 3m83 n GLY 97 N 0.05 3.05 3.83 0.08 0.00 -0.09 -4.63 105.19 107.47 3m83 n GLY 97 Ca 0.02 -0.34 -0.25 0.00 0.00 0.00 0.00 46.02 45.44 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 3.18 0.30 1.61 0.40 -1.26 -4.95 117.98 117.26 3m83 s PHE 98 Ca 0.00 -0.03 0.05 0.00 -0.60 0.00 0.00 56.93 56.35 3m83 s PHE 98 Cb 0.00 -1.50 0.75 0.00 0.51 0.00 0.00 43.02 42.79 3m83 s PHE 98 CO 0.00 0.52 1.73 -1.35 0.70 0.00 0.00 175.22 176.81 3m83 h PRO 99 N 2.06 0.53 0.00 0.24 0.11 -2.00 -1.96 132.00 130.99 3m83 h PRO 99 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3m83 h PRO 99 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3m83 h PRO 99 CO 0.63 0.35 0.00 -2.39 -0.21 0.00 0.00 178.00 176.38 3m83 n HIS 100 N -4.92 0.00 1.33 0.65 1.44 -1.26 -2.18 115.22 110.28 3m83 n HIS 100 Ca 0.23 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 56.08 3m83 n HIS 100 Cb 0.64 -0.05 0.63 0.00 0.12 0.00 0.00 29.99 31.33 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 -1.05 0.29 -2.46 4.39 8.00 -0.74 -4.29 116.55 120.70 3m83 n ASP 101 Ca 0.10 -0.31 -0.13 0.00 0.71 0.00 0.00 54.79 55.17 3m83 n ASP 101 Cb 0.06 -0.16 0.03 0.00 -0.02 0.00 0.00 41.12 41.04 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 -1.15 2.06 0.87 1.24 7.02 -0.93 -4.89 117.44 121.66 3m83 n TRP 102 Ca 0.13 -2.33 0.13 0.00 -1.02 0.00 0.00 57.50 54.41 3m83 n TRP 102 Cb 0.28 -0.27 0.46 0.00 -2.42 0.00 0.00 31.31 29.35 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 -0.58 0.35 0.44 -0.99 4.77 -1.26 -4.36 117.00 115.37 3m83 n LEU 103 Ca 0.25 0.40 -0.18 0.00 -0.03 0.00 0.00 56.01 56.46 3m83 n LEU 103 Cb 0.86 -0.38 -0.09 0.00 -2.33 0.00 0.00 43.42 41.48 3m83 n LEU 103 CO 0.25 -0.02 0.53 0.15 -1.33 0.00 0.00 177.39 176.97 3m83 h PHE 104 N 0.00 -1.09 -0.31 -1.77 3.57 -1.95 -1.70 116.94 113.69 3m83 h PHE 104 Ca 0.00 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 3m83 h PHE 104 Cb 0.58 0.37 -0.01 0.00 2.79 0.00 0.00 35.95 39.67 3m83 h PHE 104 CO 0.00 -0.66 0.17 -1.49 -2.23 0.00 0.00 178.31 174.10 3m83 h TRP 105 N -1.14 0.42 -0.97 0.41 4.06 -1.89 -1.84 115.95 115.00 3m83 h TRP 105 Ca -0.11 -0.01 0.14 0.00 2.06 0.00 0.00 58.89 60.97 3m83 h TRP 105 Cb 0.88 -0.13 -0.08 0.00 -1.00 0.00 0.00 29.16 28.82 3m83 h TRP 105 CO 0.01 0.34 0.61 -1.35 -3.56 0.00 0.00 178.44 174.50 3m83 h PRO 106 N 0.38 0.84 0.00 0.49 0.11 -1.56 -0.81 132.00 131.45 3m83 h PRO 106 Ca 0.11 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.13 3m83 h PRO 106 Cb 0.06 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 3m83 h PRO 106 CO -0.02 0.56 -0.20 0.77 -0.21 0.00 0.00 178.00 178.90 3m83 h SER 107 N 0.87 0.00 -0.37 -2.05 0.02 -0.67 -1.61 113.55 109.74 3m83 h SER 107 Ca 0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.45 3m83 h SER 107 Cb 0.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.17 3m83 h SER 107 CO -0.27 0.20 0.00 0.23 -1.14 0.00 0.00 176.83 175.85 3m83 n MET 108 N -3.63 1.86 -0.61 3.45 2.81 -0.58 -4.93 117.12 115.48 3m83 n MET 108 Ca -0.01 -1.33 0.00 0.00 -1.81 0.00 0.00 57.70 54.55 3m83 n MET 108 Cb 0.33 -1.29 0.00 0.00 -0.71 0.00 0.00 33.22 31.55 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 1.08 0.66 3.66 3.03 0.00 -0.61 -5.06 105.19 107.96 3m83 n GLY 109 Ca 0.12 -0.31 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 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 3.12 0.35 1.61 1.51 -0.41 -4.45 117.35 117.08 3m83 s TYR 110 Ca 0.00 0.15 -0.28 0.00 -1.01 0.00 0.00 57.07 55.92 3m83 s TYR 110 Cb 0.00 -1.79 -0.11 0.00 -0.11 0.00 0.00 41.96 39.95 3m83 s TYR 110 CO 0.00 0.42 1.39 0.42 -1.11 0.00 0.00 175.55 176.68 3m83 s ILE 111 N -0.80 2.42 -0.15 2.71 1.01 0.48 -2.54 121.20 124.34 3m83 s ILE 111 Ca 0.12 0.42 0.01 0.00 0.00 0.00 0.00 60.65 61.20 3m83 s ILE 111 Cb -0.11 -3.27 0.02 0.00 0.01 0.00 0.00 42.46 39.11 3m83 s ILE 111 CO 0.02 0.10 -0.16 0.00 0.00 0.00 0.00 174.94 174.90 3m83 s PHE 113 N 1.34 3.20 -0.33 0.00 2.19 -0.21 -1.31 117.98 122.87 3m83 s PHE 113 Ca 0.03 -0.73 -0.14 0.00 0.33 0.00 0.00 56.93 56.42 3m83 s PHE 113 Cb -0.13 -2.38 -0.02 0.00 -1.31 0.00 0.00 43.02 39.17 3m83 s PHE 113 CO -0.09 -0.53 0.30 0.08 1.83 0.00 0.00 175.22 176.81 3m83 s VAL 114 N 1.59 5.23 -0.26 3.12 1.01 -0.04 -0.28 120.40 130.77 3m83 s VAL 114 Ca 0.04 0.03 -0.21 0.00 0.00 0.00 0.00 61.98 61.83 3m83 s VAL 114 Cb -0.18 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 3m83 s VAL 114 CO 0.06 0.01 0.66 -0.32 0.00 0.00 0.00 175.10 175.50 3m83 s MET 115 N 1.89 4.09 0.51 2.72 1.75 -0.85 -1.76 119.30 127.64 3m83 s MET 115 Ca 0.10 0.56 -0.23 0.00 -1.25 0.00 0.00 55.69 54.86 3m83 s MET 115 Cb -0.17 -3.66 -0.06 0.00 2.84 0.00 0.00 34.83 33.78 3m83 s MET 115 CO 0.11 -0.46 1.38 0.34 -0.65 0.00 0.00 175.02 175.74 3m83 s ASP 116 N 1.49 5.53 -0.34 1.11 2.15 -0.72 -4.44 116.67 121.45 3m83 s ASP 116 Ca 0.27 2.81 -0.13 0.00 0.43 0.00 0.00 52.55 55.94 3m83 s ASP 116 Cb -0.15 -2.64 -0.01 0.00 -0.30 0.00 0.00 42.92 39.81 3m83 s ASP 116 CO 0.09 -1.40 0.24 -0.89 -0.17 0.00 0.00 175.17 173.04 3m83 s THR 117 N -1.27 5.23 -0.21 1.71 2.01 -1.26 -4.81 115.64 117.04 3m83 s THR 117 Ca 0.67 -0.27 -0.40 0.00 0.31 0.00 0.00 61.69 62.00 3m83 s THR 117 Cb -0.41 -3.70 -0.16 0.00 0.01 0.00 0.00 72.50 68.23 3m83 s THR 117 CO 0.51 -0.03 1.64 -2.11 -0.69 0.00 0.00 174.62 173.94 3m83 n ARG 118 N 5.10 1.08 -0.64 4.92 1.85 -1.26 -2.60 116.66 125.10 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 -2.06 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 3.79 1.71 0.00 2.89 0.00 0.62 -4.57 105.19 109.62 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 -2.80 1.61 6.02 -1.07 -4.88 117.38 114.26 3m83 n GLN 120 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.79 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 -0.51 0.00 1.08 0.00 -0.89 -4.70 105.19 105.17 3m83 n GLY 121 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.21 0.06 -0.08 1.61 7.64 -1.21 -1.14 113.62 118.30 3m83 n SER 122 Ca -0.14 -1.02 -0.08 0.00 1.01 0.00 0.00 58.87 58.64 3m83 n SER 122 Cb 0.62 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.80 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 -0.01 -0.52 0.00 0.23 0.00 0.00 -4.92 105.19 99.97 3m83 n GLY 123 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -4.26 0.00 -3.74 1.61 4.27 -1.00 -5.04 117.44 109.28 3m83 n TRP 124 Ca -0.12 0.00 -0.12 0.00 -3.89 0.00 0.00 57.50 53.36 3m83 n TRP 124 Cb 0.46 0.00 -0.12 0.00 -1.36 0.00 0.00 31.31 30.29 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 -1.44 0.49 0.54 5.67 2.96 -1.26 -5.03 118.68 120.61 3m83 s LEU 125 Ca 0.00 0.61 -0.20 0.00 -0.22 0.00 0.00 54.13 54.32 3m83 s LEU 125 Cb 0.00 0.93 -0.05 0.00 0.50 0.00 0.00 46.19 47.57 3m83 s LEU 125 CO 0.00 -0.15 1.19 -1.59 -1.32 0.00 0.00 176.35 174.49 3m83 s LYS 126 N 0.90 3.32 0.22 1.98 -2.85 -1.26 -1.87 119.74 120.17 3m83 s LYS 126 Ca -0.06 1.80 0.05 0.00 -1.00 0.00 0.00 55.97 56.76 3m83 s LYS 126 Cb -0.07 -2.12 -0.05 0.00 -2.06 0.00 0.00 37.83 33.52 3m83 s LYS 126 CO -0.06 -0.92 -0.07 0.20 0.10 0.00 0.00 175.35 174.60 3m83 s GLY 127 N -1.50 1.47 0.00 0.59 0.00 -0.29 -0.92 107.32 106.68 3m83 s GLY 127 Ca 0.72 -1.71 0.00 0.00 0.00 0.00 0.00 44.72 43.73 3m83 s GLY 127 CO 0.34 -1.70 0.40 1.22 0.00 0.00 0.00 173.10 173.35 3m83 n ASP 128 N -0.39 0.63 -4.45 1.64 8.00 -1.26 -4.87 116.55 115.84 3m83 n ASP 128 Ca -0.07 -1.16 -0.35 0.00 0.71 0.00 0.00 54.79 53.93 3m83 n ASP 128 Cb 0.62 0.00 -0.12 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 -0.16 4.00 0.64 -3.53 2.01 -1.26 -4.91 115.64 112.43 3m83 s THR 129 Ca 0.00 -0.29 -0.10 0.00 0.31 0.00 0.00 61.69 61.61 3m83 s THR 129 Cb 0.00 -2.82 -0.01 0.00 0.01 0.00 0.00 72.50 69.68 3m83 s THR 129 CO 0.00 0.42 1.02 -2.16 -0.69 0.00 0.00 174.62 173.21 3m83 s PRO 130 N 1.03 3.23 0.45 4.92 0.04 -1.26 -0.28 135.00 143.14 3m83 s PRO 130 Ca 0.02 0.50 -0.06 0.00 0.04 0.00 0.00 61.00 61.50 3m83 s PRO 130 Cb -0.14 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 3m83 s PRO 130 CO 0.02 -0.73 0.77 0.34 0.04 0.00 0.00 177.00 177.44 3m83 s ASP 131 N -4.26 6.32 -0.28 6.66 2.15 -1.26 -4.05 116.67 121.95 3m83 s ASP 131 Ca 0.55 0.95 -0.03 0.00 0.43 0.00 0.00 52.55 54.45 3m83 s ASP 131 Cb -0.11 -2.25 0.10 0.00 -0.30 0.00 0.00 42.92 40.35 3m83 s ASP 131 CO 0.51 -0.52 0.11 -0.31 -0.17 0.00 0.00 175.17 174.79 3m83 s TYR 132 N -2.63 0.82 0.69 -5.34 1.51 -1.26 -4.94 117.35 106.20 3m83 s TYR 132 Ca 0.48 -1.14 -0.14 0.00 -1.01 0.00 0.00 57.07 55.26 3m83 s TYR 132 Cb -0.10 -1.17 0.01 0.00 -0.11 0.00 0.00 41.96 40.59 3m83 s TYR 132 CO 0.41 -0.82 1.12 -1.25 -1.11 0.00 0.00 175.55 173.90 3m83 s PRO 133 N 1.93 2.62 -1.17 -1.71 0.04 -1.26 -4.93 135.00 130.52 3m83 s PRO 133 Ca 0.08 1.40 -0.22 0.00 0.04 0.00 0.00 61.00 62.30 3m83 s PRO 133 Cb -0.16 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.38 3m83 s PRO 133 CO -0.30 -1.39 1.91 0.39 0.04 0.00 0.00 177.00 177.65 3m83 n GLU 134 N -2.64 1.86 0.00 4.56 -0.58 -1.26 -4.89 120.64 117.69 3m83 n GLU 134 Ca 0.10 -2.53 0.00 0.00 -0.42 0.00 0.00 57.16 54.31 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 5.56 1.80 3.75 0.62 0.00 -1.26 -4.81 105.19 110.84 3m83 n GLY 135 Ca 0.46 0.22 -0.41 0.00 0.00 0.00 0.00 46.02 46.30 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 4.64 -0.65 1.61 0.04 -1.26 -4.99 135.00 134.40 3m83 s PRO 136 Ca 0.00 1.72 -0.19 0.00 0.04 0.00 0.00 61.00 62.57 3m83 s PRO 136 Cb 0.00 -3.25 0.11 0.00 0.04 0.00 0.00 34.50 31.40 3m83 s PRO 136 CO 0.00 0.18 0.77 0.08 0.04 0.00 0.00 177.00 178.07 3m83 s VAL 137 N -0.68 4.81 0.99 -0.36 1.01 -1.26 -5.01 120.40 119.89 3m83 s VAL 137 Ca 0.47 -1.08 -0.12 0.00 0.00 0.00 0.00 61.98 61.25 3m83 s VAL 137 Cb -0.30 -4.54 0.14 0.00 0.00 0.00 0.00 36.38 31.69 3m83 s VAL 137 CO 0.37 -1.19 0.86 0.47 0.00 0.00 0.00 175.10 175.61 3m83 n ASP 138 N 6.34 -0.80 -4.61 3.32 8.00 -1.26 -4.89 116.55 122.65 3m83 n ASP 138 Ca -0.04 0.26 -0.46 0.00 0.71 0.00 0.00 54.79 55.26 3m83 n ASP 138 Cb 0.44 -1.34 -0.02 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 -3.60 1.48 -3.73 -0.24 -0.02 -1.26 -4.81 135.00 122.83 3m83 n PRO 139 Ca 0.08 0.52 -0.10 0.00 -2.02 0.00 0.00 63.50 61.99 3m83 n PRO 139 Cb 0.53 -2.01 -0.05 0.00 -0.02 0.00 0.00 33.50 31.96 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 -0.98 1.14 0.33 -0.52 -2.07 -1.26 -4.87 119.66 111.43 3m83 s GLN 140 Ca 0.65 -0.84 -0.24 0.00 -1.82 0.00 0.00 55.36 53.11 3m83 s GLN 140 Cb -0.73 0.46 -0.10 0.00 -1.09 0.00 0.00 33.01 31.55 3m83 s GLN 140 CO 0.56 -0.45 0.91 -0.47 -1.32 0.00 0.00 175.29 174.52 3m83 s TYR 141 N -3.85 3.60 -0.00 9.60 5.04 -1.26 -4.98 117.35 125.48 3m83 s TYR 141 Ca 0.07 1.68 -0.39 0.00 -2.44 0.00 0.00 57.07 55.99 3m83 s TYR 141 Cb 0.02 -2.86 -0.19 0.00 0.35 0.00 0.00 41.96 39.28 3m83 s TYR 141 CO -0.08 0.16 1.21 -2.30 -1.34 0.00 0.00 175.55 173.20 3m83 n PRO 142 N 0.30 0.43 0.00 4.97 -0.02 -1.26 -4.70 135.00 134.72 3m83 n PRO 142 Ca 0.03 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 3m83 n PRO 142 Cb 0.51 -1.71 0.00 0.00 -0.02 0.00 0.00 33.50 32.28 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 2.07 0.49 0.00 -1.23 0.00 -1.26 -4.88 105.19 100.39 3m83 n GLY 143 Ca 0.20 -2.29 0.05 0.00 0.00 0.00 0.00 46.02 43.98 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 0.00 0.00 0.25 1.61 3.72 -1.26 -4.50 117.46 117.28 3m83 n PHE 144 Ca 0.00 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.52 3m83 n PHE 144 Cb 0.00 -0.19 0.61 0.00 -0.94 0.00 0.00 39.48 38.96 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 -0.04 -1.08 2.86 -1.90 -2.98 114.93 111.80 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 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 3m83 h MET 145 CO 0.00 0.16 0.00 0.25 1.06 0.00 0.00 176.91 178.38 3m83 n THR 146 N -3.44 0.74 -1.89 2.22 -2.24 -1.26 -4.86 114.28 103.54 3m83 n THR 146 Ca -0.01 -0.87 -0.40 0.00 -2.27 0.00 0.00 64.05 60.50 3m83 n THR 146 Cb 0.33 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 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 -0.78 2.80 -0.29 -0.78 3.52 -1.13 -2.67 118.95 119.63 3m83 s ARG 147 Ca 0.03 1.16 0.00 0.00 -0.13 0.00 0.00 55.73 56.79 3m83 s ARG 147 Cb 0.02 -4.36 0.00 0.00 -1.56 0.00 0.00 34.95 29.05 3m83 s ARG 147 CO 0.02 -2.49 0.00 0.41 -0.81 0.00 0.00 175.30 172.43 3m83 n GLY 148 N 5.67 0.59 0.07 8.12 0.00 -1.26 -1.17 105.19 117.21 3m83 n GLY 148 Ca 0.25 -0.88 0.08 0.00 0.00 0.00 0.00 46.02 45.47 3m83 n GLY 148 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3m83 n ILE 149 N -2.91 1.15 1.79 -0.61 3.06 -1.09 -2.72 119.36 118.03 3m83 n ILE 149 Ca -0.03 0.39 0.15 0.00 -2.50 0.00 0.00 62.75 60.77 3m83 n ILE 149 Cb 0.09 -1.30 0.83 0.00 0.54 0.00 0.00 39.64 39.81 3m83 n ILE 149 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 3m83 n LEU 150 N -1.88 0.23 -3.66 9.51 4.77 -1.26 -4.61 117.00 120.10 3m83 n LEU 150 Ca 0.01 -0.01 -0.07 0.00 -0.03 0.00 0.00 56.01 55.92 3m83 n LEU 150 Cb 0.13 -0.07 -0.08 0.00 -2.33 0.00 0.00 43.42 41.08 3m83 n LEU 150 CO 0.12 0.04 0.20 -0.62 -1.33 0.00 0.00 177.39 175.80 3m83 s ASP 151 N -2.14 -0.77 0.60 -1.43 -1.08 -1.10 -4.96 116.67 105.78 3m83 s ASP 151 Ca 0.42 1.29 0.29 0.00 -0.52 0.00 0.00 52.55 54.03 3m83 s ASP 151 Cb 0.21 1.47 1.65 0.00 -1.46 0.00 0.00 42.92 44.79 3m83 s ASP 151 CO 0.39 -0.22 2.06 1.55 0.52 0.00 0.00 175.17 179.47 3m83 h PRO 152 N 7.49 0.00 0.00 4.34 0.13 -1.84 -1.21 132.00 140.92 3m83 h PRO 152 Ca -0.26 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.79 3m83 h PRO 152 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 3m83 h PRO 152 CO 0.17 0.00 -0.37 0.00 -0.23 0.00 0.00 178.00 177.57 3m83 h ARG 153 N 0.00 0.00 -0.01 0.86 3.08 -1.96 -2.98 114.38 113.37 3m83 h ARG 153 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 3m83 h ARG 153 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.67 3m83 h ARG 153 CO -0.00 0.37 -0.59 0.25 -1.07 0.00 0.00 179.97 178.93 3m83 n THR 154 N -3.28 0.00 -2.18 2.04 -2.24 -0.54 -4.94 114.28 103.14 3m83 n THR 154 Ca 0.01 -0.18 -0.41 0.00 -2.27 0.00 0.00 64.05 61.21 3m83 n THR 154 Cb 0.62 1.09 -0.03 0.00 -2.10 0.00 0.00 70.33 69.91 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 -2.63 3.20 0.25 4.78 5.04 -0.70 -4.31 117.35 122.99 3m83 s TYR 155 Ca 0.16 1.22 -0.05 0.00 -2.44 0.00 0.00 57.07 55.96 3m83 s TYR 155 Cb 0.18 -3.64 0.47 0.00 0.35 0.00 0.00 41.96 39.32 3m83 s TYR 155 CO 0.65 -1.98 1.67 -0.92 -1.34 0.00 0.00 175.55 173.62 3m83 h TYR 156 N 5.06 0.20 0.00 4.97 3.20 -1.42 -1.46 116.97 127.52 3m83 h TYR 156 Ca -0.45 0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.46 3m83 h TYR 156 Cb 1.22 0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.52 3m83 h TYR 156 CO 0.61 -0.14 0.00 0.66 -1.64 0.00 0.00 178.16 177.65 3m83 n TYR 157 N -5.21 0.73 -0.25 -3.82 4.01 -1.26 -1.76 117.16 109.59 3m83 n TYR 157 Ca 0.14 0.29 -0.05 0.00 -0.16 0.00 0.00 57.90 58.12 3m83 n TYR 157 Cb 0.48 -0.96 0.05 0.00 -0.31 0.00 0.00 39.34 38.60 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 0.94 -0.03 -0.72 2.43 -1.55 -0.46 114.38 114.99 3m83 h ARG 158 Ca 0.00 -0.09 -0.25 0.00 -0.81 0.00 0.00 59.98 58.83 3m83 h ARG 158 Cb 0.34 -0.20 0.02 0.00 -0.42 0.00 0.00 29.97 29.71 3m83 h ARG 158 CO 0.00 0.67 -0.98 0.00 -1.51 0.00 0.00 179.97 178.15 3m83 h ARG 159 N 0.95 0.69 -0.27 0.20 3.08 -1.47 -2.85 114.38 114.71 3m83 h ARG 159 Ca 0.25 -0.70 -0.03 0.00 0.07 0.00 0.00 59.98 59.57 3m83 h ARG 159 Cb -0.03 0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3m83 h ARG 159 CO -0.05 1.29 0.06 0.28 -1.07 0.00 0.00 179.97 180.49 3m83 h VAL 160 N 0.41 1.22 -0.55 2.04 2.07 -1.41 -1.40 116.25 118.63 3m83 h VAL 160 Ca -0.11 -0.71 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 3m83 h VAL 160 Cb 1.63 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 32.54 3m83 h VAL 160 CO 0.19 0.23 0.13 -0.26 0.02 0.00 0.00 177.57 177.89 3m83 h PHE 161 N 0.27 0.86 -0.17 1.57 0.04 -1.17 -1.02 116.94 117.32 3m83 h PHE 161 Ca 0.08 -0.08 -0.04 0.00 2.80 0.00 0.00 57.97 60.74 3m83 h PHE 161 Cb 0.29 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 3m83 h PHE 161 CO 0.01 0.72 -0.03 1.15 -0.60 0.00 0.00 178.31 179.56 3m83 h THR 162 N 0.81 1.28 -0.72 -1.55 2.02 -1.44 -1.57 112.91 111.74 3m83 h THR 162 Ca 0.18 -0.98 0.16 0.00 0.77 0.00 0.00 66.41 66.53 3m83 h THR 162 Cb 0.29 1.58 -0.12 0.00 -1.74 0.00 0.00 68.15 68.17 3m83 h THR 162 CO -0.00 0.29 0.03 0.44 0.37 0.00 0.00 175.52 176.65 3m83 h ASP 163 N 0.04 -0.28 -0.46 4.18 3.32 -1.04 -1.91 116.42 120.27 3m83 h ASP 163 Ca 0.04 0.18 -0.09 0.00 0.02 0.00 0.00 57.03 57.18 3m83 h ASP 163 Cb 0.46 0.31 -0.02 0.00 0.22 0.00 0.00 39.33 40.30 3m83 h ASP 163 CO 0.02 -0.14 -0.04 0.00 -1.72 0.00 0.00 179.24 177.36 3m83 h ALA 164 N 1.66 0.97 -0.57 3.45 0.00 -0.86 0.87 119.26 124.78 3m83 h ALA 164 Ca 0.39 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 3m83 h ALA 164 Cb 0.67 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3m83 h ALA 164 CO -0.61 0.62 -0.02 0.28 0.00 0.00 0.00 179.25 179.53 3m83 h VAL 165 N 0.82 1.27 0.00 0.00 2.07 -1.00 -3.10 116.25 116.31 3m83 h VAL 165 Ca 0.15 -1.15 -0.10 0.00 0.82 0.00 0.00 66.70 66.42 3m83 h VAL 165 Cb 0.54 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 3m83 h VAL 165 CO 0.03 0.41 -0.48 0.03 0.02 0.00 0.00 177.57 177.59 3m83 h ARG 166 N 0.89 0.00 -0.82 1.57 2.47 -0.95 -2.89 114.38 114.65 3m83 h ARG 166 Ca 0.16 0.00 0.04 0.00 -1.26 0.00 0.00 59.98 58.92 3m83 h ARG 166 Cb 0.57 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.84 3m83 h ARG 166 CO 0.03 0.48 0.54 0.00 0.56 0.00 0.00 179.97 181.58 3m83 h ALA 167 N 1.52 1.53 -0.42 0.04 0.00 -0.76 0.51 119.26 121.68 3m83 h ALA 167 Ca -0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 3m83 h ALA 167 Cb 0.91 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3m83 h ALA 167 CO 0.06 0.37 -0.25 0.28 0.00 0.00 0.00 179.25 179.71 3m83 h VAL 168 N 0.98 1.27 -0.57 0.00 2.07 -1.53 -0.24 116.25 118.23 3m83 h VAL 168 Ca 0.34 -1.40 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 3m83 h VAL 168 Cb 0.10 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 3m83 h VAL 168 CO -0.11 0.47 0.20 -0.33 0.02 0.00 0.00 177.57 177.82 3m83 h GLU 169 N 0.76 0.87 -0.33 1.57 4.39 -1.46 -0.88 114.58 119.51 3m83 h GLU 169 Ca 0.09 -0.18 -0.00 0.00 0.34 0.00 0.00 59.36 59.61 3m83 h GLU 169 Cb 0.80 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.31 3m83 h GLU 169 CO 0.07 0.78 0.19 0.00 -1.16 0.00 0.00 179.01 178.88 3m83 h ALA 170 N 1.06 0.42 -0.38 3.43 0.00 -0.70 -2.61 119.26 120.48 3m83 h ALA 170 Ca 0.19 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3m83 h ALA 170 Cb 0.25 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3m83 h ALA 170 CO -0.01 -0.06 0.24 0.00 0.00 0.00 0.00 179.25 179.42 3m83 h ALA 171 N 1.06 0.48 -0.12 0.00 0.00 -0.94 -2.77 119.26 116.98 3m83 h ALA 171 Ca 0.12 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3m83 h ALA 171 Cb 0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3m83 h ALA 171 CO -0.02 -0.04 0.11 0.00 0.00 0.00 0.00 179.25 179.30 3m83 h ALA 172 N 1.11 1.81 0.00 0.00 0.00 -1.08 -1.52 119.26 119.59 3m83 h ALA 172 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3m83 h ALA 172 Cb -0.02 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3m83 h ALA 172 CO -0.03 -0.17 0.00 -1.13 0.00 0.00 0.00 179.25 177.92 3m83 n SER 173 N -4.02 0.56 -4.72 0.00 3.41 -0.99 -4.79 113.62 103.07 3m83 n SER 173 Ca -0.00 0.57 -0.42 0.00 -0.26 0.00 0.00 58.87 58.76 3m83 n SER 173 Cb 0.22 -0.71 -0.03 0.00 -0.26 0.00 0.00 64.21 63.43 3m83 n SER 173 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3m83 s PHE 174 N -3.11 3.39 0.38 7.33 5.36 -0.57 -4.93 117.98 125.83 3m83 s PHE 174 Ca 0.10 1.25 0.09 0.00 -0.96 0.00 0.00 56.93 57.41 3m83 s PHE 174 Cb 0.13 -3.49 0.77 0.00 -0.34 0.00 0.00 43.02 40.09 3m83 s PHE 174 CO 0.52 -1.53 1.91 -1.35 -1.46 0.00 0.00 175.22 173.32 3m83 h PRO 175 N 6.44 0.25 0.00 10.12 0.11 -1.88 -2.08 132.00 144.95 3m83 h PRO 175 Ca -0.42 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3m83 h PRO 175 Cb 1.21 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3m83 h PRO 175 CO 0.81 0.39 0.00 1.04 -0.21 0.00 0.00 178.00 180.03 3m83 n GLN 176 N -4.27 0.83 -2.56 1.05 6.02 -1.26 -4.82 117.38 112.37 3m83 n GLN 176 Ca -0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.56 3m83 n GLN 176 Cb 0.27 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.00 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 -2.17 4.46 -0.41 5.09 1.01 -0.78 -0.40 120.40 127.20 3m83 s VAL 177 Ca 0.42 1.76 -0.29 0.00 0.00 0.00 0.00 61.98 63.88 3m83 s VAL 177 Cb 0.21 -4.13 0.02 0.00 0.00 0.00 0.00 36.38 32.49 3m83 s VAL 177 CO 0.40 0.05 1.12 -0.62 0.00 0.00 0.00 175.10 176.05 3m83 s ASP 178 N 1.22 6.75 0.06 3.32 -1.08 0.14 -4.78 116.67 122.31 3m83 s ASP 178 Ca 0.54 0.73 0.22 0.00 -0.52 0.00 0.00 52.55 53.51 3m83 s ASP 178 Cb -0.23 -2.55 0.88 0.00 -1.46 0.00 0.00 42.92 39.56 3m83 s ASP 178 CO 0.23 -1.10 1.68 0.00 0.52 0.00 0.00 175.17 176.49 3m83 n GLN 179 N 7.45 0.06 0.00 4.34 6.02 -1.26 -1.61 117.38 132.38 3m83 n GLN 179 Ca 0.12 0.20 0.13 0.00 -0.01 0.00 0.00 57.00 57.44 3m83 n GLN 179 Cb 0.48 -1.59 0.50 0.00 1.02 0.00 0.00 30.24 30.65 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 -1.70 0.07 -2.65 -1.09 -0.58 -1.26 -4.24 120.64 109.19 3m83 n GLU 180 Ca 0.05 -0.02 -0.18 0.00 -0.42 0.00 0.00 57.16 56.59 3m83 n GLU 180 Cb 0.26 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.64 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 -1.44 2.14 -3.53 3.49 1.74 -0.63 -4.90 116.66 113.52 3m83 n ARG 181 Ca 0.07 -3.85 -0.38 0.00 -0.77 0.00 0.00 57.85 52.92 3m83 n ARG 181 Cb 0.33 -1.73 -0.10 0.00 -1.02 0.00 0.00 32.46 29.94 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 -4.08 5.27 -0.09 0.55 1.01 -1.25 -0.91 121.20 121.71 3m83 s ILE 182 Ca 0.38 0.32 -0.00 0.00 0.00 0.00 0.00 60.65 61.34 3m83 s ILE 182 Cb 0.42 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 3m83 s ILE 182 CO -0.07 0.24 -0.05 -0.69 0.00 0.00 0.00 174.94 174.37 3m83 s VAL 183 N 1.69 3.81 -0.15 2.92 1.01 0.14 -0.33 120.40 129.49 3m83 s VAL 183 Ca 0.10 -0.43 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 3m83 s VAL 183 Cb -0.15 -2.58 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 3m83 s VAL 183 CO 0.09 0.58 0.01 0.27 0.00 0.00 0.00 175.10 176.06 3m83 s ILE 184 N -0.61 4.33 -0.01 2.22 -4.36 -0.08 0.38 121.20 123.08 3m83 s ILE 184 Ca 0.09 -0.20 0.01 0.00 -0.26 0.00 0.00 60.65 60.29 3m83 s ILE 184 Cb -0.12 -2.91 0.00 0.00 1.25 0.00 0.00 42.46 40.69 3m83 s ILE 184 CO 0.02 0.50 -0.02 0.00 0.24 0.00 0.00 174.94 175.68 3m83 s ALA 185 N 0.16 0.22 -0.02 2.27 0.00 0.17 -0.39 121.76 124.16 3m83 s ALA 185 Ca 0.01 -0.04 -0.28 0.00 0.00 0.00 0.00 51.96 51.65 3m83 s ALA 185 Cb -0.13 -0.10 0.10 0.00 0.00 0.00 0.00 23.12 22.99 3m83 s ALA 185 CO 0.02 0.02 0.85 0.20 0.00 0.00 0.00 175.76 176.85 3m83 s GLY 186 N 0.17 -0.46 -0.47 0.00 0.00 -0.38 -1.09 107.32 105.10 3m83 s GLY 186 Ca -0.01 1.18 0.04 0.00 0.00 0.00 0.00 44.72 45.93 3m83 s GLY 186 CO -0.00 0.52 1.25 0.61 0.00 0.00 0.00 173.10 175.47 3m83 n GLY 187 N 0.06 6.01 0.00 0.20 0.00 -1.26 -1.40 105.19 108.79 3m83 n GLY 187 Ca -0.11 -2.71 0.00 0.00 0.00 0.00 0.00 46.02 43.20 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 -0.53 0.00 -0.26 1.61 7.27 -1.26 -3.10 117.38 121.10 3m83 n GLN 189 Ca 0.42 0.00 0.08 0.00 0.07 0.00 0.00 57.00 57.57 3m83 n GLN 189 Cb 0.65 0.00 0.33 0.00 2.41 0.00 0.00 30.24 33.63 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 1.21 1.33 1.69 0.00 -1.78 -0.44 103.07 105.07 3m83 h GLY 190 Ca 0.00 -0.34 -0.17 0.00 0.00 0.00 0.00 47.33 46.82 3m83 h GLY 190 CO 0.00 0.18 -0.52 -1.33 0.00 0.00 0.00 176.54 174.87 3m83 h GLY 191 N 0.82 0.78 1.37 4.60 0.00 -1.55 0.83 103.07 109.91 3m83 h GLY 191 Ca 0.40 -0.88 -0.15 0.00 0.00 0.00 0.00 47.33 46.70 3m83 h GLY 191 CO -0.17 0.79 -0.45 -1.33 0.00 0.00 0.00 176.54 175.38 3m83 h GLY 192 N 0.90 0.75 0.91 4.60 0.00 -1.46 -0.66 103.07 108.12 3m83 h GLY 192 Ca 0.02 -0.80 -0.01 0.00 0.00 0.00 0.00 47.33 46.54 3m83 h GLY 192 CO 0.11 0.72 -0.13 -2.22 0.00 0.00 0.00 176.54 175.01 3m83 h ILE 193 N 0.55 0.76 -1.01 2.60 2.04 -0.99 -2.51 117.51 118.95 3m83 h ILE 193 Ca 0.03 -0.18 0.09 0.00 1.00 0.00 0.00 64.86 65.81 3m83 h ILE 193 Cb 1.00 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 37.86 3m83 h ILE 193 CO 0.09 0.04 0.64 0.00 0.00 0.00 0.00 178.15 178.93 3m83 h ALA 194 N 0.25 1.46 -0.76 1.87 0.00 -0.77 -0.97 119.26 120.34 3m83 h ALA 194 Ca -0.04 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3m83 h ALA 194 Cb 0.35 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3m83 h ALA 194 CO 0.06 0.35 0.29 1.25 0.00 0.00 0.00 179.25 181.20 3m83 h LEU 195 N 1.10 1.05 -0.18 0.00 5.85 -1.08 -0.05 115.31 122.01 3m83 h LEU 195 Ca 0.46 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 59.00 3m83 h LEU 195 Cb 0.30 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3m83 h LEU 195 CO -0.21 0.94 0.07 0.00 -0.34 0.00 0.00 178.44 178.90 3m83 h ALA 196 N 1.20 0.23 0.00 1.25 0.00 -0.82 -2.95 119.26 118.17 3m83 h ALA 196 Ca 0.25 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3m83 h ALA 196 Cb 0.23 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3m83 h ALA 196 CO -0.02 -0.18 -0.08 0.28 0.00 0.00 0.00 179.25 179.25 3m83 h VAL 197 N 0.14 0.99 0.00 0.00 2.07 -0.91 -1.89 116.25 116.66 3m83 h VAL 197 Ca 0.06 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 3m83 h VAL 197 Cb 0.17 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3m83 h VAL 197 CO -0.01 0.08 -0.17 0.77 0.02 0.00 0.00 177.57 178.26 3m83 h SER 198 N 0.00 0.00 0.38 0.57 4.64 -0.83 0.58 113.55 118.89 3m83 h SER 198 Ca -0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 3m83 h SER 198 Cb 0.15 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.18 3m83 h SER 198 CO 0.01 0.17 -1.85 0.00 -0.87 0.00 0.00 176.83 174.29 3m83 n ALA 199 N -2.24 1.60 -0.07 5.18 0.00 -0.83 -4.33 120.51 119.81 3m83 n ALA 199 Ca -0.01 -0.88 -0.04 0.00 0.00 0.00 0.00 53.44 52.52 3m83 n ALA 199 Cb 0.34 -0.69 -0.16 0.00 0.00 0.00 0.00 19.45 18.94 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 -2.92 0.02 -4.84 0.00 4.77 -0.77 -4.88 117.00 108.38 3m83 n LEU 200 Ca -0.20 0.01 -0.34 0.00 -0.03 0.00 0.00 56.01 55.45 3m83 n LEU 200 Cb 1.04 0.36 -0.06 0.00 -2.33 0.00 0.00 43.42 42.43 3m83 n LEU 200 CO 0.44 0.36 0.32 -0.55 -1.33 0.00 0.00 177.39 176.63 3m83 s SER 201 N -5.25 6.84 -0.00 -1.43 0.15 0.18 -4.98 113.70 109.21 3m83 s SER 201 Ca -0.09 1.18 0.22 0.00 0.70 0.00 0.00 55.95 57.96 3m83 s SER 201 Cb 0.08 -2.33 -0.21 0.00 -1.71 0.00 0.00 66.02 61.85 3m83 s SER 201 CO 0.85 -0.01 0.79 0.29 1.20 0.00 0.00 173.24 176.37 3m83 n LYS 202 N 0.38 0.25 -0.02 5.44 4.76 -1.26 -4.57 118.16 123.14 3m83 n LYS 202 Ca -0.02 -0.06 0.04 0.00 -2.87 0.00 0.00 58.31 55.40 3m83 n LYS 202 Cb 0.52 -1.52 -0.15 0.00 -1.84 0.00 0.00 35.03 32.04 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 -1.81 0.66 -2.24 1.97 4.76 -1.26 -4.96 118.16 115.28 3m83 n LYS 203 Ca 0.01 -0.09 -0.41 0.00 -2.87 0.00 0.00 58.31 54.96 3m83 n LYS 203 Cb 0.42 -1.57 -0.03 0.00 -1.84 0.00 0.00 35.03 32.02 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 -3.17 3.48 -0.05 7.82 0.00 -1.26 -4.75 121.76 123.82 3m83 s ALA 204 Ca -0.08 1.13 0.11 0.00 0.00 0.00 0.00 51.96 53.13 3m83 s ALA 204 Cb 0.11 -3.44 -0.17 0.00 0.00 0.00 0.00 23.12 19.63 3m83 s ALA 204 CO 0.87 -0.49 0.18 1.63 0.00 0.00 0.00 175.76 177.95 3m83 n LYS 205 N 1.23 1.06 -3.75 0.00 4.76 0.55 -4.96 118.16 117.05 3m83 n LYS 205 Ca 0.01 -0.07 -0.13 0.00 -2.87 0.00 0.00 58.31 55.24 3m83 n LYS 205 Cb 0.43 -1.29 -0.08 0.00 -1.84 0.00 0.00 35.03 32.25 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 -2.62 -0.81 -0.13 7.82 0.00 -1.16 -4.18 121.76 120.68 3m83 s ALA 206 Ca -0.05 0.34 0.01 0.00 0.00 0.00 0.00 51.96 52.25 3m83 s ALA 206 Cb 0.06 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.26 3m83 s ALA 206 CO 0.48 -0.27 -0.15 -1.17 0.00 0.00 0.00 175.76 174.65 3m83 s LEU 207 N -1.37 2.61 -0.29 0.00 2.96 -0.11 -0.90 118.68 121.58 3m83 s LEU 207 Ca -0.13 -0.37 -0.06 0.00 -0.22 0.00 0.00 54.13 53.35 3m83 s LEU 207 Cb -0.05 -1.58 0.01 0.00 0.50 0.00 0.00 46.19 45.08 3m83 s LEU 207 CO 0.04 0.16 0.05 -0.76 -1.32 0.00 0.00 176.35 174.52 3m83 s LEU 208 N 0.38 3.72 -0.38 -0.68 1.43 0.47 -1.37 118.68 122.26 3m83 s LEU 208 Ca -0.12 -0.75 0.01 0.00 -1.03 0.00 0.00 54.13 52.24 3m83 s LEU 208 Cb -0.16 -1.83 0.12 0.00 0.03 0.00 0.00 46.19 44.34 3m83 s LEU 208 CO 0.06 -0.18 0.15 0.00 0.23 0.00 0.00 176.35 176.61 3m83 s ASP 210 N 0.90 6.37 -1.15 0.00 1.01 -0.49 -1.82 116.67 121.49 3m83 s ASP 210 Ca 0.13 0.44 -0.18 0.00 0.71 0.00 0.00 52.55 53.65 3m83 s ASP 210 Cb -0.21 -2.13 0.02 0.00 1.01 0.00 0.00 42.92 41.61 3m83 s ASP 210 CO -0.11 0.21 0.34 1.33 0.21 0.00 0.00 175.17 177.14 3m83 n VAL 211 N 3.11 -1.64 -2.10 -1.27 0.24 -0.23 -4.22 118.33 112.22 3m83 n VAL 211 Ca -0.15 -0.47 -0.41 0.00 -2.04 0.00 0.00 64.34 61.27 3m83 n VAL 211 Cb 0.53 -1.44 -0.02 0.00 -1.47 0.00 0.00 33.84 31.43 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 -6.96 4.32 0.45 7.34 0.04 -1.26 -4.75 135.00 134.19 3m83 s PRO 212 Ca 0.25 2.21 0.03 0.00 0.04 0.00 0.00 61.00 63.52 3m83 s PRO 212 Cb -0.14 -3.13 0.01 0.00 0.04 0.00 0.00 34.50 31.28 3m83 s PRO 212 CO 0.83 -0.32 0.65 0.12 0.04 0.00 0.00 177.00 178.33 3m83 s PHE 213 N -0.20 3.05 -0.59 0.56 5.36 -1.26 -4.66 117.98 120.23 3m83 s PHE 213 Ca 0.56 0.00 -0.02 0.00 -0.96 0.00 0.00 56.93 56.51 3m83 s PHE 213 Cb -0.40 -2.39 0.00 0.00 -0.34 0.00 0.00 43.02 39.90 3m83 s PHE 213 CO 0.44 -0.45 0.28 1.28 -1.46 0.00 0.00 175.22 175.31 3m83 n LEU 214 N -2.05 -2.09 -4.04 6.12 4.77 -1.26 -3.50 117.00 114.95 3m83 n LEU 214 Ca 0.04 -0.13 -0.24 0.00 -0.03 0.00 0.00 56.01 55.65 3m83 n LEU 214 Cb 0.58 -1.47 -0.16 0.00 -2.33 0.00 0.00 43.42 40.04 3m83 n LEU 214 CO 0.45 0.12 -0.47 0.00 -1.33 0.00 0.00 177.39 176.17 3m83 n HIS 216 N 3.53 -2.06 -0.32 0.00 -0.00 -1.26 -4.70 115.22 110.41 3m83 n HIS 216 Ca -0.21 0.66 0.04 0.00 -0.00 0.00 0.00 57.72 58.21 3m83 n HIS 216 Cb 0.53 -3.86 0.23 0.00 -0.00 0.00 0.00 29.99 26.90 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 -1.66 1.08 -0.64 1.57 0.04 -1.95 -1.65 116.94 113.72 3m83 h PHE 217 Ca -0.64 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.07 3m83 h PHE 217 Cb 1.35 -0.35 -0.02 0.00 2.20 0.00 0.00 35.95 39.12 3m83 h PHE 217 CO 0.36 0.54 0.06 -0.09 -0.60 0.00 0.00 178.31 178.58 3m83 h ARG 218 N 1.04 1.09 -0.20 1.51 9.65 -1.99 -1.94 114.38 123.54 3m83 h ARG 218 Ca 0.41 -0.32 -0.14 0.00 -1.10 0.00 0.00 59.98 58.83 3m83 h ARG 218 Cb 0.24 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 28.71 3m83 h ARG 218 CO -0.16 1.03 -0.42 -0.09 2.80 0.00 0.00 179.97 183.12 3m83 h ARG 219 N 1.00 0.64 -0.64 0.20 9.65 -1.76 -3.16 114.38 120.32 3m83 h ARG 219 Ca 0.19 -0.42 0.06 0.00 -1.10 0.00 0.00 59.98 58.71 3m83 h ARG 219 Cb 0.49 0.06 -0.06 0.00 -1.39 0.00 0.00 29.97 29.07 3m83 h ARG 219 CO 0.02 1.04 0.34 0.00 2.80 0.00 0.00 179.97 184.18 3m83 h ALA 220 N 0.60 0.86 -0.00 2.80 0.00 -1.10 -1.26 119.26 121.16 3m83 h ALA 220 Ca 0.00 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3m83 h ALA 220 Cb 1.03 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3m83 h ALA 220 CO 0.09 0.00 -0.41 0.28 0.00 0.00 0.00 179.25 179.22 3m83 h VAL 221 N 0.63 1.30 0.00 0.00 2.07 -1.44 -1.91 116.25 116.90 3m83 h VAL 221 Ca 0.29 -1.42 -0.09 0.00 0.82 0.00 0.00 66.70 66.30 3m83 h VAL 221 Cb 0.21 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 3m83 h VAL 221 CO -0.19 0.41 -0.79 -0.61 0.02 0.00 0.00 177.57 176.40 3m83 h GLN 222 N 0.01 0.00 0.07 1.57 4.15 -1.41 -3.39 115.11 116.10 3m83 h GLN 222 Ca -0.00 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.10 3m83 h GLN 222 Cb 0.73 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.40 3m83 h GLN 222 CO 0.05 0.29 -1.74 -0.11 -1.93 0.00 0.00 178.83 175.40 3m83 n LEU 223 N -3.02 2.32 -4.36 -2.39 0.00 -0.51 -4.97 117.00 104.06 3m83 n LEU 223 Ca -0.02 0.29 -0.25 0.00 0.00 0.00 0.00 56.01 56.03 3m83 n LEU 223 Cb 0.71 -1.05 -0.12 0.00 0.00 0.00 0.00 43.42 42.96 3m83 n LEU 223 CO 0.40 0.62 -0.53 0.68 0.00 0.00 0.00 177.39 178.57 3m83 s VAL 224 N -2.48 2.06 -0.25 1.96 -7.23 -0.76 -5.03 120.40 108.67 3m83 s VAL 224 Ca -0.26 -1.83 0.16 0.00 -1.81 0.00 0.00 61.98 58.24 3m83 s VAL 224 Cb 0.07 -1.90 0.45 0.00 0.56 0.00 0.00 36.38 35.56 3m83 s VAL 224 CO 0.69 -0.10 1.34 -0.90 -0.31 0.00 0.00 175.10 175.82 3m83 n ASP 225 N 0.61 3.46 -4.87 4.85 5.68 -1.26 -4.71 116.55 120.31 3m83 n ASP 225 Ca -0.16 -2.88 -0.30 0.00 -0.50 0.00 0.00 54.79 50.95 3m83 n ASP 225 Cb 0.55 -0.47 -0.03 0.00 -1.14 0.00 0.00 41.12 40.03 3m83 n ASP 225 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3m83 s THR 226 N -2.56 4.75 0.48 2.12 -4.23 -1.26 -4.78 115.64 110.16 3m83 s THR 226 Ca 0.37 0.69 -0.19 0.00 -1.18 0.00 0.00 61.69 61.37 3m83 s THR 226 Cb 0.29 -3.75 -0.09 0.00 1.34 0.00 0.00 72.50 70.29 3m83 s THR 226 CO 0.08 -0.62 1.00 -1.00 -0.54 0.00 0.00 174.62 173.54 3m83 s HIS 227 N -2.50 3.19 -1.55 3.99 3.76 -1.26 -1.16 115.29 119.76 3m83 s HIS 227 Ca 0.52 1.57 0.27 0.00 -0.15 0.00 0.00 55.06 57.26 3m83 s HIS 227 Cb -0.10 -2.93 0.81 0.00 1.11 0.00 0.00 32.58 31.47 3m83 s HIS 227 CO 0.34 -0.50 1.60 -0.35 -0.85 0.00 0.00 174.74 174.99 3m83 n PRO 228 N -1.04 0.60 0.17 8.40 -0.05 -1.26 -4.86 135.00 136.96 3m83 n PRO 228 Ca 0.08 -0.32 0.13 0.00 -0.05 0.00 0.00 63.50 63.34 3m83 n PRO 228 Cb 0.53 -1.49 0.70 0.00 -0.05 0.00 0.00 33.50 33.19 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 0.79 0.00 0.00 0.54 0.05 -1.85 -1.76 116.97 114.74 3m83 h TYR 229 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3m83 h TYR 229 Cb 0.48 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.22 3m83 h TYR 229 CO 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.11 3m83 h ALA 230 N 1.89 1.00 -0.89 3.88 0.00 -1.44 -2.26 119.26 121.44 3m83 h ALA 230 Ca 0.09 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3m83 h ALA 230 Cb 0.38 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 3m83 h ALA 230 CO -0.00 0.00 0.59 0.93 0.00 0.00 0.00 179.25 180.77 3m83 h GLU 231 N 0.00 1.14 -0.23 0.00 5.08 -1.60 -0.87 114.58 118.10 3m83 h GLU 231 Ca 0.00 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.20 3m83 h GLU 231 Cb 0.27 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 3m83 h GLU 231 CO 0.00 0.75 -0.22 0.82 -1.00 0.00 0.00 179.01 179.37 3m83 h ILE 232 N 1.17 1.32 -0.51 3.13 2.04 -1.58 -2.18 117.51 120.90 3m83 h ILE 232 Ca 0.34 -1.37 0.02 0.00 1.00 0.00 0.00 64.86 64.85 3m83 h ILE 232 Cb -0.07 1.70 -0.03 0.00 -0.74 0.00 0.00 36.82 37.68 3m83 h ILE 232 CO -0.09 0.43 0.31 0.74 0.00 0.00 0.00 178.15 179.54 3m83 h THR 233 N 0.24 1.06 -0.38 -0.27 2.02 -1.50 -1.57 112.91 112.52 3m83 h THR 233 Ca 0.04 -0.21 -0.12 0.00 0.77 0.00 0.00 66.41 66.89 3m83 h THR 233 Cb 0.77 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 3m83 h THR 233 CO 0.05 0.11 -0.24 0.78 0.37 0.00 0.00 175.52 176.60 3m83 h ASN 234 N 0.62 0.78 -0.58 4.18 2.35 -1.17 -0.02 115.58 121.75 3m83 h ASN 234 Ca 0.20 -0.29 -0.02 0.00 -0.55 0.00 0.00 56.30 55.65 3m83 h ASN 234 Cb 0.01 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 3m83 h ASN 234 CO -0.09 0.99 0.30 0.15 -1.65 0.00 0.00 177.43 177.14 3m83 h PHE 235 N 0.67 0.81 -0.07 1.19 3.04 -1.25 -3.05 116.94 118.28 3m83 h PHE 235 Ca 0.09 -0.03 -0.09 0.00 3.98 0.00 0.00 57.97 61.92 3m83 h PHE 235 Cb 0.75 -0.26 -0.01 0.00 2.56 0.00 0.00 35.95 39.00 3m83 h PHE 235 CO 0.04 0.60 -0.36 -0.07 -2.02 0.00 0.00 178.31 176.50 3m83 h LEU 236 N 0.78 0.14 -1.58 0.59 3.38 -0.90 0.35 115.31 118.08 3m83 h LEU 236 Ca 0.20 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3m83 h LEU 236 Cb 0.07 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3m83 h LEU 236 CO -0.03 0.50 0.19 0.11 0.09 0.00 0.00 178.44 179.29 3m83 h LYS 237 N 0.12 0.47 0.00 1.13 1.57 -0.90 -3.29 116.57 115.67 3m83 h LYS 237 Ca 0.01 -0.04 -0.22 0.00 -1.87 0.00 0.00 60.65 58.53 3m83 h LYS 237 Cb 0.69 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 3m83 h LYS 237 CO 0.05 0.35 -1.35 2.41 -0.57 0.00 0.00 179.45 180.33 3m83 n THR 238 N -4.45 1.51 -2.31 -0.16 -1.04 -1.07 -4.60 114.28 102.16 3m83 n THR 238 Ca 0.02 -0.04 -0.42 0.00 -2.04 0.00 0.00 64.05 61.57 3m83 n THR 238 Cb 0.10 -2.09 0.00 0.00 -1.82 0.00 0.00 70.33 66.52 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 -4.43 2.96 0.31 -1.42 8.25 0.09 -4.77 115.22 116.21 3m83 n HIS 239 Ca -0.31 -2.80 0.17 0.00 -0.26 0.00 0.00 57.72 54.52 3m83 n HIS 239 Cb 0.64 -1.97 0.75 0.00 1.12 0.00 0.00 29.99 30.53 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 5.75 0.00 -0.01 -0.41 3.08 -1.81 -1.42 114.38 119.57 3m83 h ARG 240 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.45 3m83 h ARG 240 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 3m83 h ARG 240 CO 1.64 0.00 -0.12 -0.40 -1.07 0.00 0.00 179.97 180.02 3m83 n ASP 241 N -2.79 0.77 -0.79 7.04 5.75 -1.26 -4.40 116.55 120.87 3m83 n ASP 241 Ca -0.00 -0.87 0.07 0.00 -0.01 0.00 0.00 54.79 53.98 3m83 n ASP 241 Cb 0.20 0.00 0.19 0.00 -1.03 0.00 0.00 41.12 40.49 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 -0.66 2.92 -0.03 0.11 4.76 -0.53 -4.73 118.16 120.00 3m83 n LYS 242 Ca 0.16 -2.27 -0.09 0.00 -2.87 0.00 0.00 58.31 53.23 3m83 n LYS 242 Cb 0.30 -1.42 -0.03 0.00 -1.84 0.00 0.00 35.03 32.04 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 2.28 0.13 -0.27 1.97 4.81 -1.77 -0.56 114.58 121.17 3m83 h GLU 243 Ca 0.00 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3m83 h GLU 243 Cb 0.90 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 3m83 h GLU 243 CO 0.05 0.09 0.15 1.49 -0.73 0.00 0.00 179.01 180.05 3m83 h GLU 244 N 0.14 0.38 -0.87 1.92 4.81 -1.95 -2.41 114.58 116.59 3m83 h GLU 244 Ca 0.08 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 3m83 h GLU 244 Cb 0.06 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 3m83 h GLU 244 CO -0.09 0.33 0.52 0.82 -0.73 0.00 0.00 179.01 179.86 3m83 h ILE 245 N 0.32 1.24 -0.06 2.32 2.04 -1.85 -1.48 117.51 120.05 3m83 h ILE 245 Ca 0.09 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 3m83 h ILE 245 Cb 0.06 0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 36.17 3m83 h ILE 245 CO -0.02 0.26 0.03 0.58 0.00 0.00 0.00 178.15 179.00 3m83 h VAL 246 N 1.20 1.13 0.00 1.67 2.07 -0.90 -1.79 116.25 119.63 3m83 h VAL 246 Ca 0.31 -0.38 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 3m83 h VAL 246 Cb -0.04 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 3m83 h VAL 246 CO -0.06 0.11 -0.43 -0.26 0.02 0.00 0.00 177.57 176.95 3m83 h PHE 247 N -0.04 0.00 -0.02 1.57 0.04 -1.38 -1.26 116.94 115.85 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 0.15 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.30 3m83 h PHE 247 CO -0.02 0.43 0.00 -0.09 -0.60 0.00 0.00 178.31 178.03 3m83 h ARG 248 N 0.00 0.03 -0.20 1.51 2.43 -1.18 -2.10 114.38 114.87 3m83 h ARG 248 Ca -0.00 -0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.21 3m83 h ARG 248 Cb 0.92 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.42 3m83 h ARG 248 CO 0.06 0.24 -0.11 1.15 -1.51 0.00 0.00 179.97 179.80 3m83 h THR 249 N -0.20 0.66 -0.07 0.20 2.02 -1.13 -2.79 112.91 111.60 3m83 h THR 249 Ca 0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 3m83 h THR 249 Cb 0.23 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 3m83 h THR 249 CO 0.00 0.00 -0.04 -0.07 0.37 0.00 0.00 175.52 175.78 3m83 h LEU 250 N -0.10 0.09 -1.94 2.58 3.38 -1.17 -2.54 115.31 115.61 3m83 h LEU 250 Ca 0.11 -0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.25 3m83 h LEU 250 Cb 0.27 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 3m83 h LEU 250 CO -0.26 0.15 0.46 0.77 0.09 0.00 0.00 178.44 179.64 3m83 h SER 251 N 0.10 0.06 0.95 -0.43 4.64 -1.09 -0.69 113.55 117.09 3m83 h SER 251 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3m83 h SER 251 Cb 0.14 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3m83 h SER 251 CO 0.01 0.03 0.00 -1.22 -0.87 0.00 0.00 176.83 174.77 3m83 n TYR 252 N -4.37 0.32 -0.18 4.77 4.02 -0.95 -3.64 117.16 117.12 3m83 n TYR 252 Ca 0.12 0.10 0.00 0.00 -0.01 0.00 0.00 57.90 58.12 3m83 n TYR 252 Cb 0.68 -0.67 0.00 0.00 -0.02 0.00 0.00 39.34 39.33 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 -1.77 0.00 -2.77 -0.72 3.72 -0.30 -5.03 117.46 110.59 3m83 n PHE 253 Ca 0.05 -0.27 -0.42 0.00 -0.05 0.00 0.00 57.45 56.76 3m83 n PHE 253 Cb 0.30 -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 -0.54 7.11 0.47 4.37 -1.08 -1.02 -4.87 116.67 121.11 3m83 s ASP 254 Ca 0.00 1.37 0.21 0.00 -0.52 0.00 0.00 52.55 53.61 3m83 s ASP 254 Cb 0.00 -2.51 1.21 0.00 -1.46 0.00 0.00 42.92 40.15 3m83 s ASP 254 CO 0.00 -0.45 1.92 1.23 0.52 0.00 0.00 175.17 178.39 3m83 h GLY 255 N 8.28 0.46 1.40 2.66 0.00 -1.32 -0.25 103.07 114.30 3m83 h GLY 255 Ca -0.29 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 3m83 h GLY 255 CO 0.86 0.02 0.22 -2.08 0.00 0.00 0.00 176.54 175.57 3m83 h VAL 256 N 0.25 1.20 0.04 4.60 2.07 -1.90 0.19 116.25 122.69 3m83 h VAL 256 Ca 0.36 -0.60 -0.22 0.00 0.82 0.00 0.00 66.70 67.06 3m83 h VAL 256 Cb 1.06 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 3m83 h VAL 256 CO -0.08 0.24 -1.00 0.78 0.02 0.00 0.00 177.57 177.53 3m83 h ASN 257 N 0.77 0.26 -0.36 0.57 2.35 -1.38 -2.88 115.58 114.91 3m83 h ASN 257 Ca 0.19 -0.24 -0.16 0.00 -0.55 0.00 0.00 56.30 55.54 3m83 h ASN 257 Cb 0.14 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 3m83 h ASN 257 CO -0.02 1.10 -0.41 -0.26 -1.65 0.00 0.00 177.43 176.20 3m83 h PHE 258 N 0.08 1.11 -0.86 1.19 0.04 -1.22 -3.28 116.94 114.01 3m83 h PHE 258 Ca -0.06 -0.35 0.05 0.00 2.80 0.00 0.00 57.97 60.42 3m83 h PHE 258 Cb 1.68 -0.23 -0.06 0.00 2.20 0.00 0.00 35.95 39.54 3m83 h PHE 258 CO 0.03 1.17 0.54 0.00 -0.60 0.00 0.00 178.31 179.46 3m83 h ALA 259 N 0.75 1.17 0.00 2.45 0.00 -0.62 -1.02 119.26 121.99 3m83 h ALA 259 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3m83 h ALA 259 Cb 1.01 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3m83 h ALA 259 CO 0.10 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.66 3m83 h ALA 260 N 1.39 1.00 0.00 0.00 0.00 -1.51 -1.31 119.26 118.84 3m83 h ALA 260 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3m83 h ALA 260 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3m83 h ALA 260 CO -0.16 0.00 -0.80 0.54 0.00 0.00 0.00 179.25 178.83 3m83 n ARG 261 N -2.84 1.93 -2.77 0.00 1.74 -0.44 -4.63 116.66 109.65 3m83 n ARG 261 Ca -0.02 -0.01 -0.40 0.00 -0.77 0.00 0.00 57.85 56.64 3m83 n ARG 261 Cb 0.06 -1.22 -0.06 0.00 -1.02 0.00 0.00 32.46 30.23 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 -2.47 3.34 -0.02 7.54 0.00 -0.88 -4.81 121.76 124.47 3m83 s ALA 262 Ca 0.04 0.59 0.01 0.00 0.00 0.00 0.00 51.96 52.60 3m83 s ALA 262 Cb 0.11 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 20.03 3m83 s ALA 262 CO 0.61 0.20 0.02 1.63 0.00 0.00 0.00 175.76 178.22 3m83 n LYS 263 N 1.60 3.27 -2.21 0.00 4.76 -1.26 -1.31 118.16 123.01 3m83 n LYS 263 Ca -0.02 -0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.09 3m83 n LYS 263 Cb 0.47 -0.79 -0.01 0.00 -1.84 0.00 0.00 35.03 32.87 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 -1.58 4.28 0.44 -0.18 -4.36 -1.26 -4.25 121.20 114.30 3m83 s ILE 264 Ca -0.00 1.05 -0.25 0.00 -0.26 0.00 0.00 60.65 61.19 3m83 s ILE 264 Cb 0.01 -3.61 -0.08 0.00 1.25 0.00 0.00 42.46 40.03 3m83 s ILE 264 CO 0.03 -0.67 1.38 -2.84 0.24 0.00 0.00 174.94 173.08 3m83 s PRO 265 N -4.19 3.73 -0.01 0.37 0.02 -1.26 -4.19 135.00 129.49 3m83 s PRO 265 Ca 0.60 2.30 0.01 0.00 0.02 0.00 0.00 61.00 63.93 3m83 s PRO 265 Cb -0.12 -2.65 0.00 0.00 0.02 0.00 0.00 34.50 31.75 3m83 s PRO 265 CO 0.36 -0.74 -0.02 0.00 -0.33 0.00 0.00 177.00 176.27 3m83 s ALA 266 N -1.24 0.17 -0.23 -1.55 0.00 -0.01 -0.94 121.76 117.96 3m83 s ALA 266 Ca 0.61 -0.04 -0.03 0.00 0.00 0.00 0.00 51.96 52.50 3m83 s ALA 266 Cb -0.41 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.64 3m83 s ALA 266 CO 0.53 0.02 -0.06 -1.17 0.00 0.00 0.00 175.76 175.08 3m83 s LEU 267 N 0.11 3.00 0.28 0.00 2.96 -0.47 -1.83 118.68 122.74 3m83 s LEU 267 Ca -0.01 -0.64 0.03 0.00 -0.22 0.00 0.00 54.13 53.30 3m83 s LEU 267 Cb -0.03 -1.69 -0.03 0.00 0.50 0.00 0.00 46.19 44.94 3m83 s LEU 267 CO -0.00 -0.07 0.43 -0.36 -1.32 0.00 0.00 176.35 175.02 3m83 s PHE 268 N 1.40 3.47 0.03 5.38 0.40 -0.19 -1.24 117.98 127.23 3m83 s PHE 268 Ca 0.03 0.12 -0.02 0.00 -0.60 0.00 0.00 56.93 56.46 3m83 s PHE 268 Cb -0.15 -1.70 -0.02 0.00 0.51 0.00 0.00 43.02 41.66 3m83 s PHE 268 CO -0.04 0.32 0.00 -1.54 0.70 0.00 0.00 175.22 174.65 3m83 s SER 269 N -4.00 0.31 -0.12 1.36 1.04 -0.76 -0.88 113.70 110.65 3m83 s SER 269 Ca 0.36 -0.67 -0.10 0.00 0.48 0.00 0.00 55.95 56.02 3m83 s SER 269 Cb -0.09 0.17 0.03 0.00 0.10 0.00 0.00 66.02 66.23 3m83 s SER 269 CO 0.32 -0.45 0.31 0.54 0.98 0.00 0.00 173.24 174.93 3m83 s VAL 270 N -2.57 -0.00 -0.25 5.02 0.11 -0.76 -1.07 120.40 120.87 3m83 s VAL 270 Ca -0.05 0.01 -0.08 0.00 -2.93 0.00 0.00 61.98 58.93 3m83 s VAL 270 Cb -0.02 -0.43 -0.03 0.00 -1.53 0.00 0.00 36.38 34.37 3m83 s VAL 270 CO -0.05 0.00 0.09 -0.83 -3.33 0.00 0.00 175.10 170.99 3m83 s GLY 271 N 0.27 1.80 0.16 6.54 0.00 -1.26 -0.72 107.32 114.11 3m83 s GLY 271 Ca -0.01 -1.11 0.22 0.00 0.00 0.00 0.00 44.72 43.82 3m83 s GLY 271 CO -0.01 0.54 1.67 1.04 0.00 0.00 0.00 173.10 176.34 3m83 n LEU 272 N 4.90 0.46 -1.13 0.66 4.77 -0.64 -1.84 117.00 124.17 3m83 n LEU 272 Ca -0.16 0.60 0.08 0.00 -0.03 0.00 0.00 56.01 56.50 3m83 n LEU 272 Cb 0.52 -0.52 0.28 0.00 -2.33 0.00 0.00 43.42 41.37 3m83 n LEU 272 CO 0.31 -0.39 0.74 0.23 -1.33 0.00 0.00 177.39 176.96 3m83 n MET 273 N -1.99 3.38 -2.33 3.23 2.81 -0.55 -4.66 117.12 117.01 3m83 n MET 273 Ca 0.03 -2.74 -0.43 0.00 -1.81 0.00 0.00 57.70 52.75 3m83 n MET 273 Cb 0.25 -1.80 -0.02 0.00 -0.71 0.00 0.00 33.22 30.93 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 -1.37 6.41 0.00 7.83 -1.08 -0.77 -4.44 116.67 123.25 3m83 s ASP 274 Ca 0.42 1.03 0.21 0.00 -0.52 0.00 0.00 52.55 53.69 3m83 s ASP 274 Cb 0.31 -2.54 0.50 0.00 -1.46 0.00 0.00 42.92 39.73 3m83 s ASP 274 CO 0.15 -1.34 1.43 -0.46 0.52 0.00 0.00 175.17 175.47 3m83 n ASN 275 N 8.54 3.59 -0.13 -0.34 6.94 -1.26 -3.60 115.26 129.00 3m83 n ASN 275 Ca 0.17 -1.98 -0.27 0.00 -0.02 0.00 0.00 54.58 52.48 3m83 n ASN 275 Cb 0.47 -0.35 -0.11 0.00 -2.36 0.00 0.00 39.78 37.43 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 1.42 1.53 -3.88 1.53 2.08 -1.26 -4.59 119.36 116.19 3m83 n ILE 276 Ca 0.20 -0.34 -0.32 0.00 0.56 0.00 0.00 62.75 62.85 3m83 n ILE 276 Cb 0.58 -1.86 -0.13 0.00 -0.75 0.00 0.00 39.64 37.48 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 -0.20 3.51 0.53 0.00 0.02 -1.24 -4.74 135.00 132.88 3m83 s PRO 278 Ca 0.17 2.18 0.23 0.00 0.02 0.00 0.00 61.00 63.60 3m83 s PRO 278 Cb -0.24 -2.45 1.38 0.00 0.02 0.00 0.00 34.50 33.21 3m83 s PRO 278 CO -0.01 -0.88 2.05 -1.00 -0.33 0.00 0.00 177.00 176.83 3m83 h PRO 279 N 1.95 0.00 -0.04 5.54 0.13 -1.79 -0.77 132.00 137.03 3m83 h PRO 279 Ca -0.50 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.52 3m83 h PRO 279 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 3m83 h PRO 279 CO 0.59 0.00 -0.47 0.66 -0.23 0.00 0.00 178.00 178.56 3m83 h SER 280 N 0.00 0.09 -0.13 1.44 4.64 -1.94 0.15 113.55 117.81 3m83 h SER 280 Ca 0.17 -0.04 -0.23 0.00 -0.47 0.00 0.00 61.79 61.21 3m83 h SER 280 Cb 0.69 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 62.77 3m83 h SER 280 CO -0.00 0.55 -0.82 0.71 -0.87 0.00 0.00 176.83 176.40 3m83 h THR 281 N 0.07 1.28 -0.21 2.95 1.35 -1.47 -2.03 112.91 114.84 3m83 h THR 281 Ca 0.00 -2.01 -0.03 0.00 -0.55 0.00 0.00 66.41 63.82 3m83 h THR 281 Cb 0.85 2.04 -0.01 0.00 -1.73 0.00 0.00 68.15 69.31 3m83 h THR 281 CO 0.06 0.64 0.02 0.58 -0.25 0.00 0.00 175.52 176.57 3m83 h VAL 282 N 0.52 1.24 -0.31 6.82 2.07 -1.31 -2.80 116.25 122.48 3m83 h VAL 282 Ca -0.07 -0.80 -0.10 0.00 0.82 0.00 0.00 66.70 66.55 3m83 h VAL 282 Cb 1.45 1.35 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 3m83 h VAL 282 CO 0.17 0.25 -0.24 -0.26 0.02 0.00 0.00 177.57 177.50 3m83 h PHE 283 N 0.15 0.68 -0.26 1.57 0.04 -1.05 -0.60 116.94 117.46 3m83 h PHE 283 Ca 0.06 -0.15 0.06 0.00 2.80 0.00 0.00 57.97 60.74 3m83 h PHE 283 Cb 0.35 -0.16 -0.06 0.00 2.20 0.00 0.00 35.95 38.28 3m83 h PHE 283 CO 0.03 0.80 -0.14 0.00 -0.60 0.00 0.00 178.31 178.39 3m83 h ALA 284 N 1.20 0.07 -0.47 2.45 0.00 -1.33 0.24 119.26 121.43 3m83 h ALA 284 Ca 0.07 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3m83 h ALA 284 Cb 0.70 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 3m83 h ALA 284 CO 0.05 -0.54 0.08 0.00 0.00 0.00 0.00 179.25 178.85 3m83 h ALA 285 N 1.10 0.63 -0.48 0.00 0.00 -1.31 -2.71 119.26 116.49 3m83 h ALA 285 Ca 0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3m83 h ALA 285 Cb 0.32 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3m83 h ALA 285 CO -0.33 0.35 0.19 -0.92 0.00 0.00 0.00 179.25 178.54 3m83 h TYR 286 N 0.65 0.72 -0.06 0.00 3.20 -0.81 -1.89 116.97 118.78 3m83 h TYR 286 Ca 0.14 -0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.89 3m83 h TYR 286 Cb 0.38 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 3m83 h TYR 286 CO 0.03 0.61 -0.30 -0.91 -1.64 0.00 0.00 178.16 175.94 3m83 h ASN 287 N 0.63 0.10 0.98 -2.11 2.35 -0.51 -2.31 115.58 114.72 3m83 h ASN 287 Ca 0.16 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 3m83 h ASN 287 Cb 0.19 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.53 3m83 h ASN 287 CO -0.01 0.41 -0.45 -1.22 -1.65 0.00 0.00 177.43 174.50 3m83 n TYR 288 N -4.15 0.59 -1.67 1.19 4.01 -1.03 -4.93 117.16 111.17 3m83 n TYR 288 Ca -0.02 0.17 -0.48 0.00 -0.16 0.00 0.00 57.90 57.42 3m83 n TYR 288 Cb 0.37 -0.69 -0.05 0.00 -0.31 0.00 0.00 39.34 38.67 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 -2.08 2.26 0.80 -0.72 9.36 -0.71 -3.34 117.16 122.73 3m83 n TYR 289 Ca 0.04 0.16 0.11 0.00 3.32 0.00 0.00 57.90 61.54 3m83 n TYR 289 Cb 0.43 -2.59 0.12 0.00 -0.63 0.00 0.00 39.34 36.66 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 4.90 3.57 -1.97 2.98 0.00 -0.52 -4.93 120.51 124.55 3m83 n ALA 290 Ca 0.20 -0.39 -0.24 0.00 0.00 0.00 0.00 53.44 53.01 3m83 n ALA 290 Cb 0.28 -1.03 0.09 0.00 0.00 0.00 0.00 19.45 18.80 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 -3.31 1.76 0.34 0.00 0.00 -0.43 -4.78 107.32 100.91 3m83 s GLY 291 Ca 0.08 -1.40 -0.29 0.00 0.00 0.00 0.00 44.72 43.11 3m83 s GLY 291 CO 0.76 -0.89 1.49 -1.55 0.00 0.00 0.00 173.10 172.90 3m83 n PRO 292 N -2.88 2.58 -3.65 2.90 -0.04 -1.26 -4.88 135.00 127.77 3m83 n PRO 292 Ca 0.12 0.91 -0.15 0.00 -0.04 0.00 0.00 63.50 64.34 3m83 n PRO 292 Cb 0.60 -2.63 -0.07 0.00 -0.04 0.00 0.00 33.50 31.36 3m83 n PRO 292 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 3m83 s LYS 293 N -1.47 0.87 0.03 0.54 -2.85 -1.26 -0.83 119.74 114.77 3m83 s LYS 293 Ca 0.58 -0.05 -0.01 0.00 -1.00 0.00 0.00 55.97 55.49 3m83 s LYS 293 Cb -0.50 0.40 -0.03 0.00 -2.06 0.00 0.00 37.83 35.64 3m83 s LYS 293 CO 0.58 -0.27 -0.02 -1.21 0.10 0.00 0.00 175.35 174.53 3m83 s GLU 294 N -1.50 0.43 -0.03 1.78 2.02 -0.76 -4.97 118.70 115.66 3m83 s GLU 294 Ca -0.11 -0.82 0.02 0.00 0.02 0.00 0.00 54.97 54.08 3m83 s GLU 294 Cb -0.02 0.15 0.01 0.00 0.10 0.00 0.00 34.13 34.36 3m83 s GLU 294 CO 0.05 -0.07 -0.10 -1.50 0.02 0.00 0.00 175.26 173.66 3m83 s ILE 295 N -2.35 0.85 -0.23 -1.63 2.07 -1.26 -1.02 121.20 117.62 3m83 s ILE 295 Ca -0.08 -0.38 -0.12 0.00 -1.41 0.00 0.00 60.65 58.66 3m83 s ILE 295 Cb -0.03 -0.76 -0.05 0.00 0.13 0.00 0.00 42.46 41.74 3m83 s ILE 295 CO -0.04 0.27 0.22 -0.13 -1.91 0.00 0.00 174.94 173.35 3m83 s ARG 296 N 0.29 4.10 -0.19 3.50 1.81 -0.06 -4.97 118.95 123.43 3m83 s ARG 296 Ca -0.05 -0.15 -0.06 0.00 -1.72 0.00 0.00 55.73 53.76 3m83 s ARG 296 Cb -0.10 -3.54 -0.03 0.00 -0.45 0.00 0.00 34.95 30.83 3m83 s ARG 296 CO 0.01 0.03 0.01 0.42 -0.68 0.00 0.00 175.30 175.10 3m83 s ILE 297 N 1.13 4.15 -0.52 1.52 1.01 -1.26 -1.83 121.20 125.40 3m83 s ILE 297 Ca 0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 60.65 60.50 3m83 s ILE 297 Cb -0.14 -2.87 0.13 0.00 0.01 0.00 0.00 42.46 39.59 3m83 s ILE 297 CO 0.05 0.44 0.30 -0.31 0.00 0.00 0.00 174.94 175.41 3m83 s TYR 298 N 0.83 3.45 0.47 3.97 2.02 0.10 -4.99 117.35 123.19 3m83 s TYR 298 Ca 0.01 -2.78 0.16 0.00 -0.37 0.00 0.00 57.07 54.09 3m83 s TYR 298 Cb -0.14 -3.09 1.13 0.00 -0.40 0.00 0.00 41.96 39.46 3m83 s TYR 298 CO 0.02 -0.86 2.05 -1.35 -1.57 0.00 0.00 175.55 173.84 3m83 h PRO 299 N 7.22 0.00 -0.07 -1.71 0.11 -1.95 -1.67 132.00 133.93 3m83 h PRO 299 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 3m83 h PRO 299 Cb 0.97 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3m83 h PRO 299 CO 0.68 0.12 0.00 0.66 -0.21 0.00 0.00 178.00 179.26 3m83 n TYR 300 N -4.32 0.07 -3.72 0.65 4.01 -1.26 -3.98 117.16 108.61 3m83 n TYR 300 Ca -0.03 -0.05 -0.32 0.00 -0.16 0.00 0.00 57.90 57.35 3m83 n TYR 300 Cb 0.20 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.18 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 -1.31 6.47 0.00 7.72 -0.87 -1.14 -4.83 114.94 120.99 3m83 s ASN 301 Ca 0.20 0.54 0.00 0.00 -1.57 0.00 0.00 52.86 52.03 3m83 s ASN 301 Cb 0.14 -2.07 0.00 0.00 -0.02 0.00 0.00 41.25 39.30 3m83 s ASN 301 CO 0.20 0.08 0.00 0.59 -2.57 0.00 0.00 177.10 175.41 3m83 n ASN 302 N 0.19 0.00 0.23 -1.22 4.13 -1.26 -1.48 115.26 115.84 3m83 n ASN 302 Ca -0.03 0.00 0.16 0.00 1.68 0.00 0.00 54.58 56.38 3m83 n ASN 302 Cb 0.52 0.00 0.74 0.00 -1.54 0.00 0.00 39.78 39.50 3m83 n ASN 302 CO 0.00 0.00 0.00 -0.74 0.28 0.00 0.00 177.26 176.80 3m83 h HIS 303 N 0.00 0.00 0.00 3.10 2.76 -1.92 -1.64 115.15 117.45 3m83 h HIS 303 Ca 0.00 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.16 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 -0.04 1.05 -1.30 0.00 0.00 177.93 177.64 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 0.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.33 3m83 h GLU 304 CO 0.00 0.04 0.00 0.41 0.05 0.00 0.00 179.01 179.51 3m83 n GLY 305 N -0.91 3.12 0.14 1.06 0.00 -0.62 -2.56 105.19 105.42 3m83 n GLY 305 Ca -0.02 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.91 7.00 -0.02 0.00 -1.26 -4.78 105.19 105.22 3m83 n GLY 306 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 3.26 0.24 -0.02 0.00 -1.06 -1.78 105.19 107.18 3m83 n GLY 307 Ca 0.12 -0.06 0.15 0.00 0.00 0.00 0.00 46.02 46.22 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 0.10 0.00 -0.65 1.61 0.02 -1.95 -2.51 113.55 110.18 3m83 h SER 308 Ca 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 3m83 h SER 308 Cb 0.00 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 3m83 h SER 308 CO 0.00 0.00 0.11 -0.26 -1.14 0.00 0.00 176.83 175.54 3m83 h PHE 309 N 0.00 1.13 -0.40 3.45 -1.00 -1.78 -2.98 116.94 115.37 3m83 h PHE 309 Ca 0.00 -0.15 -0.13 0.00 2.81 0.00 0.00 57.97 60.49 3m83 h PHE 309 Cb 0.74 -0.31 -0.01 0.00 3.61 0.00 0.00 35.95 39.98 3m83 h PHE 309 CO 0.00 0.95 -0.28 0.37 -1.61 0.00 0.00 178.31 177.74 3m83 h GLN 310 N 0.98 0.86 -1.00 1.51 5.75 -1.02 -2.57 115.11 119.62 3m83 h GLN 310 Ca 0.20 -0.39 0.08 0.00 -0.15 0.00 0.00 58.65 58.39 3m83 h GLN 310 Cb 0.42 -0.02 -0.07 0.00 1.07 0.00 0.00 27.48 28.88 3m83 h GLN 310 CO 0.01 1.03 0.64 0.00 -2.65 0.00 0.00 178.83 177.86 3m83 h ALA 311 N 0.94 1.42 -0.51 3.38 0.00 -1.47 -0.04 119.26 122.98 3m83 h ALA 311 Ca 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3m83 h ALA 311 Cb 0.83 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3m83 h ALA 311 CO 0.07 0.37 0.22 0.28 0.00 0.00 0.00 179.25 180.19 3m83 h VAL 312 N 1.11 1.21 -0.87 0.00 2.07 -1.36 -2.32 116.25 116.08 3m83 h VAL 312 Ca 0.45 -0.63 0.05 0.00 0.82 0.00 0.00 66.70 67.39 3m83 h VAL 312 Cb 0.27 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 3m83 h VAL 312 CO -0.20 0.24 0.57 -0.33 0.02 0.00 0.00 177.57 177.87 3m83 h GLU 313 N 0.69 1.01 -0.24 1.57 4.39 -0.76 -2.34 114.58 118.89 3m83 h GLU 313 Ca 0.17 -0.06 -0.13 0.00 0.34 0.00 0.00 59.36 59.68 3m83 h GLU 313 Cb 0.17 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 28.59 3m83 h GLU 313 CO -0.02 0.67 -0.36 1.96 -1.16 0.00 0.00 179.01 180.10 3m83 h GLN 314 N 1.04 0.67 -0.46 2.33 4.20 -0.81 -0.28 115.11 121.79 3m83 h GLN 314 Ca 0.36 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3m83 h GLN 314 Cb 0.11 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 3m83 h GLN 314 CO -0.12 1.01 0.29 0.28 -0.67 0.00 0.00 178.83 179.63 3m83 h VAL 315 N 0.38 1.13 -0.51 -0.54 2.07 -1.26 -1.78 116.25 115.73 3m83 h VAL 315 Ca 0.02 -0.25 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 3m83 h VAL 315 Cb 0.95 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 3m83 h VAL 315 CO 0.08 0.12 -0.04 0.11 0.02 0.00 0.00 177.57 177.86 3m83 h LYS 316 N 0.62 0.94 -0.35 1.57 1.57 -1.40 -1.93 116.57 117.58 3m83 h LYS 316 Ca 0.17 -0.32 0.01 0.00 -1.87 0.00 0.00 60.65 58.64 3m83 h LYS 316 Cb -0.05 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 3m83 h LYS 316 CO -0.03 0.98 0.21 0.35 -0.57 0.00 0.00 179.45 180.38 3m83 h PHE 317 N 0.80 0.39 -0.19 -1.35 3.57 -0.88 -2.15 116.94 117.13 3m83 h PHE 317 Ca 0.14 0.01 -0.18 0.00 3.53 0.00 0.00 57.97 61.47 3m83 h PHE 317 Cb 0.58 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.20 3m83 h PHE 317 CO 0.04 0.23 -0.62 -0.07 -2.23 0.00 0.00 178.31 175.67 3m83 h LEU 318 N 0.43 0.75 -0.07 0.59 3.38 -1.28 -1.52 115.31 117.59 3m83 h LEU 318 Ca 0.14 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3m83 h LEU 318 Cb -0.00 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 3m83 h LEU 318 CO -0.06 1.19 0.05 0.50 0.09 0.00 0.00 178.44 180.20 3m83 h LYS 319 N 0.49 0.09 -0.57 1.13 3.64 -1.25 -1.12 116.57 118.99 3m83 h LYS 319 Ca -0.01 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 3m83 h LYS 319 Cb 1.20 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.97 3m83 h LYS 319 CO 0.12 0.07 0.32 -0.22 -2.27 0.00 0.00 179.45 177.47 3m83 h LYS 320 N 0.09 0.79 -0.32 1.90 3.64 -1.35 -2.41 116.57 118.92 3m83 h LYS 320 Ca 0.03 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3m83 h LYS 320 Cb -0.01 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 3m83 h LYS 320 CO -0.01 0.60 0.18 1.25 -2.27 0.00 0.00 179.45 179.21 3m83 h LEU 321 N 0.77 0.39 -0.23 5.20 5.85 -1.05 -2.92 115.31 123.31 3m83 h LEU 321 Ca 0.20 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.86 3m83 h LEU 321 Cb 0.03 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.96 3m83 h LEU 321 CO -0.03 0.34 -0.07 0.49 -0.34 0.00 0.00 178.44 178.83 3m83 n PHE 322 N -4.82 0.00 1.98 1.25 3.72 -0.44 -5.10 117.46 114.05 3m83 n PHE 322 Ca -0.01 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.55 3m83 n PHE 322 Cb 0.06 -0.15 0.93 0.00 -0.94 0.00 0.00 39.48 39.38 3m83 n PHE 322 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10