#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w36 n SER 2 N 0.00 0.00 -4.55 6.12 3.41 -1.13 -4.25 113.62 113.22 1w36 n SER 2 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.26 1w36 n SER 2 Cb 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 63.84 1w36 n SER 2 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1w36 s ASP 3 N -1.51 5.34 -0.23 4.04 2.15 -1.26 -4.78 116.67 120.42 1w36 s ASP 3 Ca 0.00 -0.05 -0.04 0.00 0.43 0.00 0.00 52.55 52.89 1w36 s ASP 3 Cb 0.00 -1.92 0.02 0.00 -0.30 0.00 0.00 42.92 40.71 1w36 s ASP 3 CO 0.00 0.11 0.08 0.52 -0.17 0.00 0.00 175.17 175.71 1w36 n VAL 4 N 3.98-11.00 -1.18 1.11 0.31 -1.26 -4.94 118.33 105.35 1w36 n VAL 4 Ca -0.16 1.90 -0.38 0.00 -0.01 0.00 0.00 64.34 65.69 1w36 n VAL 4 Cb 0.52 -6.39 0.02 0.00 -0.91 0.00 0.00 33.84 27.09 1w36 n VAL 4 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1w36 n ALA 5 N 0.93 -3.63 -1.82 3.52 0.00 -1.26 -4.79 120.51 113.46 1w36 n ALA 5 Ca -0.14 -0.25 -0.32 0.00 0.00 0.00 0.00 53.44 52.72 1w36 n ALA 5 Cb 0.21 -1.38 -0.04 0.00 0.00 0.00 0.00 19.45 18.25 1w36 n ALA 5 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1w36 s GLU 6 N -1.47 3.92 -1.04 0.00 2.12 -1.09 -4.70 118.70 116.43 1w36 s GLU 6 Ca 0.53 1.03 -0.22 0.00 0.36 0.00 0.00 54.97 56.66 1w36 s GLU 6 Cb -0.39 -2.13 0.06 0.00 0.26 0.00 0.00 34.13 31.93 1w36 s GLU 6 CO 0.70 -0.30 1.45 0.99 -0.54 0.00 0.00 175.26 177.56 1w36 s THR 7 N -2.51 4.02 -0.42 -1.70 2.01 -1.26 -0.68 115.64 115.10 1w36 s THR 7 Ca 0.60 -0.95 -0.40 0.00 0.31 0.00 0.00 61.69 61.26 1w36 s THR 7 Cb -0.11 -5.05 -0.17 0.00 0.01 0.00 0.00 72.50 67.19 1w36 s THR 7 CO 0.28 -1.91 1.36 -0.11 -0.69 0.00 0.00 174.62 173.56 1w36 n LEU 8 N 8.61 1.01 -4.14 4.42 -0.00 -0.51 -4.87 117.00 121.52 1w36 n LEU 8 Ca 0.34 0.99 -0.38 0.00 -0.00 0.00 0.00 56.01 56.96 1w36 n LEU 8 Cb 0.50 -0.74 -0.10 0.00 -0.00 0.00 0.00 43.42 43.09 1w36 n LEU 8 CO 0.66 -0.71 -0.01 -0.62 -0.00 0.00 0.00 177.39 176.71 1w36 s ASP 9 N 2.61 5.42 0.08 1.96 -1.08 -1.26 -4.89 116.67 119.50 1w36 s ASP 9 Ca 0.89 -2.45 -0.15 0.00 -0.52 0.00 0.00 52.55 50.32 1w36 s ASP 9 Cb -1.27 -1.89 -0.03 0.00 -1.46 0.00 0.00 42.92 38.27 1w36 s ASP 9 CO 0.69 -0.49 0.81 -2.65 0.52 0.00 0.00 175.17 174.05 1w36 n PRO 10 N 4.07 -0.21 0.27 4.34 -0.02 -1.26 -0.48 135.00 141.72 1w36 n PRO 10 Ca 0.03 0.79 0.13 0.00 -2.02 0.00 0.00 63.50 62.43 1w36 n PRO 10 Cb 0.40 -1.17 0.69 0.00 -0.02 0.00 0.00 33.50 33.41 1w36 n PRO 10 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1w36 h LEU 11 N 0.00 0.00 -2.84 2.45 3.38 -1.97 -2.09 115.31 114.25 1w36 h LEU 11 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1w36 h LEU 11 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1w36 h LEU 11 CO -0.44 0.00 -0.01 -1.14 0.09 0.00 0.00 178.44 176.94 1w36 n ARG 12 N -2.59 2.35 -2.27 1.13 3.00 0.37 -4.72 116.66 113.93 1w36 n ARG 12 Ca -0.02 -1.65 -0.42 0.00 -0.00 0.00 0.00 57.85 55.76 1w36 n ARG 12 Cb 0.30 -1.06 -0.03 0.00 0.00 0.00 0.00 32.46 31.67 1w36 n ARG 12 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1w36 s LEU 13 N -1.32 4.29 -0.22 6.15 2.96 -0.79 -4.84 118.68 124.92 1w36 s LEU 13 Ca 0.07 2.00 -0.29 0.00 -0.22 0.00 0.00 54.13 55.69 1w36 s LEU 13 Cb 0.06 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.17 1w36 s LEU 13 CO 0.01 -0.73 1.71 -2.16 -1.32 0.00 0.00 176.35 173.86 1w36 s PRO 14 N 2.75 3.70 -0.04 0.98 0.04 -1.26 -4.79 135.00 136.38 1w36 s PRO 14 Ca 0.62 1.72 -0.01 0.00 0.04 0.00 0.00 61.00 63.37 1w36 s PRO 14 Cb -0.29 -4.09 -0.01 0.00 0.04 0.00 0.00 34.50 30.14 1w36 s PRO 14 CO 0.24 -1.42 2.23 1.28 0.04 0.00 0.00 177.00 179.37 1w36 n LEU 15 N 8.90 5.46 -3.97 -3.56 4.77 -0.88 -4.75 117.00 122.97 1w36 n LEU 15 Ca 0.20 -2.62 -0.28 0.00 -0.03 0.00 0.00 56.01 53.28 1w36 n LEU 15 Cb 0.45 -1.16 -0.17 0.00 -2.33 0.00 0.00 43.42 40.21 1w36 n LEU 15 CO 0.66 1.13 -0.46 0.00 -1.33 0.00 0.00 177.39 177.38 1w36 s GLN 16 N -0.07 1.89 0.00 3.23 1.03 -1.26 -4.51 119.66 119.97 1w36 s GLN 16 Ca 0.13 -0.41 0.00 0.00 0.04 0.00 0.00 55.36 55.12 1w36 s GLN 16 Cb 0.07 -1.79 0.00 0.00 0.03 0.00 0.00 33.01 31.32 1w36 s GLN 16 CO -0.00 -0.21 0.00 0.41 -2.54 0.00 0.00 175.29 172.95 1w36 n GLY 17 N 4.70 0.00 3.01 2.60 0.00 0.18 -4.84 105.19 110.84 1w36 n GLY 17 Ca -0.16 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.85 1w36 n GLY 17 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1w36 n GLU 18 N 0.16 -1.74 -3.80 1.61 0.00 -1.24 -4.57 120.64 111.07 1w36 n GLU 18 Ca 0.00 1.56 -0.18 0.00 0.00 0.00 0.00 57.16 58.54 1w36 n GLU 18 Cb 0.00 -1.57 -0.17 0.00 0.00 0.00 0.00 31.44 29.70 1w36 n GLU 18 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 1w36 s ARG 19 N -0.24 0.17 -0.37 3.44 1.81 -0.49 -4.57 118.95 118.70 1w36 s ARG 19 Ca -0.04 0.19 -0.12 0.00 -1.72 0.00 0.00 55.73 54.04 1w36 s ARG 19 Cb 0.00 -0.52 0.01 0.00 -0.45 0.00 0.00 34.95 34.00 1w36 s ARG 19 CO 0.14 -0.23 0.23 -1.17 -0.68 0.00 0.00 175.30 173.59 1w36 s LEU 20 N 1.53 4.69 -0.32 2.53 2.96 -0.54 -0.52 118.68 129.01 1w36 s LEU 20 Ca -0.03 -0.81 -0.10 0.00 -0.22 0.00 0.00 54.13 52.97 1w36 s LEU 20 Cb -0.13 -2.07 -0.00 0.00 0.50 0.00 0.00 46.19 44.49 1w36 s LEU 20 CO -0.03 -0.35 0.15 -0.63 -1.32 0.00 0.00 176.35 174.18 1w36 s ILE 21 N 1.62 4.56 -0.25 6.68 1.01 0.12 -1.80 121.20 133.14 1w36 s ILE 21 Ca 0.04 -0.48 -0.19 0.00 0.00 0.00 0.00 60.65 60.01 1w36 s ILE 21 Cb -0.19 -3.35 -0.02 0.00 0.01 0.00 0.00 42.46 38.91 1w36 s ILE 21 CO 0.08 0.03 0.58 -0.70 0.00 0.00 0.00 174.94 174.93 1w36 s GLU 22 N 1.60 4.10 -0.54 2.79 2.12 0.21 -1.59 118.70 127.39 1w36 s GLU 22 Ca 0.04 0.46 -0.00 0.00 0.36 0.00 0.00 54.97 55.82 1w36 s GLU 22 Cb -0.17 -3.64 0.14 0.00 0.26 0.00 0.00 34.13 30.71 1w36 s GLU 22 CO 0.06 -0.37 0.32 0.00 -0.54 0.00 0.00 175.26 174.73 1w36 s ALA 23 N 2.37 3.39 1.09 6.30 0.00 0.33 -2.34 121.76 132.90 1w36 s ALA 23 Ca 0.24 -3.10 -0.17 0.00 0.00 0.00 0.00 51.96 48.93 1w36 s ALA 23 Cb -0.16 -2.43 0.13 0.00 0.00 0.00 0.00 23.12 20.67 1w36 s ALA 23 CO 0.09 -2.00 0.09 0.43 0.00 0.00 0.00 175.76 174.36 1w36 n SER 24 N 3.60 -2.74 -4.74 0.00 7.64 -1.26 -4.54 113.62 111.58 1w36 n SER 24 Ca 0.05 -0.27 -0.42 0.00 1.01 0.00 0.00 58.87 59.25 1w36 n SER 24 Cb 0.37 -0.86 -0.02 0.00 -1.01 0.00 0.00 64.21 62.69 1w36 n SER 24 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1w36 s ALA 25 N -2.15 3.85 -1.40 -0.43 0.00 -1.26 -2.64 121.76 117.73 1w36 s ALA 25 Ca 0.47 1.59 0.00 0.00 0.00 0.00 0.00 51.96 54.03 1w36 s ALA 25 Cb -0.08 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.36 1w36 s ALA 25 CO 0.52 -0.97 0.00 0.41 0.00 0.00 0.00 175.76 175.73 1w36 n GLY 26 N 3.06 0.46 0.48 0.00 0.00 -1.26 -4.87 105.19 103.06 1w36 n GLY 26 Ca 0.12 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 45.98 1w36 n GLY 26 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1w36 n THR 27 N -3.44 0.00 0.00 2.61 -2.24 -1.08 -1.61 114.28 108.52 1w36 n THR 27 Ca -0.17 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1w36 n THR 27 Cb 0.58 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 1w36 n THR 27 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1w36 n GLY 28 N 1.37 1.21 0.31 3.38 0.00 -1.26 -4.76 105.19 105.44 1w36 n GLY 28 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.23 1w36 n GLY 28 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1w36 h LYS 29 N 0.03 0.49 -0.33 1.61 3.11 -1.91 0.10 116.57 119.67 1w36 h LYS 29 Ca 0.00 -0.03 -0.11 0.00 -2.81 0.00 0.00 60.65 57.70 1w36 h LYS 29 Cb 0.00 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 31.11 1w36 h LYS 29 CO 0.00 0.32 -0.21 1.79 -2.81 0.00 0.00 179.45 178.55 1w36 h THR 30 N 0.51 1.29 -0.64 1.00 1.35 -2.00 -2.07 112.91 112.35 1w36 h THR 30 Ca 0.50 -1.35 -0.06 0.00 -0.55 0.00 0.00 66.41 64.95 1w36 h THR 30 Cb 0.82 1.44 -0.03 0.00 -1.73 0.00 0.00 68.15 68.66 1w36 h THR 30 CO -0.44 0.44 0.15 -0.26 -0.25 0.00 0.00 175.52 175.16 1w36 h PHE 31 N 0.49 1.05 -0.06 4.73 -1.00 -1.47 -2.88 116.94 117.79 1w36 h PHE 31 Ca 0.07 -0.12 -0.01 0.00 2.81 0.00 0.00 57.97 60.72 1w36 h PHE 31 Cb 0.76 -0.30 -0.00 0.00 3.61 0.00 0.00 35.95 40.02 1w36 h PHE 31 CO 0.06 0.86 -0.00 1.15 -1.61 0.00 0.00 178.31 178.77 1w36 h THR 32 N 0.96 1.26 -0.14 -1.55 2.02 -0.82 -2.20 112.91 112.44 1w36 h THR 32 Ca 0.20 -0.81 0.03 0.00 0.77 0.00 0.00 66.41 66.61 1w36 h THR 32 Cb 0.35 1.68 -0.06 0.00 -1.74 0.00 0.00 68.15 68.37 1w36 h THR 32 CO 0.00 0.22 -0.54 0.40 0.37 0.00 0.00 175.52 175.97 1w36 h ILE 33 N -0.19 0.00 -0.94 3.11 2.04 -1.30 -0.09 117.51 120.15 1w36 h ILE 33 Ca 0.02 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.03 1w36 h ILE 33 Cb 0.35 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.28 1w36 h ILE 33 CO 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 178.15 177.79 1w36 h ALA 34 N -0.30 0.18 0.20 1.87 0.00 -1.47 0.14 119.26 119.88 1w36 h ALA 34 Ca 0.03 0.27 0.01 0.00 0.00 0.00 0.00 54.91 55.22 1w36 h ALA 34 Cb 0.68 0.96 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 1w36 h ALA 34 CO -0.44 -0.61 -0.23 0.00 0.00 0.00 0.00 179.25 177.98 1w36 h ALA 35 N 1.39 -0.45 -0.96 0.00 0.00 -0.58 -1.37 119.26 117.29 1w36 h ALA 35 Ca 0.34 -0.06 0.16 0.00 0.00 0.00 0.00 54.91 55.35 1w36 h ALA 35 Cb 0.60 0.34 -0.10 0.00 0.00 0.00 0.00 17.79 18.64 1w36 h ALA 35 CO -0.95 -0.78 0.57 -0.07 0.00 0.00 0.00 179.25 178.01 1w36 h LEU 36 N -0.47 0.76 0.03 0.00 4.07 0.75 0.52 115.31 120.97 1w36 h LEU 36 Ca 0.01 0.08 0.00 0.00 0.08 0.00 0.00 57.88 58.05 1w36 h LEU 36 Cb 0.45 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.13 1w36 h LEU 36 CO -0.07 0.33 -0.04 0.22 -1.08 0.00 0.00 178.44 177.80 1w36 h TYR 37 N 0.80 -0.10 0.54 1.13 3.20 0.15 -0.16 116.97 122.53 1w36 h TYR 37 Ca 0.52 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.38 1w36 h TYR 37 Cb 0.70 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 1w36 h TYR 37 CO -0.03 -0.06 -0.43 -0.07 -1.64 0.00 0.00 178.16 175.93 1w36 h LEU 38 N -0.08 -1.13 -0.93 2.82 3.38 -0.23 -1.75 115.31 117.38 1w36 h LEU 38 Ca 0.01 0.08 0.22 0.00 0.09 0.00 0.00 57.88 58.28 1w36 h LEU 38 Cb 0.08 0.36 -0.17 0.00 0.09 0.00 0.00 40.66 41.02 1w36 h LEU 38 CO -0.02 -0.61 -0.10 0.03 0.09 0.00 0.00 178.44 177.83 1w36 h ARG 39 N -0.95 0.02 -0.56 1.13 2.47 -0.72 -1.08 114.38 114.69 1w36 h ARG 39 Ca -0.06 -0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.56 1w36 h ARG 39 Cb 0.80 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.10 1w36 h ARG 39 CO -0.00 0.01 -0.04 -0.07 0.56 0.00 0.00 179.97 180.43 1w36 h LEU 40 N 0.02 0.98 -1.06 3.04 3.38 -0.43 -1.54 115.31 119.69 1w36 h LEU 40 Ca 0.50 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1w36 h LEU 40 Cb 0.91 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 1w36 h LEU 40 CO -0.91 1.05 0.42 -0.07 0.09 0.00 0.00 178.44 179.02 1w36 h LEU 41 N 0.90 0.96 -3.70 1.67 3.38 -0.35 -2.61 115.31 115.56 1w36 h LEU 41 Ca 0.16 -0.08 -0.26 0.00 0.09 0.00 0.00 57.88 57.79 1w36 h LEU 41 Cb 0.58 -0.24 -0.15 0.00 0.09 0.00 0.00 40.66 40.93 1w36 h LEU 41 CO 0.03 0.77 0.28 0.18 0.09 0.00 0.00 178.44 179.80 1w36 n LEU 42 N -4.35 5.77 -1.24 1.67 4.77 -1.03 -3.93 117.00 118.66 1w36 n LEU 42 Ca 0.08 -3.37 0.00 0.00 -0.03 0.00 0.00 56.01 52.69 1w36 n LEU 42 Cb 0.10 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 40.46 1w36 n LEU 42 CO 0.38 0.91 0.00 0.61 -1.33 0.00 0.00 177.39 177.96 1w36 n GLY 43 N -0.54 -0.09 1.31 -0.72 0.00 -0.99 -4.86 105.19 99.30 1w36 n GLY 43 Ca 0.42 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.32 1w36 n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1w36 n LEU 44 N -1.24 0.00 0.00 0.99 4.32 -0.62 -4.58 117.00 115.87 1w36 n LEU 44 Ca 0.00 -0.37 0.00 0.00 -0.02 0.00 0.00 56.01 55.62 1w36 n LEU 44 Cb 0.09 -0.40 0.00 0.00 -1.62 0.00 0.00 43.42 41.48 1w36 n LEU 44 CO 0.00 -1.97 0.00 0.61 -1.22 0.00 0.00 177.39 174.81 1w36 n GLY 45 N -2.08 0.41 0.00 -0.72 0.00 -1.26 -4.15 105.19 97.40 1w36 n GLY 45 Ca 0.06 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.30 1w36 n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w36 n GLY 46 N 0.00 0.24 0.05 -0.02 0.00 -1.26 -4.77 105.19 99.43 1w36 n GLY 46 Ca 0.00 0.44 0.12 0.00 0.00 0.00 0.00 46.02 46.59 1w36 n GLY 46 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1w36 n SER 47 N 0.00 0.63 -1.33 1.61 3.41 -1.26 -2.93 113.62 113.76 1w36 n SER 47 Ca 0.00 0.12 0.09 0.00 -0.26 0.00 0.00 58.87 58.81 1w36 n SER 47 Cb 0.00 0.06 0.30 0.00 -0.26 0.00 0.00 64.21 64.31 1w36 n SER 47 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w36 n ALA 48 N -1.75 2.79 -2.28 7.33 0.00 -1.26 -4.93 120.51 120.42 1w36 n ALA 48 Ca 0.04 -1.27 -0.23 0.00 0.00 0.00 0.00 53.44 51.98 1w36 n ALA 48 Cb 0.41 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 18.88 1w36 n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w36 s ALA 49 N -1.57 3.72 0.14 0.00 0.00 -1.15 -2.07 121.76 120.84 1w36 s ALA 49 Ca 0.44 -1.04 -0.21 0.00 0.00 0.00 0.00 51.96 51.15 1w36 s ALA 49 Cb 0.26 -2.18 -0.07 0.00 0.00 0.00 0.00 23.12 21.13 1w36 s ALA 49 CO 0.24 -0.44 0.66 0.12 0.00 0.00 0.00 175.76 176.35 1w36 s PHE 50 N -2.61 3.78 0.24 0.00 5.36 -1.26 -4.60 117.98 118.90 1w36 s PHE 50 Ca 0.49 1.38 0.07 0.00 -0.96 0.00 0.00 56.93 57.92 1w36 s PHE 50 Cb -0.10 -2.59 0.72 0.00 -0.34 0.00 0.00 43.02 40.71 1w36 s PHE 50 CO 0.39 0.50 1.14 -2.30 -1.46 0.00 0.00 175.22 173.48 1w36 n PRO 51 N 1.37 -0.05 -4.18 10.12 -0.01 -1.26 -4.68 135.00 136.30 1w36 n PRO 51 Ca -0.07 1.06 -0.11 0.00 -0.01 0.00 0.00 63.50 64.37 1w36 n PRO 51 Cb 0.50 -1.76 -0.10 0.00 -0.01 0.00 0.00 33.50 32.13 1w36 n PRO 51 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 175.50 174.51 1w36 s ARG 52 N -5.43 1.06 0.28 -0.52 1.70 -1.26 -5.13 118.95 109.65 1w36 s ARG 52 Ca -0.08 -1.53 -0.22 0.00 -0.47 0.00 0.00 55.73 53.43 1w36 s ARG 52 Cb 0.23 0.20 -0.09 0.00 -0.57 0.00 0.00 34.95 34.71 1w36 s ARG 52 CO 0.57 -0.30 0.82 -1.25 -1.08 0.00 0.00 175.30 174.06 1w36 s PRO 53 N -4.08 4.36 0.37 3.89 0.04 -1.26 -4.56 135.00 133.77 1w36 s PRO 53 Ca 0.30 1.05 0.08 0.00 0.04 0.00 0.00 61.00 62.46 1w36 s PRO 53 Cb 0.07 -2.78 -0.04 0.00 0.04 0.00 0.00 34.50 31.80 1w36 s PRO 53 CO 0.06 0.31 0.23 -0.51 0.04 0.00 0.00 177.00 177.13 1w36 s LEU 54 N -2.14 3.31 0.39 -3.56 1.43 -1.10 -4.94 118.68 112.07 1w36 s LEU 54 Ca 0.48 -0.79 0.08 0.00 -1.03 0.00 0.00 54.13 52.86 1w36 s LEU 54 Cb -0.17 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1w36 s LEU 54 CO 0.21 -0.45 0.40 -0.89 0.23 0.00 0.00 176.35 175.86 1w36 s THR 55 N -2.46 3.10 0.27 5.49 2.01 -1.26 -4.40 115.64 118.39 1w36 s THR 55 Ca 0.41 -1.25 -0.00 0.00 0.31 0.00 0.00 61.69 61.16 1w36 s THR 55 Cb -0.02 -3.09 0.27 0.00 0.01 0.00 0.00 72.50 69.67 1w36 s THR 55 CO 0.24 -0.06 1.83 0.58 -0.69 0.00 0.00 174.62 176.53 1w36 h VAL 56 N 0.99 0.93 0.00 3.82 2.07 -1.96 -0.52 116.25 121.59 1w36 h VAL 56 Ca -0.42 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1w36 h VAL 56 Cb 1.26 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1w36 h VAL 56 CO 0.55 0.18 0.00 -0.62 0.02 0.00 0.00 177.57 177.69 1w36 n GLU 57 N -4.64 0.99 0.00 1.57 4.71 -1.26 -3.06 120.64 118.95 1w36 n GLU 57 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.32 1w36 n GLU 57 Cb 0.32 -1.03 0.00 0.00 -1.01 0.00 0.00 31.44 29.72 1w36 n GLU 57 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1w36 n GLU 58 N -0.47 4.64 -3.01 3.49 1.02 -0.22 -4.83 120.64 121.26 1w36 n GLU 58 Ca 0.00 -0.04 -0.44 0.00 -0.02 0.00 0.00 57.16 56.66 1w36 n GLU 58 Cb 0.02 -0.43 -0.04 0.00 -0.02 0.00 0.00 31.44 30.97 1w36 n GLU 58 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1w36 s LEU 59 N -1.35 5.16 0.05 -4.62 1.43 -1.11 -4.02 118.68 114.22 1w36 s LEU 59 Ca 0.00 -1.61 -0.30 0.00 -1.03 0.00 0.00 54.13 51.19 1w36 s LEU 59 Cb 0.00 -2.35 -0.05 0.00 0.03 0.00 0.00 46.19 43.82 1w36 s LEU 59 CO 0.00 -1.14 1.06 -0.22 0.23 0.00 0.00 176.35 176.29 1w36 s LEU 60 N 2.81 4.39 -0.19 1.79 0.20 -1.06 -4.33 118.68 122.29 1w36 s LEU 60 Ca 0.21 1.83 -0.02 0.00 0.69 0.00 0.00 54.13 56.83 1w36 s LEU 60 Cb -0.16 -3.58 0.06 0.00 -0.43 0.00 0.00 46.19 42.08 1w36 s LEU 60 CO 0.01 -0.31 0.03 -0.69 -0.29 0.00 0.00 176.35 175.10 1w36 s VAL 61 N 0.82 0.61 -0.12 1.68 1.01 -0.75 0.27 120.40 123.92 1w36 s VAL 61 Ca 0.54 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.89 1w36 s VAL 61 Cb -0.25 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 1w36 s VAL 61 CO 0.29 -0.18 0.03 0.68 0.00 0.00 0.00 175.10 175.92 1w36 s VAL 62 N 1.82 4.52 0.40 2.92 -7.23 -0.66 -2.31 120.40 119.86 1w36 s VAL 62 Ca -0.01 -0.16 0.03 0.00 -1.81 0.00 0.00 61.98 60.04 1w36 s VAL 62 Cb -0.17 -2.95 -0.04 0.00 0.56 0.00 0.00 36.38 33.78 1w36 s VAL 62 CO -0.08 0.56 0.08 0.42 -0.31 0.00 0.00 175.10 175.78 1w36 s THR 63 N -0.48 0.95 -0.21 5.32 -4.23 -0.63 -1.56 115.64 114.80 1w36 s THR 63 Ca 0.09 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 1w36 s THR 63 Cb -0.12 -2.49 -0.20 0.00 1.34 0.00 0.00 72.50 71.03 1w36 s THR 63 CO 0.02 0.00 -0.03 0.33 -0.54 0.00 0.00 174.62 174.40 1w36 n PHE 64 N -0.91 0.39 -2.72 3.99 7.35 -1.26 -2.19 117.46 122.11 1w36 n PHE 64 Ca -0.07 0.08 -0.26 0.00 -0.76 0.00 0.00 57.45 56.45 1w36 n PHE 64 Cb 0.66 -1.05 0.01 0.00 0.35 0.00 0.00 39.48 39.45 1w36 n PHE 64 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1w36 s THR 65 N -2.53 4.25 0.03 -2.13 2.01 -1.26 -4.74 115.64 111.26 1w36 s THR 65 Ca -0.30 -0.12 -0.16 0.00 0.31 0.00 0.00 61.69 61.42 1w36 s THR 65 Cb 0.08 -3.62 -0.36 0.00 0.01 0.00 0.00 72.50 68.62 1w36 s THR 65 CO 0.66 -0.55 0.99 -0.08 -0.69 0.00 0.00 174.62 174.95 1w36 h GLU 66 N 0.19 0.54 0.00 4.92 4.57 -2.00 -3.00 114.58 119.80 1w36 h GLU 66 Ca -0.46 -0.92 -0.03 0.00 -1.18 0.00 0.00 59.36 56.76 1w36 h GLU 66 Cb 1.24 0.34 -0.00 0.00 -0.16 0.00 0.00 28.75 30.17 1w36 h GLU 66 CO 0.60 1.44 -0.15 0.00 -1.18 0.00 0.00 179.01 179.72 1w36 h ALA 67 N 0.15 1.21 0.02 2.92 0.00 -1.99 -2.36 119.26 119.19 1w36 h ALA 67 Ca -0.26 -0.14 -0.23 0.00 0.00 0.00 0.00 54.91 54.28 1w36 h ALA 67 Cb 2.17 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 19.95 1w36 h ALA 67 CO 0.27 0.19 -0.92 0.00 0.00 0.00 0.00 179.25 178.80 1w36 h ALA 68 N 1.85 0.09 -0.56 0.00 0.00 -1.93 -2.18 119.26 116.53 1w36 h ALA 68 Ca -0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 54.91 54.21 1w36 h ALA 68 Cb 0.45 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1w36 h ALA 68 CO 0.02 0.57 0.21 1.79 0.00 0.00 0.00 179.25 181.84 1w36 h THR 69 N 0.20 1.23 0.49 0.00 1.35 -1.36 0.94 112.91 115.76 1w36 h THR 69 Ca -0.12 -0.73 -0.01 0.00 -0.55 0.00 0.00 66.41 65.00 1w36 h THR 69 Cb 1.59 0.65 -0.02 0.00 -1.73 0.00 0.00 68.15 68.64 1w36 h THR 69 CO 0.18 0.28 -0.46 0.00 -0.25 0.00 0.00 175.52 175.26 1w36 h ALA 70 N 1.06 -1.05 0.37 6.62 0.00 -1.42 0.29 119.26 125.14 1w36 h ALA 70 Ca 0.19 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1w36 h ALA 70 Cb 0.23 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1w36 h ALA 70 CO -0.01 -1.13 -0.38 1.49 0.00 0.00 0.00 179.25 179.23 1w36 h GLU 71 N -0.96 -0.74 -0.79 0.00 4.81 -1.28 -0.32 114.58 115.30 1w36 h GLU 71 Ca -0.06 0.05 0.19 0.00 -0.13 0.00 0.00 59.36 59.41 1w36 h GLU 71 Cb 0.83 0.17 -0.13 0.00 0.63 0.00 0.00 28.75 30.25 1w36 h GLU 71 CO -0.05 -0.50 0.13 1.25 -0.73 0.00 0.00 179.01 179.12 1w36 h LEU 72 N -0.77 -0.13 -0.77 1.64 5.85 -0.66 0.35 115.31 120.82 1w36 h LEU 72 Ca -0.03 0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1w36 h LEU 72 Cb 0.69 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.97 1w36 h LEU 72 CO -0.07 -0.13 0.33 0.03 -0.34 0.00 0.00 178.44 178.26 1w36 h ARG 73 N 0.19 1.14 -0.27 1.25 3.08 0.12 -1.16 114.38 118.72 1w36 h ARG 73 Ca 0.46 -0.20 -0.10 0.00 0.07 0.00 0.00 59.98 60.22 1w36 h ARG 73 Cb 0.85 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 1w36 h ARG 73 CO -0.62 0.91 -0.24 0.78 -1.07 0.00 0.00 179.97 179.74 1w36 h GLY 74 N 1.11 0.57 1.47 0.04 0.00 0.11 -2.10 103.07 104.27 1w36 h GLY 74 Ca 0.26 -0.46 -0.13 0.00 0.00 0.00 0.00 47.33 47.00 1w36 h GLY 74 CO -0.02 0.42 -0.36 -0.09 0.00 0.00 0.00 176.54 176.49 1w36 h ARG 75 N 0.46 0.59 -0.01 4.80 9.65 0.14 -3.12 114.38 126.90 1w36 h ARG 75 Ca 0.07 -0.28 -0.27 0.00 -1.10 0.00 0.00 59.98 58.40 1w36 h ARG 75 Cb 0.67 -0.01 0.02 0.00 -1.39 0.00 0.00 29.97 29.26 1w36 h ARG 75 CO 0.05 0.86 -1.03 0.82 2.80 0.00 0.00 179.97 183.47 1w36 h ILE 76 N 0.50 1.28 -0.52 1.20 2.04 -1.09 -2.70 117.51 118.21 1w36 h ILE 76 Ca 0.05 -2.23 0.14 0.00 1.00 0.00 0.00 64.86 63.82 1w36 h ILE 76 Cb 0.85 2.36 -0.02 0.00 -0.74 0.00 0.00 36.82 39.27 1w36 h ILE 76 CO 0.07 0.69 0.37 -0.09 0.00 0.00 0.00 178.15 179.20 1w36 h ARG 77 N 0.40 0.04 0.22 2.37 2.43 -1.36 -1.58 114.38 116.91 1w36 h ARG 77 Ca -0.13 -0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.74 1w36 h ARG 77 Cb 1.69 -0.01 0.03 0.00 -0.42 0.00 0.00 29.97 31.26 1w36 h ARG 77 CO 0.20 0.03 -1.33 1.03 -1.51 0.00 0.00 179.97 178.39 1w36 h SER 78 N 0.04 0.74 -0.71 -3.80 0.87 -1.48 -2.15 113.55 107.07 1w36 h SER 78 Ca 0.25 -0.93 -0.07 0.00 -1.23 0.00 0.00 61.79 59.81 1w36 h SER 78 Cb 0.94 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.63 1w36 h SER 78 CO -0.01 1.64 0.15 0.78 -0.53 0.00 0.00 176.83 178.86 1w36 h ASN 79 N 0.01 1.09 0.52 6.23 2.35 -0.99 -0.79 115.58 123.99 1w36 h ASN 79 Ca -0.23 -0.24 -0.02 0.00 -0.55 0.00 0.00 56.30 55.26 1w36 h ASN 79 Cb 2.03 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 40.10 1w36 h ASN 79 CO 0.24 1.05 -0.44 0.40 -1.65 0.00 0.00 177.43 177.03 1w36 h ILE 80 N 1.08 0.00 -1.29 2.81 2.04 -1.40 0.12 117.51 120.87 1w36 h ILE 80 Ca 0.22 0.00 0.38 0.00 1.00 0.00 0.00 64.86 66.46 1w36 h ILE 80 Cb 0.40 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.39 1w36 h ILE 80 CO 0.01 0.00 0.87 -0.74 0.00 0.00 0.00 178.15 178.28 1w36 h HIS 81 N -0.93 0.38 0.03 1.37 2.76 -1.09 0.18 115.15 117.84 1w36 h HIS 81 Ca -0.07 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 57.97 1w36 h HIS 81 Cb 0.79 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 29.63 1w36 h HIS 81 CO -0.18 -0.06 -0.80 0.93 -1.30 0.00 0.00 177.93 176.52 1w36 h GLU 82 N 0.14 0.06 -0.01 5.26 5.08 -0.61 -2.96 114.58 121.54 1w36 h GLU 82 Ca 0.71 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.98 1w36 h GLU 82 Cb 2.34 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 31.63 1w36 h GLU 82 CO -0.24 1.05 0.03 1.25 -1.00 0.00 0.00 179.01 180.09 1w36 h LEU 83 N -0.85 0.00 0.05 1.33 6.46 -0.28 0.70 115.31 122.72 1w36 h LEU 83 Ca -0.20 0.00 -0.23 0.00 -0.12 0.00 0.00 57.88 57.32 1w36 h LEU 83 Cb 1.29 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 41.24 1w36 h LEU 83 CO -0.07 0.00 -0.94 -0.09 -0.62 0.00 0.00 178.44 176.72 1w36 h ARG 84 N 0.00 0.55 -0.17 1.25 2.43 -0.70 -3.09 114.38 114.65 1w36 h ARG 84 Ca 0.01 -0.66 -0.12 0.00 -0.81 0.00 0.00 59.98 58.40 1w36 h ARG 84 Cb 0.06 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1w36 h ARG 84 CO -0.00 1.27 -0.35 0.82 -1.51 0.00 0.00 179.97 180.19 1w36 h ILE 85 N 0.12 1.35 0.00 1.20 2.04 -1.03 -2.12 117.51 119.07 1w36 h ILE 85 Ca -0.13 -1.60 0.00 0.00 1.00 0.00 0.00 64.86 64.13 1w36 h ILE 85 Cb 1.64 1.94 0.00 0.00 -0.74 0.00 0.00 36.82 39.66 1w36 h ILE 85 CO 0.18 0.49 0.00 0.00 0.00 0.00 0.00 178.15 178.82 1w36 n ALA 86 N -2.50 1.52 -0.01 1.87 0.00 0.11 0.68 120.51 122.19 1w36 n ALA 86 Ca -0.06 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.39 1w36 n ALA 86 Cb 0.51 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 1w36 n ALA 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w36 h LEU 88 N 0.00 0.68 0.00 0.00 3.38 0.45 -3.21 115.31 116.62 1w36 h LEU 88 Ca -0.02 -0.91 0.00 0.00 0.09 0.00 0.00 57.88 57.04 1w36 h LEU 88 Cb 0.43 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1w36 h LEU 88 CO 0.00 1.54 -0.01 0.54 0.09 0.00 0.00 178.44 180.60 1w36 n ARG 89 N -3.93 0.10 -1.03 1.13 1.74 -0.50 -4.91 116.66 109.26 1w36 n ARG 89 Ca -0.15 0.08 -0.06 0.00 -0.77 0.00 0.00 57.85 56.95 1w36 n ARG 89 Cb 0.95 -1.61 -0.03 0.00 -1.02 0.00 0.00 32.46 30.74 1w36 n ARG 89 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1w36 n GLU 90 N -1.79 -1.74 -3.82 5.56 1.02 -1.21 -4.89 120.64 113.77 1w36 n GLU 90 Ca 0.06 0.59 -0.12 0.00 -0.02 0.00 0.00 57.16 57.68 1w36 n GLU 90 Cb 0.37 -4.71 -0.12 0.00 -0.02 0.00 0.00 31.44 26.97 1w36 n GLU 90 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1w36 s THR 91 N -1.38 0.01 -0.08 2.62 -4.23 -1.24 -5.00 115.64 106.34 1w36 s THR 91 Ca 0.00 -0.08 -0.05 0.00 -1.18 0.00 0.00 61.69 60.39 1w36 s THR 91 Cb 0.00 -0.28 0.03 0.00 1.34 0.00 0.00 72.50 73.60 1w36 s THR 91 CO 0.00 -0.04 0.18 -0.89 -0.54 0.00 0.00 174.62 173.33 1w36 s THR 92 N -0.08 -0.03 -0.68 3.99 2.01 -1.26 -4.72 115.64 114.88 1w36 s THR 92 Ca -0.02 0.11 0.05 0.00 0.31 0.00 0.00 61.69 62.15 1w36 s THR 92 Cb -0.02 -0.28 0.22 0.00 0.01 0.00 0.00 72.50 72.43 1w36 s THR 92 CO 0.00 0.04 0.65 0.47 -0.69 0.00 0.00 174.62 175.10 1w36 n ASP 93 N 3.78 3.49 -3.19 3.53 8.00 -1.26 -4.70 116.55 126.20 1w36 n ASP 93 Ca -0.21 -3.35 0.05 0.00 0.71 0.00 0.00 54.79 51.99 1w36 n ASP 93 Cb 0.55 -0.72 -0.03 0.00 -0.02 0.00 0.00 41.12 40.90 1w36 n ASP 93 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1w36 s ASN 94 N -2.02 -0.30 0.00 -2.24 -0.87 -1.26 -5.12 114.94 103.13 1w36 s ASN 94 Ca 0.33 0.26 0.00 0.00 -1.57 0.00 0.00 52.86 51.89 1w36 s ASN 94 Cb 0.06 1.28 0.00 0.00 -0.02 0.00 0.00 41.25 42.58 1w36 s ASN 94 CO -0.08 -0.06 0.00 -2.65 -2.57 0.00 0.00 177.10 171.74 1w36 n PRO 95 N 5.19 0.00 -0.11 -0.60 -0.02 -1.26 -3.30 135.00 134.90 1w36 n PRO 95 Ca -0.08 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.37 1w36 n PRO 95 Cb 0.54 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.00 1w36 n PRO 95 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1w36 n LEU 96 N 0.00 -0.28 -0.31 2.45 0.00 -1.26 0.06 117.00 117.67 1w36 n LEU 96 Ca 0.00 0.83 0.25 0.00 0.00 0.00 0.00 56.01 57.09 1w36 n LEU 96 Cb 0.00 -0.24 0.56 0.00 0.00 0.00 0.00 43.42 43.73 1w36 n LEU 96 CO 0.00 -0.56 1.24 1.88 0.00 0.00 0.00 177.39 179.94 1w36 h TYR 97 N 0.00 0.52 -0.00 1.96 -1.99 -1.98 -1.07 116.97 114.41 1w36 h TYR 97 Ca 0.04 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.79 1w36 h TYR 97 Cb 0.11 -0.15 -0.00 0.00 2.00 0.00 0.00 36.73 38.69 1w36 h TYR 97 CO -0.61 0.05 0.00 1.49 -0.00 0.00 0.00 178.16 179.09 1w36 h GLU 98 N 0.31 0.00 -0.47 4.88 4.81 -0.36 0.13 114.58 123.89 1w36 h GLU 98 Ca 0.57 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.77 1w36 h GLU 98 Cb 1.61 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.96 1w36 h GLU 98 CO -0.23 0.27 0.15 -0.09 -0.73 0.00 0.00 179.01 178.38 1w36 h ARG 99 N -0.26 0.68 -0.14 1.92 2.43 -1.09 -1.49 114.38 116.43 1w36 h ARG 99 Ca 0.00 -0.11 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 1w36 h ARG 99 Cb 0.27 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1w36 h ARG 99 CO 0.00 0.59 0.00 -0.07 -1.51 0.00 0.00 179.97 178.98 1w36 h LEU 100 N 0.67 0.24 -1.26 3.80 3.38 -1.15 -2.83 115.31 118.16 1w36 h LEU 100 Ca 0.16 -0.31 0.13 0.00 0.09 0.00 0.00 57.88 57.95 1w36 h LEU 100 Cb 0.19 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.81 1w36 h LEU 100 CO -0.01 0.49 0.57 -0.07 0.09 0.00 0.00 178.44 179.50 1w36 h LEU 101 N -0.02 0.70 -1.32 1.67 3.38 -0.19 0.54 115.31 120.07 1w36 h LEU 101 Ca 0.04 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1w36 h LEU 101 Cb 0.36 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1w36 h LEU 101 CO 0.01 0.37 0.16 -0.33 0.09 0.00 0.00 178.44 178.74 1w36 h GLU 102 N 0.75 0.62 -0.00 1.13 5.08 -1.06 -2.53 114.58 118.56 1w36 h GLU 102 Ca 0.43 -0.09 -0.17 0.00 -1.00 0.00 0.00 59.36 58.54 1w36 h GLU 102 Cb 0.61 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1w36 h GLU 102 CO -0.19 0.53 -0.78 1.49 -1.00 0.00 0.00 179.01 179.06 1w36 h GLU 103 N 0.62 0.04 -7.14 2.33 4.57 -0.70 -3.46 114.58 110.84 1w36 h GLU 103 Ca 0.15 -0.04 -0.54 0.00 -1.18 0.00 0.00 59.36 57.75 1w36 h GLU 103 Cb 0.15 0.01 0.14 0.00 -0.16 0.00 0.00 28.75 28.89 1w36 h GLU 103 CO -0.01 0.80 0.45 0.42 -1.18 0.00 0.00 179.01 179.48 1w36 s ILE 104 N -3.27 2.39 -0.13 2.32 1.01 -0.65 -4.90 121.20 117.97 1w36 s ILE 104 Ca -0.01 0.22 0.05 0.00 0.00 0.00 0.00 60.65 60.91 1w36 s ILE 104 Cb 0.11 -2.94 -0.07 0.00 0.01 0.00 0.00 42.46 39.57 1w36 s ILE 104 CO 0.79 -0.08 0.17 0.47 0.00 0.00 0.00 174.94 176.29 1w36 n ASP 105 N -2.16 1.86 -2.91 3.58 9.92 -1.26 -4.86 116.55 120.73 1w36 n ASP 105 Ca 0.14 -0.34 -0.13 0.00 -0.53 0.00 0.00 54.79 53.94 1w36 n ASP 105 Cb 0.50 1.11 0.00 0.00 -0.64 0.00 0.00 41.12 42.08 1w36 n ASP 105 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 1w36 n ASP 106 N -1.37 -2.09 -0.49 -2.24 -0.08 -1.26 -5.00 116.55 104.01 1w36 n ASP 106 Ca 0.00 -3.01 0.41 0.00 -1.51 0.00 0.00 54.79 50.67 1w36 n ASP 106 Cb 0.10 1.05 0.67 0.00 2.34 0.00 0.00 41.12 45.28 1w36 n ASP 106 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1w36 n LYS 107 N 1.93 -0.03 -0.27 -0.67 4.01 -1.26 0.66 118.16 122.53 1w36 n LYS 107 Ca 0.15 1.14 -0.04 0.00 -0.51 0.00 0.00 58.31 59.05 1w36 n LYS 107 Cb 0.58 -2.33 0.11 0.00 -0.51 0.00 0.00 35.03 32.88 1w36 n LYS 107 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1w36 h ALA 108 N 1.37 1.13 0.04 7.82 0.00 -1.95 -2.26 119.26 125.41 1w36 h ALA 108 Ca 0.84 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.57 1w36 h ALA 108 Cb 2.87 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 20.35 1w36 h ALA 108 CO -0.35 0.64 -0.02 0.37 0.00 0.00 0.00 179.25 179.89 1w36 h GLN 109 N 1.11 -0.05 -0.72 0.00 4.15 -0.18 -3.28 115.11 116.14 1w36 h GLN 109 Ca 0.26 0.00 0.12 0.00 0.77 0.00 0.00 58.65 59.81 1w36 h GLN 109 Cb 0.17 0.01 -0.13 0.00 0.21 0.00 0.00 27.48 27.75 1w36 h GLN 109 CO -0.03 0.60 -0.33 0.00 -1.93 0.00 0.00 178.83 177.14 1w36 h ALA 110 N 0.02 0.07 0.00 3.38 0.00 -1.41 0.31 119.26 121.63 1w36 h ALA 110 Ca -0.01 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1w36 h ALA 110 Cb 0.68 0.82 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1w36 h ALA 110 CO 0.01 -0.64 0.25 0.00 0.00 0.00 0.00 179.25 178.87 1w36 h ALA 111 N 1.18 1.18 0.02 0.00 0.00 -1.47 0.52 119.26 120.68 1w36 h ALA 111 Ca 0.28 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.79 1w36 h ALA 111 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 1w36 h ALA 111 CO -0.77 -0.18 -2.35 0.94 0.00 0.00 0.00 179.25 176.89 1w36 n GLN 112 N -2.18 0.64 -0.04 0.00 -0.06 0.99 -2.65 117.38 114.07 1w36 n GLN 112 Ca -0.01 0.23 -0.09 0.00 -2.00 0.00 0.00 57.00 55.13 1w36 n GLN 112 Cb 0.28 -1.55 -0.02 0.00 -4.06 0.00 0.00 30.24 24.88 1w36 n GLN 112 CO 0.00 0.00 0.00 -1.49 -0.20 0.00 0.00 177.06 175.37 1w36 h TRP 113 N -0.39 0.08 -0.47 3.69 6.55 -0.13 -0.09 115.95 125.18 1w36 h TRP 113 Ca -0.59 0.01 0.02 0.00 0.95 0.00 0.00 58.89 59.29 1w36 h TRP 113 Cb 1.78 -0.00 -0.03 0.00 -0.86 0.00 0.00 29.16 30.04 1w36 h TRP 113 CO 0.00 0.03 0.28 -0.07 -1.05 0.00 0.00 178.44 177.63 1w36 h LEU 114 N 0.13 0.44 -1.42 -4.49 3.38 -0.22 -1.65 115.31 111.49 1w36 h LEU 114 Ca 0.09 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.17 1w36 h LEU 114 Cb 0.08 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 1w36 h LEU 114 CO -0.12 0.32 0.49 0.25 0.09 0.00 0.00 178.44 179.47 1w36 h LEU 115 N 0.55 0.58 -0.44 1.67 5.85 -1.11 0.18 115.31 122.59 1w36 h LEU 115 Ca 0.19 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.82 1w36 h LEU 115 Cb 0.02 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1w36 h LEU 115 CO -0.09 0.34 -0.15 -0.07 -0.34 0.00 0.00 178.44 178.13 1w36 h LEU 116 N 0.64 0.89 -0.78 2.25 3.38 -0.16 -2.48 115.31 119.05 1w36 h LEU 116 Ca 0.35 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1w36 h LEU 116 Cb 0.50 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1w36 h LEU 116 CO -0.13 1.07 0.04 0.00 0.09 0.00 0.00 178.44 179.51 1w36 h ALA 117 N 0.85 0.99 -0.76 1.53 0.00 -0.46 -1.27 119.26 120.14 1w36 h ALA 117 Ca 0.11 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1w36 h ALA 117 Cb 0.70 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1w36 h ALA 117 CO 0.05 0.63 0.25 1.49 0.00 0.00 0.00 179.25 181.67 1w36 h GLU 118 N 0.90 1.17 0.00 0.00 4.81 -0.62 -2.15 114.58 118.69 1w36 h GLU 118 Ca 0.17 -0.24 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 1w36 h GLU 118 Cb 0.47 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1w36 h GLU 118 CO 0.02 0.99 -0.26 0.00 -0.73 0.00 0.00 179.01 179.03 1w36 h ARG 119 N 1.13 0.00 0.00 1.92 3.08 -0.92 -3.19 114.38 116.39 1w36 h ARG 119 Ca 0.25 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.19 1w36 h ARG 119 Cb 0.29 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 1w36 h ARG 119 CO -0.01 0.26 -0.74 1.96 -1.07 0.00 0.00 179.97 180.37 1w36 h GLN 120 N 0.00 0.00 -1.18 0.04 1.08 -0.93 -3.41 115.11 110.70 1w36 h GLN 120 Ca -0.00 0.00 0.36 0.00 -1.45 0.00 0.00 58.65 57.56 1w36 h GLN 120 Cb 0.88 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.24 1w36 h GLN 120 CO 0.03 0.36 0.83 -1.33 -0.95 0.00 0.00 178.83 177.78 1w36 n MET 121 N -3.08 -0.01 0.00 1.46 2.81 -0.84 0.35 117.12 117.82 1w36 n MET 121 Ca -0.01 0.75 0.05 0.00 -1.81 0.00 0.00 57.70 56.68 1w36 n MET 121 Cb 0.73 -1.64 0.28 0.00 -0.71 0.00 0.00 33.22 31.87 1w36 n MET 121 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1w36 n ASP 122 N -3.49 0.00 -0.34 7.83 3.85 -1.26 -1.94 116.55 121.19 1w36 n ASP 122 Ca 0.29 -0.26 0.01 0.00 -0.71 0.00 0.00 54.79 54.12 1w36 n ASP 122 Cb 1.24 -0.02 0.02 0.00 -1.35 0.00 0.00 41.12 41.00 1w36 n ASP 122 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1w36 n GLU 123 N -1.02 0.24 -1.71 0.11 1.02 0.16 -5.07 120.64 114.35 1w36 n GLU 123 Ca 0.07 -1.09 -0.41 0.00 -0.02 0.00 0.00 57.16 55.71 1w36 n GLU 123 Cb 0.04 -0.63 0.01 0.00 -0.02 0.00 0.00 31.44 30.84 1w36 n GLU 123 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1w36 n ALA 124 N -0.17 1.47 -0.98 0.62 0.00 -0.82 -4.56 120.51 116.07 1w36 n ALA 124 Ca 0.02 0.29 -0.23 0.00 0.00 0.00 0.00 53.44 53.53 1w36 n ALA 124 Cb 0.64 -2.29 -0.08 0.00 0.00 0.00 0.00 19.45 17.72 1w36 n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w36 n ALA 125 N -0.01 6.06 -3.71 0.00 0.00 -1.17 -4.76 120.51 116.92 1w36 n ALA 125 Ca 0.05 -2.32 -0.35 0.00 0.00 0.00 0.00 53.44 50.83 1w36 n ALA 125 Cb 0.39 -2.83 -0.14 0.00 0.00 0.00 0.00 19.45 16.88 1w36 n ALA 125 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1w36 s VAL 126 N 2.06 2.93 0.36 0.00 1.01 -1.26 -1.82 120.40 123.69 1w36 s VAL 126 Ca 0.57 -1.55 0.04 0.00 0.00 0.00 0.00 61.98 61.05 1w36 s VAL 126 Cb 0.20 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 1w36 s VAL 126 CO -0.03 -0.21 0.16 -0.36 0.00 0.00 0.00 175.10 174.66 1w36 s PHE 127 N 1.21 1.74 0.40 5.22 0.08 -0.98 -5.00 117.98 120.65 1w36 s PHE 127 Ca -0.03 -1.36 0.05 0.00 0.12 0.00 0.00 56.93 55.72 1w36 s PHE 127 Cb -0.20 -1.01 0.00 0.00 -0.57 0.00 0.00 43.02 41.24 1w36 s PHE 127 CO -0.02 -0.44 0.57 0.95 -0.10 0.00 0.00 175.22 176.18 1w36 s THR 128 N -3.36 3.71 0.36 0.64 -4.23 -1.26 -1.60 115.64 109.90 1w36 s THR 128 Ca 0.30 -0.85 0.08 0.00 -1.18 0.00 0.00 61.69 60.04 1w36 s THR 128 Cb 0.03 -3.31 0.31 0.00 1.34 0.00 0.00 72.50 70.88 1w36 s THR 128 CO 0.17 -0.15 1.91 0.40 -0.54 0.00 0.00 174.62 176.42 1w36 h ILE 129 N 0.65 0.91 -0.08 2.99 1.08 -1.73 0.13 117.51 121.46 1w36 h ILE 129 Ca -0.44 -0.24 -0.20 0.00 -0.39 0.00 0.00 64.86 63.59 1w36 h ILE 129 Cb 1.26 0.15 -0.00 0.00 -3.07 0.00 0.00 36.82 35.16 1w36 h ILE 129 CO 0.52 0.13 -0.78 0.45 -0.69 0.00 0.00 178.15 177.78 1w36 h HIS 130 N 0.70 0.67 0.39 1.37 3.86 -1.93 -2.32 115.15 117.89 1w36 h HIS 130 Ca 0.38 -0.31 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1w36 h HIS 130 Cb 0.53 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.91 1w36 h HIS 130 CO -0.00 1.09 -0.19 0.78 0.86 0.00 0.00 177.93 180.47 1w36 h GLY 131 N 1.12 -0.55 0.07 2.45 0.00 -1.41 -1.03 103.07 103.72 1w36 h GLY 131 Ca -0.04 0.20 0.18 0.00 0.00 0.00 0.00 47.33 47.67 1w36 h GLY 131 CO 0.14 -0.20 0.46 -2.75 0.00 0.00 0.00 176.54 174.19 1w36 h PHE 132 N -0.59 0.80 0.08 5.60 3.04 -0.81 -2.48 116.94 122.57 1w36 h PHE 132 Ca -0.05 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 61.93 1w36 h PHE 132 Cb 0.44 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 38.74 1w36 h PHE 132 CO -0.03 0.12 -0.04 0.00 -2.02 0.00 0.00 178.31 176.34 1w36 h GLN 134 N -0.58 0.00 0.13 0.00 3.07 -1.00 0.99 115.11 117.72 1w36 h GLN 134 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.72 1w36 h GLN 134 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.04 1w36 h GLN 134 CO 0.02 0.01 -0.06 -0.09 0.09 0.00 0.00 178.83 178.79 1w36 h ARG 135 N 0.00 -0.16 -0.97 0.06 2.43 -1.33 -0.76 114.38 113.65 1w36 h ARG 135 Ca -0.00 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.31 1w36 h ARG 135 Cb 0.09 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.60 1w36 h ARG 135 CO 0.00 0.04 0.61 0.52 -1.51 0.00 0.00 179.97 179.63 1w36 h MET 136 N -1.02 0.88 0.23 0.20 2.86 -0.90 -1.71 114.93 115.47 1w36 h MET 136 Ca -0.02 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1w36 h MET 136 Cb 0.28 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1w36 h MET 136 CO 0.03 0.58 -0.21 -0.07 1.06 0.00 0.00 176.91 178.29 1w36 h LEU 137 N 0.90 -0.58 -1.13 1.22 4.07 -0.83 -2.77 115.31 116.19 1w36 h LEU 137 Ca 0.48 0.04 0.18 0.00 0.08 0.00 0.00 57.88 58.67 1w36 h LEU 137 Cb 0.56 0.19 -0.09 0.00 1.08 0.00 0.00 40.66 42.39 1w36 h LEU 137 CO -0.25 -0.29 0.61 0.78 -1.08 0.00 0.00 178.44 178.22 1w36 h ASN 138 N -0.44 0.72 0.49 -0.43 4.21 -0.70 -2.46 115.58 116.98 1w36 h ASN 138 Ca -0.03 0.08 -0.02 0.00 1.21 0.00 0.00 56.30 57.53 1w36 h ASN 138 Cb 0.38 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.52 1w36 h ASN 138 CO -0.02 0.29 -0.24 -0.07 -1.29 0.00 0.00 177.43 176.10 1w36 h LEU 139 N 0.72 -0.56 -5.50 1.61 4.07 -1.30 -3.21 115.31 111.13 1w36 h LEU 139 Ca 0.54 -0.07 -0.71 0.00 0.08 0.00 0.00 57.88 57.72 1w36 h LEU 139 Cb 0.89 0.15 -0.18 0.00 1.08 0.00 0.00 40.66 42.60 1w36 h LEU 139 CO -0.31 -0.24 1.58 0.59 -1.08 0.00 0.00 178.44 178.98 1w36 n ASN 140 N -5.29 7.54 -0.04 -0.43 3.02 -1.01 -4.74 115.26 114.31 1w36 n ASN 140 Ca -0.11 -3.34 0.13 0.00 -0.03 0.00 0.00 54.58 51.23 1w36 n ASN 140 Cb 0.31 -1.27 0.54 0.00 -0.61 0.00 0.00 39.78 38.76 1w36 n ASN 140 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1w36 h ALA 141 N 4.05 2.09 -0.23 5.41 0.00 -1.46 -2.36 119.26 126.77 1w36 h ALA 141 Ca 0.59 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.37 1w36 h ALA 141 Cb 0.37 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1w36 h ALA 141 CO 1.28 -0.21 -0.36 0.74 0.00 0.00 0.00 179.25 180.70 1w36 h PHE 142 N 0.31 0.58 0.00 0.00 0.05 -1.87 0.89 116.94 116.90 1w36 h PHE 142 Ca 0.25 -0.15 -0.00 0.00 3.82 0.00 0.00 57.97 61.89 1w36 h PHE 142 Cb 0.57 -0.13 0.00 0.00 2.00 0.00 0.00 35.95 38.39 1w36 h PHE 142 CO -0.00 0.79 -0.00 0.93 -0.18 0.00 0.00 178.31 179.85 1w36 h GLU 143 N 0.42 -0.00 0.00 1.51 3.07 -1.83 -3.33 114.58 114.43 1w36 h GLU 143 Ca 0.05 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.86 1w36 h GLU 143 Cb 0.82 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.72 1w36 h GLU 143 CO 0.07 0.79 -0.21 0.66 -1.40 0.00 0.00 179.01 178.91 1w36 h SER 144 N -0.79 0.00 0.00 1.42 4.64 -1.41 -3.47 113.55 113.94 1w36 h SER 144 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1w36 h SER 144 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1w36 h SER 144 CO 0.00 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 176.78 1w36 n GLY 145 N -0.78 0.71 3.76 -0.77 0.00 0.29 -4.97 105.19 103.42 1w36 n GLY 145 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 1w36 n GLY 145 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1w36 s MET 146 N -0.38 2.91 0.25 1.61 -1.94 -1.09 -5.03 119.30 115.62 1w36 s MET 146 Ca 0.00 1.63 -0.17 0.00 -1.71 0.00 0.00 55.69 55.44 1w36 s MET 146 Cb 0.00 -1.94 -0.08 0.00 2.01 0.00 0.00 34.83 34.81 1w36 s MET 146 CO 0.00 -1.21 0.71 -0.51 -0.01 0.00 0.00 175.02 174.00 1w36 s LEU 147 N -4.38 4.24 0.50 -0.03 1.43 -1.26 -4.85 118.68 114.32 1w36 s LEU 147 Ca 0.73 1.33 0.29 0.00 -1.03 0.00 0.00 54.13 55.44 1w36 s LEU 147 Cb -0.26 -3.74 0.93 0.00 0.03 0.00 0.00 46.19 43.16 1w36 s LEU 147 CO 0.35 -0.05 1.83 -0.26 0.23 0.00 0.00 176.35 178.45 1w36 h PHE 148 N 2.98 0.00 -3.11 0.29 -1.00 -1.97 -3.36 116.94 110.78 1w36 h PHE 148 Ca -0.48 0.00 -0.62 0.00 2.81 0.00 0.00 57.97 59.68 1w36 h PHE 148 Cb 1.19 0.00 -0.41 0.00 3.61 0.00 0.00 35.95 40.34 1w36 h PHE 148 CO 0.63 0.02 -0.66 -1.21 -1.61 0.00 0.00 178.31 175.48 1w36 s GLU 149 N -3.48 1.92 0.33 1.51 2.02 -1.26 -5.09 118.70 114.64 1w36 s GLU 149 Ca 0.03 -2.71 0.03 0.00 0.02 0.00 0.00 54.97 52.34 1w36 s GLU 149 Cb 0.07 -2.99 -0.02 0.00 0.10 0.00 0.00 34.13 31.29 1w36 s GLU 149 CO 0.60 -1.21 0.50 -0.65 0.02 0.00 0.00 175.26 174.52 1w36 s GLN 150 N -0.54 3.34 -0.14 1.61 -1.52 -1.26 -5.01 119.66 116.15 1w36 s GLN 150 Ca 0.21 -0.60 0.01 0.00 -1.95 0.00 0.00 55.36 53.02 1w36 s GLN 150 Cb -0.16 -2.74 0.02 0.00 -0.22 0.00 0.00 33.01 29.91 1w36 s GLN 150 CO -0.07 0.15 -0.13 -0.65 -0.25 0.00 0.00 175.29 174.34 1w36 s GLN 151 N -4.23 2.17 -0.69 2.91 -0.21 -1.10 -5.04 119.66 113.47 1w36 s GLN 151 Ca 0.40 -0.52 -0.26 0.00 0.02 0.00 0.00 55.36 55.01 1w36 s GLN 151 Cb -0.09 -1.99 -0.02 0.00 1.00 0.00 0.00 33.01 31.91 1w36 s GLN 151 CO 0.33 -0.20 1.84 -1.17 -2.12 0.00 0.00 175.29 173.97 1w36 s LEU 152 N 1.41 3.26 0.31 2.90 1.98 -1.26 -2.05 118.68 125.22 1w36 s LEU 152 Ca 0.03 0.03 -0.30 0.00 -2.89 0.00 0.00 54.13 51.00 1w36 s LEU 152 Cb -0.13 -2.54 -0.11 0.00 0.66 0.00 0.00 46.19 44.07 1w36 s LEU 152 CO -0.08 -2.42 1.55 -0.51 -1.89 0.00 0.00 176.35 173.00 1w36 s ILE 153 N 9.07 2.14 -0.26 6.68 1.10 0.13 -4.88 121.20 135.18 1w36 s ILE 153 Ca 0.66 0.12 -0.15 0.00 -0.51 0.00 0.00 60.65 60.77 1w36 s ILE 153 Cb -0.11 -3.08 -0.12 0.00 0.15 0.00 0.00 42.46 39.30 1w36 s ILE 153 CO 0.15 0.02 -0.28 -1.84 -2.11 0.00 0.00 174.94 170.88 1w36 n GLU 154 N 1.82 0.58 0.00 3.50 0.00 -1.26 -4.41 120.64 120.86 1w36 n GLU 154 Ca 0.06 0.30 0.00 0.00 0.00 0.00 0.00 57.16 57.53 1w36 n GLU 154 Cb 0.38 -1.52 0.00 0.00 0.00 0.00 0.00 31.44 30.30 1w36 n GLU 154 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1w36 n ASP 155 N -4.30 0.00 0.00 -1.84 5.75 -1.26 -4.92 116.55 109.98 1w36 n ASP 155 Ca -0.48 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.30 1w36 n ASP 155 Cb 0.82 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.91 1w36 n ASP 155 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1w36 n GLU 156 N 0.00 0.00 0.08 0.11 1.02 -1.26 -4.93 120.64 115.67 1w36 n GLU 156 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 1w36 n GLU 156 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.37 1w36 n GLU 156 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1w36 h SER 157 N 0.00 0.19 0.77 1.62 4.64 -1.99 -1.72 113.55 117.06 1w36 h SER 157 Ca 0.00 -0.18 -0.25 0.00 -0.47 0.00 0.00 61.79 60.89 1w36 h SER 157 Cb 0.00 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.00 1w36 h SER 157 CO 0.00 1.04 -1.27 -0.07 -0.87 0.00 0.00 176.83 175.67 1w36 h LEU 158 N 0.06 0.08 -1.10 5.97 3.38 -1.99 -2.15 115.31 119.57 1w36 h LEU 158 Ca -0.05 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 1w36 h LEU 158 Cb 1.64 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 42.35 1w36 h LEU 158 CO 0.14 1.08 -0.06 0.25 0.09 0.00 0.00 178.44 179.95 1w36 h LEU 159 N 0.01 0.54 -0.05 1.67 7.12 -1.95 -0.49 115.31 122.17 1w36 h LEU 159 Ca -0.12 -0.13 -0.09 0.00 0.13 0.00 0.00 57.88 57.68 1w36 h LEU 159 Cb 1.88 -0.14 0.00 0.00 -0.53 0.00 0.00 40.66 41.87 1w36 h LEU 159 CO 0.13 0.65 -0.31 -0.09 -0.13 0.00 0.00 178.44 178.69 1w36 h ARG 160 N 0.53 0.30 -0.88 1.25 2.43 -1.22 -1.96 114.38 114.83 1w36 h ARG 160 Ca 0.11 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1w36 h ARG 160 Cb 0.43 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 1w36 h ARG 160 CO 0.02 0.91 0.51 -0.92 -1.51 0.00 0.00 179.97 178.98 1w36 h TYR 161 N -0.23 1.19 0.00 2.20 3.20 -1.20 -0.09 116.97 122.03 1w36 h TYR 161 Ca -0.02 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.76 1w36 h TYR 161 Cb 0.98 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1w36 h TYR 161 CO 0.14 0.81 -0.31 0.37 -1.64 0.00 0.00 178.16 177.52 1w36 h GLN 162 N 1.22 0.00 0.01 1.82 4.15 -1.07 -1.58 115.11 119.67 1w36 h GLN 162 Ca 0.31 0.00 -0.23 0.00 0.77 0.00 0.00 58.65 59.50 1w36 h GLN 162 Cb -0.01 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1w36 h GLN 162 CO -0.05 0.31 -0.98 0.00 -1.93 0.00 0.00 178.83 176.18 1w36 h ALA 163 N 1.69 0.32 -0.26 3.38 0.00 -0.47 -2.53 119.26 121.38 1w36 h ALA 163 Ca -0.00 -0.72 -0.05 0.00 0.00 0.00 0.00 54.91 54.13 1w36 h ALA 163 Cb 0.63 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1w36 h ALA 163 CO 0.04 0.82 -0.05 0.00 0.00 0.00 0.00 179.25 180.05 1w36 h ALA 165 N 1.56 0.22 -0.95 0.00 0.00 -1.24 -2.26 119.26 116.59 1w36 h ALA 165 Ca 0.08 -0.58 0.02 0.00 0.00 0.00 0.00 54.91 54.43 1w36 h ALA 165 Cb 0.35 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.09 1w36 h ALA 165 CO 0.02 0.56 0.62 -0.44 0.00 0.00 0.00 179.25 180.01 1w36 h ASP 166 N 0.33 1.06 0.50 0.00 3.32 -1.13 0.47 116.42 120.98 1w36 h ASP 166 Ca -0.06 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 1w36 h ASP 166 Cb 1.37 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.65 1w36 h ASP 166 CO 0.15 0.75 -0.47 0.15 -1.72 0.00 0.00 179.24 178.10 1w36 h PHE 167 N 1.24 -1.30 -0.52 4.55 3.57 -0.97 0.14 116.94 123.66 1w36 h PHE 167 Ca 0.36 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.97 1w36 h PHE 167 Cb -0.07 0.50 -0.10 0.00 2.79 0.00 0.00 35.95 39.07 1w36 h PHE 167 CO -0.01 -0.63 -0.12 2.35 -2.23 0.00 0.00 178.31 177.67 1w36 h TRP 168 N -0.96 -0.26 -0.20 0.41 7.01 -0.76 0.32 115.95 121.52 1w36 h TRP 168 Ca -0.06 0.05 0.05 0.00 2.11 0.00 0.00 58.89 61.03 1w36 h TRP 168 Cb 0.82 0.19 -0.05 0.00 -2.10 0.00 0.00 29.16 28.03 1w36 h TRP 168 CO -0.22 -0.22 -0.12 0.00 -2.79 0.00 0.00 178.44 175.09 1w36 h ARG 169 N 0.01 -0.11 0.00 2.65 3.08 0.20 0.48 114.38 120.69 1w36 h ARG 169 Ca 0.25 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1w36 h ARG 169 Cb 0.38 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1w36 h ARG 169 CO -0.53 -0.08 0.00 0.07 -1.07 0.00 0.00 179.97 178.37 1w36 h ARG 170 N -0.12 0.00 -0.01 0.04 0.11 0.89 -3.05 114.38 112.24 1w36 h ARG 170 Ca 0.11 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.19 1w36 h ARG 170 Cb 0.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.36 1w36 h ARG 170 CO -0.27 0.00 -0.41 0.72 0.10 0.00 0.00 179.97 180.11 1w36 n HIS 171 N -2.38 0.00 0.00 4.08 8.25 0.96 -4.74 115.22 121.39 1w36 n HIS 171 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1w36 n HIS 171 Cb 0.44 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.55 1w36 n HIS 171 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1w36 h TYR 173 N 0.00 -0.37 0.00 0.00 0.99 -1.57 0.01 116.97 116.03 1w36 h TYR 173 Ca 0.00 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.77 1w36 h TYR 173 Cb 0.90 0.22 0.00 0.00 1.00 0.00 0.00 36.73 38.85 1w36 h TYR 173 CO 0.00 -0.23 0.00 -1.00 -0.00 0.00 0.00 178.16 176.93 1w36 h PRO 174 N -0.09 0.00 -6.85 4.88 0.13 -1.85 -3.44 132.00 124.77 1w36 h PRO 174 Ca 0.17 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.78 1w36 h PRO 174 Cb 0.36 0.00 0.06 0.00 0.13 0.00 0.00 31.00 31.54 1w36 h PRO 174 CO -0.40 0.00 0.63 -0.51 -0.23 0.00 0.00 178.00 177.48 1w36 s LEU 175 N -4.69 4.44 0.32 1.56 1.43 -0.01 -5.01 118.68 116.71 1w36 s LEU 175 Ca -0.01 2.62 -0.27 0.00 -1.03 0.00 0.00 54.13 55.44 1w36 s LEU 175 Cb 0.07 -3.64 -0.09 0.00 0.03 0.00 0.00 46.19 42.56 1w36 s LEU 175 CO 0.26 -0.50 1.01 -2.16 0.23 0.00 0.00 176.35 175.19 1w36 s PRO 176 N -1.58 4.54 0.34 1.29 0.04 -1.26 -4.68 135.00 133.69 1w36 s PRO 176 Ca 0.49 1.52 0.25 0.00 0.04 0.00 0.00 61.00 63.31 1w36 s PRO 176 Cb -0.39 -2.91 1.17 0.00 0.04 0.00 0.00 34.50 32.41 1w36 s PRO 176 CO 0.50 0.20 1.22 -2.13 0.04 0.00 0.00 177.00 176.83 1w36 n ARG 177 N 0.71 -0.03 -0.11 4.56 3.00 -1.26 -1.21 116.66 122.32 1w36 n ARG 177 Ca 0.01 0.98 -0.12 0.00 -0.00 0.00 0.00 57.85 58.73 1w36 n ARG 177 Cb 0.48 -1.94 -0.03 0.00 0.00 0.00 0.00 32.46 30.97 1w36 n ARG 177 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 1w36 h GLU 178 N 0.00 0.66 0.10 -0.14 4.11 -1.92 -2.02 114.58 115.37 1w36 h GLU 178 Ca 0.69 -0.27 -0.29 0.00 0.07 0.00 0.00 59.36 59.57 1w36 h GLU 178 Cb 2.22 -0.03 0.02 0.00 0.50 0.00 0.00 28.75 31.47 1w36 h GLU 178 CO -0.37 0.85 -1.21 0.82 0.07 0.00 0.00 179.01 179.17 1w36 h ILE 179 N 0.43 1.32 -0.24 -1.06 2.04 -1.51 -3.21 117.51 115.28 1w36 h ILE 179 Ca 0.08 -2.52 0.06 0.00 1.00 0.00 0.00 64.86 63.48 1w36 h ILE 179 Cb 0.62 2.68 -0.07 0.00 -0.74 0.00 0.00 36.82 39.31 1w36 h ILE 179 CO 0.04 0.76 -0.24 0.00 0.00 0.00 0.00 178.15 178.71 1w36 h ALA 180 N 0.38 -0.13 -0.84 1.87 0.00 -1.38 -0.45 119.26 118.72 1w36 h ALA 180 Ca -0.17 0.08 0.16 0.00 0.00 0.00 0.00 54.91 54.98 1w36 h ALA 180 Cb 1.88 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 20.11 1w36 h ALA 180 CO 0.23 -0.67 0.55 0.37 0.00 0.00 0.00 179.25 179.73 1w36 h GLN 181 N -0.25 0.50 -0.22 0.00 4.15 -1.43 0.13 115.11 118.00 1w36 h GLN 181 Ca 0.14 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.45 1w36 h GLN 181 Cb 0.46 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.03 1w36 h GLN 181 CO -0.38 0.33 -0.17 0.28 -1.93 0.00 0.00 178.83 176.96 1w36 h VAL 182 N 0.51 1.32 0.73 2.39 2.07 -1.12 -2.08 116.25 120.08 1w36 h VAL 182 Ca 0.42 -1.30 -0.04 0.00 0.82 0.00 0.00 66.70 66.60 1w36 h VAL 182 Cb 0.87 1.69 0.01 0.00 -1.52 0.00 0.00 31.29 32.34 1w36 h VAL 182 CO -0.17 0.40 -0.35 0.58 0.02 0.00 0.00 177.57 178.05 1w36 h VAL 183 N 0.19 0.26 -1.17 2.57 2.07 -0.39 -2.48 116.25 117.30 1w36 h VAL 183 Ca 0.04 -0.05 0.40 0.00 0.82 0.00 0.00 66.70 67.91 1w36 h VAL 183 Cb 0.70 0.28 -0.14 0.00 -1.52 0.00 0.00 31.29 30.61 1w36 h VAL 183 CO 0.04 0.01 0.72 0.15 0.02 0.00 0.00 177.57 178.51 1w36 h PHE 184 N -1.02 0.68 0.00 1.57 3.57 -0.78 1.29 116.94 122.26 1w36 h PHE 184 Ca -0.10 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.43 1w36 h PHE 184 Cb 0.76 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.33 1w36 h PHE 184 CO -0.02 -0.24 0.00 0.39 -2.23 0.00 0.00 178.31 176.22 1w36 n GLU 185 N -4.88 0.47 -0.11 1.11 1.02 -0.79 -3.42 120.64 114.04 1w36 n GLU 185 Ca 0.35 0.02 -0.17 0.00 -0.02 0.00 0.00 57.16 57.35 1w36 n GLU 185 Cb 1.27 -1.50 -0.10 0.00 -0.02 0.00 0.00 31.44 31.09 1w36 n GLU 185 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1w36 n THR 186 N -1.24 1.28 -3.74 2.62 -1.04 0.43 -4.95 114.28 107.63 1w36 n THR 186 Ca 0.14 -0.46 -0.12 0.00 -2.04 0.00 0.00 64.05 61.57 1w36 n THR 186 Cb 0.20 -1.38 -0.12 0.00 -1.82 0.00 0.00 70.33 67.21 1w36 n THR 186 CO 0.00 0.00 0.00 0.26 -0.64 0.00 0.00 175.07 174.69 1w36 s TRP 187 N -2.44 -0.36 0.06 -1.42 0.52 -0.17 -5.04 118.94 110.09 1w36 s TRP 187 Ca -0.30 0.84 0.26 0.00 0.02 0.00 0.00 56.10 56.92 1w36 s TRP 187 Cb 0.09 0.09 0.97 0.00 -1.15 0.00 0.00 33.47 33.47 1w36 s TRP 187 CO 0.50 -0.22 1.84 0.87 0.02 0.00 0.00 176.95 179.95 1w36 h LYS 188 N 6.80 0.00 -1.60 4.98 1.57 -1.83 -3.31 116.57 123.18 1w36 h LYS 188 Ca -0.36 0.00 0.34 0.00 -1.87 0.00 0.00 60.65 58.76 1w36 h LYS 188 Cb 1.17 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.37 1w36 h LYS 188 CO 0.35 0.15 0.88 0.20 -0.57 0.00 0.00 179.45 180.46 1w36 s GLY 189 N -4.25 -0.34 0.45 3.86 0.00 -1.26 -4.94 107.32 100.84 1w36 s GLY 189 Ca 0.01 0.52 0.24 0.00 0.00 0.00 0.00 44.72 45.50 1w36 s GLY 189 CO 0.62 1.89 1.81 -0.56 0.00 0.00 0.00 173.10 176.86 1w36 h PRO 190 N 2.00 0.25 -0.80 2.90 0.13 -1.91 -0.75 132.00 133.82 1w36 h PRO 190 Ca -0.28 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1w36 h PRO 190 Cb 1.20 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.23 1w36 h PRO 190 CO 0.30 0.16 0.49 0.37 -0.23 0.00 0.00 178.00 179.09 1w36 h GLN 191 N 0.26 1.08 -0.34 0.86 5.75 -1.96 -0.80 115.11 119.96 1w36 h GLN 191 Ca 0.55 -0.09 -0.09 0.00 -0.15 0.00 0.00 58.65 58.87 1w36 h GLN 191 Cb 1.65 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 29.96 1w36 h GLN 191 CO -0.18 0.75 -0.16 0.00 -2.65 0.00 0.00 178.83 176.59 1w36 h ALA 192 N 1.26 1.08 0.15 3.38 0.00 -1.55 -1.60 119.26 121.98 1w36 h ALA 192 Ca 0.29 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1w36 h ALA 192 Cb -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1w36 h ALA 192 CO -0.06 0.56 -0.08 1.25 0.00 0.00 0.00 179.25 180.93 1w36 h LEU 193 N 0.56 -0.19 -1.00 0.00 6.46 -0.90 -2.46 115.31 117.78 1w36 h LEU 193 Ca 0.09 0.01 0.39 0.00 -0.12 0.00 0.00 57.88 58.25 1w36 h LEU 193 Cb 0.60 0.05 -0.17 0.00 -0.73 0.00 0.00 40.66 40.41 1w36 h LEU 193 CO 0.04 -0.13 0.52 0.25 -0.62 0.00 0.00 178.44 178.50 1w36 h LEU 194 N -0.21 0.32 -1.44 2.25 6.46 -1.14 1.03 115.31 122.58 1w36 h LEU 194 Ca -0.02 0.24 0.01 0.00 -0.12 0.00 0.00 57.88 57.99 1w36 h LEU 194 Cb 0.16 0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 40.31 1w36 h LEU 194 CO 0.03 -0.36 0.39 -0.09 -0.62 0.00 0.00 178.44 177.79 1w36 h ARG 195 N 0.08 0.75 0.00 1.25 2.43 -0.83 0.55 114.38 118.61 1w36 h ARG 195 Ca 0.80 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.92 1w36 h ARG 195 Cb 2.04 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 31.42 1w36 h ARG 195 CO -0.74 0.50 -0.03 -0.44 -1.51 0.00 0.00 179.97 177.75 1w36 h ASP 196 N 0.77 0.00 0.00 -3.80 5.19 0.14 -3.38 116.42 115.34 1w36 h ASP 196 Ca 0.22 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.63 1w36 h ASP 196 Cb -0.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.45 1w36 h ASP 196 CO -0.05 0.03 -0.29 2.30 -3.12 0.00 0.00 179.24 178.11 1w36 n ILE 197 N -3.10 0.00 -0.43 0.35 -5.35 -0.68 -4.79 119.36 105.36 1w36 n ILE 197 Ca 0.04 -0.29 0.35 0.00 -0.27 0.00 0.00 62.75 62.57 1w36 n ILE 197 Cb 0.54 0.81 0.63 0.00 -1.74 0.00 0.00 39.64 39.89 1w36 n ILE 197 CO 0.00 0.00 0.00 -1.13 -1.76 0.00 0.00 176.55 173.66 1w36 h ASN 198 N 0.00 0.26 0.27 7.28 -1.24 -0.12 -0.06 115.58 121.97 1w36 h ASN 198 Ca 0.00 0.12 -0.00 0.00 0.71 0.00 0.00 56.30 57.12 1w36 h ASN 198 Cb 0.00 0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.13 1w36 h ASN 198 CO 0.00 -0.12 -0.21 -0.09 -1.29 0.00 0.00 177.43 175.72 1w36 h ARG 199 N 0.14 -0.47 0.00 6.67 2.43 -1.86 -3.39 114.38 117.89 1w36 h ARG 199 Ca 0.77 0.03 -0.32 0.00 -0.81 0.00 0.00 59.98 59.65 1w36 h ARG 199 Cb 2.40 0.11 0.16 0.00 -0.42 0.00 0.00 29.97 32.21 1w36 h ARG 199 CO -0.37 -0.31 0.12 0.66 -1.51 0.00 0.00 179.97 178.56 1w36 n TYR 200 N -5.34 -3.75 0.00 2.20 4.02 -0.04 -3.31 117.16 110.95 1w36 n TYR 200 Ca -0.09 -0.81 0.00 0.00 -0.01 0.00 0.00 57.90 56.99 1w36 n TYR 200 Cb 0.25 -0.90 0.00 0.00 -0.02 0.00 0.00 39.34 38.67 1w36 n TYR 200 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1w36 n LEU 201 N 0.00 0.00 -4.26 7.72 4.77 -1.26 -4.94 117.00 119.03 1w36 n LEU 201 Ca 0.12 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.78 1w36 n LEU 201 Cb 0.47 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.40 1w36 n LEU 201 CO 0.33 0.00 -0.55 -1.10 -1.33 0.00 0.00 177.39 174.73 1w36 s GLN 202 N -0.04 2.83 1.67 3.23 -0.21 -1.21 -4.93 119.66 120.99 1w36 s GLN 202 Ca 0.00 -0.87 0.00 0.00 0.02 0.00 0.00 55.36 54.51 1w36 s GLN 202 Cb 0.00 -2.26 0.00 0.00 1.00 0.00 0.00 33.01 31.75 1w36 s GLN 202 CO 0.00 0.29 0.00 0.41 -2.12 0.00 0.00 175.29 173.87 1w36 n GLY 203 N 3.23 -1.19 3.48 3.09 0.00 -1.26 -4.72 105.19 107.82 1w36 n GLY 203 Ca -0.18 -1.07 -0.52 0.00 0.00 0.00 0.00 46.02 44.25 1w36 n GLY 203 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1w36 n GLU 204 N -2.00 0.31 -2.68 1.61 1.02 -1.26 -4.89 120.64 112.75 1w36 n GLU 204 Ca 0.00 0.11 -0.40 0.00 -0.02 0.00 0.00 57.16 56.85 1w36 n GLU 204 Cb 0.07 -1.43 -0.06 0.00 -0.02 0.00 0.00 31.44 30.01 1w36 n GLU 204 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1w36 s ALA 205 N -0.42 3.34 0.77 0.62 0.00 -1.26 -4.84 121.76 119.96 1w36 s ALA 205 Ca 0.76 0.68 -0.11 0.00 0.00 0.00 0.00 51.96 53.29 1w36 s ALA 205 Cb -1.04 -3.24 0.05 0.00 0.00 0.00 0.00 23.12 18.90 1w36 s ALA 205 CO 0.56 0.11 1.09 -1.25 0.00 0.00 0.00 175.76 176.27 1w36 s PRO 206 N -1.36 2.33 0.07 0.00 0.04 -1.26 -5.00 135.00 129.82 1w36 s PRO 206 Ca 0.43 0.64 -0.28 0.00 0.04 0.00 0.00 61.00 61.84 1w36 s PRO 206 Cb -0.27 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.27 1w36 s PRO 206 CO 0.33 -1.45 0.87 0.08 0.04 0.00 0.00 177.00 176.87 1w36 s VAL 207 N -3.18 4.64 -0.35 -0.36 1.01 -0.55 -4.86 120.40 116.75 1w36 s VAL 207 Ca 0.60 1.86 -0.22 0.00 0.00 0.00 0.00 61.98 64.22 1w36 s VAL 207 Cb -0.14 -4.22 0.00 0.00 0.00 0.00 0.00 36.38 32.02 1w36 s VAL 207 CO 0.54 0.33 0.70 -0.63 0.00 0.00 0.00 175.10 176.03 1w36 s ILE 208 N 0.07 4.84 -0.01 2.22 1.01 -1.26 -0.73 121.20 127.33 1w36 s ILE 208 Ca 0.43 0.77 -0.30 0.00 0.00 0.00 0.00 60.65 61.56 1w36 s ILE 208 Cb -0.22 -4.11 -0.07 0.00 0.01 0.00 0.00 42.46 38.07 1w36 s ILE 208 CO 0.26 -0.32 1.76 -0.75 0.00 0.00 0.00 174.94 175.89 1w36 s LYS 209 N 2.84 4.17 -0.71 2.79 2.20 -0.66 -3.36 119.74 127.00 1w36 s LYS 209 Ca 0.27 2.35 -0.03 0.00 -0.36 0.00 0.00 55.97 58.21 1w36 s LYS 209 Cb -0.14 -3.99 -0.04 0.00 -1.51 0.00 0.00 37.83 32.15 1w36 s LYS 209 CO 0.15 -0.87 0.64 0.00 -0.36 0.00 0.00 175.35 174.91 1w36 n ALA 210 N 7.05 -2.08 -1.57 3.13 0.00 -1.26 -4.51 120.51 121.27 1w36 n ALA 210 Ca 0.18 0.07 -0.30 0.00 0.00 0.00 0.00 53.44 53.39 1w36 n ALA 210 Cb 0.42 -3.40 0.10 0.00 0.00 0.00 0.00 19.45 16.57 1w36 n ALA 210 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1w36 s PRO 211 N -3.70 1.86 0.81 0.00 0.04 -1.21 -4.98 135.00 127.82 1w36 s PRO 211 Ca 0.23 0.53 -0.10 0.00 0.04 0.00 0.00 61.00 61.70 1w36 s PRO 211 Cb -0.03 -1.90 0.08 0.00 0.04 0.00 0.00 34.50 32.69 1w36 s PRO 211 CO 0.56 -1.75 1.11 -2.14 0.04 0.00 0.00 177.00 174.82 1w36 s PRO 212 N -5.21 1.88 0.19 0.56 0.02 -1.26 -4.90 135.00 126.29 1w36 s PRO 212 Ca 0.61 1.29 -0.32 0.00 0.02 0.00 0.00 61.00 62.61 1w36 s PRO 212 Cb -0.14 -1.85 -0.11 0.00 0.02 0.00 0.00 34.50 32.42 1w36 s PRO 212 CO 0.54 -1.94 1.61 -2.14 -0.33 0.00 0.00 177.00 174.74 1w36 s PRO 213 N -4.81 4.18 0.00 5.54 0.02 -1.26 -4.68 135.00 133.99 1w36 s PRO 213 Ca 0.63 2.45 0.00 0.00 0.02 0.00 0.00 61.00 64.10 1w36 s PRO 213 Cb -0.19 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.21 1w36 s PRO 213 CO 0.56 -0.65 0.00 -3.47 -0.33 0.00 0.00 177.00 173.12 1w36 n ASP 214 N 3.81 0.00 0.00 2.53 2.03 -1.26 -1.50 116.55 122.16 1w36 n ASP 214 Ca 0.14 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1w36 n ASP 214 Cb 0.37 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.77 1w36 n ASP 214 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1w36 n ASP 215 N 0.66 0.00 -4.52 1.67 5.68 -1.26 -5.12 116.55 113.66 1w36 n ASP 215 Ca 0.00 0.00 -0.52 0.00 -0.50 0.00 0.00 54.79 53.77 1w36 n ASP 215 Cb 0.00 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 39.93 1w36 n ASP 215 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1w36 n GLU 216 N 0.00 0.60 -2.98 0.11 1.02 -0.56 -4.94 120.64 113.88 1w36 n GLU 216 Ca 0.00 0.21 -0.17 0.00 -0.02 0.00 0.00 57.16 57.18 1w36 n GLU 216 Cb 0.00 -1.64 0.01 0.00 -0.02 0.00 0.00 31.44 29.79 1w36 n GLU 216 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1w36 s THR 217 N -0.19 2.95 0.18 2.62 -4.23 -1.26 -4.95 115.64 110.76 1w36 s THR 217 Ca 0.79 -0.97 -0.11 0.00 -1.18 0.00 0.00 61.69 60.21 1w36 s THR 217 Cb -1.01 -2.98 0.10 0.00 1.34 0.00 0.00 72.50 69.95 1w36 s THR 217 CO 0.54 0.00 1.77 -0.07 -0.54 0.00 0.00 174.62 176.32 1w36 h LEU 218 N 0.58 0.84 -0.77 4.79 3.38 -1.99 -2.41 115.31 119.73 1w36 h LEU 218 Ca -0.40 -0.13 0.16 0.00 0.09 0.00 0.00 57.88 57.60 1w36 h LEU 218 Cb 1.28 -0.22 -0.11 0.00 0.09 0.00 0.00 40.66 41.71 1w36 h LEU 218 CO 0.45 0.74 0.25 0.00 0.09 0.00 0.00 178.44 179.97 1w36 h ALA 219 N 1.14 1.05 0.17 1.53 0.00 -1.99 -0.86 119.26 120.30 1w36 h ALA 219 Ca 0.22 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1w36 h ALA 219 Cb 0.12 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1w36 h ALA 219 CO -0.03 -0.30 -0.08 0.77 0.00 0.00 0.00 179.25 179.61 1w36 h SER 220 N 0.34 -0.19 -0.84 0.00 0.02 -1.81 -2.82 113.55 108.25 1w36 h SER 220 Ca 0.44 0.01 0.21 0.00 -0.84 0.00 0.00 61.79 61.61 1w36 h SER 220 Cb 0.73 0.05 -0.14 0.00 0.14 0.00 0.00 62.40 63.19 1w36 h SER 220 CO -0.48 -0.09 0.15 -0.09 -1.14 0.00 0.00 176.83 175.17 1w36 h ARG 221 N -0.32 0.16 -0.18 3.45 9.65 -1.45 -0.12 114.38 125.58 1w36 h ARG 221 Ca -0.02 -0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.90 1w36 h ARG 221 Cb 0.17 -0.04 -0.07 0.00 -1.39 0.00 0.00 29.97 28.65 1w36 h ARG 221 CO 0.04 0.11 -0.30 1.25 2.80 0.00 0.00 179.97 183.86 1w36 h HIS 222 N 0.17 -0.83 0.00 2.20 2.76 -1.21 -0.04 115.15 118.19 1w36 h HIS 222 Ca 0.50 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.71 1w36 h HIS 222 Cb 0.97 0.39 0.00 0.00 1.55 0.00 0.00 27.41 30.33 1w36 h HIS 222 CO -0.33 -0.38 0.00 0.00 -1.30 0.00 0.00 177.93 175.92 1w36 n ALA 223 N -2.84 -0.15 -0.29 5.26 0.00 -0.12 -0.47 120.51 121.89 1w36 n ALA 223 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.53 1w36 n ALA 223 Cb 0.32 0.27 0.23 0.00 0.00 0.00 0.00 19.45 20.27 1w36 n ALA 223 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1w36 n GLN 224 N -2.21 -0.07 0.35 0.00 6.02 -0.80 -1.17 117.38 119.51 1w36 n GLN 224 Ca 0.00 1.27 -0.16 0.00 -0.01 0.00 0.00 57.00 58.10 1w36 n GLN 224 Cb 0.00 -2.00 -0.08 0.00 1.02 0.00 0.00 30.24 29.18 1w36 n GLN 224 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1w36 h ILE 225 N 0.00 0.21 -0.80 5.09 1.08 -0.21 -2.31 117.51 120.57 1w36 h ILE 225 Ca 0.50 -0.24 0.17 0.00 -0.39 0.00 0.00 64.86 64.89 1w36 h ILE 225 Cb 0.99 0.27 -0.15 0.00 -3.07 0.00 0.00 36.82 34.86 1w36 h ILE 225 CO -0.80 0.02 -0.14 0.58 -0.69 0.00 0.00 178.15 177.12 1w36 h VAL 226 N -1.09 0.22 -0.46 1.67 2.07 0.76 -1.12 116.25 118.30 1w36 h VAL 226 Ca -0.09 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1w36 h VAL 226 Cb 0.72 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 1w36 h VAL 226 CO 0.15 0.00 0.18 0.00 0.02 0.00 0.00 177.57 177.93 1w36 h ALA 227 N 1.79 0.57 0.00 1.67 0.00 -1.12 0.42 119.26 122.58 1w36 h ALA 227 Ca 0.40 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.33 1w36 h ALA 227 Cb 0.66 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1w36 h ALA 227 CO -0.79 -0.20 -0.13 0.00 0.00 0.00 0.00 179.25 178.13 1w36 h ARG 228 N 0.37 0.00 0.00 0.00 3.08 -0.65 -2.53 114.38 114.65 1w36 h ARG 228 Ca 0.22 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 1w36 h ARG 228 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1w36 h ARG 228 CO -0.21 0.13 -0.03 0.82 -1.07 0.00 0.00 179.97 179.61 1w36 h ILE 229 N 0.00 1.74 0.00 2.04 2.04 -0.43 -3.36 117.51 119.55 1w36 h ILE 229 Ca -0.00 -2.22 -0.09 0.00 1.00 0.00 0.00 64.86 63.55 1w36 h ILE 229 Cb 0.25 3.25 -0.01 0.00 -0.74 0.00 0.00 36.82 39.57 1w36 h ILE 229 CO 0.02 0.58 -0.42 -0.78 0.00 0.00 0.00 178.15 177.54 1w36 h ASP 230 N -0.92 0.00 0.22 1.72 1.82 -0.17 -2.16 116.42 116.93 1w36 h ASP 230 Ca -0.01 0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.60 1w36 h ASP 230 Cb 0.97 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.97 1w36 h ASP 230 CO 0.01 0.42 -0.17 0.71 -1.61 0.00 0.00 179.24 178.60 1w36 h THR 231 N 0.00 1.00 0.00 2.25 1.35 -1.61 0.21 112.91 116.11 1w36 h THR 231 Ca -0.00 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 1w36 h THR 231 Cb 0.78 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 1w36 h THR 231 CO 0.05 0.17 -0.49 0.52 -0.25 0.00 0.00 175.52 175.52 1w36 n VAL 232 N -4.16 0.28 0.70 6.82 0.31 -1.03 -3.19 118.33 118.06 1w36 n VAL 232 Ca -0.02 -0.20 0.13 0.00 -0.01 0.00 0.00 64.34 64.24 1w36 n VAL 232 Cb 0.24 -0.13 0.37 0.00 -0.91 0.00 0.00 33.84 33.41 1w36 n VAL 232 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1w36 n LYS 233 N -1.96 0.21 -0.10 5.55 5.02 0.59 -3.63 118.16 123.85 1w36 n LYS 233 Ca 0.04 0.13 -0.23 0.00 -2.02 0.00 0.00 58.31 56.24 1w36 n LYS 233 Cb 0.41 -1.71 -0.12 0.00 -0.02 0.00 0.00 35.03 33.60 1w36 n LYS 233 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1w36 n GLN 234 N -2.05 0.59 0.00 1.97 6.02 -0.39 -2.92 117.38 120.59 1w36 n GLN 234 Ca 0.05 0.50 0.00 0.00 -0.01 0.00 0.00 57.00 57.55 1w36 n GLN 234 Cb 0.41 -1.71 0.00 0.00 1.02 0.00 0.00 30.24 29.96 1w36 n GLN 234 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1w36 n GLN 235 N -4.31 0.46 0.00 -1.09 6.02 -1.19 -0.91 117.38 116.36 1w36 n GLN 235 Ca -0.35 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.64 1w36 n GLN 235 Cb 0.75 -1.20 0.00 0.00 1.02 0.00 0.00 30.24 30.80 1w36 n GLN 235 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 177.06 177.92 1w36 n TRP 236 N 0.17 0.00 1.76 1.08 -0.00 -1.24 -4.66 117.44 114.55 1w36 n TRP 236 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.50 57.62 1w36 n TRP 236 Cb 0.10 0.00 0.74 0.00 -0.00 0.00 0.00 31.31 32.15 1w36 n TRP 236 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1w36 n ARG 237 N 0.00 0.88 -3.25 5.87 1.74 -0.08 -3.58 116.66 118.24 1w36 n ARG 237 Ca 0.00 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.81 1w36 n ARG 237 Cb 0.00 -1.44 -0.07 0.00 -1.02 0.00 0.00 32.46 29.93 1w36 n ARG 237 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1w36 n ASP 238 N -0.94 3.68 -1.02 0.55 8.00 -1.21 -4.81 116.55 120.80 1w36 n ASP 238 Ca 0.19 -3.46 0.05 0.00 0.71 0.00 0.00 54.79 52.28 1w36 n ASP 238 Cb 0.09 -0.63 0.20 0.00 -0.02 0.00 0.00 41.12 40.75 1w36 n ASP 238 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1w36 n ALA 239 N 0.52 2.86 0.03 2.24 0.00 -1.23 -4.33 120.51 120.61 1w36 n ALA 239 Ca 0.30 -0.89 -0.04 0.00 0.00 0.00 0.00 53.44 52.81 1w36 n ALA 239 Cb 0.42 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.82 1w36 n ALA 239 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1w36 h VAL 240 N 2.28 0.00 0.01 0.00 2.07 -1.92 -3.27 116.25 115.42 1w36 h VAL 240 Ca 0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1w36 h VAL 240 Cb 0.94 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1w36 h VAL 240 CO 0.14 0.00 -0.01 1.23 0.02 0.00 0.00 177.57 178.95 1w36 h GLY 241 N -0.19 -0.02 -7.14 2.17 0.00 -2.02 -3.43 103.07 92.44 1w36 h GLY 241 Ca -0.00 0.01 -0.52 0.00 0.00 0.00 0.00 47.33 46.82 1w36 h GLY 241 CO -0.06 -0.01 1.69 1.18 0.00 0.00 0.00 176.54 179.34 1w36 n GLU 242 N -4.98 0.31 -0.36 4.80 1.02 -1.24 -4.07 120.64 116.12 1w36 n GLU 242 Ca -0.08 0.01 -0.01 0.00 -0.02 0.00 0.00 57.16 57.07 1w36 n GLU 242 Cb 0.15 -2.02 -0.01 0.00 -0.02 0.00 0.00 31.44 29.54 1w36 n GLU 242 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1w36 n LEU 243 N 11.59 -0.12 -1.81 -4.62 4.77 -1.26 -4.96 117.00 120.59 1w36 n LEU 243 Ca 0.57 -0.39 -0.16 0.00 -0.03 0.00 0.00 56.01 56.00 1w36 n LEU 243 Cb 0.16 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.27 1w36 n LEU 243 CO 0.87 0.70 -0.57 0.47 -1.33 0.00 0.00 177.39 177.52 1w36 n ASP 244 N 0.00 -2.63 0.00 -1.43 8.00 -1.26 -5.08 116.55 114.16 1w36 n ASP 244 Ca -0.03 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1w36 n ASP 244 Cb 0.24 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 1w36 n ASP 244 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1w36 n ALA 245 N -1.08 0.00 -1.66 2.24 0.00 -1.26 -5.00 120.51 113.74 1w36 n ALA 245 Ca -0.01 0.00 -0.48 0.00 0.00 0.00 0.00 53.44 52.95 1w36 n ALA 245 Cb 0.25 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.65 1w36 n ALA 245 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1w36 n LEU 246 N 0.00 2.94 0.00 0.00 4.77 -1.26 -5.01 117.00 118.44 1w36 n LEU 246 Ca 0.00 1.05 0.00 0.00 -0.03 0.00 0.00 56.01 57.03 1w36 n LEU 246 Cb 0.00 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 39.73 1w36 n LEU 246 CO 0.00 -0.34 0.00 2.30 -1.33 0.00 0.00 177.39 178.02 1w36 n ILE 247 N 3.90 0.00 0.00 -0.08 -6.64 -1.26 -4.94 119.36 110.34 1w36 n ILE 247 Ca 0.20 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.18 1w36 n ILE 247 Cb 0.26 -1.06 0.00 0.00 -1.44 0.00 0.00 39.64 37.40 1w36 n ILE 247 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1w36 n GLU 248 N -0.55 0.00 0.00 6.28 -0.58 -1.26 -5.08 120.64 119.45 1w36 n GLU 248 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1w36 n GLU 248 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1w36 n GLU 248 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1w36 n SER 249 N 0.00 0.00 -0.21 1.62 3.41 -1.26 -4.03 113.62 113.15 1w36 n SER 249 Ca 0.00 0.55 -0.05 0.00 -0.26 0.00 0.00 58.87 59.10 1w36 n SER 249 Cb 0.00 -0.16 -0.05 0.00 -0.26 0.00 0.00 64.21 63.74 1w36 n SER 249 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1w36 n SER 250 N -0.99 -0.53 -4.52 4.04 3.41 -1.26 -3.87 113.62 109.90 1w36 n SER 250 Ca 0.00 1.07 -0.52 0.00 -0.26 0.00 0.00 58.87 59.16 1w36 n SER 250 Cb 0.00 -0.21 -0.07 0.00 -0.26 0.00 0.00 64.21 63.68 1w36 n SER 250 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1w36 n GLY 251 N -1.12 0.68 3.41 5.00 0.00 -1.26 -4.90 105.19 107.00 1w36 n GLY 251 Ca 0.01 0.93 -0.19 0.00 0.00 0.00 0.00 46.02 46.77 1w36 n GLY 251 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1w36 n ILE 252 N 6.48 0.00 -0.81 -0.61 3.06 -1.25 -4.72 119.36 121.51 1w36 n ILE 252 Ca 0.36 -1.76 0.08 0.00 -2.50 0.00 0.00 62.75 58.94 1w36 n ILE 252 Cb 0.22 -0.45 0.38 0.00 0.54 0.00 0.00 39.64 40.33 1w36 n ILE 252 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 1w36 n ASP 253 N -2.27 5.23 -1.60 9.51 8.00 -1.26 -3.40 116.55 130.76 1w36 n ASP 253 Ca 0.10 -2.77 0.03 0.00 0.71 0.00 0.00 54.79 52.87 1w36 n ASP 253 Cb 0.53 -0.63 0.32 0.00 -0.02 0.00 0.00 41.12 41.33 1w36 n ASP 253 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1w36 n ARG 254 N 0.69 3.83 0.11 -1.24 5.12 -1.26 -3.83 116.66 120.08 1w36 n ARG 254 Ca 0.26 -3.06 0.03 0.00 -1.93 0.00 0.00 57.85 53.15 1w36 n ARG 254 Cb 1.06 -2.11 -0.00 0.00 -1.16 0.00 0.00 32.46 30.25 1w36 n ARG 254 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1w36 h ARG 255 N 2.82 0.00 0.00 5.56 3.08 -1.97 -2.84 114.38 121.02 1w36 h ARG 255 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1w36 h ARG 255 Cb 1.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.97 1w36 h ARG 255 CO 0.49 0.39 0.00 1.63 -1.07 0.00 0.00 179.97 181.41 1w36 n LYS 256 N -3.09 0.23 -0.09 0.04 5.02 -1.25 0.11 118.16 119.13 1w36 n LYS 256 Ca -0.01 0.12 -0.17 0.00 -2.02 0.00 0.00 58.31 56.23 1w36 n LYS 256 Cb 0.75 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 34.16 1w36 n LYS 256 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1w36 h PHE 257 N 0.00 0.00 -0.07 2.13 0.05 -1.80 -3.35 116.94 113.90 1w36 h PHE 257 Ca 0.00 0.00 0.04 0.00 3.82 0.00 0.00 57.97 61.83 1w36 h PHE 257 Cb 0.08 0.00 -0.05 0.00 2.00 0.00 0.00 35.95 37.98 1w36 h PHE 257 CO 0.00 1.11 -0.23 -0.91 -0.18 0.00 0.00 178.31 178.11 1w36 h ASN 258 N -1.00 -0.69 0.00 2.17 2.35 -0.14 -3.29 115.58 114.98 1w36 h ASN 258 Ca -0.23 0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 1w36 h ASN 258 Cb 1.08 0.30 0.00 0.00 0.05 0.00 0.00 38.32 39.75 1w36 h ASN 258 CO -0.14 -0.28 0.00 0.54 -1.65 0.00 0.00 177.43 175.89 1w36 n ARG 259 N -5.35 0.00 -0.18 0.81 1.74 0.31 -2.82 116.66 111.16 1w36 n ARG 259 Ca -0.04 0.00 0.16 0.00 -0.77 0.00 0.00 57.85 57.20 1w36 n ARG 259 Cb 0.27 0.00 0.26 0.00 -1.02 0.00 0.00 32.46 31.97 1w36 n ARG 259 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1w36 n SER 260 N 0.00 0.08 -0.23 0.55 3.41 -1.26 -0.15 113.62 116.02 1w36 n SER 260 Ca 0.00 0.54 0.03 0.00 -0.26 0.00 0.00 58.87 59.18 1w36 n SER 260 Cb 0.00 -0.26 0.13 0.00 -0.26 0.00 0.00 64.21 63.82 1w36 n SER 260 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1w36 h ASN 261 N 0.00 -0.31 0.72 4.04 2.35 -1.59 0.57 115.58 121.36 1w36 h ASN 261 Ca 0.34 0.18 -0.26 0.00 -0.55 0.00 0.00 56.30 56.01 1w36 h ASN 261 Cb 1.11 0.31 -0.04 0.00 0.05 0.00 0.00 38.32 39.75 1w36 h ASN 261 CO -0.18 -0.15 -1.38 1.56 -1.65 0.00 0.00 177.43 175.64 1w36 h GLN 262 N 0.11 0.01 -0.77 0.81 4.20 -0.63 -2.44 115.11 116.40 1w36 h GLN 262 Ca 0.37 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 59.02 1w36 h GLN 262 Cb 0.63 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.39 1w36 h GLN 262 CO -0.60 0.75 0.30 0.00 -0.67 0.00 0.00 178.83 178.60 1w36 h ALA 263 N 0.98 1.00 -0.01 3.87 0.00 -1.30 0.14 119.26 123.94 1w36 h ALA 263 Ca -0.16 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1w36 h ALA 263 Cb 1.90 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1w36 h ALA 263 CO 0.11 0.63 -0.03 1.63 0.00 0.00 0.00 179.25 181.59 1w36 n LYS 264 N -4.30 1.24 -0.11 0.00 5.02 0.19 -3.36 118.16 116.84 1w36 n LYS 264 Ca 0.07 -0.50 -0.00 0.00 -2.02 0.00 0.00 58.31 55.86 1w36 n LYS 264 Cb 0.19 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.75 1w36 n LYS 264 CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75 1w36 n TRP 265 N -0.45 0.27 -2.92 2.13 -0.00 0.04 -4.32 117.44 112.19 1w36 n TRP 265 Ca 0.20 -0.25 -0.37 0.00 -0.00 0.00 0.00 57.50 57.07 1w36 n TRP 265 Cb 0.26 -0.20 -0.01 0.00 -0.00 0.00 0.00 31.31 31.36 1w36 n TRP 265 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 1w36 n ILE 266 N 0.14 4.82 -2.46 5.87 2.08 -1.21 -4.94 119.36 123.66 1w36 n ILE 266 Ca 0.04 -5.80 -0.17 0.00 0.56 0.00 0.00 62.75 57.38 1w36 n ILE 266 Cb 0.44 -1.77 0.09 0.00 -0.75 0.00 0.00 39.64 37.66 1w36 n ILE 266 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1w36 n ASP 267 N 0.46 0.93 -2.04 4.38 10.43 -1.26 -4.91 116.55 124.54 1w36 n ASP 267 Ca 0.35 -1.80 -0.15 0.00 2.57 0.00 0.00 54.79 55.76 1w36 n ASP 267 Cb 0.33 -0.49 -0.09 0.00 1.84 0.00 0.00 41.12 42.71 1w36 n ASP 267 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 1w36 n LYS 268 N -2.40 1.92 0.00 -1.24 3.00 -1.26 -4.94 118.16 113.24 1w36 n LYS 268 Ca 0.12 -1.27 0.00 0.00 -0.00 0.00 0.00 58.31 57.16 1w36 n LYS 268 Cb 0.43 -1.82 0.00 0.00 0.00 0.00 0.00 35.03 33.64 1w36 n LYS 268 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1w36 n ILE 269 N 1.62 0.00 0.00 3.15 5.41 -1.26 -4.88 119.36 123.40 1w36 n ILE 269 Ca 0.36 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.11 1w36 n ILE 269 Cb 0.71 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.64 1w36 n ILE 269 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1w36 n SER 270 N 0.57 0.00 -3.69 4.38 7.64 -1.26 -5.06 113.62 116.20 1w36 n SER 270 Ca 0.00 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.69 1w36 n SER 270 Cb 0.00 0.00 -0.18 0.00 -1.01 0.00 0.00 64.21 63.02 1w36 n SER 270 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1w36 s ALA 271 N -2.08 0.21 -2.00 -0.43 0.00 -1.26 -4.04 121.76 112.15 1w36 s ALA 271 Ca 0.00 0.21 0.11 0.00 0.00 0.00 0.00 51.96 52.28 1w36 s ALA 271 Cb 0.00 -0.55 0.65 0.00 0.00 0.00 0.00 23.12 23.21 1w36 s ALA 271 CO 0.00 -0.42 1.07 0.91 0.00 0.00 0.00 175.76 177.32 1w36 n TRP 272 N 5.10 0.00 -2.19 0.00 5.03 -1.26 -4.71 117.44 119.40 1w36 n TRP 272 Ca -0.08 0.00 -0.32 0.00 3.03 0.00 0.00 57.50 60.14 1w36 n TRP 272 Cb 0.50 0.00 -0.01 0.00 -1.03 0.00 0.00 31.31 30.77 1w36 n TRP 272 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 1w36 s ALA 273 N -2.00 3.01 -0.29 6.99 0.00 -1.26 -5.05 121.76 123.16 1w36 s ALA 273 Ca 0.16 0.14 -0.00 0.00 0.00 0.00 0.00 51.96 52.27 1w36 s ALA 273 Cb 0.07 -3.13 0.19 0.00 0.00 0.00 0.00 23.12 20.26 1w36 s ALA 273 CO 0.13 -0.46 0.72 -1.83 0.00 0.00 0.00 175.76 174.31 1w36 s GLU 274 N -4.37 0.45 0.95 0.00 -1.05 -1.26 -5.11 118.70 108.30 1w36 s GLU 274 Ca 0.59 0.53 -0.15 0.00 -0.15 0.00 0.00 54.97 55.78 1w36 s GLU 274 Cb -0.11 0.26 -0.08 0.00 -0.44 0.00 0.00 34.13 33.76 1w36 s GLU 274 CO 0.38 -0.76 -0.27 0.39 0.95 0.00 0.00 175.26 175.96 1w36 n GLU 275 N 5.36 -0.09 -1.73 -4.83 -0.58 -1.26 -4.71 120.64 112.80 1w36 n GLU 275 Ca 0.04 -0.01 -0.43 0.00 -0.42 0.00 0.00 57.16 56.34 1w36 n GLU 275 Cb 0.54 -1.35 -0.03 0.00 -0.57 0.00 0.00 31.44 30.03 1w36 n GLU 275 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1w36 s GLU 276 N -2.59 3.34 -0.71 3.49 0.41 -1.26 -4.89 118.70 116.49 1w36 s GLU 276 Ca 0.48 1.94 0.05 0.00 -0.41 0.00 0.00 54.97 57.03 1w36 s GLU 276 Cb -0.21 -4.29 0.24 0.00 -1.78 0.00 0.00 34.13 28.09 1w36 s GLU 276 CO 0.75 -1.86 0.77 0.25 -0.49 0.00 0.00 175.26 174.68 1w36 n THR 277 N 7.33 2.55 -0.07 3.63 -2.24 -1.26 -4.85 114.28 119.37 1w36 n THR 277 Ca 0.26 -5.23 -0.04 0.00 -2.27 0.00 0.00 64.05 56.78 1w36 n THR 277 Cb 0.45 -2.13 -0.02 0.00 -2.10 0.00 0.00 70.33 66.53 1w36 n THR 277 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1w36 h ASN 278 N 4.59 0.00 -0.32 3.42 2.35 -1.99 -3.42 115.58 120.21 1w36 h ASN 278 Ca 0.19 -0.04 0.05 0.00 -0.55 0.00 0.00 56.30 55.95 1w36 h ASN 278 Cb 0.68 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.97 1w36 h ASN 278 CO 0.86 0.72 -0.48 0.77 -1.65 0.00 0.00 177.43 177.65 1w36 h SER 279 N -1.00 -1.57 0.00 5.81 4.64 -1.99 -2.85 113.55 116.59 1w36 h SER 279 Ca -0.02 0.22 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1w36 h SER 279 Cb 0.40 0.65 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1w36 h SER 279 CO -0.01 -0.41 0.00 -1.22 -0.87 0.00 0.00 176.83 174.32 1w36 n TYR 280 N -5.41 0.00 0.00 4.77 4.02 -1.26 -4.46 117.16 114.81 1w36 n TYR 280 Ca -0.03 -0.56 0.00 0.00 -0.01 0.00 0.00 57.90 57.31 1w36 n TYR 280 Cb 0.36 -0.38 0.00 0.00 -0.02 0.00 0.00 39.34 39.29 1w36 n TYR 280 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 1w36 n GLN 281 N 1.66 0.00 0.00 -0.72 6.02 -1.08 -4.99 117.38 118.28 1w36 n GLN 281 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1w36 n GLN 281 Cb 0.28 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.54 1w36 n GLN 281 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1w36 n LEU 282 N 0.00 0.00 0.11 1.08 -0.00 -1.26 -4.45 117.00 112.48 1w36 n LEU 282 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 56.01 55.78 1w36 n LEU 282 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.28 1w36 n LEU 282 CO 0.00 0.00 -0.11 1.55 -0.00 0.00 0.00 177.39 178.83 1w36 h PRO 283 N 0.00 0.60 0.00 1.96 0.13 -1.93 -3.30 132.00 129.46 1w36 h PRO 283 Ca 0.00 -0.86 -0.08 0.00 -0.87 0.00 0.00 66.00 64.19 1w36 h PRO 283 Cb 0.00 0.29 -0.01 0.00 0.13 0.00 0.00 31.00 31.41 1w36 h PRO 283 CO 0.00 1.40 -1.51 -0.85 -0.23 0.00 0.00 178.00 176.81 1w36 n GLU 284 N -3.79 0.63 -0.30 0.86 0.28 -1.26 -3.86 120.64 113.21 1w36 n GLU 284 Ca -0.15 0.06 0.10 0.00 -0.16 0.00 0.00 57.16 57.01 1w36 n GLU 284 Cb 1.01 -1.71 0.23 0.00 1.43 0.00 0.00 31.44 32.40 1w36 n GLU 284 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1w36 h SER 285 N 0.00 -0.33 0.91 -1.84 4.64 -1.79 1.37 113.55 116.52 1w36 h SER 285 Ca -0.10 0.23 -0.20 0.00 -0.47 0.00 0.00 61.79 61.25 1w36 h SER 285 Cb 1.28 0.38 -0.03 0.00 -0.31 0.00 0.00 62.40 63.72 1w36 h SER 285 CO 0.02 -0.23 -0.93 -0.07 -0.87 0.00 0.00 176.83 174.74 1w36 h LEU 286 N 0.09 0.02 0.00 5.97 3.38 -1.71 -3.08 115.31 119.98 1w36 h LEU 286 Ca 0.51 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.46 1w36 h LEU 286 Cb 0.98 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1w36 h LEU 286 CO -0.76 0.93 0.00 -0.62 0.09 0.00 0.00 178.44 178.09 1w36 n GLU 287 N -3.45 0.32 -2.25 1.13 1.02 0.39 -5.13 120.64 112.66 1w36 n GLU 287 Ca -0.01 0.08 -0.01 0.00 -0.02 0.00 0.00 57.16 57.21 1w36 n GLU 287 Cb 0.88 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.84 1w36 n GLU 287 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1w36 n LYS 288 N -1.28 1.02 0.00 3.49 5.02 0.34 -5.04 118.16 121.71 1w36 n LYS 288 Ca 0.10 -2.26 0.00 0.00 -2.02 0.00 0.00 58.31 54.14 1w36 n LYS 288 Cb 0.17 -0.45 0.00 0.00 -0.02 0.00 0.00 35.03 34.72 1w36 n LYS 288 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1w36 n PRO 305 N -0.52 0.00 0.00 1.97 -0.02 -1.26 -4.93 135.00 130.24 1w36 n PRO 305 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 1w36 n PRO 305 Cb 0.88 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.36 1w36 n PRO 305 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1w36 n ARG 306 N 0.00 0.00 -4.46 -0.52 1.74 -1.26 -4.78 116.66 107.38 1w36 n ARG 306 Ca 0.00 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.86 1w36 n ARG 306 Cb 0.00 0.00 -0.11 0.00 -1.02 0.00 0.00 32.46 31.33 1w36 n ARG 306 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1w36 s HIS 307 N -0.41 2.02 0.00 -1.55 3.76 -1.26 -4.89 115.29 112.95 1w36 s HIS 307 Ca 0.00 -0.83 0.00 0.00 -0.15 0.00 0.00 55.06 54.08 1w36 s HIS 307 Cb 0.00 -1.27 0.00 0.00 1.11 0.00 0.00 32.58 32.42 1w36 s HIS 307 CO 0.00 0.16 0.00 -0.35 -0.85 0.00 0.00 174.74 173.70 1w36 n PRO 308 N -0.68 2.68 -2.87 8.40 -0.04 -1.26 -5.07 135.00 136.17 1w36 n PRO 308 Ca -0.04 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.00 1w36 n PRO 308 Cb 0.65 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.13 1w36 n PRO 308 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1w36 n LEU 309 N 0.00 6.79 -2.74 1.53 4.77 -1.26 -4.56 117.00 121.52 1w36 n LEU 309 Ca 0.00 -5.28 -0.10 0.00 -0.03 0.00 0.00 56.01 50.60 1w36 n LEU 309 Cb 0.00 -1.23 0.03 0.00 -2.33 0.00 0.00 43.42 39.89 1w36 n LEU 309 CO 0.00 1.83 -0.05 2.22 -1.33 0.00 0.00 177.39 180.05 1w36 n PHE 310 N 0.81 0.51 1.32 -1.77 -0.00 -1.26 -4.85 117.46 112.23 1w36 n PHE 310 Ca 0.34 -2.82 0.09 0.00 -0.00 0.00 0.00 57.45 55.06 1w36 n PHE 310 Cb 0.30 -0.11 0.34 0.00 -0.00 0.00 0.00 39.48 40.01 1w36 n PHE 310 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 1w36 n GLU 311 N -0.06 1.60 0.05 3.97 1.02 -1.26 -3.40 120.64 122.55 1w36 n GLU 311 Ca 0.10 -0.90 0.13 0.00 -0.02 0.00 0.00 57.16 56.46 1w36 n GLU 311 Cb 0.80 -1.34 0.43 0.00 -0.02 0.00 0.00 31.44 31.31 1w36 n GLU 311 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1w36 n ALA 312 N 0.15 2.53 0.37 0.62 0.00 -1.26 -2.66 120.51 120.25 1w36 n ALA 312 Ca 0.14 -0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.58 1w36 n ALA 312 Cb 0.27 -1.39 0.08 0.00 0.00 0.00 0.00 19.45 18.41 1w36 n ALA 312 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1w36 h ILE 313 N 0.00 0.00 -0.04 0.00 2.04 -1.86 -0.79 117.51 116.86 1w36 h ILE 313 Ca 0.00 -0.71 -0.16 0.00 1.00 0.00 0.00 64.86 64.99 1w36 h ILE 313 Cb 0.63 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1w36 h ILE 313 CO 0.00 0.00 -0.67 0.44 0.00 0.00 0.00 178.15 177.92 1w36 h ASP 314 N 0.00 0.21 0.00 1.72 5.19 -1.72 -3.08 116.42 118.74 1w36 h ASP 314 Ca 0.00 -0.14 -0.00 0.00 -0.62 0.00 0.00 57.03 56.27 1w36 h ASP 314 Cb 0.86 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.30 1w36 h ASP 314 CO 0.00 0.82 -0.00 1.56 -3.12 0.00 0.00 179.24 178.50 1w36 h GLN 315 N 0.13 -0.00 -0.72 3.56 4.20 -1.53 -3.29 115.11 117.46 1w36 h GLN 315 Ca -0.01 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.75 1w36 h GLN 315 Cb 1.20 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.94 1w36 h GLN 315 CO 0.10 0.92 0.47 -0.07 -0.67 0.00 0.00 178.83 179.59 1w36 h LEU 316 N -0.97 0.70 -0.24 1.46 3.38 -1.22 -1.03 115.31 117.39 1w36 h LEU 316 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1w36 h LEU 316 Cb 0.93 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1w36 h LEU 316 CO 0.00 0.46 -0.01 0.18 0.09 0.00 0.00 178.44 179.16 1w36 n LEU 317 N -4.47 0.38 -0.07 1.67 4.77 -1.17 -3.83 117.00 114.29 1w36 n LEU 317 Ca 0.10 -0.10 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 1w36 n LEU 317 Cb 0.19 -0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1w36 n LEU 317 CO 0.34 0.06 -0.04 0.00 -1.33 0.00 0.00 177.39 176.43 1w36 h ALA 318 N 4.02 0.03 -2.73 -1.18 0.00 -1.25 -3.47 119.26 114.69 1w36 h ALA 318 Ca 0.00 -0.38 -0.51 0.00 0.00 0.00 0.00 54.91 54.02 1w36 h ALA 318 Cb 0.16 0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.15 1w36 h ALA 318 CO 0.00 0.19 0.47 -1.83 0.00 0.00 0.00 179.25 178.09 1w36 s GLU 319 N -1.96 4.63 0.20 0.00 -1.05 -1.20 -5.03 118.70 114.28 1w36 s GLU 319 Ca -0.11 1.75 -0.16 0.00 -0.15 0.00 0.00 54.97 56.30 1w36 s GLU 319 Cb 0.00 -3.24 0.19 0.00 -0.44 0.00 0.00 34.13 30.64 1w36 s GLU 319 CO 0.29 0.15 1.63 -1.35 0.95 0.00 0.00 175.26 176.94 1w36 h PRO 320 N 4.49 -0.04 -4.65 -4.83 0.11 -1.90 -3.48 132.00 121.70 1w36 h PRO 320 Ca -0.45 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1w36 h PRO 320 Cb 1.21 0.01 0.02 0.00 0.11 0.00 0.00 31.00 32.35 1w36 h PRO 320 CO 0.70 -0.03 -0.09 1.28 -0.21 0.00 0.00 178.00 179.66 1w36 n LEU 321 N -5.41 -5.21 -3.66 2.35 4.77 -1.26 -5.06 117.00 103.51 1w36 n LEU 321 Ca 0.06 -0.11 -0.10 0.00 -0.03 0.00 0.00 56.01 55.82 1w36 n LEU 321 Cb 0.31 -2.57 -0.04 0.00 -2.33 0.00 0.00 43.42 38.79 1w36 n LEU 321 CO 0.06 -0.66 0.27 -0.55 -1.33 0.00 0.00 177.39 175.19 1w36 s SER 322 N -2.77 -0.31 -0.01 -1.43 0.15 -1.26 -4.96 113.70 103.12 1w36 s SER 322 Ca 0.05 -0.37 0.12 0.00 0.70 0.00 0.00 55.95 56.45 1w36 s SER 322 Cb -0.01 0.56 -0.15 0.00 -1.71 0.00 0.00 66.02 64.72 1w36 s SER 322 CO 0.52 -1.00 0.41 0.00 1.20 0.00 0.00 173.24 174.37 1w36 n ILE 323 N -0.32 0.00 0.00 6.45 0.13 -1.26 -4.83 119.36 119.53 1w36 n ILE 323 Ca -0.12 -0.24 0.00 0.00 -1.10 0.00 0.00 62.75 61.28 1w36 n ILE 323 Cb 0.63 0.73 0.00 0.00 -0.84 0.00 0.00 39.64 40.16 1w36 n ILE 323 CO 0.00 0.00 0.00 -1.14 2.80 0.00 0.00 176.55 178.21 1w36 n ARG 324 N -1.49 0.00 -0.32 9.51 0.63 -1.26 -1.14 116.66 122.59 1w36 n ARG 324 Ca 0.01 0.94 0.09 0.00 -0.92 0.00 0.00 57.85 57.97 1w36 n ARG 324 Cb 0.23 -1.46 0.30 0.00 0.45 0.00 0.00 32.46 31.97 1w36 n ARG 324 CO 0.00 0.00 0.00 0.38 -2.51 0.00 0.00 177.63 175.50 1w36 h ASP 325 N 0.00 0.81 0.60 6.15 2.03 -1.88 0.88 116.42 125.01 1w36 h ASP 325 Ca 0.00 0.04 -0.03 0.00 -0.73 0.00 0.00 57.03 56.31 1w36 h ASP 325 Cb 0.00 -0.12 0.01 0.00 -0.83 0.00 0.00 39.33 38.39 1w36 h ASP 325 CO 0.00 0.43 -0.29 0.25 -1.03 0.00 0.00 179.24 178.60 1w36 h LEU 326 N 0.87 -0.68 -0.55 0.15 7.12 -1.81 -0.40 115.31 120.00 1w36 h LEU 326 Ca 0.47 -0.02 -0.02 0.00 0.13 0.00 0.00 57.88 58.44 1w36 h LEU 326 Cb 0.56 0.18 -0.03 0.00 -0.53 0.00 0.00 40.66 40.85 1w36 h LEU 326 CO -0.23 -0.40 0.28 0.58 -0.13 0.00 0.00 178.44 178.53 1w36 h VAL 327 N -0.95 1.20 0.50 1.05 2.07 -0.71 -2.37 116.25 117.03 1w36 h VAL 327 Ca -0.08 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.88 1w36 h VAL 327 Cb 0.66 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1w36 h VAL 327 CO 0.14 0.22 -0.35 0.40 0.02 0.00 0.00 177.57 178.00 1w36 h ILE 328 N 0.74 0.29 -0.75 4.57 2.04 -0.85 -0.50 117.51 123.06 1w36 h ILE 328 Ca 0.19 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.22 1w36 h ILE 328 Cb 0.10 0.29 -0.13 0.00 -0.74 0.00 0.00 36.82 36.34 1w36 h ILE 328 CO -0.03 0.00 0.00 0.74 0.00 0.00 0.00 178.15 178.87 1w36 h THR 329 N -0.82 0.35 0.13 -0.27 2.02 -1.01 -0.30 112.91 113.01 1w36 h THR 329 Ca -0.05 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 1w36 h THR 329 Cb 0.68 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1w36 h THR 329 CO 0.03 0.02 -0.06 0.03 0.37 0.00 0.00 175.52 175.91 1w36 h ARG 330 N 0.10 -0.16 -0.22 6.66 -0.00 -1.23 -2.71 114.38 116.82 1w36 h ARG 330 Ca 0.41 0.01 0.06 0.00 -0.50 0.00 0.00 59.98 59.96 1w36 h ARG 330 Cb 0.71 0.04 -0.07 0.00 0.00 0.00 0.00 29.97 30.65 1w36 h ARG 330 CO -0.66 -0.10 -0.24 0.00 0.00 0.00 0.00 179.97 178.98 1w36 h ALA 331 N 0.69 -0.14 0.00 0.04 0.00 0.61 -1.02 119.26 119.45 1w36 h ALA 331 Ca -0.02 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1w36 h ALA 331 Cb 0.14 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1w36 h ALA 331 CO 0.03 -0.67 -0.54 1.37 0.00 0.00 0.00 179.25 179.44 1w36 h LEU 332 N -0.25 0.00 0.46 0.00 -0.00 -1.34 1.41 115.31 115.58 1w36 h LEU 332 Ca 0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.99 1w36 h LEU 332 Cb 0.45 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.11 1w36 h LEU 332 CO -0.37 0.54 -0.26 0.00 -0.00 0.00 0.00 178.44 178.36 1w36 h ALA 333 N 1.46 -0.67 -0.23 0.17 0.00 -1.07 -2.08 119.26 116.84 1w36 h ALA 333 Ca -0.01 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.61 1w36 h ALA 333 Cb 0.98 0.30 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1w36 h ALA 333 CO 0.07 -0.88 -0.45 1.49 0.00 0.00 0.00 179.25 179.47 1w36 h GLU 334 N -0.67 0.71 0.00 0.00 4.81 -0.96 -3.00 114.58 115.47 1w36 h GLU 334 Ca -0.06 -0.46 -0.04 0.00 -0.13 0.00 0.00 59.36 58.67 1w36 h GLU 334 Cb 0.54 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1w36 h GLU 334 CO 0.08 1.08 -0.20 0.82 -0.73 0.00 0.00 179.01 180.06 1w36 h ILE 335 N 0.43 1.04 -0.09 2.32 2.04 0.19 -0.12 117.51 123.32 1w36 h ILE 335 Ca 0.01 -0.71 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 1w36 h ILE 335 Cb 1.06 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 38.53 1w36 h ILE 335 CO 0.10 0.20 -0.06 0.03 0.00 0.00 0.00 178.15 178.42 1w36 h ARG 336 N 0.00 0.20 0.00 2.37 3.08 -1.32 -2.91 114.38 115.81 1w36 h ARG 336 Ca -0.00 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 59.91 1w36 h ARG 336 Cb 0.38 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1w36 h ARG 336 CO 0.03 0.58 -0.20 1.05 -1.07 0.00 0.00 179.97 180.36 1w36 h GLU 337 N -0.18 0.00 -0.52 0.04 4.11 -1.32 -0.85 114.58 115.86 1w36 h GLU 337 Ca 0.02 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.32 1w36 h GLU 337 Cb 0.53 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1w36 h GLU 337 CO 0.02 0.20 -0.16 1.15 0.07 0.00 0.00 179.01 180.28 1w36 h THR 338 N 0.00 1.27 -0.10 -1.06 2.02 -0.98 0.14 112.91 114.20 1w36 h THR 338 Ca -0.00 -1.33 -0.01 0.00 0.77 0.00 0.00 66.41 65.84 1w36 h THR 338 Cb 0.61 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1w36 h THR 338 CO 0.03 0.47 0.01 0.58 0.37 0.00 0.00 175.52 176.97 1w36 h VAL 339 N 0.89 1.23 0.02 3.16 2.07 -1.28 -2.03 116.25 120.31 1w36 h VAL 339 Ca 0.13 -0.72 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 1w36 h VAL 339 Cb 0.74 1.52 -0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1w36 h VAL 339 CO 0.06 0.21 -0.02 0.00 0.02 0.00 0.00 177.57 177.84 1w36 h ALA 340 N 0.77 -0.79 -0.97 1.67 0.00 -1.02 -0.30 119.26 118.62 1w36 h ALA 340 Ca 0.03 -0.01 0.30 0.00 0.00 0.00 0.00 54.91 55.23 1w36 h ALA 340 Cb 0.31 0.25 -0.18 0.00 0.00 0.00 0.00 17.79 18.17 1w36 h ALA 340 CO 0.00 -0.79 0.17 0.00 0.00 0.00 0.00 179.25 178.64 1w36 h ARG 341 N -0.04 0.04 0.04 0.00 3.08 -0.76 0.21 114.38 116.95 1w36 h ARG 341 Ca -0.00 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1w36 h ARG 341 Cb 0.03 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1w36 h ARG 341 CO -0.00 0.03 -0.02 1.49 -1.07 0.00 0.00 179.97 180.40 1w36 h GLU 342 N 0.04 -0.05 -1.00 0.04 4.57 -1.12 -0.87 114.58 116.19 1w36 h GLU 342 Ca 0.65 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.92 1w36 h GLU 342 Cb 1.44 0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 29.96 1w36 h GLU 342 CO -0.85 0.08 0.64 0.87 -1.18 0.00 0.00 179.01 178.57 1w36 h LYS 343 N -0.17 1.07 0.56 1.92 1.57 0.12 0.80 116.57 122.43 1w36 h LYS 343 Ca -0.01 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1w36 h LYS 343 Cb 0.15 -0.24 0.01 0.00 0.08 0.00 0.00 32.23 32.23 1w36 h LYS 343 CO 0.01 0.71 -0.27 0.00 -0.57 0.00 0.00 179.45 179.33 1w36 h ARG 344 N 1.10 -0.72 -1.00 3.15 3.08 -0.87 0.94 114.38 120.06 1w36 h ARG 344 Ca 0.45 0.05 0.35 0.00 0.07 0.00 0.00 59.98 60.90 1w36 h ARG 344 Cb 0.28 0.16 -0.16 0.00 0.08 0.00 0.00 29.97 30.34 1w36 h ARG 344 CO -0.21 -0.48 0.56 -0.09 -1.07 0.00 0.00 179.97 178.68 1w36 h ARG 345 N -0.77 0.24 0.00 0.04 2.43 -0.52 1.21 114.38 117.01 1w36 h ARG 345 Ca -0.08 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1w36 h ARG 345 Cb 0.57 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1w36 h ARG 345 CO 0.13 0.16 -0.11 0.00 -1.51 0.00 0.00 179.97 178.63 1w36 h ARG 346 N 0.24 0.00 -1.09 0.20 3.08 -0.73 -3.47 114.38 112.61 1w36 h ARG 346 Ca 0.76 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.81 1w36 h ARG 346 Cb 1.82 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.87 1w36 h ARG 346 CO -0.65 0.11 0.00 0.41 -1.07 0.00 0.00 179.97 178.77 1w36 n GLY 347 N 0.71 0.74 3.62 0.04 0.00 0.41 -4.98 105.19 105.74 1w36 n GLY 347 Ca 0.02 -0.44 -0.28 0.00 0.00 0.00 0.00 46.02 45.32 1w36 n GLY 347 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w36 s GLU 348 N -3.30 1.99 -0.14 1.61 2.02 0.24 -2.71 118.70 118.40 1w36 s GLU 348 Ca 0.00 -2.20 -0.09 0.00 0.02 0.00 0.00 54.97 52.70 1w36 s GLU 348 Cb 0.00 -1.24 0.05 0.00 0.10 0.00 0.00 34.13 33.04 1w36 s GLU 348 CO 0.00 -0.29 0.34 -1.17 0.02 0.00 0.00 175.26 174.16 1w36 s LEU 349 N -3.71 0.29 0.00 1.80 2.96 -0.87 -4.59 118.68 114.56 1w36 s LEU 349 Ca 0.22 0.72 0.05 0.00 -0.22 0.00 0.00 54.13 54.89 1w36 s LEU 349 Cb 0.05 1.11 0.05 0.00 0.50 0.00 0.00 46.19 47.90 1w36 s LEU 349 CO 0.11 -0.16 0.38 0.61 -1.32 0.00 0.00 176.35 175.97 1w36 n GLY 350 N 3.84 2.19 0.18 7.98 0.00 -1.26 0.22 105.19 118.34 1w36 n GLY 350 Ca -0.21 -2.20 -0.20 0.00 0.00 0.00 0.00 46.02 43.42 1w36 n GLY 350 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1w36 h PHE 351 N 0.19 0.91 0.00 1.61 0.05 -1.95 -3.02 116.94 114.73 1w36 h PHE 351 Ca -0.16 -0.50 -0.02 0.00 3.82 0.00 0.00 57.97 61.11 1w36 h PHE 351 Cb 0.68 -0.10 -0.00 0.00 2.00 0.00 0.00 35.95 38.53 1w36 h PHE 351 CO 0.00 1.33 -0.09 -0.44 -0.18 0.00 0.00 178.31 178.93 1w36 h ASP 352 N 0.23 0.00 -0.33 2.17 3.45 -1.99 -2.07 116.42 117.87 1w36 h ASP 352 Ca -0.12 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 57.18 1w36 h ASP 352 Cb 1.59 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.36 1w36 h ASP 352 CO 0.18 0.09 -0.42 0.44 -1.57 0.00 0.00 179.24 177.96 1w36 h ASP 353 N 0.00 0.95 -0.11 6.45 3.32 -1.95 -0.57 116.42 124.51 1w36 h ASP 353 Ca -0.00 -0.49 0.04 0.00 0.02 0.00 0.00 57.03 56.60 1w36 h ASP 353 Cb 0.23 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 39.45 1w36 h ASP 353 CO 0.01 1.25 -0.33 -0.03 -1.72 0.00 0.00 179.24 178.43 1w36 h MET 354 N 0.67 -0.40 0.00 3.56 4.05 -1.24 0.42 114.93 121.99 1w36 h MET 354 Ca 0.04 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.49 1w36 h MET 354 Cb 1.02 0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.91 1w36 h MET 354 CO 0.10 -0.27 -0.26 1.47 0.23 0.00 0.00 176.91 178.18 1w36 n LEU 355 N -5.41 0.52 0.08 3.39 -0.00 -1.21 -2.77 117.00 111.60 1w36 n LEU 355 Ca -0.03 0.36 -0.09 0.00 -0.00 0.00 0.00 56.01 56.24 1w36 n LEU 355 Cb 0.33 -0.31 -0.06 0.00 -0.00 0.00 0.00 43.42 43.38 1w36 n LEU 355 CO 0.16 -0.05 0.29 -1.28 -0.00 0.00 0.00 177.39 176.51 1w36 h SER 356 N 0.00 -0.24 -0.21 1.45 0.87 -0.26 -2.70 113.55 112.46 1w36 h SER 356 Ca 0.00 -0.22 0.06 0.00 -1.23 0.00 0.00 61.79 60.40 1w36 h SER 356 Cb 0.64 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 1w36 h SER 356 CO 0.00 0.29 0.19 0.03 -0.53 0.00 0.00 176.83 176.81 1w36 h ARG 357 N -0.97 0.00 -0.06 2.24 2.47 -0.26 0.59 114.38 118.40 1w36 h ARG 357 Ca -0.03 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.56 1w36 h ARG 357 Cb 0.45 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.75 1w36 h ARG 357 CO 0.05 0.00 -0.57 1.25 0.56 0.00 0.00 179.97 181.26 1w36 h LEU 358 N 0.00 0.19 0.31 3.04 6.46 -1.49 -2.37 115.31 121.46 1w36 h LEU 358 Ca 0.10 -0.11 -0.02 0.00 -0.12 0.00 0.00 57.88 57.74 1w36 h LEU 358 Cb 0.48 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.36 1w36 h LEU 358 CO -0.00 0.72 -0.15 -0.78 -0.62 0.00 0.00 178.44 177.61 1w36 h ASP 359 N 0.13 -0.35 -0.95 1.25 3.58 0.49 -2.18 116.42 118.39 1w36 h ASP 359 Ca -0.00 -0.18 0.21 0.00 0.42 0.00 0.00 57.03 57.48 1w36 h ASP 359 Cb 1.05 0.09 -0.08 0.00 1.72 0.00 0.00 39.33 42.11 1w36 h ASP 359 CO 0.08 0.04 0.62 0.28 -2.88 0.00 0.00 179.24 177.38 1w36 h SER 360 N -0.80 0.46 -0.29 2.28 0.02 -1.31 -0.85 113.55 113.05 1w36 h SER 360 Ca -0.04 0.06 -0.12 0.00 -0.84 0.00 0.00 61.79 60.85 1w36 h SER 360 Cb 0.51 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.01 1w36 h SER 360 CO 0.07 0.16 -0.23 0.00 -1.14 0.00 0.00 176.83 175.69 1w36 h ALA 361 N 1.61 0.86 0.00 3.77 0.00 -1.26 0.42 119.26 124.66 1w36 h ALA 361 Ca 0.51 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1w36 h ALA 361 Cb 1.21 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1w36 h ALA 361 CO -0.22 0.63 0.00 1.28 0.00 0.00 0.00 179.25 180.94 1w36 n LEU 362 N -4.11 0.00 -0.03 0.00 4.77 -0.36 -3.31 117.00 113.97 1w36 n LEU 362 Ca 0.00 0.35 0.03 0.00 -0.03 0.00 0.00 56.01 56.37 1w36 n LEU 362 Cb 0.44 -0.35 -0.13 0.00 -2.33 0.00 0.00 43.42 41.05 1w36 n LEU 362 CO 0.45 -0.03 -0.80 0.54 -1.33 0.00 0.00 177.39 176.22 1w36 n ARG 363 N -1.35 0.81 -0.58 3.23 1.74 -0.99 -4.65 116.66 114.86 1w36 n ARG 363 Ca 0.11 -0.11 -0.28 0.00 -0.77 0.00 0.00 57.85 56.80 1w36 n ARG 363 Cb 0.25 -1.40 0.25 0.00 -1.02 0.00 0.00 32.46 30.54 1w36 n ARG 363 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1w36 s SER 364 N -4.25 0.97 0.22 0.55 1.04 0.10 -4.82 113.70 107.52 1w36 s SER 364 Ca -0.07 1.47 -0.07 0.00 0.48 0.00 0.00 55.95 57.76 1w36 s SER 364 Cb 0.09 -2.26 0.18 0.00 0.10 0.00 0.00 66.02 64.14 1w36 s SER 364 CO 0.68 -4.20 1.77 -0.33 0.98 0.00 0.00 173.24 172.14 1w36 h GLU 365 N -2.62 1.13 -1.53 4.02 5.08 -1.91 -1.29 114.58 117.46 1w36 h GLU 365 Ca -0.62 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 57.51 1w36 h GLU 365 Cb 1.34 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1w36 h GLU 365 CO 0.51 0.95 0.00 -1.13 -1.00 0.00 0.00 179.01 178.34 1w36 n SER 366 N -4.26 1.27 0.01 1.42 3.41 -1.26 -3.72 113.62 110.49 1w36 n SER 366 Ca 0.06 -0.86 0.11 0.00 -0.26 0.00 0.00 58.87 57.92 1w36 n SER 366 Cb 0.22 -0.22 0.12 0.00 -0.26 0.00 0.00 64.21 64.08 1w36 n SER 366 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1w36 n GLY 367 N 0.77 -1.22 0.11 5.00 0.00 -0.49 -3.98 105.19 105.38 1w36 n GLY 367 Ca 0.00 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.47 1w36 n GLY 367 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1w36 h GLU 368 N 0.00 0.20 -0.71 1.61 4.39 -1.83 -2.37 114.58 115.87 1w36 h GLU 368 Ca 0.00 -0.34 0.04 0.00 0.34 0.00 0.00 59.36 59.40 1w36 h GLU 368 Cb 0.59 0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 29.32 1w36 h GLU 368 CO 0.00 1.01 0.43 0.28 -1.16 0.00 0.00 179.01 179.57 1w36 h VAL 369 N 0.05 1.05 0.02 3.13 2.07 -1.87 -1.39 116.25 119.31 1w36 h VAL 369 Ca -0.28 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1w36 h VAL 369 Cb 2.01 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1w36 h VAL 369 CO 0.13 0.15 -0.01 0.25 0.02 0.00 0.00 177.57 178.11 1w36 h LEU 370 N 0.82 -0.02 -0.02 2.57 5.85 -1.69 0.52 115.31 123.35 1w36 h LEU 370 Ca 0.30 -0.39 0.02 0.00 0.84 0.00 0.00 57.88 58.65 1w36 h LEU 370 Cb 0.08 0.01 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 1w36 h LEU 370 CO -0.14 0.38 -0.53 0.00 -0.34 0.00 0.00 178.44 177.82 1w36 h ALA 371 N 0.54 -0.93 -0.61 1.25 0.00 -1.25 -1.16 119.26 117.10 1w36 h ALA 371 Ca -0.00 -0.08 0.13 0.00 0.00 0.00 0.00 54.91 54.95 1w36 h ALA 371 Cb 0.41 0.95 -0.11 0.00 0.00 0.00 0.00 17.79 19.04 1w36 h ALA 371 CO 0.00 -1.10 -0.03 0.00 0.00 0.00 0.00 179.25 178.12 1w36 h ALA 372 N -0.38 0.57 -0.06 0.00 0.00 -1.29 0.31 119.26 118.41 1w36 h ALA 372 Ca 0.02 0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1w36 h ALA 372 Cb 0.72 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1w36 h ALA 372 CO -0.37 -0.40 -0.15 0.00 0.00 0.00 0.00 179.25 178.33 1w36 h ALA 373 N 1.57 -0.53 -0.16 0.00 0.00 -0.09 -1.56 119.26 118.50 1w36 h ALA 373 Ca 0.32 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.26 1w36 h ALA 373 Cb 0.51 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.96 1w36 h ALA 373 CO -0.55 -0.58 -0.35 0.82 0.00 0.00 0.00 179.25 178.59 1w36 h ILE 374 N -0.15 0.24 -1.14 0.00 2.04 -0.45 -1.46 117.51 116.59 1w36 h ILE 374 Ca 0.01 0.00 0.32 0.00 1.00 0.00 0.00 64.86 66.20 1w36 h ILE 374 Cb 0.18 0.24 -0.06 0.00 -0.74 0.00 0.00 36.82 36.44 1w36 h ILE 374 CO -0.13 0.00 0.80 -0.09 0.00 0.00 0.00 178.15 178.73 1w36 h ARG 375 N -0.41 0.09 -0.03 2.37 2.43 -0.21 0.00 114.38 118.63 1w36 h ARG 375 Ca 0.10 -0.01 -0.20 0.00 -0.81 0.00 0.00 59.98 59.07 1w36 h ARG 375 Cb 0.57 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1w36 h ARG 375 CO -0.38 0.06 -0.74 1.15 -1.51 0.00 0.00 179.97 178.54 1w36 h THR 376 N 0.10 1.35 -0.13 0.20 2.02 -0.23 -3.02 112.91 113.20 1w36 h THR 376 Ca 0.57 -2.08 -0.01 0.00 0.77 0.00 0.00 66.41 65.66 1w36 h THR 376 Cb 2.06 2.40 -0.01 0.00 -1.74 0.00 0.00 68.15 70.87 1w36 h THR 376 CO -0.09 0.63 0.04 -0.09 0.37 0.00 0.00 175.52 176.37 1w36 h ARG 377 N 0.16 0.20 -3.29 6.66 1.12 -0.91 -3.37 114.38 114.95 1w36 h ARG 377 Ca -0.08 -0.05 -0.64 0.00 -1.11 0.00 0.00 59.98 58.10 1w36 h ARG 377 Cb 1.42 -0.03 -0.41 0.00 -0.01 0.00 0.00 29.97 30.94 1w36 h ARG 377 CO 0.15 0.36 -0.56 -0.06 -3.11 0.00 0.00 179.97 176.74 1w36 s PHE 378 N -5.34 3.37 0.28 2.20 0.08 -0.16 -4.49 117.98 113.93 1w36 s PHE 378 Ca -0.14 -3.20 -0.01 0.00 0.12 0.00 0.00 56.93 53.71 1w36 s PHE 378 Cb 0.06 -2.83 0.41 0.00 -0.57 0.00 0.00 43.02 40.09 1w36 s PHE 378 CO 0.70 -0.68 1.83 -1.00 -0.10 0.00 0.00 175.22 175.97 1w36 h PRO 379 N 6.12 0.81 -5.58 0.24 0.13 -1.66 -3.42 132.00 128.64 1w36 h PRO 379 Ca 0.02 -0.16 -0.51 0.00 -0.87 0.00 0.00 66.00 64.47 1w36 h PRO 379 Cb 0.84 -0.12 -0.28 0.00 0.13 0.00 0.00 31.00 31.58 1w36 h PRO 379 CO 0.71 0.73 -0.82 0.54 -0.23 0.00 0.00 178.00 178.93 1w36 s VAL 380 N -5.19 1.31 -0.01 1.56 0.11 -1.26 -1.84 120.40 115.09 1w36 s VAL 380 Ca -0.10 -0.85 0.00 0.00 -2.93 0.00 0.00 61.98 58.11 1w36 s VAL 380 Cb 0.15 -1.12 0.00 0.00 -1.53 0.00 0.00 36.38 33.89 1w36 s VAL 380 CO 0.80 0.25 -0.01 0.00 -3.33 0.00 0.00 175.10 172.81 1w36 s ALA 381 N -0.56 0.14 -0.26 1.54 0.00 -0.89 -2.56 121.76 119.17 1w36 s ALA 381 Ca 0.05 -0.01 -0.07 0.00 0.00 0.00 0.00 51.96 51.93 1w36 s ALA 381 Cb -0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 1w36 s ALA 381 CO 0.00 0.01 0.06 -1.64 0.00 0.00 0.00 175.76 174.20 1w36 s MET 382 N 0.14 3.49 -0.22 0.00 -1.94 0.14 -1.29 119.30 119.62 1w36 s MET 382 Ca -0.01 -0.59 -0.07 0.00 -1.71 0.00 0.00 55.69 53.31 1w36 s MET 382 Cb -0.03 -3.31 -0.03 0.00 2.01 0.00 0.00 34.83 33.47 1w36 s MET 382 CO -0.00 -0.26 0.05 0.42 -0.01 0.00 0.00 175.02 175.22 1w36 s ILE 383 N 1.58 4.38 0.17 2.53 -1.09 -0.04 -1.66 121.20 127.07 1w36 s ILE 383 Ca 0.05 -0.16 0.06 0.00 -2.23 0.00 0.00 60.65 58.37 1w36 s ILE 383 Cb -0.16 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.67 1w36 s ILE 383 CO 0.03 0.39 0.08 -0.62 -1.23 0.00 0.00 174.94 173.59 1w36 s ASP 384 N 1.11 5.22 -1.33 3.58 -1.08 -0.60 -1.24 116.67 122.33 1w36 s ASP 384 Ca 0.04 -0.24 0.00 0.00 -0.52 0.00 0.00 52.55 51.83 1w36 s ASP 384 Cb -0.14 -1.27 0.00 0.00 -1.46 0.00 0.00 42.92 40.05 1w36 s ASP 384 CO 0.03 0.07 0.00 -0.62 0.52 0.00 0.00 175.17 175.17 1w36 n GLU 385 N -0.28 -1.22 0.25 4.34 -0.58 -0.98 -4.58 120.64 117.58 1w36 n GLU 385 Ca -0.09 0.76 0.15 0.00 -0.42 0.00 0.00 57.16 57.57 1w36 n GLU 385 Cb 0.55 -5.10 0.80 0.00 -0.57 0.00 0.00 31.44 27.11 1w36 n GLU 385 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1w36 h PHE 386 N 0.00 0.00 0.00 -0.32 3.57 -1.53 -0.98 116.94 117.68 1w36 h PHE 386 Ca -0.36 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.14 1w36 h PHE 386 Cb 1.25 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.99 1w36 h PHE 386 CO 0.41 0.00 0.00 -0.56 -2.23 0.00 0.00 178.31 175.93 1w36 h GLN 387 N 0.00 0.00 -0.60 1.11 -0.00 -1.85 -2.74 115.11 111.03 1w36 h GLN 387 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 58.57 1w36 h GLN 387 Cb 0.19 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 27.62 1w36 h GLN 387 CO 0.00 0.00 0.10 -0.25 -0.00 0.00 0.00 178.83 178.68 1w36 n ASP 388 N -2.52 5.18 -2.38 0.06 8.00 -0.37 -4.66 116.55 119.86 1w36 n ASP 388 Ca 0.01 -3.07 0.00 0.00 0.71 0.00 0.00 54.79 52.44 1w36 n ASP 388 Cb 0.21 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.61 1w36 n ASP 388 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1w36 n THR 389 N 0.18 0.00 -3.62 -3.53 -2.24 -1.04 -4.55 114.28 99.48 1w36 n THR 389 Ca 0.32 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 62.00 1w36 n THR 389 Cb 1.24 -1.46 -0.04 0.00 -2.10 0.00 0.00 70.33 67.98 1w36 n THR 389 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1w36 s ASP 390 N -1.27 -0.33 0.25 3.42 -4.77 -1.26 -1.18 116.67 111.53 1w36 s ASP 390 Ca 0.00 -0.30 -0.12 0.00 -3.30 0.00 0.00 52.55 48.83 1w36 s ASP 390 Cb 0.00 0.55 0.35 0.00 -1.09 0.00 0.00 42.92 42.73 1w36 s ASP 390 CO 0.00 -0.96 1.52 -0.81 0.70 0.00 0.00 175.17 175.62 1w36 n PRO 391 N -0.31 -0.15 -0.25 2.11 -0.04 -1.26 -1.70 135.00 133.41 1w36 n PRO 391 Ca -0.14 1.52 0.04 0.00 -0.04 0.00 0.00 63.50 64.88 1w36 n PRO 391 Cb 0.64 -2.26 0.17 0.00 -0.04 0.00 0.00 33.50 32.01 1w36 n PRO 391 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1w36 h GLN 392 N 0.00 0.42 -0.14 0.54 4.20 -1.97 0.52 115.11 118.67 1w36 h GLN 392 Ca 0.41 -0.03 -0.09 0.00 0.06 0.00 0.00 58.65 59.00 1w36 h GLN 392 Cb 0.66 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1w36 h GLN 392 CO -0.99 0.28 -0.27 1.96 -0.67 0.00 0.00 178.83 179.14 1w36 h GLN 393 N 0.43 0.44 -0.57 1.46 4.20 -1.67 -2.73 115.11 116.67 1w36 h GLN 393 Ca 0.39 -0.28 -0.03 0.00 0.06 0.00 0.00 58.65 58.80 1w36 h GLN 393 Cb 0.58 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.37 1w36 h GLN 393 CO -0.39 0.88 0.26 -0.92 -0.67 0.00 0.00 178.83 177.98 1w36 h TYR 394 N 0.05 0.84 -0.68 2.96 3.20 -1.01 0.85 116.97 123.18 1w36 h TYR 394 Ca 0.01 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.84 1w36 h TYR 394 Cb 0.86 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.83 1w36 h TYR 394 CO 0.10 0.66 0.44 -0.09 -1.64 0.00 0.00 178.16 177.64 1w36 h ARG 395 N 0.78 0.87 -0.03 1.82 2.43 -0.94 0.88 114.38 120.19 1w36 h ARG 395 Ca 0.19 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1w36 h ARG 395 Cb 0.15 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1w36 h ARG 395 CO -0.02 0.58 -0.04 0.82 -1.51 0.00 0.00 179.97 179.79 1w36 h ILE 396 N 0.90 0.87 -0.71 1.20 2.04 -1.07 -1.93 117.51 118.81 1w36 h ILE 396 Ca 0.26 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.07 1w36 h ILE 396 Cb -0.07 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 1w36 h ILE 396 CO -0.07 0.00 0.24 -0.26 0.00 0.00 0.00 178.15 178.06 1w36 h PHE 397 N -0.06 1.10 0.02 1.37 0.05 0.13 -2.85 116.94 116.69 1w36 h PHE 397 Ca 0.03 -0.09 -0.09 0.00 3.82 0.00 0.00 57.97 61.64 1w36 h PHE 397 Cb 0.11 -0.33 0.01 0.00 2.00 0.00 0.00 35.95 37.74 1w36 h PHE 397 CO -0.13 0.86 -0.37 0.07 -0.18 0.00 0.00 178.31 178.55 1w36 h ARG 398 N 1.04 0.21 -1.03 1.51 0.11 -0.75 -0.83 114.38 114.65 1w36 h ARG 398 Ca 0.23 -0.26 0.39 0.00 0.10 0.00 0.00 59.98 60.44 1w36 h ARG 398 Cb 0.26 0.08 -0.17 0.00 1.11 0.00 0.00 29.97 31.25 1w36 h ARG 398 CO -0.01 1.02 0.57 -0.09 0.10 0.00 0.00 179.97 181.56 1w36 h ARG 399 N -0.47 0.10 0.09 0.08 9.65 -1.36 0.76 114.38 123.23 1w36 h ARG 399 Ca -0.05 -0.01 -0.33 0.00 -1.10 0.00 0.00 59.98 58.49 1w36 h ARG 399 Cb 1.16 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.70 1w36 h ARG 399 CO 0.07 0.07 -1.82 0.82 2.80 0.00 0.00 179.97 181.90 1w36 h ILE 400 N 0.10 0.79 0.00 1.20 2.04 -1.47 -3.43 117.51 116.74 1w36 h ILE 400 Ca 0.81 -2.53 -0.03 0.00 1.00 0.00 0.00 64.86 64.12 1w36 h ILE 400 Cb 2.11 2.53 -0.00 0.00 -0.74 0.00 0.00 36.82 40.71 1w36 h ILE 400 CO -0.70 0.76 -1.28 0.79 0.00 0.00 0.00 178.15 177.73 1w36 n TRP 401 N -3.35 0.00 -1.68 1.37 8.01 -0.31 -4.75 117.44 116.73 1w36 n TRP 401 Ca -0.25 0.00 -0.43 0.00 -1.31 0.00 0.00 57.50 55.51 1w36 n TRP 401 Cb 1.05 -0.16 -0.01 0.00 -2.01 0.00 0.00 31.31 30.18 1w36 n TRP 401 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.69 178.26 1w36 n HIS 402 N -1.83 2.15 -3.86 -5.99 -0.00 0.25 -3.14 115.22 102.79 1w36 n HIS 402 Ca -0.03 0.55 -0.32 0.00 0.46 0.00 0.00 57.72 58.38 1w36 n HIS 402 Cb 0.29 -2.40 0.01 0.00 -0.12 0.00 0.00 29.99 27.77 1w36 n HIS 402 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 1w36 n HIS 403 N 0.56 -1.27 -3.67 1.57 8.25 -1.26 -4.93 115.22 114.46 1w36 n HIS 403 Ca 0.06 0.25 -0.27 0.00 -0.26 0.00 0.00 57.72 57.50 1w36 n HIS 403 Cb 0.35 -2.20 -0.16 0.00 1.12 0.00 0.00 29.99 29.09 1w36 n HIS 403 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1w36 s GLN 404 N -6.13 0.40 1.08 -0.41 2.00 -1.19 -5.13 119.66 110.27 1w36 s GLN 404 Ca 0.26 -0.34 -0.12 0.00 -2.00 0.00 0.00 55.36 53.16 1w36 s GLN 404 Cb -0.15 -1.92 0.23 0.00 0.80 0.00 0.00 33.01 31.98 1w36 s GLN 404 CO 0.76 -0.70 1.07 -2.14 -0.50 0.00 0.00 175.29 173.78 1w36 s PRO 405 N 1.97 -0.23 -0.12 1.67 0.02 -1.26 -3.10 135.00 133.96 1w36 s PRO 405 Ca 0.02 1.05 0.00 0.00 0.02 0.00 0.00 61.00 62.08 1w36 s PRO 405 Cb -0.17 -1.62 0.00 0.00 0.02 0.00 0.00 34.50 32.74 1w36 s PRO 405 CO -0.12 -3.32 0.00 0.39 -0.33 0.00 0.00 177.00 173.62 1w36 n GLU 406 N -4.66 -1.19 -4.23 5.54 -0.58 -1.26 -4.96 120.64 109.30 1w36 n GLU 406 Ca 0.06 0.36 -0.13 0.00 -0.42 0.00 0.00 57.16 57.03 1w36 n GLU 406 Cb 0.54 -4.29 -0.10 0.00 -0.57 0.00 0.00 31.44 27.02 1w36 n GLU 406 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1w36 s THR 407 N -1.48 0.34 -0.04 2.62 -4.23 -1.18 -4.84 115.64 106.83 1w36 s THR 407 Ca 0.00 -1.97 -0.05 0.00 -1.18 0.00 0.00 61.69 58.49 1w36 s THR 407 Cb 0.00 -2.33 0.01 0.00 1.34 0.00 0.00 72.50 71.53 1w36 s THR 407 CO 0.00 -0.24 0.14 0.00 -0.54 0.00 0.00 174.62 173.98 1w36 s ALA 408 N -3.90 -0.33 -0.36 3.99 0.00 -0.76 0.47 121.76 120.86 1w36 s ALA 408 Ca 0.31 0.31 0.01 0.00 0.00 0.00 0.00 51.96 52.60 1w36 s ALA 408 Cb 0.07 -0.18 0.11 0.00 0.00 0.00 0.00 23.12 23.12 1w36 s ALA 408 CO 0.08 -0.08 0.13 -1.17 0.00 0.00 0.00 175.76 174.71 1w36 s LEU 409 N -0.11 3.11 -0.38 0.00 2.96 -1.26 -2.09 118.68 120.90 1w36 s LEU 409 Ca -0.02 -2.08 -0.22 0.00 -0.22 0.00 0.00 54.13 51.59 1w36 s LEU 409 Cb -0.02 -1.14 0.01 0.00 0.50 0.00 0.00 46.19 45.54 1w36 s LEU 409 CO 0.00 -0.36 0.74 -0.76 -1.32 0.00 0.00 176.35 174.66 1w36 s LEU 410 N 1.03 4.20 -0.27 -0.68 1.43 -0.41 -1.40 118.68 122.58 1w36 s LEU 410 Ca 0.12 0.18 -0.08 0.00 -1.03 0.00 0.00 54.13 53.33 1w36 s LEU 410 Cb -0.20 -2.94 -0.02 0.00 0.03 0.00 0.00 46.19 43.06 1w36 s LEU 410 CO -0.13 -0.74 0.10 -0.76 0.23 0.00 0.00 176.35 175.05 1w36 s LEU 411 N 3.04 3.71 0.07 1.79 1.43 0.32 -0.86 118.68 128.17 1w36 s LEU 411 Ca 0.29 -0.34 0.08 0.00 -1.03 0.00 0.00 54.13 53.13 1w36 s LEU 411 Cb -0.13 -1.95 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 1w36 s LEU 411 CO 0.18 -0.10 -0.23 -0.51 0.23 0.00 0.00 176.35 175.92 1w36 s ILE 412 N 1.61 1.87 -3.82 -0.59 2.07 -0.37 0.15 121.20 122.12 1w36 s ILE 412 Ca 0.05 -1.39 0.00 0.00 -1.41 0.00 0.00 60.65 57.91 1w36 s ILE 412 Cb -0.16 -1.64 0.00 0.00 0.13 0.00 0.00 42.46 40.79 1w36 s ILE 412 CO 0.05 0.18 0.00 0.61 -1.91 0.00 0.00 174.94 173.86 1w36 n GLY 413 N 1.55 -0.71 2.94 1.50 0.00 -0.62 -1.69 105.19 108.17 1w36 n GLY 413 Ca -0.18 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.69 1w36 n GLY 413 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1w36 s ASP 414 N -4.00 0.52 0.56 1.61 -1.08 -1.26 -0.51 116.67 112.50 1w36 s ASP 414 Ca 0.00 0.31 0.32 0.00 -0.52 0.00 0.00 52.55 52.66 1w36 s ASP 414 Cb 0.00 0.82 1.63 0.00 -1.46 0.00 0.00 42.92 43.91 1w36 s ASP 414 CO 0.00 -0.28 2.12 1.55 0.52 0.00 0.00 175.17 179.07 1w36 h PRO 415 N 8.25 0.00 0.00 4.34 0.13 -1.94 -1.66 132.00 141.11 1w36 h PRO 415 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1w36 h PRO 415 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1w36 h PRO 415 CO 0.22 0.07 0.00 1.63 -0.23 0.00 0.00 178.00 179.69 1w36 n LYS 416 N -3.43 0.27 -0.34 0.86 5.02 -1.26 -2.93 118.16 116.35 1w36 n LYS 416 Ca -0.02 0.11 0.08 0.00 -2.02 0.00 0.00 58.31 56.46 1w36 n LYS 416 Cb 0.22 -1.50 0.15 0.00 -0.02 0.00 0.00 35.03 33.88 1w36 n LYS 416 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1w36 n GLN 417 N -1.28 1.25 -2.73 1.97 6.02 -0.62 -4.58 117.38 117.40 1w36 n GLN 417 Ca 0.09 -2.70 -0.42 0.00 -0.01 0.00 0.00 57.00 53.96 1w36 n GLN 417 Cb 0.15 -1.41 -0.03 0.00 1.02 0.00 0.00 30.24 29.96 1w36 n GLN 417 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1w36 s ALA 418 N -2.69 2.97 -0.12 -1.58 0.00 -1.15 -4.81 121.76 114.38 1w36 s ALA 418 Ca 0.32 -1.72 0.16 0.00 0.00 0.00 0.00 51.96 50.72 1w36 s ALA 418 Cb 0.30 -4.05 0.28 0.00 0.00 0.00 0.00 23.12 19.65 1w36 s ALA 418 CO -0.01 -3.01 1.14 0.44 0.00 0.00 0.00 175.76 174.32 1w36 n ILE 419 N 6.12 1.69 -1.46 0.00 -5.35 -1.26 -4.79 119.36 114.31 1w36 n ILE 419 Ca 0.01 -2.13 -0.31 0.00 -0.27 0.00 0.00 62.75 60.05 1w36 n ILE 419 Cb 0.47 -0.13 0.08 0.00 -1.74 0.00 0.00 39.64 38.32 1w36 n ILE 419 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 1w36 n TYR 420 N -1.19 3.07 -0.14 4.28 4.02 -1.26 -4.68 117.16 121.25 1w36 n TYR 420 Ca 0.14 -2.76 -0.04 0.00 -0.01 0.00 0.00 57.90 55.23 1w36 n TYR 420 Cb 0.66 -1.18 0.05 0.00 -0.02 0.00 0.00 39.34 38.85 1w36 n TYR 420 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1w36 h ALA 421 N 1.94 0.49 0.00 -0.72 0.00 -1.87 -1.32 119.26 117.78 1w36 h ALA 421 Ca 0.55 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.53 1w36 h ALA 421 Cb 1.11 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1w36 h ALA 421 CO 1.37 -0.31 -0.11 0.27 0.00 0.00 0.00 179.25 180.47 1w36 h PHE 422 N 0.23 0.00 0.01 0.00 -5.15 -1.87 -2.76 116.94 107.40 1w36 h PHE 422 Ca 0.22 0.00 -0.20 0.00 -0.20 0.00 0.00 57.97 57.78 1w36 h PHE 422 Cb 0.27 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.41 1w36 h PHE 422 CO -0.21 0.11 -0.96 0.00 -2.00 0.00 0.00 178.31 175.26 1w36 h ARG 423 N 0.00 0.05 0.00 6.09 3.08 -1.64 -3.47 114.38 118.49 1w36 h ARG 423 Ca -0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1w36 h ARG 423 Cb 0.23 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1w36 h ARG 423 CO 0.01 0.96 0.00 0.41 -1.07 0.00 0.00 179.97 180.29 1w36 n GLY 424 N 1.16 -0.16 3.67 0.04 0.00 -1.04 -5.01 105.19 103.85 1w36 n GLY 424 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1w36 n GLY 424 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w36 s ALA 425 N 0.00 3.63 -0.37 4.61 0.00 -0.81 -4.76 121.76 124.07 1w36 s ALA 425 Ca 0.00 1.03 -0.12 0.00 0.00 0.00 0.00 51.96 52.87 1w36 s ALA 425 Cb 0.00 -3.71 0.01 0.00 0.00 0.00 0.00 23.12 19.43 1w36 s ALA 425 CO 0.00 -1.23 0.23 0.34 0.00 0.00 0.00 175.76 175.10 1w36 s ASP 426 N 2.82 5.84 0.51 0.00 2.15 -0.32 -3.96 116.67 123.70 1w36 s ASP 426 Ca 0.72 -0.82 0.31 0.00 0.43 0.00 0.00 52.55 53.20 1w36 s ASP 426 Cb -0.35 -2.07 1.20 0.00 -0.30 0.00 0.00 42.92 41.40 1w36 s ASP 426 CO 0.30 -0.35 1.91 -0.29 -0.17 0.00 0.00 175.17 176.57 1w36 h ILE 427 N 5.73 0.00 -0.08 4.11 6.09 -1.85 -2.64 117.51 128.87 1w36 h ILE 427 Ca -0.28 -0.54 -0.22 0.00 -1.37 0.00 0.00 64.86 62.45 1w36 h ILE 427 Cb 1.12 1.52 0.01 0.00 0.47 0.00 0.00 36.82 39.94 1w36 h ILE 427 CO 0.67 0.00 -0.79 -0.26 -3.07 0.00 0.00 178.15 174.70 1w36 h PHE 428 N 0.00 0.95 0.00 2.19 0.04 -1.92 -2.19 116.94 116.01 1w36 h PHE 428 Ca 0.00 -0.46 0.00 0.00 2.80 0.00 0.00 57.97 60.31 1w36 h PHE 428 Cb 0.56 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 38.58 1w36 h PHE 428 CO 0.00 1.29 0.00 -2.37 -0.60 0.00 0.00 178.31 176.63 1w36 n THR 429 N -4.00 1.04 0.06 -1.55 5.66 -1.00 -0.24 114.28 114.24 1w36 n THR 429 Ca -0.09 0.38 -0.21 0.00 -3.05 0.00 0.00 64.05 61.08 1w36 n THR 429 Cb 0.76 -1.30 -0.15 0.00 -1.55 0.00 0.00 70.33 68.09 1w36 n THR 429 CO 0.00 0.00 0.00 0.22 -3.05 0.00 0.00 175.07 172.24 1w36 h TYR 430 N 0.00 0.60 -0.09 1.09 3.20 -1.46 -2.90 116.97 117.41 1w36 h TYR 430 Ca 0.00 -0.44 -0.04 0.00 3.14 0.00 0.00 58.73 61.38 1w36 h TYR 430 Cb 0.22 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1w36 h TYR 430 CO 0.00 1.43 -0.15 0.52 -1.64 0.00 0.00 178.16 178.32 1w36 h MET 431 N -0.25 0.14 0.31 1.82 2.86 -0.43 -0.77 114.93 118.61 1w36 h MET 431 Ca -0.21 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.39 1w36 h MET 431 Cb 1.78 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 33.42 1w36 h MET 431 CO 0.15 0.30 -0.15 -0.22 1.06 0.00 0.00 176.91 178.05 1w36 h LYS 432 N 0.14 -0.40 -0.66 1.72 1.63 -0.65 -2.61 116.57 115.73 1w36 h LYS 432 Ca 0.03 0.03 0.19 0.00 -0.85 0.00 0.00 60.65 60.05 1w36 h LYS 432 Cb 0.35 0.09 -0.03 0.00 -0.60 0.00 0.00 32.23 32.05 1w36 h LYS 432 CO 0.02 -0.08 0.51 0.00 -3.45 0.00 0.00 179.45 176.45 1w36 h ALA 433 N -0.22 2.56 -0.03 5.00 0.00 -1.25 0.95 119.26 126.27 1w36 h ALA 433 Ca -0.04 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 1w36 h ALA 433 Cb 0.50 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1w36 h ALA 433 CO 0.07 -0.85 -0.51 -0.09 0.00 0.00 0.00 179.25 177.87 1w36 h ARG 434 N 0.00 0.08 -0.19 0.00 2.43 -0.85 -1.57 114.38 114.28 1w36 h ARG 434 Ca 0.31 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.31 1w36 h ARG 434 Cb 1.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 1w36 h ARG 434 CO -0.00 0.57 -0.37 0.77 -1.51 0.00 0.00 179.97 179.43 1w36 h SER 435 N 0.06 0.66 0.85 -3.80 0.02 0.13 -3.33 113.55 108.14 1w36 h SER 435 Ca -0.00 -0.54 -0.08 0.00 -0.84 0.00 0.00 61.79 60.32 1w36 h SER 435 Cb 0.92 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.26 1w36 h SER 435 CO 0.07 1.08 -0.40 -0.33 -1.14 0.00 0.00 176.83 176.11 1w36 h GLU 436 N 0.26 0.00 -5.58 3.45 5.08 -1.14 -3.42 114.58 113.23 1w36 h GLU 436 Ca 0.01 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.72 1w36 h GLU 436 Cb 0.96 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.05 1w36 h GLU 436 CO 0.08 0.40 -0.61 0.14 -1.00 0.00 0.00 179.01 178.03 1w36 s VAL 437 N -3.58 4.42 -0.14 3.13 -7.23 -0.61 -5.01 120.40 111.39 1w36 s VAL 437 Ca 0.00 -0.18 0.19 0.00 -1.81 0.00 0.00 61.98 60.18 1w36 s VAL 437 Cb 0.11 -2.92 -0.16 0.00 0.56 0.00 0.00 36.38 33.97 1w36 s VAL 437 CO 0.70 0.54 0.72 1.41 -0.31 0.00 0.00 175.10 178.15 1w36 n HIS 438 N 2.89 0.70 -2.76 2.82 8.25 -1.26 -4.81 115.22 121.05 1w36 n HIS 438 Ca -0.18 0.22 -0.43 0.00 -0.26 0.00 0.00 57.72 57.08 1w36 n HIS 438 Cb 0.53 -0.95 -0.03 0.00 1.12 0.00 0.00 29.99 30.65 1w36 n HIS 438 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1w36 s ALA 439 N -3.06 3.31 0.13 -1.41 0.00 -1.26 -2.82 121.76 116.64 1w36 s ALA 439 Ca -0.04 -0.54 0.06 0.00 0.00 0.00 0.00 51.96 51.43 1w36 s ALA 439 Cb 0.09 -3.65 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 1w36 s ALA 439 CO 0.83 -1.87 0.01 -1.01 0.00 0.00 0.00 175.76 173.71 1w36 s HIS 440 N 3.77 2.96 0.09 0.00 0.09 -1.26 -1.46 115.29 119.47 1w36 s HIS 440 Ca 0.40 -0.06 -0.11 0.00 -0.00 0.00 0.00 55.06 55.28 1w36 s HIS 440 Cb -0.10 -1.48 0.01 0.00 -0.00 0.00 0.00 32.58 31.01 1w36 s HIS 440 CO 0.24 0.49 0.27 0.71 -0.00 0.00 0.00 174.74 176.44 1w36 s TYR 441 N -1.49 0.01 0.09 1.40 2.02 -0.74 -2.68 117.35 115.96 1w36 s TYR 441 Ca 0.27 -0.37 -0.05 0.00 -0.37 0.00 0.00 57.07 56.55 1w36 s TYR 441 Cb -0.11 0.05 -0.02 0.00 -0.40 0.00 0.00 41.96 41.49 1w36 s TYR 441 CO 0.19 -0.58 0.11 0.99 -1.57 0.00 0.00 175.55 174.68 1w36 s THR 442 N -3.65 0.16 -0.19 -0.71 2.01 0.15 -0.62 115.64 112.79 1w36 s THR 442 Ca 0.03 -1.52 -0.07 0.00 0.31 0.00 0.00 61.69 60.44 1w36 s THR 442 Cb 0.03 -1.55 -0.04 0.00 0.01 0.00 0.00 72.50 70.96 1w36 s THR 442 CO -0.10 -0.71 0.06 -0.76 -0.69 0.00 0.00 174.62 172.41 1w36 s LEU 443 N -2.92 3.72 -0.06 4.42 1.43 -0.99 -1.42 118.68 122.85 1w36 s LEU 443 Ca 0.09 0.02 -0.01 0.00 -1.03 0.00 0.00 54.13 53.21 1w36 s LEU 443 Cb 0.06 -1.94 -0.26 0.00 0.03 0.00 0.00 46.19 44.08 1w36 s LEU 443 CO -0.08 0.15 0.58 -2.24 0.23 0.00 0.00 176.35 174.99 1w36 h ASP 444 N 6.90 0.30 -2.97 2.29 -0.00 -1.92 -3.41 116.42 117.61 1w36 h ASP 444 Ca -0.36 -0.59 -0.61 0.00 -0.00 0.00 0.00 57.03 55.47 1w36 h ASP 444 Cb 1.17 -0.10 -0.05 0.00 -0.00 0.00 0.00 39.33 40.36 1w36 h ASP 444 CO 0.68 1.52 -0.37 0.28 -0.00 0.00 0.00 179.24 181.35 1w36 s THR 445 N -2.58 5.26 -0.76 1.15 -1.32 -1.26 -1.13 115.64 115.00 1w36 s THR 445 Ca -0.14 0.11 -0.11 0.00 -1.21 0.00 0.00 61.69 60.34 1w36 s THR 445 Cb 0.07 -3.59 0.20 0.00 -1.51 0.00 0.00 72.50 67.67 1w36 s THR 445 CO 0.81 0.27 0.67 0.21 -2.21 0.00 0.00 174.62 174.38 1w36 s ASN 446 N -1.93 6.36 1.22 8.08 3.84 0.73 -4.42 114.94 128.83 1w36 s ASN 446 Ca 0.31 -2.69 -0.20 0.00 0.21 0.00 0.00 52.86 50.49 1w36 s ASN 446 Cb -0.13 -2.12 0.30 0.00 -0.55 0.00 0.00 41.25 38.74 1w36 s ASN 446 CO 0.19 -0.54 1.12 0.79 -2.79 0.00 0.00 177.10 175.87 1w36 n TRP 447 N 3.91 -3.91 0.00 0.43 8.01 -0.63 -3.28 117.44 121.97 1w36 n TRP 447 Ca 0.11 -1.01 0.00 0.00 -1.31 0.00 0.00 57.50 55.29 1w36 n TRP 447 Cb 0.44 -1.12 0.00 0.00 -2.01 0.00 0.00 31.31 28.62 1w36 n TRP 447 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22 1w36 n ARG 448 N -4.72 0.00 -4.40 -0.99 3.00 -1.26 -4.73 116.66 103.56 1w36 n ARG 448 Ca 0.15 0.00 -0.21 0.00 -0.01 0.00 0.00 57.85 57.78 1w36 n ARG 448 Cb 0.59 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.94 1w36 n ARG 448 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1w36 s SER 449 N 0.02 3.04 0.39 0.55 0.15 -1.26 -4.79 113.70 111.81 1w36 s SER 449 Ca 0.00 -1.00 -0.26 0.00 0.70 0.00 0.00 55.95 55.39 1w36 s SER 449 Cb 0.00 -0.21 -0.09 0.00 -1.71 0.00 0.00 66.02 64.01 1w36 s SER 449 CO 0.00 -0.06 1.23 0.00 1.20 0.00 0.00 173.24 175.61 1w36 s ALA 450 N -2.64 3.22 0.56 5.45 0.00 -0.52 -4.69 121.76 123.14 1w36 s ALA 450 Ca 0.25 1.09 0.29 0.00 0.00 0.00 0.00 51.96 53.58 1w36 s ALA 450 Cb -0.03 -3.43 1.46 0.00 0.00 0.00 0.00 23.12 21.13 1w36 s ALA 450 CO 0.10 -0.64 1.93 -1.00 0.00 0.00 0.00 175.76 176.16 1w36 h PRO 451 N 2.75 0.00 0.05 0.00 0.13 -1.86 -1.03 132.00 132.04 1w36 h PRO 451 Ca -0.49 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.39 1w36 h PRO 451 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1w36 h PRO 451 CO 0.63 0.00 -1.20 0.78 -0.23 0.00 0.00 178.00 177.98 1w36 h GLY 452 N 0.00 0.12 0.78 1.56 0.00 -1.92 -0.35 103.07 103.26 1w36 h GLY 452 Ca 0.29 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 1w36 h GLY 452 CO -0.00 0.26 0.01 -0.33 0.00 0.00 0.00 176.54 176.48 1w36 h MET 453 N 0.03 0.08 -0.70 4.80 2.86 -1.54 0.27 114.93 120.72 1w36 h MET 453 Ca -0.10 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.47 1w36 h MET 453 Cb 1.88 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 33.50 1w36 h MET 453 CO 0.15 0.29 0.24 0.28 1.06 0.00 0.00 176.91 178.93 1w36 h VAL 454 N -0.14 1.25 -0.33 -2.22 2.07 -1.26 -1.30 116.25 114.32 1w36 h VAL 454 Ca 0.02 -0.85 -0.03 0.00 0.82 0.00 0.00 66.70 66.66 1w36 h VAL 454 Cb 0.25 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1w36 h VAL 454 CO 0.00 0.33 0.10 0.78 0.02 0.00 0.00 177.57 178.81 1w36 h ASN 455 N 1.02 0.48 0.81 0.57 -0.26 -0.74 -2.08 115.58 115.38 1w36 h ASN 455 Ca 0.23 -0.20 -0.07 0.00 -0.56 0.00 0.00 56.30 55.69 1w36 h ASN 455 Cb 0.27 -0.12 -0.01 0.00 -1.06 0.00 0.00 38.32 37.40 1w36 h ASN 455 CO -0.01 0.55 -0.35 0.77 -1.06 0.00 0.00 177.43 177.33 1w36 h SER 456 N 0.37 0.00 -0.01 5.81 4.64 -0.27 0.75 113.55 124.84 1w36 h SER 456 Ca 0.11 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.37 1w36 h SER 456 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1w36 h SER 456 CO -0.00 0.35 -0.23 0.58 -0.87 0.00 0.00 176.83 176.66 1w36 h VAL 457 N 0.00 1.52 -0.84 0.95 2.07 -1.10 -1.56 116.25 117.28 1w36 h VAL 457 Ca -0.00 -1.85 0.09 0.00 0.82 0.00 0.00 66.70 65.75 1w36 h VAL 457 Cb 0.85 2.66 -0.07 0.00 -1.52 0.00 0.00 31.29 33.21 1w36 h VAL 457 CO 0.05 0.51 0.49 0.78 0.02 0.00 0.00 177.57 179.42 1w36 h ASN 458 N -0.46 0.72 0.75 0.57 -0.26 -1.18 -1.61 115.58 114.10 1w36 h ASN 458 Ca -0.02 0.04 -0.04 0.00 -0.56 0.00 0.00 56.30 55.72 1w36 h ASN 458 Cb 0.95 -0.10 0.01 0.00 -1.06 0.00 0.00 38.32 38.12 1w36 h ASN 458 CO 0.05 0.42 -0.36 0.50 -1.06 0.00 0.00 177.43 176.97 1w36 h LYS 459 N 0.83 -0.97 -0.27 0.81 3.64 -0.80 -1.90 116.57 117.90 1w36 h LYS 459 Ca 0.40 0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.90 1w36 h LYS 459 Cb 0.34 0.22 -0.08 0.00 -0.41 0.00 0.00 32.23 32.31 1w36 h LYS 459 CO -0.24 -0.65 -0.42 1.25 -2.27 0.00 0.00 179.45 177.13 1w36 h LEU 460 N -1.01 -1.35 -0.09 5.20 5.85 -0.71 0.19 115.31 123.40 1w36 h LEU 460 Ca -0.10 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1w36 h LEU 460 Cb 0.78 0.57 0.00 0.00 0.37 0.00 0.00 40.66 42.38 1w36 h LEU 460 CO 0.16 -0.39 0.00 0.49 -0.34 0.00 0.00 178.44 178.36 1w36 n PHE 461 N -5.42 0.00 0.26 1.25 3.01 -0.66 -3.13 117.46 112.77 1w36 n PHE 461 Ca -0.02 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.51 1w36 n PHE 461 Cb 0.35 -0.01 -0.10 0.00 -0.01 0.00 0.00 39.48 39.72 1w36 n PHE 461 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1w36 n SER 462 N -0.45 1.28 0.00 4.37 7.64 0.65 -4.70 113.62 122.40 1w36 n SER 462 Ca 0.00 -0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.55 1w36 n SER 462 Cb 0.02 1.40 0.00 0.00 -1.01 0.00 0.00 64.21 64.62 1w36 n SER 462 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1w36 n GLN 463 N -1.73 0.00 -1.73 1.43 1.13 -1.02 -4.73 117.38 110.73 1w36 n GLN 463 Ca -0.01 0.02 -0.29 0.00 -1.94 0.00 0.00 57.00 54.78 1w36 n GLN 463 Cb 0.31 -0.34 0.15 0.00 0.11 0.00 0.00 30.24 30.47 1w36 n GLN 463 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1w36 s THR 464 N -0.05 1.96 0.30 5.09 -4.23 -1.26 -5.08 115.64 112.37 1w36 s THR 464 Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.49 1w36 s THR 464 Cb 0.00 -2.88 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 1w36 s THR 464 CO 0.00 0.00 0.52 -1.81 -0.54 0.00 0.00 174.62 172.79 1w36 s ASP 465 N -4.45 6.36 -0.72 3.99 1.11 -1.26 -4.47 116.67 117.22 1w36 s ASP 465 Ca 0.67 0.53 -0.05 0.00 0.18 0.00 0.00 52.55 53.87 1w36 s ASP 465 Cb -0.10 -2.06 0.01 0.00 1.07 0.00 0.00 42.92 41.83 1w36 s ASP 465 CO 0.52 -0.21 0.65 0.47 1.18 0.00 0.00 175.17 177.77 1w36 n ASP 466 N -1.29 -6.31 -0.22 0.27 9.92 -1.26 -4.82 116.55 112.85 1w36 n ASP 466 Ca -0.04 -0.42 -0.07 0.00 -0.53 0.00 0.00 54.79 53.74 1w36 n ASP 466 Cb 0.55 -3.38 0.03 0.00 -0.64 0.00 0.00 41.12 37.68 1w36 n ASP 466 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1w36 h ALA 467 N 1.11 0.78 -0.15 2.24 0.00 -1.84 -0.31 119.26 121.09 1w36 h ALA 467 Ca -0.33 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1w36 h ALA 467 Cb 1.21 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1w36 h ALA 467 CO 0.31 0.35 0.00 1.19 0.00 0.00 0.00 179.25 181.10 1w36 n PHE 468 N -4.51 0.34 -3.98 0.00 3.01 -1.26 -4.92 117.46 106.15 1w36 n PHE 468 Ca 0.04 -0.14 -0.27 0.00 1.01 0.00 0.00 57.45 58.09 1w36 n PHE 468 Cb 0.13 -0.09 -0.06 0.00 -0.01 0.00 0.00 39.48 39.45 1w36 n PHE 468 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1w36 n MET 469 N 0.07 -0.84 -3.15 -1.08 0.00 -0.13 -4.83 117.12 107.16 1w36 n MET 469 Ca 0.06 0.05 0.04 0.00 0.00 0.00 0.00 57.70 57.85 1w36 n MET 469 Cb 0.29 -2.68 -0.00 0.00 0.00 0.00 0.00 33.22 30.83 1w36 n MET 469 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1w36 s PHE 470 N -4.06 -1.59 0.57 3.17 2.99 -1.26 -4.99 117.98 112.81 1w36 s PHE 470 Ca 0.07 0.81 0.43 0.00 0.00 0.00 0.00 56.93 58.24 1w36 s PHE 470 Cb -0.04 0.28 1.51 0.00 0.00 0.00 0.00 43.02 44.77 1w36 s PHE 470 CO 0.80 -0.95 1.54 0.07 -0.00 0.00 0.00 175.22 176.69 1w36 h ARG 471 N 7.65 0.00 0.00 0.44 0.11 -1.93 1.15 114.38 121.81 1w36 h ARG 471 Ca -0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 1w36 h ARG 471 Cb 1.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.27 1w36 h ARG 471 CO 0.10 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.56 1w36 n GLU 472 N -3.79 0.06 -3.34 0.08 4.71 -1.26 -3.53 120.64 113.58 1w36 n GLU 472 Ca 0.36 0.23 -0.28 0.00 -0.01 0.00 0.00 57.16 57.46 1w36 n GLU 472 Cb 1.77 -1.60 -0.07 0.00 -1.01 0.00 0.00 31.44 30.53 1w36 n GLU 472 CO 0.00 0.00 0.00 -0.89 0.09 0.00 0.00 177.13 176.33 1w36 n ILE 473 N -1.72 2.68 -2.35 -3.67 5.41 0.40 -5.01 119.36 115.09 1w36 n ILE 473 Ca 0.04 -5.32 -0.35 0.00 1.00 0.00 0.00 62.75 58.12 1w36 n ILE 473 Cb 0.24 -2.02 -0.01 0.00 -0.71 0.00 0.00 39.64 37.14 1w36 n ILE 473 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1w36 s PRO 474 N -2.63 3.55 -0.33 0.38 0.04 -1.23 -4.41 135.00 130.37 1w36 s PRO 474 Ca 0.40 1.56 -0.09 0.00 0.04 0.00 0.00 61.00 62.91 1w36 s PRO 474 Cb 0.16 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.62 1w36 s PRO 474 CO -0.02 -0.67 0.14 0.12 0.04 0.00 0.00 177.00 176.61 1w36 s PHE 475 N -1.80 3.20 -0.17 0.56 5.36 -1.26 -5.03 117.98 118.84 1w36 s PHE 475 Ca 0.70 -0.89 -0.01 0.00 -0.96 0.00 0.00 56.93 55.77 1w36 s PHE 475 Cb -0.22 -2.34 -0.01 0.00 -0.34 0.00 0.00 43.02 40.11 1w36 s PHE 475 CO 0.26 -0.58 -0.11 0.96 -1.46 0.00 0.00 175.22 174.29 1w36 s ILE 476 N 1.54 2.99 1.02 3.12 -4.36 -1.26 -5.02 121.20 119.23 1w36 s ILE 476 Ca 0.03 -0.65 -0.18 0.00 -0.26 0.00 0.00 60.65 59.58 1w36 s ILE 476 Cb -0.18 -2.29 -0.02 0.00 1.25 0.00 0.00 42.46 41.22 1w36 s ILE 476 CO 0.05 0.49 -0.29 -2.65 0.24 0.00 0.00 174.94 172.78 1w36 n PRO 477 N 4.13 -0.59 -4.16 0.37 -0.02 -1.26 -5.06 135.00 128.40 1w36 n PRO 477 Ca -0.19 -0.15 -0.10 0.00 -2.02 0.00 0.00 63.50 61.04 1w36 n PRO 477 Cb 0.52 -1.49 -0.10 0.00 -0.02 0.00 0.00 33.50 32.40 1w36 n PRO 477 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1w36 s VAL 478 N -2.20 0.63 0.09 -1.45 -7.23 -1.26 -5.00 120.40 103.98 1w36 s VAL 478 Ca 0.50 -1.92 0.01 0.00 -1.81 0.00 0.00 61.98 58.76 1w36 s VAL 478 Cb -0.12 -1.67 -0.04 0.00 0.56 0.00 0.00 36.38 35.11 1w36 s VAL 478 CO 0.70 -0.88 0.23 -1.59 -0.31 0.00 0.00 175.10 173.25 1w36 s LYS 479 N -3.85 3.44 0.01 4.82 -2.85 -0.28 -4.90 119.74 116.13 1w36 s LYS 479 Ca 0.11 -0.50 -0.19 0.00 -1.00 0.00 0.00 55.97 54.40 1w36 s LYS 479 Cb 0.06 -3.01 -0.06 0.00 -2.06 0.00 0.00 37.83 32.76 1w36 s LYS 479 CO -0.05 0.58 0.55 -1.54 0.10 0.00 0.00 175.35 174.98 1w36 s SER 480 N -2.76 6.95 0.77 0.03 1.04 -1.26 -0.19 113.70 118.28 1w36 s SER 480 Ca 0.35 1.13 -0.14 0.00 0.48 0.00 0.00 55.95 57.78 1w36 s SER 480 Cb -0.12 -2.34 0.06 0.00 0.10 0.00 0.00 66.02 63.72 1w36 s SER 480 CO 0.28 0.18 1.19 0.00 0.98 0.00 0.00 173.24 175.87 1w36 s ALA 481 N -0.55 2.00 0.16 5.32 0.00 -1.21 -4.88 121.76 122.60 1w36 s ALA 481 Ca 0.29 0.78 0.02 0.00 0.00 0.00 0.00 51.96 53.05 1w36 s ALA 481 Cb -0.18 -3.45 -0.02 0.00 0.00 0.00 0.00 23.12 19.47 1w36 s ALA 481 CO 0.17 -2.05 1.37 0.78 0.00 0.00 0.00 175.76 176.03 1w36 h GLY 482 N -0.67 0.24 1.81 0.00 0.00 -1.97 -2.86 103.07 99.62 1w36 h GLY 482 Ca -0.46 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.44 1w36 h GLY 482 CO 0.48 0.38 0.02 0.58 0.00 0.00 0.00 176.54 178.00 1w36 n LYS 483 N -3.66 0.00 -0.05 4.80 2.85 -1.26 -1.24 118.16 119.59 1w36 n LYS 483 Ca -0.04 0.43 0.02 0.00 -1.05 0.00 0.00 58.31 57.67 1w36 n LYS 483 Cb 0.81 -1.52 0.05 0.00 -0.65 0.00 0.00 35.03 33.72 1w36 n LYS 483 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1w36 n ASN 484 N -1.43 2.26 0.20 -5.58 5.03 -1.08 -4.73 115.26 109.93 1w36 n ASN 484 Ca 0.00 -2.15 0.14 0.00 0.87 0.00 0.00 54.58 53.44 1w36 n ASN 484 Cb 0.02 -0.11 0.59 0.00 -1.02 0.00 0.00 39.78 39.26 1w36 n ASN 484 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 1w36 h GLN 485 N 0.42 0.00 -0.01 3.52 1.08 -1.17 -2.93 115.11 116.02 1w36 h GLN 485 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1w36 h GLN 485 Cb 0.63 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 1w36 h GLN 485 CO 0.01 0.00 -0.20 0.00 -0.95 0.00 0.00 178.83 177.68 1w36 n ALA 486 N -1.91 2.97 -1.88 3.87 0.00 -1.26 -4.88 120.51 117.42 1w36 n ALA 486 Ca 0.01 -0.49 -0.41 0.00 0.00 0.00 0.00 53.44 52.55 1w36 n ALA 486 Cb 0.25 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 1w36 n ALA 486 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1w36 s LEU 487 N -2.31 4.43 0.04 0.00 1.43 -1.10 0.32 118.68 121.49 1w36 s LEU 487 Ca 0.27 2.52 -0.27 0.00 -1.03 0.00 0.00 54.13 55.62 1w36 s LEU 487 Cb 0.20 -3.63 0.09 0.00 0.03 0.00 0.00 46.19 42.88 1w36 s LEU 487 CO 0.46 -0.51 0.76 0.00 0.23 0.00 0.00 176.35 177.29 1w36 s ARG 488 N -0.85 1.01 -0.11 1.70 1.70 0.57 -4.77 118.95 118.20 1w36 s ARG 488 Ca 0.53 -0.28 0.03 0.00 -0.47 0.00 0.00 55.73 55.54 1w36 s ARG 488 Cb -0.38 0.47 -0.00 0.00 -0.57 0.00 0.00 34.95 34.47 1w36 s ARG 488 CO 0.44 -0.42 -0.21 0.12 -1.08 0.00 0.00 175.30 174.15 1w36 s PHE 489 N -3.01 2.64 -0.03 5.89 5.36 -1.26 -1.67 117.98 125.89 1w36 s PHE 489 Ca 0.01 -0.97 0.05 0.00 -0.96 0.00 0.00 56.93 55.06 1w36 s PHE 489 Cb -0.01 -1.76 -0.03 0.00 -0.34 0.00 0.00 43.02 40.89 1w36 s PHE 489 CO -0.08 -0.39 -0.17 0.14 -1.46 0.00 0.00 175.22 173.27 1w36 s VAL 490 N 0.40 2.86 -0.04 3.12 -7.23 -0.86 0.21 120.40 118.86 1w36 s VAL 490 Ca -0.16 -0.85 -0.01 0.00 -1.81 0.00 0.00 61.98 59.15 1w36 s VAL 490 Cb -0.17 -2.11 0.03 0.00 0.56 0.00 0.00 36.38 34.69 1w36 s VAL 490 CO 0.07 0.56 0.09 0.12 -0.31 0.00 0.00 175.10 175.62 1w36 s PHE 491 N -0.74 -0.07 -1.00 2.82 5.36 -0.72 -0.30 117.98 123.33 1w36 s PHE 491 Ca 0.12 0.29 -0.03 0.00 -0.96 0.00 0.00 56.93 56.35 1w36 s PHE 491 Cb -0.10 -0.14 0.03 0.00 -0.34 0.00 0.00 43.02 42.46 1w36 s PHE 491 CO 0.01 -0.12 0.08 1.63 -1.46 0.00 0.00 175.22 175.36 1w36 n LYS 492 N 4.08 -0.93 0.00 10.12 5.02 -0.95 -3.61 118.16 131.89 1w36 n LYS 492 Ca -0.26 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 1w36 n LYS 492 Cb 0.52 -2.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.17 1w36 n LYS 492 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1w36 n GLY 493 N -1.74 0.86 2.57 0.72 0.00 -1.26 -5.10 105.19 101.23 1w36 n GLY 493 Ca -0.15 -0.22 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 1w36 n GLY 493 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1w36 n GLU 494 N 0.00 1.05 -2.11 1.61 0.00 -1.24 -5.06 120.64 114.90 1w36 n GLU 494 Ca 0.00 -2.48 -0.42 0.00 0.00 0.00 0.00 57.16 54.27 1w36 n GLU 494 Cb 0.00 0.48 -0.03 0.00 0.00 0.00 0.00 31.44 31.89 1w36 n GLU 494 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 1w36 s THR 495 N -2.09 3.03 0.32 3.84 -4.23 -1.26 -1.75 115.64 113.51 1w36 s THR 495 Ca 0.10 0.78 -0.04 0.00 -1.18 0.00 0.00 61.69 61.35 1w36 s THR 495 Cb -0.01 -3.50 -0.05 0.00 1.34 0.00 0.00 72.50 70.28 1w36 s THR 495 CO 0.06 0.08 0.58 -1.10 -0.54 0.00 0.00 174.62 173.71 1w36 s GLN 496 N 0.58 3.60 0.76 3.99 -1.52 0.13 -4.91 119.66 122.30 1w36 s GLN 496 Ca 0.63 -0.02 -0.11 0.00 -1.95 0.00 0.00 55.36 53.92 1w36 s GLN 496 Cb -0.39 -2.61 0.05 0.00 -0.22 0.00 0.00 33.01 29.83 1w36 s GLN 496 CO 0.34 0.15 1.08 -1.25 -0.25 0.00 0.00 175.29 175.37 1w36 s PRO 497 N -3.80 2.37 0.35 2.91 0.04 -1.26 -4.54 135.00 131.07 1w36 s PRO 497 Ca 0.44 1.04 0.08 0.00 0.04 0.00 0.00 61.00 62.60 1w36 s PRO 497 Cb -0.10 -1.92 0.66 0.00 0.04 0.00 0.00 34.50 33.18 1w36 s PRO 497 CO 0.32 -1.52 1.84 0.00 0.04 0.00 0.00 177.00 177.68 1w36 h ALA 498 N -1.03 1.37 -3.28 8.56 0.00 -1.63 -3.43 119.26 119.81 1w36 h ALA 498 Ca -0.44 -0.27 -0.43 0.00 0.00 0.00 0.00 54.91 53.77 1w36 h ALA 498 Cb 1.23 -0.09 -0.38 0.00 0.00 0.00 0.00 17.79 18.55 1w36 h ALA 498 CO 0.54 0.44 -0.76 1.41 0.00 0.00 0.00 179.25 180.87 1w36 s MET 499 N -4.56 0.57 -0.13 0.00 -2.45 0.13 -1.31 119.30 111.56 1w36 s MET 499 Ca -0.05 0.11 0.01 0.00 -1.25 0.00 0.00 55.69 54.51 1w36 s MET 499 Cb 0.15 -0.91 0.02 0.00 1.25 0.00 0.00 34.83 35.33 1w36 s MET 499 CO 0.75 -0.28 -0.15 0.21 1.05 0.00 0.00 175.02 176.59 1w36 s LYS 500 N 1.86 2.31 -0.16 4.11 2.20 -0.68 -1.42 119.74 127.97 1w36 s LYS 500 Ca 0.03 -0.58 -0.19 0.00 -0.36 0.00 0.00 55.97 54.87 1w36 s LYS 500 Cb -0.12 -2.01 -0.03 0.00 -1.51 0.00 0.00 37.83 34.15 1w36 s LYS 500 CO -0.05 -0.13 0.55 -1.64 -0.36 0.00 0.00 175.35 173.73 1w36 s MET 501 N 1.17 4.26 -0.03 4.03 -1.94 0.11 -2.03 119.30 124.87 1w36 s MET 501 Ca -0.02 0.52 -0.09 0.00 -1.71 0.00 0.00 55.69 54.39 1w36 s MET 501 Cb -0.14 -3.52 -0.05 0.00 2.01 0.00 0.00 34.83 33.13 1w36 s MET 501 CO -0.05 -0.06 0.28 -1.58 -0.01 0.00 0.00 175.02 173.59 1w36 s TRP 502 N 1.34 3.63 -0.18 -0.03 0.52 0.11 -1.81 118.94 122.52 1w36 s TRP 502 Ca 0.27 0.69 -0.03 0.00 0.02 0.00 0.00 56.10 57.05 1w36 s TRP 502 Cb -0.16 -2.07 0.06 0.00 -1.15 0.00 0.00 33.47 30.15 1w36 s TRP 502 CO 0.11 0.65 0.04 -1.17 0.02 0.00 0.00 176.95 176.60 1w36 s LEU 503 N -1.37 0.96 0.80 2.99 2.96 -0.40 -0.47 118.68 124.14 1w36 s LEU 503 Ca 0.23 -0.70 -0.14 0.00 -0.22 0.00 0.00 54.13 53.30 1w36 s LEU 503 Cb -0.14 -0.51 0.02 0.00 0.50 0.00 0.00 46.19 46.06 1w36 s LEU 503 CO 0.12 -0.30 0.80 0.23 -1.32 0.00 0.00 176.35 175.88 1w36 n MET 504 N 5.10 0.18 -2.88 1.98 2.81 -0.63 -2.45 117.12 121.23 1w36 n MET 504 Ca -0.08 0.12 -0.20 0.00 -1.81 0.00 0.00 57.70 55.73 1w36 n MET 504 Cb 0.48 -2.10 0.05 0.00 -0.71 0.00 0.00 33.22 30.94 1w36 n MET 504 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1w36 s GLU 505 N -3.48 2.39 0.00 0.03 2.02 -1.26 -4.68 118.70 113.72 1w36 s GLU 505 Ca 0.68 -1.28 0.00 0.00 0.02 0.00 0.00 54.97 54.39 1w36 s GLU 505 Cb -0.30 -2.60 0.00 0.00 0.10 0.00 0.00 34.13 31.33 1w36 s GLU 505 CO 0.56 -0.77 0.00 0.41 0.02 0.00 0.00 175.26 175.48 1w36 n GLY 506 N -2.25 -3.41 0.28 -1.39 0.00 -1.26 -4.89 105.19 92.27 1w36 n GLY 506 Ca 0.12 -2.12 -0.13 0.00 0.00 0.00 0.00 46.02 43.89 1w36 n GLY 506 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1w36 n GLU 507 N -0.05 0.34 -0.33 1.61 1.02 -1.26 -4.83 120.64 117.13 1w36 n GLU 507 Ca 0.00 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 1w36 n GLU 507 Cb 0.00 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 1w36 n GLU 507 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1w36 n SER 508 N -3.26 0.00 0.00 1.62 2.88 -1.26 -4.61 113.62 108.99 1w36 n SER 508 Ca -0.27 -0.34 0.00 0.00 -1.33 0.00 0.00 58.87 56.93 1w36 n SER 508 Cb 0.74 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.20 1w36 n SER 508 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1w36 s GLY 510 N 0.00 1.46 0.26 0.00 0.00 -1.26 -1.16 107.32 106.62 1w36 s GLY 510 Ca 0.00 -1.03 -0.02 0.00 0.00 0.00 0.00 44.72 43.67 1w36 s GLY 510 CO 0.00 -1.01 1.79 -2.08 0.00 0.00 0.00 173.10 171.80 1w36 h VAL 511 N 1.23 0.83 -0.39 1.40 2.07 -1.87 -1.66 116.25 117.85 1w36 h VAL 511 Ca -0.50 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 66.80 1w36 h VAL 511 Cb 1.21 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 1w36 h VAL 511 CO 0.64 0.13 0.21 1.23 0.02 0.00 0.00 177.57 179.80 1w36 h GLY 512 N 0.73 0.54 0.44 2.17 0.00 -1.98 -3.18 103.07 101.79 1w36 h GLY 512 Ca 0.44 -0.15 -0.02 0.00 0.00 0.00 0.00 47.33 47.60 1w36 h GLY 512 CO -0.30 0.11 -0.24 -0.55 0.00 0.00 0.00 176.54 175.56 1w36 h ASP 513 N 0.42 -0.59 -0.12 0.19 5.19 -1.74 -3.04 116.42 116.74 1w36 h ASP 513 Ca 0.16 0.03 -0.02 0.00 -0.62 0.00 0.00 57.03 56.59 1w36 h ASP 513 Cb 0.06 0.16 -0.00 0.00 0.18 0.00 0.00 39.33 39.73 1w36 h ASP 513 CO -0.10 -0.39 0.05 -0.47 -3.12 0.00 0.00 179.24 175.21 1w36 s TYR 514 N -4.44 1.20 0.00 4.55 6.14 -0.71 -1.20 117.35 122.90 1w36 s TYR 514 Ca -0.10 2.33 0.00 0.00 0.64 0.00 0.00 57.07 59.94 1w36 s TYR 514 Cb 0.01 -3.32 0.00 0.00 0.42 0.00 0.00 41.96 39.07 1w36 s TYR 514 CO 0.29 -0.70 0.00 1.04 0.64 0.00 0.00 175.55 176.83 1w36 n GLN 515 N 8.20 0.00 -0.22 4.97 6.02 -1.25 -4.79 117.38 130.32 1w36 n GLN 515 Ca 0.42 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 57.35 1w36 n GLN 515 Cb 0.47 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.68 1w36 n GLN 515 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1w36 n SER 516 N 0.00 -0.54 -0.05 1.08 7.64 -0.34 0.42 113.62 121.83 1w36 n SER 516 Ca 0.00 1.30 -0.10 0.00 1.01 0.00 0.00 58.87 61.07 1w36 n SER 516 Cb 0.00 -0.31 -0.04 0.00 -1.01 0.00 0.00 64.21 62.85 1w36 n SER 516 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1w36 h THR 517 N 0.00 1.12 -0.27 0.44 1.03 -1.47 -0.26 112.91 113.50 1w36 h THR 517 Ca 0.08 -0.35 -0.08 0.00 -0.01 0.00 0.00 66.41 66.05 1w36 h THR 517 Cb 0.21 1.00 -0.01 0.00 -1.07 0.00 0.00 68.15 68.28 1w36 h THR 517 CO -0.48 0.12 -0.17 0.24 -0.01 0.00 0.00 175.52 175.21 1w36 h MET 518 N 0.19 0.47 -0.57 0.00 2.07 -0.50 -0.49 114.93 116.10 1w36 h MET 518 Ca 0.07 -0.15 -0.09 0.00 -2.07 0.00 0.00 59.70 57.46 1w36 h MET 518 Cb 0.10 -0.04 -0.02 0.00 -1.87 0.00 0.00 31.60 29.77 1w36 h MET 518 CO -0.01 0.63 0.02 0.00 1.07 0.00 0.00 176.91 178.62 1w36 h ALA 519 N 1.39 0.77 0.03 6.32 0.00 0.88 -0.60 119.26 128.04 1w36 h ALA 519 Ca 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1w36 h ALA 519 Cb 0.55 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1w36 h ALA 519 CO 0.04 0.59 -0.08 0.37 0.00 0.00 0.00 179.25 180.16 1w36 h GLN 520 N 0.89 -0.12 -0.77 0.00 4.15 0.02 -1.46 115.11 117.81 1w36 h GLN 520 Ca 0.16 0.01 0.15 0.00 0.77 0.00 0.00 58.65 59.75 1w36 h GLN 520 Cb 0.53 0.03 -0.15 0.00 0.21 0.00 0.00 27.48 28.10 1w36 h GLN 520 CO 0.03 -0.08 -0.19 0.28 -1.93 0.00 0.00 178.83 176.93 1w36 h VAL 521 N -0.13 0.23 0.45 2.39 2.07 -1.06 -2.13 116.25 118.08 1w36 h VAL 521 Ca -0.00 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1w36 h VAL 521 Cb 0.13 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 1w36 h VAL 521 CO -0.04 0.00 -0.49 0.00 0.02 0.00 0.00 177.57 177.06 1w36 h ALA 523 N -0.76 1.44 0.27 0.00 0.00 -0.62 -1.24 119.26 118.34 1w36 h ALA 523 Ca -0.05 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1w36 h ALA 523 Cb 0.84 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1w36 h ALA 523 CO -0.08 -0.20 -0.18 0.00 0.00 0.00 0.00 179.25 178.79 1w36 h ALA 524 N 1.65 -0.42 -0.01 0.00 0.00 -1.09 -0.51 119.26 118.87 1w36 h ALA 524 Ca 0.53 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.36 1w36 h ALA 524 Cb 0.90 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1w36 h ALA 524 CO -0.44 -0.75 -0.03 1.96 0.00 0.00 0.00 179.25 179.99 1w36 h GLN 525 N -0.43 0.02 -0.10 0.00 1.08 -0.62 0.11 115.11 115.16 1w36 h GLN 525 Ca -0.02 -0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.14 1w36 h GLN 525 Cb 0.37 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.79 1w36 h GLN 525 CO 0.02 0.05 -0.07 0.82 -0.95 0.00 0.00 178.83 178.70 1w36 h ILE 526 N 0.02 1.34 -0.46 2.54 5.03 -0.26 -0.77 117.51 124.95 1w36 h ILE 526 Ca 0.00 -1.17 -0.08 0.00 -0.12 0.00 0.00 64.86 63.49 1w36 h ILE 526 Cb 0.07 1.89 -0.02 0.00 -3.03 0.00 0.00 36.82 35.73 1w36 h ILE 526 CO 0.00 0.33 -0.05 0.08 -0.68 0.00 0.00 178.15 177.84 1w36 h ARG 527 N -0.15 0.79 -0.75 2.37 -0.00 -0.49 0.14 114.38 116.29 1w36 h ARG 527 Ca 0.02 -0.24 0.09 0.00 -0.00 0.00 0.00 59.98 59.85 1w36 h ARG 527 Cb 0.56 -0.08 -0.05 0.00 -0.00 0.00 0.00 29.97 30.40 1w36 h ARG 527 CO 0.02 0.83 0.49 -0.44 -0.00 0.00 0.00 179.97 180.87 1w36 h ASP 528 N 0.73 0.62 0.24 0.08 3.32 -0.59 0.21 116.42 121.03 1w36 h ASP 528 Ca 0.13 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 1w36 h ASP 528 Cb 0.51 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1w36 h ASP 528 CO 0.03 0.37 -0.11 -0.50 -1.72 0.00 0.00 179.24 177.31 1w36 h TRP 529 N 0.69 -0.30 -0.90 4.55 6.55 -0.38 -2.95 115.95 123.20 1w36 h TRP 529 Ca 0.34 -0.01 0.25 0.00 0.95 0.00 0.00 58.89 60.43 1w36 h TRP 529 Cb 0.42 0.10 -0.15 0.00 -0.86 0.00 0.00 29.16 28.67 1w36 h TRP 529 CO -0.00 -0.18 0.26 -0.07 -1.05 0.00 0.00 178.44 177.39 1w36 h LEU 530 N -0.89 0.02 0.24 -4.49 3.38 -0.31 0.10 115.31 113.35 1w36 h LEU 530 Ca -0.03 0.21 -0.32 0.00 0.09 0.00 0.00 57.88 57.82 1w36 h LEU 530 Cb 0.25 0.27 0.03 0.00 0.09 0.00 0.00 40.66 41.30 1w36 h LEU 530 CO 0.05 -0.18 -1.45 0.06 0.09 0.00 0.00 178.44 177.01 1w36 h GLN 531 N 0.19 0.50 0.00 1.13 3.07 -0.74 -2.65 115.11 116.61 1w36 h GLN 531 Ca 0.58 -0.85 0.00 0.00 0.09 0.00 0.00 58.65 58.47 1w36 h GLN 531 Cb 1.22 0.32 0.00 0.00 0.08 0.00 0.00 27.48 29.09 1w36 h GLN 531 CO -0.68 1.41 0.04 0.00 0.09 0.00 0.00 178.83 179.69 1w36 h ALA 532 N 0.13 1.03 0.00 0.06 0.00 -1.13 0.38 119.26 119.73 1w36 h ALA 532 Ca -0.26 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.41 1w36 h ALA 532 Cb 2.10 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.86 1w36 h ALA 532 CO 0.25 -0.03 -1.28 0.78 0.00 0.00 0.00 179.25 178.97 1w36 h GLY 533 N 0.00 0.00 2.00 0.00 0.00 -0.51 0.81 103.07 105.37 1w36 h GLY 533 Ca 0.00 -0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1w36 h GLY 533 CO 0.00 0.00 -0.37 1.46 0.00 0.00 0.00 176.54 177.63 1w36 h GLN 534 N 0.00 0.00 -0.00 4.80 4.20 0.07 -2.11 115.11 122.07 1w36 h GLN 534 Ca -0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1w36 h GLN 534 Cb 1.87 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.65 1w36 h GLN 534 CO 0.11 0.37 -0.05 0.54 -0.67 0.00 0.00 178.83 179.13 1w36 n ARG 535 N -4.06 0.96 -0.66 1.46 1.74 -0.92 -4.92 116.66 110.26 1w36 n ARG 535 Ca -0.02 -0.31 0.00 0.00 -0.77 0.00 0.00 57.85 56.76 1w36 n ARG 535 Cb 0.41 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 1w36 n ARG 535 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1w36 n GLY 536 N 1.18 0.91 0.12 -0.13 0.00 -0.79 -4.94 105.19 101.53 1w36 n GLY 536 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.33 1w36 n GLY 536 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1w36 n GLU 537 N -2.00 0.52 -3.97 1.61 1.02 0.26 -4.66 120.64 113.42 1w36 n GLU 537 Ca 0.00 -0.24 -0.34 0.00 -0.02 0.00 0.00 57.16 56.56 1w36 n GLU 537 Cb 0.00 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.78 1w36 n GLU 537 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1w36 s ALA 538 N -2.65 2.69 -0.03 0.62 0.00 -1.10 -2.24 121.76 119.06 1w36 s ALA 538 Ca 0.22 -1.53 0.06 0.00 0.00 0.00 0.00 51.96 50.71 1w36 s ALA 538 Cb 0.19 -1.70 -0.01 0.00 0.00 0.00 0.00 23.12 21.60 1w36 s ALA 538 CO 0.54 -0.90 -0.19 -0.51 0.00 0.00 0.00 175.76 174.70 1w36 s LEU 539 N 1.29 2.00 -0.34 0.00 1.43 0.59 -2.82 118.68 120.84 1w36 s LEU 539 Ca -0.01 -0.37 -0.17 0.00 -1.03 0.00 0.00 54.13 52.55 1w36 s LEU 539 Cb -0.17 -1.03 -0.01 0.00 0.03 0.00 0.00 46.19 45.01 1w36 s LEU 539 CO -0.04 0.22 0.44 -0.76 0.23 0.00 0.00 176.35 176.44 1w36 s LEU 540 N -0.29 4.36 0.04 1.79 1.43 -0.01 -2.03 118.68 123.97 1w36 s LEU 540 Ca 0.03 -0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.13 1w36 s LEU 540 Cb -0.09 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.62 1w36 s LEU 540 CO 0.00 -0.40 -0.22 -0.04 0.23 0.00 0.00 176.35 175.92 1w36 s MET 541 N 2.22 1.50 -0.31 1.70 -1.94 -0.67 -2.15 119.30 119.64 1w36 s MET 541 Ca 0.16 -0.99 0.02 0.00 -1.71 0.00 0.00 55.69 53.17 1w36 s MET 541 Cb -0.16 -1.63 0.09 0.00 2.01 0.00 0.00 34.83 35.15 1w36 s MET 541 CO 0.12 0.42 0.05 1.21 -0.01 0.00 0.00 175.02 176.82 1w36 s ASN 542 N -1.20 4.34 1.91 3.03 3.84 -1.05 -0.32 114.94 125.49 1w36 s ASN 542 Ca 0.09 -1.81 0.00 0.00 0.21 0.00 0.00 52.86 51.35 1w36 s ASN 542 Cb -0.09 -1.25 0.00 0.00 -0.55 0.00 0.00 41.25 39.35 1w36 s ASN 542 CO 0.02 -0.37 0.00 0.61 -2.79 0.00 0.00 177.10 174.56 1w36 n GLY 543 N 4.55 3.57 1.57 1.21 0.00 0.15 -1.62 105.19 114.63 1w36 n GLY 543 Ca -0.01 0.16 0.04 0.00 0.00 0.00 0.00 46.02 46.21 1w36 n GLY 543 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w36 n ASP 544 N 9.64 4.75 -4.67 1.61 8.00 -1.26 -4.93 116.55 129.68 1w36 n ASP 544 Ca 0.00 -3.09 -0.26 0.00 0.71 0.00 0.00 54.79 52.15 1w36 n ASP 544 Cb 0.00 -0.66 -0.07 0.00 -0.02 0.00 0.00 41.12 40.37 1w36 n ASP 544 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1w36 s ASP 545 N -1.32 4.78 0.17 -2.24 1.01 -0.64 -5.12 116.67 113.30 1w36 s ASP 545 Ca 0.50 -0.42 -0.23 0.00 0.71 0.00 0.00 52.55 53.11 1w36 s ASP 545 Cb 0.40 -1.01 0.06 0.00 1.01 0.00 0.00 42.92 43.38 1w36 s ASP 545 CO 0.12 0.07 0.65 0.00 0.21 0.00 0.00 175.17 176.22 1w36 s ALA 546 N -1.83 -1.56 -0.19 5.23 0.00 -1.26 -2.53 121.76 119.61 1w36 s ALA 546 Ca 0.28 0.40 -0.16 0.00 0.00 0.00 0.00 51.96 52.48 1w36 s ALA 546 Cb -0.09 0.84 0.05 0.00 0.00 0.00 0.00 23.12 23.93 1w36 s ALA 546 CO 0.19 -0.81 0.50 -0.98 0.00 0.00 0.00 175.76 174.66 1w36 s ARG 547 N -3.72 0.57 0.86 0.00 1.70 -0.92 -4.97 118.95 112.47 1w36 s ARG 547 Ca 0.03 0.76 -0.11 0.00 -0.47 0.00 0.00 55.73 55.94 1w36 s ARG 547 Cb -0.02 0.22 0.11 0.00 -0.57 0.00 0.00 34.95 34.70 1w36 s ARG 547 CO -0.09 -0.09 1.14 -1.25 -1.08 0.00 0.00 175.30 173.92 1w36 s PRO 548 N 0.56 1.44 -0.08 3.89 0.04 -1.26 -0.83 135.00 138.76 1w36 s PRO 548 Ca -0.02 1.46 -0.27 0.00 0.04 0.00 0.00 61.00 62.21 1w36 s PRO 548 Cb -0.04 -1.78 -0.02 0.00 0.04 0.00 0.00 34.50 32.69 1w36 s PRO 548 CO -0.03 -2.30 0.86 0.14 0.04 0.00 0.00 177.00 175.71 1w36 s VAL 549 N -2.67 4.91 0.43 -0.36 -7.23 -1.13 -4.75 120.40 109.60 1w36 s VAL 549 Ca 0.66 1.76 0.08 0.00 -1.81 0.00 0.00 61.98 62.67 1w36 s VAL 549 Cb -0.22 -4.19 -0.00 0.00 0.56 0.00 0.00 36.38 32.54 1w36 s VAL 549 CO 0.56 0.12 0.48 -0.13 -0.31 0.00 0.00 175.10 175.82 1w36 s ARG 550 N 1.43 2.62 0.51 4.82 0.52 -1.26 -4.67 118.95 122.92 1w36 s ARG 550 Ca 0.43 -1.45 0.28 0.00 -0.52 0.00 0.00 55.73 54.47 1w36 s ARG 550 Cb -0.18 -2.52 1.37 0.00 0.52 0.00 0.00 34.95 34.13 1w36 s ARG 550 CO 0.19 -0.28 2.02 0.00 0.02 0.00 0.00 175.30 177.25 1w36 h ALA 551 N 0.82 1.18 0.00 2.13 0.00 -1.91 -2.24 119.26 119.23 1w36 h ALA 551 Ca -0.40 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1w36 h ALA 551 Cb 1.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1w36 h ALA 551 CO 0.52 0.16 0.00 -1.13 0.00 0.00 0.00 179.25 178.80 1w36 n SER 552 N -3.50 0.00 -0.17 0.00 3.41 -1.26 -2.41 113.62 109.70 1w36 n SER 552 Ca -0.01 -0.06 0.04 0.00 -0.26 0.00 0.00 58.87 58.58 1w36 n SER 552 Cb 0.28 -0.15 -0.01 0.00 -0.26 0.00 0.00 64.21 64.07 1w36 n SER 552 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1w36 n ASP 553 N -1.15 1.00 -4.93 4.04 10.43 -0.84 -4.88 116.55 120.23 1w36 n ASP 553 Ca 0.06 -1.00 -0.27 0.00 2.57 0.00 0.00 54.79 56.15 1w36 n ASP 553 Cb 0.05 0.58 -0.03 0.00 1.84 0.00 0.00 41.12 43.56 1w36 n ASP 553 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1w36 s ILE 554 N -1.40 5.17 -0.20 0.53 1.09 -1.01 -1.35 121.20 124.04 1w36 s ILE 554 Ca 0.07 -0.34 -0.14 0.00 -1.10 0.00 0.00 60.65 59.14 1w36 s ILE 554 Cb 0.07 -3.75 0.06 0.00 -1.06 0.00 0.00 42.46 37.78 1w36 s ILE 554 CO 0.26 -0.23 0.50 -0.55 -0.10 0.00 0.00 174.94 174.82 1w36 s SER 555 N -3.26 -0.59 -0.31 3.58 0.15 -0.94 -3.35 113.70 108.97 1w36 s SER 555 Ca 0.39 1.05 -0.01 0.00 0.70 0.00 0.00 55.95 58.08 1w36 s SER 555 Cb -0.11 0.99 0.06 0.00 -1.71 0.00 0.00 66.02 65.25 1w36 s SER 555 CO 0.30 -0.19 0.02 -0.69 1.20 0.00 0.00 173.24 173.88 1w36 s VAL 556 N 0.91 2.95 0.24 4.45 1.01 0.65 -0.56 120.40 130.05 1w36 s VAL 556 Ca -0.05 -1.54 -0.30 0.00 0.00 0.00 0.00 61.98 60.09 1w36 s VAL 556 Cb -0.06 -2.76 -0.09 0.00 0.00 0.00 0.00 36.38 33.47 1w36 s VAL 556 CO -0.08 -0.21 1.07 -0.76 0.00 0.00 0.00 175.10 175.12 1w36 s LEU 557 N 1.21 4.55 0.08 3.92 1.43 -0.84 -1.12 118.68 127.90 1w36 s LEU 557 Ca -0.03 2.14 -0.09 0.00 -1.03 0.00 0.00 54.13 55.12 1w36 s LEU 557 Cb -0.20 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.41 1w36 s LEU 557 CO -0.02 -0.11 0.20 0.54 0.23 0.00 0.00 176.35 177.19 1w36 s VAL 558 N -0.84 0.13 -0.66 -1.59 0.11 0.24 -4.53 120.40 113.25 1w36 s VAL 558 Ca 0.45 -1.07 0.23 0.00 -2.93 0.00 0.00 61.98 58.66 1w36 s VAL 558 Cb -0.30 -1.22 -0.13 0.00 -1.53 0.00 0.00 36.38 33.21 1w36 s VAL 558 CO 0.37 -0.59 1.01 0.54 -3.33 0.00 0.00 175.10 173.10 1w36 n ARG 559 N 0.14 0.25 -3.67 1.54 5.12 -1.26 -1.49 116.66 117.28 1w36 n ARG 559 Ca -0.16 -0.01 -0.07 0.00 -1.93 0.00 0.00 57.85 55.68 1w36 n ARG 559 Cb 0.61 -1.57 -0.02 0.00 -1.16 0.00 0.00 32.46 30.33 1w36 n ARG 559 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1w36 s SER 560 N -3.77 -0.30 0.49 0.55 1.04 -1.26 -4.94 113.70 105.51 1w36 s SER 560 Ca 0.04 -0.30 0.20 0.00 0.48 0.00 0.00 55.95 56.38 1w36 s SER 560 Cb 0.15 0.53 1.24 0.00 0.10 0.00 0.00 66.02 68.04 1w36 s SER 560 CO 0.81 -0.95 1.99 -0.09 0.98 0.00 0.00 173.24 175.98 1w36 h ARG 561 N 2.00 0.16 0.32 4.02 2.43 -1.97 -1.18 114.38 120.17 1w36 h ARG 561 Ca -0.24 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.90 1w36 h ARG 561 Cb 1.25 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.77 1w36 h ARG 561 CO 0.28 0.11 -0.15 1.96 -1.51 0.00 0.00 179.97 180.66 1w36 h GLN 562 N 0.17 -0.41 -0.66 0.20 4.20 -2.00 -2.89 115.11 113.73 1w36 h GLN 562 Ca 0.26 0.03 0.11 0.00 0.06 0.00 0.00 58.65 59.11 1w36 h GLN 562 Cb 0.79 0.09 -0.12 0.00 0.30 0.00 0.00 27.48 28.54 1w36 h GLN 562 CO -0.04 -0.20 -0.34 0.93 -0.67 0.00 0.00 178.83 178.51 1w36 h GLU 563 N -1.08 -0.13 -1.00 1.46 5.08 -1.88 0.15 114.58 117.19 1w36 h GLU 563 Ca -0.04 0.01 0.22 0.00 -1.00 0.00 0.00 59.36 58.55 1w36 h GLU 563 Cb 0.40 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.58 1w36 h GLU 563 CO 0.07 -0.09 0.62 0.00 -1.00 0.00 0.00 179.01 178.62 1w36 h ALA 564 N 1.06 1.91 0.08 3.43 0.00 -1.29 0.47 119.26 124.92 1w36 h ALA 564 Ca 0.25 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1w36 h ALA 564 Cb 0.56 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1w36 h ALA 564 CO -0.73 -0.29 -0.04 0.00 0.00 0.00 0.00 179.25 178.19 1w36 h ALA 565 N 1.65 -0.11 -1.19 0.00 0.00 -0.53 -0.88 119.26 118.20 1w36 h ALA 565 Ca 0.58 -0.18 0.38 0.00 0.00 0.00 0.00 54.91 55.69 1w36 h ALA 565 Cb 1.14 0.04 -0.13 0.00 0.00 0.00 0.00 17.79 18.85 1w36 h ALA 565 CO -0.35 -0.39 0.75 1.96 0.00 0.00 0.00 179.25 181.22 1w36 h GLN 566 N -0.46 0.18 0.05 0.00 1.08 0.27 0.35 115.11 116.58 1w36 h GLN 566 Ca -0.01 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1w36 h GLN 566 Cb 0.39 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 1w36 h GLN 566 CO 0.02 0.12 -0.02 0.28 -0.95 0.00 0.00 178.83 178.27 1w36 h VAL 567 N 0.18 0.22 -1.00 -0.54 2.07 -1.09 -3.04 116.25 113.06 1w36 h VAL 567 Ca 0.76 -1.11 0.31 0.00 0.82 0.00 0.00 66.70 67.49 1w36 h VAL 567 Cb 2.19 0.42 -0.15 0.00 -1.52 0.00 0.00 31.29 32.23 1w36 h VAL 567 CO -0.45 0.07 0.55 -0.09 0.02 0.00 0.00 177.57 177.68 1w36 h ARG 568 N -1.01 0.32 0.80 1.57 2.43 0.07 0.17 114.38 118.74 1w36 h ARG 568 Ca -0.01 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 1w36 h ARG 568 Cb 0.17 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1w36 h ARG 568 CO 0.01 0.21 -0.38 -0.44 -1.51 0.00 0.00 179.97 177.86 1w36 h ASP 569 N 0.33 -0.91 -0.04 -3.80 3.45 -0.46 0.67 116.42 115.66 1w36 h ASP 569 Ca 0.72 0.03 0.01 0.00 0.43 0.00 0.00 57.03 58.22 1w36 h ASP 569 Cb 1.62 0.24 -0.00 0.00 -0.56 0.00 0.00 39.33 40.63 1w36 h ASP 569 CO -0.60 -0.60 0.05 0.00 -1.57 0.00 0.00 179.24 176.52 1w36 h ALA 570 N -1.41 1.48 0.07 3.45 0.00 -0.91 -0.31 119.26 121.64 1w36 h ALA 570 Ca -0.11 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 1w36 h ALA 570 Cb 0.82 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.63 1w36 h ALA 570 CO 0.18 -0.07 -0.55 1.25 0.00 0.00 0.00 179.25 180.06 1w36 h LEU 571 N 0.00 0.36 -2.49 0.00 5.85 -0.54 -3.21 115.31 115.27 1w36 h LEU 571 Ca 0.02 -0.91 0.00 0.00 0.84 0.00 0.00 57.88 57.83 1w36 h LEU 571 Cb 0.13 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1w36 h LEU 571 CO -0.00 1.23 0.00 0.00 -0.34 0.00 0.00 178.44 179.33 1w36 h THR 572 N -0.47 0.00 0.00 1.05 1.03 0.19 -0.97 112.91 113.74 1w36 h THR 572 Ca -0.09 -0.15 0.00 0.00 -0.01 0.00 0.00 66.41 66.16 1w36 h THR 572 Cb 1.38 1.14 0.00 0.00 -1.07 0.00 0.00 68.15 69.60 1w36 h THR 572 CO 0.10 0.00 0.00 -0.11 -0.01 0.00 0.00 175.52 175.50 1w36 n LEU 573 N -3.05 0.53 -0.32 0.00 0.00 -0.28 -2.41 117.00 111.47 1w36 n LEU 573 Ca -0.02 0.57 0.09 0.00 0.00 0.00 0.00 56.01 56.65 1w36 n LEU 573 Cb 0.14 -0.43 0.16 0.00 0.00 0.00 0.00 43.42 43.29 1w36 n LEU 573 CO 0.22 -0.23 0.60 0.18 0.00 0.00 0.00 177.39 178.17 1w36 n LEU 574 N -2.02 2.77 -0.23 -1.96 4.77 -0.84 -4.67 117.00 114.83 1w36 n LEU 574 Ca 0.05 -2.93 -0.03 0.00 -0.03 0.00 0.00 56.01 53.07 1w36 n LEU 574 Cb 0.35 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 41.01 1w36 n LEU 574 CO 0.26 0.68 -0.03 -0.62 -1.33 0.00 0.00 177.39 176.35 1w36 n GLU 575 N -1.01 -1.31 -2.98 3.23 1.02 -1.01 -3.85 120.64 114.73 1w36 n GLU 575 Ca 0.16 0.48 -0.44 0.00 -0.02 0.00 0.00 57.16 57.35 1w36 n GLU 575 Cb 0.67 -4.54 -0.04 0.00 -0.02 0.00 0.00 31.44 27.50 1w36 n GLU 575 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1w36 s ILE 576 N -1.56 4.57 0.62 -3.67 1.01 -0.43 -4.90 121.20 116.84 1w36 s ILE 576 Ca 0.00 -0.49 -0.19 0.00 0.00 0.00 0.00 60.65 59.97 1w36 s ILE 576 Cb 0.00 -4.54 -0.03 0.00 0.01 0.00 0.00 42.46 37.90 1w36 s ILE 576 CO 0.00 -1.21 1.27 -0.81 0.00 0.00 0.00 174.94 174.19 1w36 n PRO 577 N 7.02 1.24 -3.96 2.79 -0.04 -1.26 -3.72 135.00 137.07 1w36 n PRO 577 Ca -0.05 0.48 -0.10 0.00 -0.04 0.00 0.00 63.50 63.79 1w36 n PRO 577 Cb 0.45 -2.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.34 1w36 n PRO 577 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1w36 s SER 578 N -1.24 0.02 -0.00 3.54 1.04 -1.26 -3.48 113.70 112.32 1w36 s SER 578 Ca 0.79 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 56.35 1w36 s SER 578 Cb -0.40 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.18 1w36 s SER 578 CO 0.43 -0.92 -0.01 0.54 0.98 0.00 0.00 173.24 174.27 1w36 s VAL 579 N -3.97 0.05 -1.09 5.02 0.11 -0.93 -4.96 120.40 114.63 1w36 s VAL 579 Ca 0.18 -0.02 -0.07 0.00 -2.93 0.00 0.00 61.98 59.13 1w36 s VAL 579 Cb 0.03 -0.06 0.28 0.00 -1.53 0.00 0.00 36.38 35.10 1w36 s VAL 579 CO 0.01 0.02 1.13 0.00 -3.33 0.00 0.00 175.10 172.93 1w36 n TYR 580 N 3.09 4.74 -0.37 1.54 9.36 -1.25 -0.07 117.16 134.19 1w36 n TYR 580 Ca -0.12 -3.75 0.36 0.00 3.32 0.00 0.00 57.90 57.70 1w36 n TYR 580 Cb 0.60 -1.57 0.56 0.00 -0.63 0.00 0.00 39.34 38.29 1w36 n TYR 580 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1w36 h LEU 581 N 6.37 0.00 -2.36 2.98 3.38 -1.79 0.35 115.31 124.25 1w36 h LEU 581 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1w36 h LEU 581 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1w36 h LEU 581 CO 1.05 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 178.38 1w36 n SER 582 N -3.47 3.57 -4.71 -0.43 7.64 -1.26 -4.96 113.62 110.00 1w36 n SER 582 Ca 0.30 -2.34 -0.42 0.00 1.01 0.00 0.00 58.87 57.42 1w36 n SER 582 Cb 1.69 -0.49 -0.03 0.00 -1.01 0.00 0.00 64.21 64.37 1w36 n SER 582 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1w36 s ASN 583 N -0.76 6.49 0.00 6.43 3.84 0.12 -4.92 114.94 126.15 1w36 s ASN 583 Ca 0.36 2.71 0.12 0.00 0.21 0.00 0.00 52.86 56.26 1w36 s ASN 583 Cb 0.24 -2.59 -0.11 0.00 -0.55 0.00 0.00 41.25 38.24 1w36 s ASN 583 CO 0.17 -0.91 0.56 0.54 -2.79 0.00 0.00 177.10 174.66 1w36 n ARG 584 N 4.49 2.79 -1.38 0.43 1.74 -1.26 -4.83 116.66 118.65 1w36 n ARG 584 Ca 0.15 -0.13 -0.37 0.00 -0.77 0.00 0.00 57.85 56.74 1w36 n ARG 584 Cb 0.38 -1.09 0.06 0.00 -1.02 0.00 0.00 32.46 30.78 1w36 n ARG 584 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1w36 n ASP 585 N -1.09 -0.86 -4.96 0.55 8.00 -1.26 -4.77 116.55 112.16 1w36 n ASP 585 Ca 0.03 0.67 -0.22 0.00 0.71 0.00 0.00 54.79 55.97 1w36 n ASP 585 Cb 0.20 -1.23 -0.02 0.00 -0.02 0.00 0.00 41.12 40.06 1w36 n ASP 585 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1w36 s SER 586 N -1.35 6.32 0.22 -2.24 1.04 -1.26 -2.70 113.70 113.74 1w36 s SER 586 Ca 0.68 0.19 0.22 0.00 0.48 0.00 0.00 55.95 57.52 1w36 s SER 586 Cb -0.39 -1.91 0.93 0.00 0.10 0.00 0.00 66.02 64.75 1w36 s SER 586 CO 0.55 -0.12 1.67 0.52 0.98 0.00 0.00 173.24 176.84 1w36 n VAL 587 N -1.41 0.88 0.93 5.02 0.31 0.74 -2.81 118.33 121.98 1w36 n VAL 587 Ca -0.08 0.26 0.12 0.00 -0.01 0.00 0.00 64.34 64.63 1w36 n VAL 587 Cb 0.56 -1.17 0.55 0.00 -0.91 0.00 0.00 33.84 32.87 1w36 n VAL 587 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1w36 n PHE 588 N -2.13 0.00 -2.85 3.52 3.01 -1.26 -3.35 117.46 114.39 1w36 n PHE 588 Ca 0.02 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.26 1w36 n PHE 588 Cb 0.21 -0.44 -0.02 0.00 -0.01 0.00 0.00 39.48 39.22 1w36 n PHE 588 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 1w36 n GLU 589 N -1.44 2.40 -0.20 -1.08 0.00 -1.12 -4.52 120.64 114.67 1w36 n GLU 589 Ca 0.07 -4.16 0.06 0.00 0.00 0.00 0.00 57.16 53.13 1w36 n GLU 589 Cb 0.26 -1.95 0.16 0.00 0.00 0.00 0.00 31.44 29.91 1w36 n GLU 589 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1w36 n THR 590 N -0.14 1.17 0.00 3.84 -2.24 -1.21 -4.96 114.28 110.73 1w36 n THR 590 Ca 0.28 -1.11 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 1w36 n THR 590 Cb 0.59 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 1w36 n THR 590 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1w36 n LEU 591 N 0.34 0.00 -0.10 3.22 -0.00 -1.26 -4.39 117.00 114.81 1w36 n LEU 591 Ca 0.12 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 56.00 1w36 n LEU 591 Cb 0.48 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.86 1w36 n LEU 591 CO 0.09 0.00 0.52 -0.33 -0.00 0.00 0.00 177.39 177.66 1w36 h GLU 592 N 0.00 0.85 0.09 1.96 3.07 -1.93 -2.62 114.58 116.01 1w36 h GLU 592 Ca 0.00 -0.48 0.02 0.00 -0.50 0.00 0.00 59.36 58.40 1w36 h GLU 592 Cb 0.00 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 1w36 h GLU 592 CO 0.00 1.12 -0.19 0.00 -1.40 0.00 0.00 179.01 178.54 1w36 h ALA 593 N 0.72 -0.31 -1.00 3.43 0.00 -1.79 0.34 119.26 120.65 1w36 h ALA 593 Ca 0.04 -0.02 0.24 0.00 0.00 0.00 0.00 54.91 55.17 1w36 h ALA 593 Cb 1.00 0.31 -0.09 0.00 0.00 0.00 0.00 17.79 19.02 1w36 h ALA 593 CO 0.10 -0.72 0.65 1.96 0.00 0.00 0.00 179.25 181.24 1w36 h GLN 594 N -0.36 0.42 0.00 0.00 1.08 -1.85 0.87 115.11 115.27 1w36 h GLN 594 Ca 0.03 -0.03 -0.23 0.00 -1.45 0.00 0.00 58.65 56.98 1w36 h GLN 594 Cb 0.39 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 1w36 h GLN 594 CO -0.12 0.28 -0.95 0.93 -0.95 0.00 0.00 178.83 178.01 1w36 h GLU 595 N 0.43 0.41 0.00 1.46 5.08 -0.23 -1.79 114.58 119.94 1w36 h GLU 595 Ca 0.56 -0.45 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1w36 h GLU 595 Cb 1.36 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.73 1w36 h GLU 595 CO -0.26 1.11 -0.25 0.52 -1.00 0.00 0.00 179.01 179.13 1w36 h MET 596 N 0.23 0.00 -0.13 2.33 2.86 0.15 -0.27 114.93 120.11 1w36 h MET 596 Ca -0.08 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.42 1w36 h MET 596 Cb 1.59 0.00 0.01 0.00 0.06 0.00 0.00 31.60 33.26 1w36 h MET 596 CO 0.17 0.25 -0.47 1.25 1.06 0.00 0.00 176.91 179.16 1w36 h LEU 597 N 0.00 0.63 -0.28 1.22 6.46 -0.58 -0.59 115.31 122.18 1w36 h LEU 597 Ca -0.00 -0.62 -0.02 0.00 -0.12 0.00 0.00 57.88 57.12 1w36 h LEU 597 Cb 0.57 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.31 1w36 h LEU 597 CO 0.03 1.15 0.10 -0.50 -0.62 0.00 0.00 178.44 178.60 1w36 h TRP 598 N 0.16 0.43 -0.25 1.25 6.55 -0.98 -2.34 115.95 120.77 1w36 h TRP 598 Ca -0.02 -0.04 0.05 0.00 0.95 0.00 0.00 58.89 59.83 1w36 h TRP 598 Cb 1.11 -0.13 -0.05 0.00 -0.86 0.00 0.00 29.16 29.22 1w36 h TRP 598 CO 0.11 0.45 -0.10 -0.07 -1.05 0.00 0.00 178.44 177.78 1w36 h LEU 599 N 0.29 -0.34 -0.46 -4.49 3.38 -1.03 -0.42 115.31 112.24 1w36 h LEU 599 Ca 0.09 0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.20 1w36 h LEU 599 Cb 0.21 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 1w36 h LEU 599 CO -0.01 -0.13 0.20 -0.07 0.09 0.00 0.00 178.44 178.52 1w36 h LEU 600 N -0.06 0.26 -1.44 1.67 3.38 -0.95 0.17 115.31 118.34 1w36 h LEU 600 Ca 0.13 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1w36 h LEU 600 Cb 0.25 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1w36 h LEU 600 CO -0.29 0.18 0.25 1.56 0.09 0.00 0.00 178.44 180.23 1w36 h GLN 601 N 0.40 0.62 -0.28 1.13 4.20 -1.14 0.34 115.11 120.38 1w36 h GLN 601 Ca 0.21 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.81 1w36 h GLN 601 Cb 0.16 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1w36 h GLN 601 CO -0.18 0.46 -0.00 0.00 -0.67 0.00 0.00 178.83 178.45 1w36 h ALA 602 N 1.64 0.38 -0.61 3.87 0.00 0.47 -3.02 119.26 121.98 1w36 h ALA 602 Ca 0.16 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1w36 h ALA 602 Cb 0.02 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1w36 h ALA 602 CO -0.03 0.12 0.16 0.28 0.00 0.00 0.00 179.25 179.78 1w36 h VAL 603 N 0.28 1.25 0.00 0.00 2.07 0.62 -1.87 116.25 118.61 1w36 h VAL 603 Ca 0.08 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.69 1w36 h VAL 603 Cb 0.43 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1w36 h VAL 603 CO 0.01 0.34 0.00 0.80 0.02 0.00 0.00 177.57 178.74 1w36 n MET 604 N -4.35 0.50 -2.66 1.57 0.00 0.11 -4.25 117.12 108.04 1w36 n MET 604 Ca 0.03 0.00 -0.04 0.00 0.00 0.00 0.00 57.70 57.70 1w36 n MET 604 Cb 0.24 -1.50 0.09 0.00 0.00 0.00 0.00 33.22 32.05 1w36 n MET 604 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 175.97 173.60 1w36 n THR 605 N -1.01 0.00 0.92 1.12 5.66 -0.91 -4.98 114.28 115.08 1w36 n THR 605 Ca 0.12 -0.57 0.07 0.00 -3.05 0.00 0.00 64.05 60.62 1w36 n THR 605 Cb 0.06 1.03 0.42 0.00 -1.55 0.00 0.00 70.33 70.29 1w36 n THR 605 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1w36 n PRO 606 N 1.27 0.46 0.03 1.09 -0.04 -0.75 -2.54 135.00 134.52 1w36 n PRO 606 Ca -0.01 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.32 1w36 n PRO 606 Cb 0.73 -1.48 -0.09 0.00 -0.04 0.00 0.00 33.50 32.62 1w36 n PRO 606 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1w36 h GLU 607 N 0.00 -0.06 -5.72 0.54 4.39 -1.94 -3.39 114.58 108.41 1w36 h GLU 607 Ca 0.00 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.35 1w36 h GLU 607 Cb 0.00 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.61 1w36 h GLU 607 CO 0.00 0.25 0.94 1.03 -1.16 0.00 0.00 179.01 180.07 1w36 s ARG 608 N -4.94 2.72 0.00 2.33 0.52 -1.05 -4.85 118.95 113.67 1w36 s ARG 608 Ca -0.15 -0.62 0.00 0.00 -0.52 0.00 0.00 55.73 54.44 1w36 s ARG 608 Cb 0.03 -5.15 0.00 0.00 0.52 0.00 0.00 34.95 30.35 1w36 s ARG 608 CO 0.65 -3.32 0.00 -1.91 0.02 0.00 0.00 175.30 170.74 1w36 n GLU 609 N 8.73 0.00 -0.09 3.54 2.13 -1.26 -0.32 120.64 133.36 1w36 n GLU 609 Ca 0.41 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 58.10 1w36 n GLU 609 Cb 0.47 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.14 1w36 n GLU 609 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1w36 h ASN 610 N 0.00 0.65 1.03 4.31 -0.26 -1.95 -2.67 115.58 116.70 1w36 h ASN 610 Ca 0.00 -0.45 0.00 0.00 -0.56 0.00 0.00 56.30 55.29 1w36 h ASN 610 Cb 0.00 -0.18 0.00 0.00 -1.06 0.00 0.00 38.32 37.08 1w36 h ASN 610 CO 0.00 0.96 0.00 0.71 -1.06 0.00 0.00 177.43 178.04 1w36 h THR 611 N 0.35 0.00 0.11 2.81 1.35 -1.02 -2.55 112.91 113.95 1w36 h THR 611 Ca 0.05 -0.45 -0.21 0.00 -0.55 0.00 0.00 66.41 65.25 1w36 h THR 611 Cb 0.76 1.36 0.01 0.00 -1.73 0.00 0.00 68.15 68.54 1w36 h THR 611 CO 0.06 0.00 -1.00 0.25 -0.25 0.00 0.00 175.52 174.58 1w36 h LEU 612 N 0.00 0.35 -0.94 3.87 6.46 -1.55 -3.16 115.31 120.34 1w36 h LEU 612 Ca 0.00 -0.89 0.13 0.00 -0.12 0.00 0.00 57.88 57.00 1w36 h LEU 612 Cb 0.52 -0.11 -0.09 0.00 -0.73 0.00 0.00 40.66 40.25 1w36 h LEU 612 CO 0.00 1.45 0.57 -0.09 -0.62 0.00 0.00 178.44 179.74 1w36 h ARG 613 N -0.46 0.83 -0.34 1.25 2.43 -1.31 -0.42 114.38 116.37 1w36 h ARG 613 Ca -0.21 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1w36 h ARG 613 Cb 1.60 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.94 1w36 h ARG 613 CO 0.07 0.55 0.22 0.77 -1.51 0.00 0.00 179.97 180.08 1w36 h SER 614 N 0.86 0.39 0.61 -3.80 0.02 -1.54 0.38 113.55 110.47 1w36 h SER 614 Ca 0.49 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.40 1w36 h SER 614 Cb 0.56 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 1w36 h SER 614 CO -0.30 0.28 -0.43 0.00 -1.14 0.00 0.00 176.83 175.25 1w36 h ALA 615 N 1.12 -1.05 -0.82 3.77 0.00 -1.10 -1.64 119.26 119.55 1w36 h ALA 615 Ca 0.12 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 55.06 1w36 h ALA 615 Cb -0.05 0.56 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1w36 h ALA 615 CO -0.03 -1.11 0.57 -0.07 0.00 0.00 0.00 179.25 178.62 1w36 h LEU 616 N -1.00 0.12 -0.01 0.00 3.38 -0.98 -0.54 115.31 116.28 1w36 h LEU 616 Ca -0.07 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1w36 h LEU 616 Cb 0.83 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1w36 h LEU 616 CO 0.04 0.05 -0.03 0.00 0.09 0.00 0.00 178.44 178.58 1w36 n ALA 617 N -2.64 2.44 -1.75 1.53 0.00 0.11 -4.44 120.51 115.77 1w36 n ALA 617 Ca 0.17 -0.13 -0.38 0.00 0.00 0.00 0.00 53.44 53.10 1w36 n ALA 617 Cb 0.81 -1.45 0.04 0.00 0.00 0.00 0.00 19.45 18.85 1w36 n ALA 617 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1w36 s THR 618 N -2.92 2.03 -0.37 0.00 -4.23 -0.21 -4.85 115.64 105.09 1w36 s THR 618 Ca 0.17 0.02 0.23 0.00 -1.18 0.00 0.00 61.69 60.93 1w36 s THR 618 Cb 0.19 -3.01 0.24 0.00 1.34 0.00 0.00 72.50 71.26 1w36 s THR 618 CO 0.53 -0.00 1.70 -1.54 -0.54 0.00 0.00 174.62 174.77 1w36 n SER 619 N -1.10 0.66 -0.14 3.99 3.41 -1.26 -2.31 113.62 116.87 1w36 n SER 619 Ca 0.11 0.70 -0.10 0.00 -0.26 0.00 0.00 58.87 59.32 1w36 n SER 619 Cb 0.45 -0.83 -0.02 0.00 -0.26 0.00 0.00 64.21 63.56 1w36 n SER 619 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1w36 h MET 620 N 0.00 0.70 0.00 4.33 1.85 -1.93 -2.92 114.93 116.96 1w36 h MET 620 Ca 0.00 -0.23 0.00 0.00 -0.61 0.00 0.00 59.70 58.86 1w36 h MET 620 Cb 0.25 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 32.21 1w36 h MET 620 CO 0.00 0.79 0.00 -1.33 -0.40 0.00 0.00 176.91 175.97 1w36 n MET 621 N -4.45 0.26 -2.08 0.39 2.00 -0.98 -4.93 117.12 107.34 1w36 n MET 621 Ca -0.01 0.09 -0.20 0.00 0.00 0.00 0.00 57.70 57.57 1w36 n MET 621 Cb 0.29 -1.50 -0.04 0.00 0.00 0.00 0.00 33.22 31.97 1w36 n MET 621 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1w36 n GLY 622 N 0.58 0.47 3.85 3.03 0.00 -1.10 -5.02 105.19 107.01 1w36 n GLY 622 Ca 0.10 -0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1w36 n GLY 622 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1w36 s LEU 623 N -5.39 2.26 0.23 0.99 1.43 -1.26 -5.08 118.68 111.86 1w36 s LEU 623 Ca 0.00 0.78 0.07 0.00 -1.03 0.00 0.00 54.13 53.94 1w36 s LEU 623 Cb 0.00 -3.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.07 1w36 s LEU 623 CO 0.00 -2.37 0.18 0.20 0.23 0.00 0.00 176.35 174.59 1w36 s ASN 624 N -4.37 5.49 0.15 2.29 0.01 -1.26 -4.96 114.94 112.28 1w36 s ASN 624 Ca 0.65 -0.24 -0.11 0.00 -0.71 0.00 0.00 52.86 52.44 1w36 s ASN 624 Cb -0.11 -1.39 0.01 0.00 0.41 0.00 0.00 41.25 40.17 1w36 s ASN 624 CO 0.52 -0.01 1.58 0.00 -1.51 0.00 0.00 177.10 177.67 1w36 h ALA 625 N 1.70 0.68 -0.52 0.60 0.00 -1.98 0.30 119.26 120.03 1w36 h ALA 625 Ca -0.48 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.08 1w36 h ALA 625 Cb 1.23 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1w36 h ALA 625 CO 0.61 0.55 0.21 1.25 0.00 0.00 0.00 179.25 181.87 1w36 h LEU 626 N 0.78 0.68 0.75 0.00 7.12 -1.99 -0.55 115.31 122.10 1w36 h LEU 626 Ca 0.13 -0.08 -0.04 0.00 0.13 0.00 0.00 57.88 58.03 1w36 h LEU 626 Cb 0.61 -0.17 0.01 0.00 -0.53 0.00 0.00 40.66 40.58 1w36 h LEU 626 CO 0.04 0.61 -0.36 0.44 -0.13 0.00 0.00 178.44 179.04 1w36 h ASP 627 N 0.74 -0.85 -0.73 1.25 3.32 -1.68 -1.96 116.42 116.51 1w36 h ASP 627 Ca 0.18 0.03 0.16 0.00 0.02 0.00 0.00 57.03 57.42 1w36 h ASP 627 Cb 0.15 0.22 -0.13 0.00 0.22 0.00 0.00 39.33 39.79 1w36 h ASP 627 CO -0.02 -0.53 -0.03 0.40 -1.72 0.00 0.00 179.24 177.34 1w36 h ILE 628 N -1.17 0.35 0.33 0.35 1.08 -0.15 -1.36 117.51 116.93 1w36 h ILE 628 Ca -0.10 -0.03 -0.01 0.00 -0.39 0.00 0.00 64.86 64.33 1w36 h ILE 628 Cb 0.77 0.26 -0.01 0.00 -3.07 0.00 0.00 36.82 34.77 1w36 h ILE 628 CO 0.17 0.01 -0.27 -0.08 -0.69 0.00 0.00 178.15 177.30 1w36 h GLU 629 N 0.08 -0.58 -0.03 2.37 4.57 -1.08 -2.68 114.58 117.23 1w36 h GLU 629 Ca 0.39 0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.58 1w36 h GLU 629 Cb 0.66 0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.38 1w36 h GLU 629 CO -0.66 -0.39 -0.12 1.79 -1.18 0.00 0.00 179.01 178.45 1w36 h THR 630 N -0.61 1.11 0.00 0.32 1.35 -0.51 0.11 112.91 114.69 1w36 h THR 630 Ca -0.02 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1w36 h THR 630 Cb 0.53 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1w36 h THR 630 CO -0.01 0.14 0.00 -0.11 -0.25 0.00 0.00 175.52 175.29 1w36 n LEU 631 N -4.37 0.59 0.03 3.87 0.00 -0.60 -1.93 117.00 114.58 1w36 n LEU 631 Ca -0.02 0.59 -0.05 0.00 0.00 0.00 0.00 56.01 56.52 1w36 n LEU 631 Cb 0.21 -0.44 -0.11 0.00 0.00 0.00 0.00 43.42 43.08 1w36 n LEU 631 CO 0.36 -0.29 -0.16 0.78 0.00 0.00 0.00 177.39 178.08 1w36 h ASN 632 N 0.00 0.00 0.59 1.96 2.35 -0.65 -3.34 115.58 116.50 1w36 h ASN 632 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1w36 h ASN 632 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 1w36 h ASN 632 CO 0.00 0.88 -0.67 0.59 -1.65 0.00 0.00 177.43 176.57 1w36 n ASN 633 N -3.14 0.60 -4.21 5.81 3.02 -1.01 -4.64 115.26 111.69 1w36 n ASN 633 Ca -0.08 -0.14 -0.41 0.00 -0.03 0.00 0.00 54.58 53.93 1w36 n ASN 633 Cb 0.95 0.36 -0.04 0.00 -0.61 0.00 0.00 39.78 40.44 1w36 n ASN 633 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1w36 s ASP 634 N -3.62 6.49 0.37 6.41 -1.08 -0.81 -4.95 116.67 119.48 1w36 s ASP 634 Ca 0.08 -3.48 0.26 0.00 -0.52 0.00 0.00 52.55 48.89 1w36 s ASP 634 Cb 0.15 -2.05 1.34 0.00 -1.46 0.00 0.00 42.92 40.91 1w36 s ASP 634 CO 0.73 -0.28 1.78 -0.08 0.52 0.00 0.00 175.17 177.84 1w36 h GLU 635 N 6.55 0.00 0.22 4.34 4.81 -1.83 -2.00 114.58 126.67 1w36 h GLU 635 Ca 0.14 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 59.04 1w36 h GLU 635 Cb 0.87 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.28 1w36 h GLU 635 CO 0.88 0.00 -1.51 1.12 -0.73 0.00 0.00 179.01 178.78 1w36 h HIS 636 N 0.00 0.86 -0.31 0.92 2.07 -1.95 -3.08 115.15 113.66 1w36 h HIS 636 Ca 0.00 -0.63 -0.05 0.00 -2.85 0.00 0.00 60.37 56.85 1w36 h HIS 636 Cb 0.06 -0.03 -0.02 0.00 2.57 0.00 0.00 27.41 29.99 1w36 h HIS 636 CO 0.00 1.58 -0.01 0.00 -3.07 0.00 0.00 177.93 176.43 1w36 h ALA 637 N 0.12 1.40 0.17 6.11 0.00 -1.75 -2.83 119.26 122.48 1w36 h ALA 637 Ca -0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1w36 h ALA 637 Cb 2.09 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1w36 h ALA 637 CO 0.23 0.42 -0.08 2.35 0.00 0.00 0.00 179.25 182.17 1w36 h TRP 638 N 0.46 -0.21 0.00 0.00 2.91 -1.47 -2.18 115.95 115.46 1w36 h TRP 638 Ca 0.10 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.11 1w36 h TRP 638 Cb 0.32 0.07 0.00 0.00 -0.51 0.00 0.00 29.16 29.04 1w36 h TRP 638 CO 0.01 0.08 0.00 -0.25 -1.03 0.00 0.00 178.44 177.25 1w36 n ASP 639 N -5.07 0.55 0.01 2.65 8.00 -1.12 0.01 116.55 121.58 1w36 n ASP 639 Ca -0.09 0.74 -0.17 0.00 0.71 0.00 0.00 54.79 55.98 1w36 n ASP 639 Cb 0.21 -0.82 -0.12 0.00 -0.02 0.00 0.00 41.12 40.37 1w36 n ASP 639 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1w36 h VAL 640 N 0.00 1.49 -0.12 2.53 2.07 -1.22 -1.36 116.25 119.63 1w36 h VAL 640 Ca 0.00 -2.17 -0.08 0.00 0.82 0.00 0.00 66.70 65.27 1w36 h VAL 640 Cb 0.03 2.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 1w36 h VAL 640 CO 0.00 0.62 -0.28 0.58 0.02 0.00 0.00 177.57 178.51 1w36 h VAL 641 N -0.28 1.25 -0.59 2.57 2.07 0.11 0.15 116.25 121.54 1w36 h VAL 641 Ca -0.08 -1.17 -0.10 0.00 0.82 0.00 0.00 66.70 66.17 1w36 h VAL 641 Cb 1.32 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.53 1w36 h VAL 641 CO 0.11 0.35 -0.02 0.58 0.02 0.00 0.00 177.57 178.61 1w36 h VAL 642 N 0.20 1.27 0.03 2.57 2.07 -0.33 -1.09 116.25 120.97 1w36 h VAL 642 Ca 0.03 -1.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.38 1w36 h VAL 642 Cb 0.60 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1w36 h VAL 642 CO 0.04 0.42 -0.02 -0.08 0.02 0.00 0.00 177.57 177.96 1w36 h GLU 643 N 0.95 -0.04 -0.84 1.57 4.57 -0.49 0.14 114.58 120.43 1w36 h GLU 643 Ca 0.16 0.00 0.21 0.00 -1.18 0.00 0.00 59.36 58.55 1w36 h GLU 643 Cb 0.58 0.01 -0.15 0.00 -0.16 0.00 0.00 28.75 29.03 1w36 h GLU 643 CO 0.03 0.08 0.02 1.49 -1.18 0.00 0.00 179.01 179.46 1w36 h GLU 644 N -0.15 0.08 -0.02 1.92 4.81 -0.76 0.48 114.58 120.95 1w36 h GLU 644 Ca -0.00 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.08 1w36 h GLU 644 Cb 0.14 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 1w36 h GLU 644 CO 0.01 0.06 -0.65 0.74 -0.73 0.00 0.00 179.01 178.44 1w36 h PHE 645 N 0.09 0.12 -0.14 0.92 -1.00 -0.42 -2.03 116.94 114.48 1w36 h PHE 645 Ca 0.48 -0.05 -0.07 0.00 2.81 0.00 0.00 57.97 61.15 1w36 h PHE 645 Cb 0.90 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.43 1w36 h PHE 645 CO -0.44 0.71 -0.21 0.22 -1.61 0.00 0.00 178.31 176.97 1w36 h ASP 646 N 0.06 0.22 -0.56 2.17 3.58 0.25 -1.39 116.42 120.75 1w36 h ASP 646 Ca -0.01 -0.06 -0.04 0.00 0.42 0.00 0.00 57.03 57.34 1w36 h ASP 646 Cb 1.15 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 42.12 1w36 h ASP 646 CO 0.09 0.45 0.20 1.23 -2.88 0.00 0.00 179.24 178.33 1w36 h GLY 647 N 0.88 0.92 1.01 -0.78 0.00 0.37 -2.48 103.07 102.99 1w36 h GLY 647 Ca 0.04 -0.52 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 1w36 h GLY 647 CO 0.03 0.49 0.19 -0.97 0.00 0.00 0.00 176.54 176.29 1w36 h TYR 648 N 0.78 0.96 -0.60 5.60 0.05 -0.61 -1.49 116.97 121.66 1w36 h TYR 648 Ca 0.19 -0.10 0.14 0.00 0.05 0.00 0.00 58.73 59.01 1w36 h TYR 648 Cb 0.24 -0.28 -0.03 0.00 1.01 0.00 0.00 36.73 37.67 1w36 h TYR 648 CO 0.01 0.79 0.41 0.07 -1.05 0.00 0.00 178.16 178.40 1w36 h ARG 649 N 0.85 0.20 0.05 4.88 0.11 -1.00 0.37 114.38 119.85 1w36 h ARG 649 Ca 0.19 -0.01 -0.00 0.00 0.10 0.00 0.00 59.98 60.26 1w36 h ARG 649 Cb 0.28 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.31 1w36 h ARG 649 CO -0.01 0.14 -0.02 0.37 0.10 0.00 0.00 179.97 180.54 1w36 h GLN 650 N 0.21 -0.07 -0.49 0.08 5.75 -0.84 0.13 115.11 119.88 1w36 h GLN 650 Ca 0.29 0.00 0.06 0.00 -0.15 0.00 0.00 58.65 58.85 1w36 h GLN 650 Cb 0.84 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.35 1w36 h GLN 650 CO -0.05 0.27 0.19 0.82 -2.65 0.00 0.00 178.83 177.41 1w36 h ILE 651 N -0.41 0.86 -0.13 2.39 1.08 -0.70 -1.52 117.51 119.08 1w36 h ILE 651 Ca -0.01 -0.13 0.03 0.00 -0.39 0.00 0.00 64.86 64.37 1w36 h ILE 651 Cb 0.37 0.45 -0.04 0.00 -3.07 0.00 0.00 36.82 34.53 1w36 h ILE 651 CO 0.01 0.07 -0.09 -0.25 -0.69 0.00 0.00 178.15 177.20 1w36 h TRP 652 N 0.38 -0.22 -0.50 1.37 2.91 -0.77 0.27 115.95 119.39 1w36 h TRP 652 Ca 0.23 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.28 1w36 h TRP 652 Cb 0.22 0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 28.97 1w36 h TRP 652 CO -0.15 -0.14 0.33 0.00 -1.03 0.00 0.00 178.44 177.45 1w36 h ARG 653 N -0.10 0.63 0.00 2.65 3.08 -0.08 -2.71 114.38 117.85 1w36 h ARG 653 Ca 0.08 -0.04 -0.20 0.00 0.07 0.00 0.00 59.98 59.90 1w36 h ARG 653 Cb 0.22 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1w36 h ARG 653 CO -0.19 0.42 -1.15 0.87 -1.07 0.00 0.00 179.97 178.85 1w36 h LYS 654 N 0.65 0.00 0.00 0.04 1.57 -0.75 -3.43 116.57 114.65 1w36 h LYS 654 Ca 0.19 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 1w36 h LYS 654 Cb -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1w36 h LYS 654 CO -0.04 0.84 -1.92 0.54 -0.57 0.00 0.00 179.45 178.30 1w36 n ARG 655 N -4.46 0.63 0.00 3.15 5.12 0.91 -5.10 116.66 116.91 1w36 n ARG 655 Ca -0.28 -0.16 0.00 0.00 -1.93 0.00 0.00 57.85 55.47 1w36 n ARG 655 Cb 0.62 -1.46 0.00 0.00 -1.16 0.00 0.00 32.46 30.45 1w36 n ARG 655 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1w36 n GLY 656 N 1.44 2.88 0.18 -0.13 0.00 -1.02 -4.74 105.19 103.80 1w36 n GLY 656 Ca -0.06 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 43.86 1w36 n GLY 656 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1w36 h VAL 657 N 0.33 1.28 -0.11 1.61 2.07 -1.90 -2.49 116.25 117.04 1w36 h VAL 657 Ca 0.00 -1.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 1w36 h VAL 657 Cb 0.00 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1w36 h VAL 657 CO 0.00 0.35 0.05 -0.03 0.02 0.00 0.00 177.57 177.96 1w36 h MET 658 N 0.29 0.16 0.00 1.57 1.85 -1.91 0.73 114.93 117.62 1w36 h MET 658 Ca 0.07 -0.02 -0.00 0.00 -0.61 0.00 0.00 59.70 59.13 1w36 h MET 658 Cb 0.55 -0.03 -0.00 0.00 0.43 0.00 0.00 31.60 32.55 1w36 h MET 658 CO 0.03 0.23 -0.01 -1.35 -0.40 0.00 0.00 176.91 175.41 1w36 h PRO 659 N 0.05 0.00 0.04 0.39 0.11 -1.85 0.12 132.00 130.86 1w36 h PRO 659 Ca 0.04 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.15 1w36 h PRO 659 Cb 0.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.24 1w36 h PRO 659 CO -0.00 0.01 -0.02 1.98 -0.21 0.00 0.00 178.00 179.76 1w36 h MET 660 N 0.00 -0.05 0.00 1.05 1.85 -0.93 -2.72 114.93 114.13 1w36 h MET 660 Ca -0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 59.09 1w36 h MET 660 Cb 0.02 0.01 -0.00 0.00 0.43 0.00 0.00 31.60 32.06 1w36 h MET 660 CO 0.00 0.59 -0.04 -0.07 -0.40 0.00 0.00 176.91 176.99 1w36 h LEU 661 N -0.78 0.00 -0.24 3.39 3.38 -0.52 -0.77 115.31 119.76 1w36 h LEU 661 Ca -0.01 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.75 1w36 h LEU 661 Cb 0.67 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1w36 h LEU 661 CO 0.01 0.04 -0.89 -0.09 0.09 0.00 0.00 178.44 177.60 1w36 h ARG 662 N 0.00 0.35 0.65 1.13 2.43 -0.74 -1.82 114.38 116.38 1w36 h ARG 662 Ca -0.00 -0.36 -0.03 0.00 -0.81 0.00 0.00 59.98 58.78 1w36 h ARG 662 Cb 0.14 0.10 0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1w36 h ARG 662 CO 0.01 1.04 -0.31 0.00 -1.51 0.00 0.00 179.97 179.19 1w36 h ALA 663 N 0.84 -0.87 -0.42 2.80 0.00 -0.90 -1.59 119.26 119.12 1w36 h ALA 663 Ca -0.06 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 54.74 1w36 h ALA 663 Cb 1.51 0.34 -0.08 0.00 0.00 0.00 0.00 17.79 19.56 1w36 h ALA 663 CO 0.15 -0.97 -0.13 1.25 0.00 0.00 0.00 179.25 179.54 1w36 h LEU 664 N -0.91 -0.48 -0.90 0.00 5.85 -1.18 -1.50 115.31 116.18 1w36 h LEU 664 Ca -0.09 0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.84 1w36 h LEU 664 Cb 0.68 0.29 -0.07 0.00 0.37 0.00 0.00 40.66 41.94 1w36 h LEU 664 CO 0.15 -0.17 0.57 0.24 -0.34 0.00 0.00 178.44 178.88 1w36 h MET 665 N -0.04 0.99 -0.29 1.25 2.86 -1.15 -1.67 114.93 116.87 1w36 h MET 665 Ca 0.20 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.72 1w36 h MET 665 Cb 0.35 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 1w36 h MET 665 CO -0.45 0.65 -0.09 0.77 1.06 0.00 0.00 176.91 178.85 1w36 h SER 666 N 1.02 0.45 0.17 1.22 0.02 -0.29 -0.66 113.55 115.46 1w36 h SER 666 Ca 0.40 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 61.24 1w36 h SER 666 Cb 0.20 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1w36 h SER 666 CO -0.18 0.58 -0.08 0.00 -1.14 0.00 0.00 176.83 176.01 1w36 h ALA 667 N 1.47 -0.52 0.00 3.77 0.00 -0.66 -3.00 119.26 120.32 1w36 h ALA 667 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1w36 h ALA 667 Cb 0.43 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1w36 h ALA 667 CO 0.02 -0.51 0.00 0.54 0.00 0.00 0.00 179.25 179.31 1w36 n ARG 668 N -3.12 0.56 -3.12 0.00 5.12 -0.71 -4.82 116.66 110.56 1w36 n ARG 668 Ca -0.03 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.75 1w36 n ARG 668 Cb 0.09 -1.26 -0.04 0.00 -1.16 0.00 0.00 32.46 30.09 1w36 n ARG 668 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1w36 n ASN 669 N 0.40 0.05 0.16 0.55 3.02 -0.36 -4.84 115.26 114.23 1w36 n ASN 669 Ca 0.00 -0.54 -0.14 0.00 -0.03 0.00 0.00 54.58 53.87 1w36 n ASN 669 Cb 0.19 -0.67 -0.08 0.00 -0.61 0.00 0.00 39.78 38.61 1w36 n ASN 669 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1w36 h ILE 670 N -0.23 0.77 -0.29 2.41 1.08 -1.58 -2.65 117.51 117.01 1w36 h ILE 670 Ca -0.27 -0.13 -0.02 0.00 -0.39 0.00 0.00 64.86 64.06 1w36 h ILE 670 Cb 0.59 0.85 -0.01 0.00 -3.07 0.00 0.00 36.82 35.17 1w36 h ILE 670 CO 0.32 0.03 0.11 0.00 -0.69 0.00 0.00 178.15 177.93 1w36 h ALA 671 N 0.33 0.38 0.35 1.87 0.00 -1.88 0.38 119.26 120.69 1w36 h ALA 671 Ca -0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1w36 h ALA 671 Cb 0.31 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1w36 h ALA 671 CO 0.06 -0.02 -0.41 0.93 0.00 0.00 0.00 179.25 179.81 1w36 h GLU 672 N 0.33 -0.74 -0.03 0.00 5.08 -1.93 -1.40 114.58 115.88 1w36 h GLU 672 Ca 0.10 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1w36 h GLU 672 Cb 0.19 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1w36 h GLU 672 CO -0.01 -0.50 -0.07 -0.91 -1.00 0.00 0.00 179.01 176.53 1w36 h ASN 673 N -0.77 -0.20 -0.68 1.42 2.35 -1.34 -2.66 115.58 113.69 1w36 h ASN 673 Ca -0.04 0.04 0.14 0.00 -0.55 0.00 0.00 56.30 55.89 1w36 h ASN 673 Cb 0.69 0.09 -0.10 0.00 0.05 0.00 0.00 38.32 39.04 1w36 h ASN 673 CO -0.08 -0.10 0.12 -0.07 -1.65 0.00 0.00 177.43 175.65 1w36 h LEU 674 N -0.11 -0.07 -2.35 1.61 3.38 -0.16 -0.92 115.31 116.68 1w36 h LEU 674 Ca 0.04 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1w36 h LEU 674 Cb 0.16 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1w36 h LEU 674 CO -0.09 -0.05 -0.03 -0.07 0.09 0.00 0.00 178.44 178.28 1w36 h LEU 675 N 0.23 0.00 -0.21 1.67 3.38 -0.91 0.12 115.31 119.59 1w36 h LEU 675 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1w36 h LEU 675 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1w36 h LEU 675 CO -0.50 0.03 -0.05 0.00 0.09 0.00 0.00 178.44 178.02 1w36 n ALA 676 N -2.28 2.67 -1.89 1.53 0.00 -0.36 -4.56 120.51 115.62 1w36 n ALA 676 Ca -0.03 -0.25 -0.33 0.00 0.00 0.00 0.00 53.44 52.83 1w36 n ALA 676 Cb 0.13 -1.39 0.04 0.00 0.00 0.00 0.00 19.45 18.22 1w36 n ALA 676 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1w36 n THR 677 N -0.89 3.19 -2.16 0.00 -1.04 0.43 -5.03 114.28 108.79 1w36 n THR 677 Ca 0.18 -4.03 0.00 0.00 -2.04 0.00 0.00 64.05 58.15 1w36 n THR 677 Cb 0.23 -1.21 0.00 0.00 -1.82 0.00 0.00 70.33 67.54 1w36 n THR 677 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1w36 n ALA 678 N -0.66 -1.53 -0.97 2.41 0.00 -1.26 -3.70 120.51 114.80 1w36 n ALA 678 Ca 0.52 0.27 0.00 0.00 0.00 0.00 0.00 53.44 54.22 1w36 n ALA 678 Cb 0.56 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.98 1w36 n ALA 678 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w36 n GLY 679 N 1.91 0.09 0.04 0.00 0.00 -1.26 -4.81 105.19 101.15 1w36 n GLY 679 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1w36 n GLY 679 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w36 n GLY 680 N 0.17 -1.19 0.14 -0.02 0.00 -1.24 -2.66 105.19 100.39 1w36 n GLY 680 Ca 0.00 -0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 1w36 n GLY 680 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1w36 h GLU 681 N 0.00 0.46 -0.13 1.61 4.81 -1.85 -1.83 114.58 117.65 1w36 h GLU 681 Ca 0.00 -0.76 0.04 0.00 -0.13 0.00 0.00 59.36 58.51 1w36 h GLU 681 Cb 0.35 0.28 -0.05 0.00 0.63 0.00 0.00 28.75 29.96 1w36 h GLU 681 CO 0.00 1.36 -0.16 -0.09 -0.73 0.00 0.00 179.01 179.39 1w36 h ARG 682 N -0.04 -0.19 -0.56 1.92 1.12 -1.90 0.56 114.38 115.29 1w36 h ARG 682 Ca -0.21 0.01 -0.02 0.00 -1.11 0.00 0.00 59.98 58.65 1w36 h ARG 682 Cb 1.94 0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 31.91 1w36 h ARG 682 CO 0.23 -0.13 0.26 0.00 -3.11 0.00 0.00 179.97 177.22 1w36 h ARG 683 N -0.20 0.81 -0.31 0.20 3.08 -1.58 -1.82 114.38 114.56 1w36 h ARG 683 Ca 0.09 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1w36 h ARG 683 Cb 0.33 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1w36 h ARG 683 CO -0.24 0.68 0.14 1.25 -1.07 0.00 0.00 179.97 180.73 1w36 h LEU 684 N 0.76 0.41 -1.24 3.04 5.85 -0.71 -0.65 115.31 122.77 1w36 h LEU 684 Ca 0.19 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.70 1w36 h LEU 684 Cb 0.14 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1w36 h LEU 684 CO -0.02 0.43 -0.37 0.71 -0.34 0.00 0.00 178.44 178.85 1w36 h THR 685 N 0.36 1.16 -0.29 1.05 1.35 -0.78 -2.23 112.91 113.53 1w36 h THR 685 Ca 0.11 -1.30 -0.08 0.00 -0.55 0.00 0.00 66.41 64.58 1w36 h THR 685 Cb 0.13 1.72 -0.01 0.00 -1.73 0.00 0.00 68.15 68.27 1w36 h THR 685 CO -0.01 0.36 -0.13 0.44 -0.25 0.00 0.00 175.52 175.92 1w36 h ASP 686 N 0.00 0.62 -0.98 5.36 3.45 -0.55 -1.44 116.42 122.88 1w36 h ASP 686 Ca -0.00 -0.40 0.10 0.00 0.43 0.00 0.00 57.03 57.15 1w36 h ASP 686 Cb 0.69 -0.17 -0.08 0.00 -0.56 0.00 0.00 39.33 39.21 1w36 h ASP 686 CO 0.05 0.89 0.61 0.40 -1.57 0.00 0.00 179.24 179.62 1w36 h ILE 687 N 0.35 0.96 -0.55 0.35 2.04 -0.82 -0.02 117.51 119.83 1w36 h ILE 687 Ca 0.07 -0.35 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 1w36 h ILE 687 Cb 0.65 -0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 1w36 h ILE 687 CO 0.04 0.19 -0.03 -0.07 0.00 0.00 0.00 178.15 178.28 1w36 h LEU 688 N 1.02 0.95 -0.60 1.44 4.07 -1.18 -2.17 115.31 118.83 1w36 h LEU 688 Ca 0.47 -0.27 -0.05 0.00 0.08 0.00 0.00 57.88 58.10 1w36 h LEU 688 Cb 0.39 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 41.85 1w36 h LEU 688 CO -0.24 1.02 0.16 -0.74 -1.08 0.00 0.00 178.44 177.57 1w36 h HIS 689 N 0.88 1.00 -0.59 1.13 2.76 -0.07 -1.23 115.15 119.03 1w36 h HIS 689 Ca 0.16 -0.11 -0.06 0.00 -2.20 0.00 0.00 60.37 58.16 1w36 h HIS 689 Cb 0.56 -0.28 -0.03 0.00 1.55 0.00 0.00 27.41 29.21 1w36 h HIS 689 CO 0.04 0.84 0.14 0.82 -1.30 0.00 0.00 177.93 178.46 1w36 h ILE 690 N 0.87 1.24 -0.11 6.26 2.04 -0.86 -2.12 117.51 124.83 1w36 h ILE 690 Ca 0.19 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 65.14 1w36 h ILE 690 Cb 0.33 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1w36 h ILE 690 CO -0.00 0.33 -0.13 0.28 0.00 0.00 0.00 178.15 178.62 1w36 h SER 691 N 0.88 0.17 -0.38 1.72 0.02 -0.70 0.61 113.55 115.86 1w36 h SER 691 Ca 0.19 -0.03 -0.13 0.00 -0.84 0.00 0.00 61.79 60.98 1w36 h SER 691 Cb 0.32 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 1w36 h SER 691 CO -0.00 0.32 -0.26 -0.33 -1.14 0.00 0.00 176.83 175.42 1w36 h GLU 692 N 0.17 0.89 -0.21 3.45 5.08 -0.61 -1.92 114.58 121.43 1w36 h GLU 692 Ca 0.04 -0.39 -0.15 0.00 -1.00 0.00 0.00 59.36 57.85 1w36 h GLU 692 Cb 0.35 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1w36 h GLU 692 CO 0.02 1.04 -0.46 -0.07 -1.00 0.00 0.00 179.01 178.54 1w36 h LEU 693 N 0.76 0.78 -1.96 1.33 3.38 -0.71 -2.90 115.31 115.98 1w36 h LEU 693 Ca 0.09 -0.55 0.09 0.00 0.09 0.00 0.00 57.88 57.60 1w36 h LEU 693 Cb 0.82 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1w36 h LEU 693 CO 0.07 1.19 0.25 -0.07 0.09 0.00 0.00 178.44 179.97 1w36 h LEU 694 N 0.40 0.04 0.01 1.67 4.07 0.21 -2.07 115.31 119.63 1w36 h LEU 694 Ca 0.00 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.73 1w36 h LEU 694 Cb 1.07 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.79 1w36 h LEU 694 CO 0.10 0.02 -1.09 1.56 -1.08 0.00 0.00 178.44 177.95 1w36 h GLN 695 N 0.04 0.17 0.28 1.13 1.08 -1.15 -2.55 115.11 114.12 1w36 h GLN 695 Ca 0.17 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 1w36 h GLN 695 Cb 0.61 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.14 1w36 h GLN 695 CO -0.01 1.10 -0.14 0.93 -0.95 0.00 0.00 178.83 179.76 1w36 h GLU 696 N 0.06 -0.37 -0.93 1.46 5.08 -1.38 -3.19 114.58 115.31 1w36 h GLU 696 Ca -0.08 0.03 0.26 0.00 -1.00 0.00 0.00 59.36 58.57 1w36 h GLU 696 Cb 1.82 0.08 -0.14 0.00 0.50 0.00 0.00 28.75 31.01 1w36 h GLU 696 CO 0.17 -0.09 0.39 0.00 -1.00 0.00 0.00 179.01 178.47 1w36 h ALA 697 N -0.77 1.55 -0.00 3.43 0.00 -1.49 0.42 119.26 122.40 1w36 h ALA 697 Ca -0.04 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1w36 h ALA 697 Cb 0.45 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1w36 h ALA 697 CO 0.06 -0.47 0.02 0.78 0.00 0.00 0.00 179.25 179.64 1w36 h GLY 698 N 0.29 0.00 -2.56 0.00 0.00 -1.44 -2.00 103.07 97.36 1w36 h GLY 698 Ca 0.62 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.88 1w36 h GLY 698 CO -0.61 0.00 0.09 -1.30 0.00 0.00 0.00 176.54 174.72 1w36 n THR 699 N -3.15 1.68 -2.29 4.70 -2.24 0.14 -3.26 114.28 109.84 1w36 n THR 699 Ca -0.03 -0.83 0.01 0.00 -2.27 0.00 0.00 64.05 60.93 1w36 n THR 699 Cb 0.09 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 1w36 n THR 699 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1w36 n GLN 700 N 0.15 0.00 -3.66 -0.78 1.13 -0.75 -5.05 117.38 108.42 1w36 n GLN 700 Ca 0.19 -1.53 -0.11 0.00 -1.94 0.00 0.00 57.00 53.62 1w36 n GLN 700 Cb 0.86 -0.01 -0.08 0.00 0.11 0.00 0.00 30.24 31.11 1w36 n GLN 700 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1w36 s LEU 701 N 0.00 -0.47 -0.44 1.08 1.43 -1.20 -5.05 118.68 114.02 1w36 s LEU 701 Ca 0.20 1.25 0.04 0.00 -1.03 0.00 0.00 54.13 54.59 1w36 s LEU 701 Cb 0.23 2.03 0.62 0.00 0.03 0.00 0.00 46.19 49.09 1w36 s LEU 701 CO -0.10 -0.22 1.84 1.21 0.23 0.00 0.00 176.35 179.32 1w36 n GLU 702 N 3.55 2.24 -3.88 1.70 4.07 -1.26 -4.89 120.64 122.17 1w36 n GLU 702 Ca -0.18 -3.09 -0.11 0.00 -0.06 0.00 0.00 57.16 53.73 1w36 n GLU 702 Cb 0.57 -2.13 -0.10 0.00 -0.06 0.00 0.00 31.44 29.72 1w36 n GLU 702 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1w36 s SER 703 N -1.61 0.04 -0.08 4.31 0.15 -1.26 -5.03 113.70 110.23 1w36 s SER 703 Ca 0.56 -0.23 -0.27 0.00 0.70 0.00 0.00 55.95 56.71 1w36 s SER 703 Cb 0.47 0.20 -0.23 0.00 -1.71 0.00 0.00 66.02 64.74 1w36 s SER 703 CO 0.08 -0.36 1.00 1.05 1.20 0.00 0.00 173.24 176.20 1w36 h GLU 704 N 4.33 0.04 -0.75 5.44 9.09 -1.98 -3.28 114.58 127.47 1w36 h GLU 704 Ca -0.31 -0.04 0.17 0.00 0.05 0.00 0.00 59.36 59.23 1w36 h GLU 704 Cb 1.20 0.01 -0.12 0.00 -1.65 0.00 0.00 28.75 28.18 1w36 h GLU 704 CO 0.41 0.81 0.10 0.45 0.05 0.00 0.00 179.01 180.82 1w36 h HIS 705 N -0.71 0.12 -0.89 2.06 3.86 -1.98 0.47 115.15 118.07 1w36 h HIS 705 Ca -0.01 0.05 0.16 0.00 -1.16 0.00 0.00 60.37 59.41 1w36 h HIS 705 Cb 0.82 0.06 -0.07 0.00 1.06 0.00 0.00 27.41 29.29 1w36 h HIS 705 CO 0.19 -0.17 0.58 0.00 0.86 0.00 0.00 177.93 179.39 1w36 h ALA 706 N 1.66 1.91 -0.26 2.45 0.00 -1.97 -1.54 119.26 121.52 1w36 h ALA 706 Ca 0.42 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.34 1w36 h ALA 706 Cb 0.75 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1w36 h ALA 706 CO -0.59 -0.17 0.12 1.25 0.00 0.00 0.00 179.25 179.86 1w36 h LEU 707 N 0.62 0.34 -0.18 0.00 6.46 -0.14 0.30 115.31 122.71 1w36 h LEU 707 Ca 0.46 -0.13 0.05 0.00 -0.12 0.00 0.00 57.88 58.15 1w36 h LEU 707 Cb 0.84 -0.09 -0.07 0.00 -0.73 0.00 0.00 40.66 40.61 1w36 h LEU 707 CO -0.21 0.37 -0.32 0.58 -0.62 0.00 0.00 178.44 178.24 1w36 h VAL 708 N 0.28 0.28 -1.00 1.05 2.07 -0.97 0.50 116.25 118.46 1w36 h VAL 708 Ca 0.09 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.75 1w36 h VAL 708 Cb 0.12 0.28 -0.09 0.00 -1.52 0.00 0.00 31.29 30.08 1w36 h VAL 708 CO -0.01 0.00 0.63 -0.09 0.02 0.00 0.00 177.57 178.11 1w36 h ARG 709 N -0.37 0.89 -0.87 1.57 9.65 -1.09 -0.24 114.38 123.92 1w36 h ARG 709 Ca 0.11 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 1w36 h ARG 709 Cb 0.54 -0.20 -0.04 0.00 -1.39 0.00 0.00 29.97 28.88 1w36 h ARG 709 CO -0.38 0.59 0.55 2.35 2.80 0.00 0.00 179.97 185.88 1w36 h TRP 710 N 0.92 1.12 0.06 2.20 7.01 0.38 -2.10 115.95 125.52 1w36 h TRP 710 Ca 0.52 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.53 1w36 h TRP 710 Cb 0.62 -0.37 0.00 0.00 -2.10 0.00 0.00 29.16 27.31 1w36 h TRP 710 CO -0.00 0.72 -0.03 1.25 -2.79 0.00 0.00 178.44 177.59 1w36 h LEU 711 N 1.19 -0.06 -0.52 0.65 6.46 0.78 -2.71 115.31 121.10 1w36 h LEU 711 Ca 0.32 -0.43 0.06 0.00 -0.12 0.00 0.00 57.88 57.71 1w36 h LEU 711 Cb -0.10 0.02 -0.09 0.00 -0.73 0.00 0.00 40.66 39.76 1w36 h LEU 711 CO -0.06 0.42 -0.53 0.28 -0.62 0.00 0.00 178.44 177.93 1w36 h SER 712 N -0.56 -1.80 -0.66 1.25 0.02 -1.00 0.17 113.55 110.97 1w36 h SER 712 Ca -0.01 0.25 0.14 0.00 -0.84 0.00 0.00 61.79 61.33 1w36 h SER 712 Cb 0.49 0.76 -0.10 0.00 0.14 0.00 0.00 62.40 63.69 1w36 h SER 712 CO 0.01 -0.37 0.08 1.56 -1.14 0.00 0.00 176.83 176.98 1w36 h GLN 713 N -0.31 0.18 0.00 3.45 7.50 -1.42 0.12 115.11 124.63 1w36 h GLN 713 Ca 0.11 -0.01 -0.02 0.00 0.50 0.00 0.00 58.65 59.23 1w36 h GLN 713 Cb 0.57 -0.04 -0.00 0.00 0.05 0.00 0.00 27.48 28.05 1w36 h GLN 713 CO -0.66 0.12 -0.08 0.45 -1.50 0.00 0.00 178.83 177.16 1w36 h HIS 714 N 0.19 0.00 0.00 2.96 3.86 -0.84 -1.88 115.15 119.44 1w36 h HIS 714 Ca 0.36 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.38 1w36 h HIS 714 Cb 0.58 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.03 1w36 h HIS 714 CO -0.31 0.08 -0.98 0.82 0.86 0.00 0.00 177.93 178.40 1w36 h ILE 715 N 0.00 1.29 0.00 2.45 2.04 0.16 -3.30 117.51 120.15 1w36 h ILE 715 Ca -0.00 -2.91 0.00 0.00 1.00 0.00 0.00 64.86 62.95 1w36 h ILE 715 Cb 0.65 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 39.35 1w36 h ILE 715 CO 0.01 0.74 -0.53 -0.07 0.00 0.00 0.00 178.15 178.29 1w36 h LEU 716 N 0.00 0.00 -5.94 1.44 3.38 -0.53 -3.42 115.31 110.24 1w36 h LEU 716 Ca -0.05 -0.02 -0.27 0.00 0.09 0.00 0.00 57.88 57.63 1w36 h LEU 716 Cb 1.68 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 42.18 1w36 h LEU 716 CO 0.10 0.01 -0.62 -0.70 0.09 0.00 0.00 178.44 177.32 1w36 s GLU 717 N -3.27 0.83 0.00 1.13 2.56 -0.74 -5.09 118.70 114.12 1w36 s GLU 717 Ca 0.04 -0.95 0.00 0.00 0.00 0.00 0.00 54.97 54.06 1w36 s GLU 717 Cb 0.08 -0.45 0.00 0.00 2.00 0.00 0.00 34.13 35.76 1w36 s GLU 717 CO 0.73 -1.26 0.00 -0.35 -0.56 0.00 0.00 175.26 173.82 1w36 n PRO 718 N 3.77 3.68 -1.49 4.30 -0.04 -1.24 -4.65 135.00 139.32 1w36 n PRO 718 Ca 0.16 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.45 1w36 n PRO 718 Cb 0.51 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.90 1w36 n PRO 718 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1w36 n ASP 719 N 0.00 -4.78 0.00 3.54 2.03 -1.26 -4.98 116.55 111.11 1w36 n ASP 719 Ca 0.00 0.42 0.00 0.00 0.52 0.00 0.00 54.79 55.73 1w36 n ASP 719 Cb 0.00 -4.20 0.00 0.00 -0.72 0.00 0.00 41.12 36.20 1w36 n ASP 719 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1w36 n SER 720 N -1.02 0.00 -3.81 1.67 3.41 -1.26 -4.92 113.62 107.69 1w36 n SER 720 Ca -0.17 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.14 1w36 n SER 720 Cb 0.58 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.78 1w36 n SER 720 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1w36 s ASN 721 N -2.44 0.53 0.00 4.04 0.02 -1.26 -4.92 114.94 110.91 1w36 s ASN 721 Ca 0.00 0.76 0.27 0.00 -1.02 0.00 0.00 52.86 52.88 1w36 s ASN 721 Cb 0.00 -1.09 0.96 0.00 0.02 0.00 0.00 41.25 41.13 1w36 s ASN 721 CO 0.00 -4.38 1.70 0.00 0.02 0.00 0.00 177.10 174.44 1w36 n ALA 722 N -4.95 2.96 0.14 0.60 0.00 -1.26 -3.44 120.51 114.55 1w36 n ALA 722 Ca 0.12 -0.31 0.02 0.00 0.00 0.00 0.00 53.44 53.27 1w36 n ALA 722 Cb 0.59 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.82 1w36 n ALA 722 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1w36 h SER 723 N 0.64 0.00 -0.63 0.00 4.64 -2.00 -3.15 113.55 113.05 1w36 h SER 723 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1w36 h SER 723 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1w36 h SER 723 CO 0.00 0.51 0.00 -1.54 -0.87 0.00 0.00 176.83 174.93 1w36 n SER 724 N -3.22 4.11 -4.82 4.97 3.41 -1.22 -4.94 113.62 111.92 1w36 n SER 724 Ca 0.02 -2.26 -0.32 0.00 -0.26 0.00 0.00 58.87 56.05 1w36 n SER 724 Cb 0.74 -0.52 0.02 0.00 -0.26 0.00 0.00 64.21 64.20 1w36 n SER 724 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1w36 s GLN 725 N -1.56 3.23 0.24 4.33 -0.21 -1.19 -0.19 119.66 124.31 1w36 s GLN 725 Ca 0.46 1.03 -0.30 0.00 0.02 0.00 0.00 55.36 56.58 1w36 s GLN 725 Cb 0.28 -2.03 -0.09 0.00 1.00 0.00 0.00 33.01 32.17 1w36 s GLN 725 CO 0.26 -0.87 1.16 -0.65 -2.12 0.00 0.00 175.29 173.07 1w36 s GLN 726 N -4.59 4.55 0.16 2.91 -0.21 -1.10 -4.58 119.66 116.80 1w36 s GLN 726 Ca 0.60 1.87 -0.24 0.00 0.02 0.00 0.00 55.36 57.61 1w36 s GLN 726 Cb -0.14 -3.20 -0.08 0.00 1.00 0.00 0.00 33.01 30.59 1w36 s GLN 726 CO 0.46 0.05 0.75 -1.64 -2.12 0.00 0.00 175.29 172.78 1w36 s MET 727 N -0.95 4.52 0.14 2.91 -1.94 -1.26 -5.04 119.30 117.67 1w36 s MET 727 Ca 0.48 1.10 -0.20 0.00 -1.71 0.00 0.00 55.69 55.36 1w36 s MET 727 Cb -0.33 -3.25 -0.07 0.00 2.01 0.00 0.00 34.83 33.19 1w36 s MET 727 CO 0.40 0.58 0.65 -0.98 -0.01 0.00 0.00 175.02 175.66 1w36 s ARG 728 N -1.16 4.28 0.38 2.03 1.04 -1.26 -5.01 118.95 119.24 1w36 s ARG 728 Ca 0.35 0.85 -0.25 0.00 -1.04 0.00 0.00 55.73 55.64 1w36 s ARG 728 Cb -0.23 -3.13 -0.09 0.00 -2.04 0.00 0.00 34.95 29.46 1w36 s ARG 728 CO 0.25 0.55 1.09 -0.51 -0.04 0.00 0.00 175.30 176.65 1w36 s LEU 729 N -1.40 4.23 -0.33 -1.89 2.01 -1.26 -4.97 118.68 115.08 1w36 s LEU 729 Ca 0.35 2.17 -0.29 0.00 0.01 0.00 0.00 54.13 56.37 1w36 s LEU 729 Cb -0.19 -4.03 0.00 0.00 0.01 0.00 0.00 46.19 41.98 1w36 s LEU 729 CO 0.21 -0.49 1.30 -0.70 1.01 0.00 0.00 176.35 177.69 1w36 s GLU 730 N -2.24 3.86 0.00 1.70 2.56 -1.26 -1.49 118.70 121.83 1w36 s GLU 730 Ca 0.55 1.15 0.00 0.00 0.00 0.00 0.00 54.97 56.67 1w36 s GLU 730 Cb -0.27 -3.90 0.00 0.00 2.00 0.00 0.00 34.13 31.97 1w36 s GLU 730 CO 0.33 -1.20 0.00 -1.13 -0.56 0.00 0.00 175.26 172.71 1w36 n SER 731 N 7.80 0.00 0.14 -1.70 3.41 -1.26 -4.91 113.62 117.10 1w36 n SER 731 Ca 0.15 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.84 1w36 n SER 731 Cb 0.47 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 64.88 1w36 n SER 731 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1w36 n ASP 732 N 0.00 0.44 0.24 4.04 8.00 -0.56 0.89 116.55 129.61 1w36 n ASP 732 Ca 0.00 0.68 0.09 0.00 0.71 0.00 0.00 54.79 56.26 1w36 n ASP 732 Cb 0.00 -0.71 0.60 0.00 -0.02 0.00 0.00 41.12 40.99 1w36 n ASP 732 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1w36 h LYS 733 N 0.00 0.00 -0.67 -1.24 1.57 -1.91 -2.62 116.57 111.70 1w36 h LYS 733 Ca 0.00 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.54 1w36 h LYS 733 Cb 0.16 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.33 1w36 h LYS 733 CO 0.00 0.18 0.25 0.72 -0.57 0.00 0.00 179.45 180.03 1w36 n HIS 734 N -3.91 2.17 -4.40 -1.35 8.25 0.26 -4.32 115.22 111.92 1w36 n HIS 734 Ca -0.02 -1.34 -0.30 0.00 -0.26 0.00 0.00 57.72 55.80 1w36 n HIS 734 Cb 0.27 -0.66 -0.12 0.00 1.12 0.00 0.00 29.99 30.60 1w36 n HIS 734 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1w36 s LEU 735 N -3.07 2.61 0.31 2.41 1.43 -0.99 -4.46 118.68 116.92 1w36 s LEU 735 Ca 0.52 -0.56 -0.29 0.00 -1.03 0.00 0.00 54.13 52.77 1w36 s LEU 735 Cb 0.43 -1.48 -0.11 0.00 0.03 0.00 0.00 46.19 45.06 1w36 s LEU 735 CO 0.10 0.20 1.53 0.68 0.23 0.00 0.00 176.35 179.08 1w36 s VAL 736 N -1.08 2.18 -0.16 -1.59 -7.23 -1.22 -4.33 120.40 106.98 1w36 s VAL 736 Ca 0.17 0.16 -0.07 0.00 -1.81 0.00 0.00 61.98 60.43 1w36 s VAL 736 Cb -0.10 -3.10 -0.04 0.00 0.56 0.00 0.00 36.38 33.69 1w36 s VAL 736 CO 0.08 0.03 0.06 -1.10 -0.31 0.00 0.00 175.10 173.86 1w36 s GLN 737 N -1.01 3.80 -0.20 4.82 -0.21 -1.21 -2.19 119.66 123.45 1w36 s GLN 737 Ca 0.59 -0.33 -0.00 0.00 0.02 0.00 0.00 55.36 55.64 1w36 s GLN 737 Cb -0.46 -3.15 0.02 0.00 1.00 0.00 0.00 33.01 30.41 1w36 s GLN 737 CO 0.52 0.38 -0.15 -1.50 -2.12 0.00 0.00 175.29 172.42 1w36 s ILE 738 N 0.06 2.42 0.32 1.08 2.07 0.90 -0.25 121.20 127.80 1w36 s ILE 738 Ca 0.05 -0.89 0.03 0.00 -1.41 0.00 0.00 60.65 58.43 1w36 s ILE 738 Cb -0.12 -2.08 -0.05 0.00 0.13 0.00 0.00 42.46 40.34 1w36 s ILE 738 CO 0.01 0.45 0.08 0.54 -1.91 0.00 0.00 174.94 174.12 1w36 s VAL 739 N 1.32 0.88 0.28 4.00 0.11 -0.28 -1.95 120.40 124.76 1w36 s VAL 739 Ca 0.04 -2.00 -0.06 0.00 -2.93 0.00 0.00 61.98 57.03 1w36 s VAL 739 Cb -0.14 -2.67 -0.06 0.00 -1.53 0.00 0.00 36.38 31.99 1w36 s VAL 739 CO -0.10 0.00 0.56 0.42 -3.33 0.00 0.00 175.10 172.65 1w36 s THR 740 N -3.42 4.99 0.20 5.04 -4.23 -1.26 -0.59 115.64 116.37 1w36 s THR 740 Ca 0.35 0.17 -0.14 0.00 -1.18 0.00 0.00 61.69 60.89 1w36 s THR 740 Cb 0.07 -3.71 0.18 0.00 1.34 0.00 0.00 72.50 70.39 1w36 s THR 740 CO 0.15 -0.28 1.65 0.40 -0.54 0.00 0.00 174.62 176.00 1w36 h ILE 741 N 1.48 0.47 0.31 2.99 1.08 -1.62 -1.38 117.51 120.84 1w36 h ILE 741 Ca -0.47 -0.01 -0.00 0.00 -0.39 0.00 0.00 64.86 63.98 1w36 h ILE 741 Cb 1.18 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 35.36 1w36 h ILE 741 CO 0.67 0.01 -0.26 0.45 -0.69 0.00 0.00 178.15 178.32 1w36 h HIS 742 N 0.03 -0.70 0.00 1.37 3.86 -1.94 0.20 115.15 117.97 1w36 h HIS 742 Ca 0.27 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.49 1w36 h HIS 742 Cb 0.43 0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.16 1w36 h HIS 742 CO -0.43 -0.39 0.00 1.63 0.86 0.00 0.00 177.93 179.60 1w36 n LYS 743 N -5.39 0.19 0.06 2.45 5.02 -0.74 -1.71 118.16 118.04 1w36 n LYS 743 Ca -0.09 0.08 0.11 0.00 -2.02 0.00 0.00 58.31 56.39 1w36 n LYS 743 Cb 0.29 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.84 1w36 n LYS 743 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1w36 n SER 744 N -1.10 0.67 -4.64 4.39 3.41 0.04 -4.70 113.62 111.69 1w36 n SER 744 Ca 0.05 0.07 -0.45 0.00 -0.26 0.00 0.00 58.87 58.27 1w36 n SER 744 Cb 0.04 0.61 -0.02 0.00 -0.26 0.00 0.00 64.21 64.57 1w36 n SER 744 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1w36 n LYS 745 N -2.26 1.70 0.00 4.33 4.81 -0.69 -0.65 118.16 125.39 1w36 n LYS 745 Ca 0.01 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 58.05 1w36 n LYS 745 Cb 0.48 -2.14 0.00 0.00 0.02 0.00 0.00 35.03 33.40 1w36 n LYS 745 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1w36 n GLY 746 N 1.66 2.13 3.76 3.14 0.00 -1.26 -5.00 105.19 109.62 1w36 n GLY 746 Ca 0.11 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 1w36 n GLY 746 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1w36 s LEU 747 N 0.00 3.61 -0.02 0.99 1.02 0.18 -5.07 118.68 119.39 1w36 s LEU 747 Ca 0.00 2.23 0.07 0.00 0.02 0.00 0.00 54.13 56.45 1w36 s LEU 747 Cb 0.00 -4.58 -0.02 0.00 0.02 0.00 0.00 46.19 41.61 1w36 s LEU 747 CO 0.00 -1.53 -0.24 -0.70 0.02 0.00 0.00 176.35 173.90 1w36 s GLU 748 N -3.52 1.94 -0.02 1.70 2.12 -1.26 -4.76 118.70 114.89 1w36 s GLU 748 Ca 0.73 -0.85 -0.05 0.00 0.36 0.00 0.00 54.97 55.17 1w36 s GLU 748 Cb -0.26 -1.86 0.00 0.00 0.26 0.00 0.00 34.13 32.27 1w36 s GLU 748 CO 0.34 0.50 0.11 0.71 -0.54 0.00 0.00 175.26 176.38 1w36 s TYR 749 N -0.53 -0.01 0.02 5.30 1.51 -0.54 -5.03 117.35 118.08 1w36 s TYR 749 Ca 0.08 0.02 -0.25 0.00 -1.01 0.00 0.00 57.07 55.91 1w36 s TYR 749 Cb -0.09 -0.03 -0.18 0.00 -0.11 0.00 0.00 41.96 41.55 1w36 s TYR 749 CO -0.01 -0.17 1.41 -1.35 -1.11 0.00 0.00 175.55 174.32 1w36 h PRO 750 N 5.09 -0.14 -5.29 -1.71 0.11 -1.87 0.05 132.00 128.24 1w36 h PRO 750 Ca -0.28 0.01 -0.48 0.00 0.11 0.00 0.00 66.00 65.36 1w36 h PRO 750 Cb 1.20 0.03 -0.29 0.00 0.11 0.00 0.00 31.00 32.05 1w36 h PRO 750 CO 0.42 0.15 -0.81 -0.51 -0.21 0.00 0.00 178.00 177.04 1w36 s LEU 751 N -9.61 2.04 0.03 2.35 1.43 -0.46 -2.31 118.68 112.15 1w36 s LEU 751 Ca -0.15 -0.27 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 1w36 s LEU 751 Cb 0.03 -0.72 -0.02 0.00 0.03 0.00 0.00 46.19 45.51 1w36 s LEU 751 CO 0.63 0.16 -0.08 0.68 0.23 0.00 0.00 176.35 177.98 1w36 s VAL 752 N -0.36 0.58 -0.08 -1.59 -7.23 -0.17 -2.21 120.40 109.34 1w36 s VAL 752 Ca 0.05 -0.90 0.02 0.00 -1.81 0.00 0.00 61.98 59.34 1w36 s VAL 752 Cb -0.06 -0.60 -0.02 0.00 0.56 0.00 0.00 36.38 36.26 1w36 s VAL 752 CO -0.00 -0.24 -0.12 0.26 -0.31 0.00 0.00 175.10 174.69 1w36 s TRP 753 N -1.07 2.80 -0.61 2.82 0.52 0.28 -1.86 118.94 121.81 1w36 s TRP 753 Ca -0.06 -0.23 0.06 0.00 0.02 0.00 0.00 56.10 55.89 1w36 s TRP 753 Cb -0.08 -1.71 0.25 0.00 -1.15 0.00 0.00 33.47 30.77 1w36 s TRP 753 CO 0.00 0.12 0.71 1.28 0.02 0.00 0.00 176.95 179.09 1w36 n LEU 754 N 2.62 3.30 -0.32 2.99 4.32 -0.05 -1.99 117.00 127.88 1w36 n LEU 754 Ca -0.18 -5.35 0.03 0.00 -0.02 0.00 0.00 56.01 50.50 1w36 n LEU 754 Cb 0.52 -0.51 0.22 0.00 -1.62 0.00 0.00 43.42 42.04 1w36 n LEU 754 CO 0.27 2.05 1.25 1.55 -1.22 0.00 0.00 177.39 181.30 1w36 h PRO 755 N 4.19 1.04 -0.66 3.23 0.13 -1.80 -0.96 132.00 137.18 1w36 h PRO 755 Ca 0.18 -0.06 -0.46 0.00 -0.87 0.00 0.00 66.00 64.79 1w36 h PRO 755 Cb 0.69 -0.24 -0.30 0.00 0.13 0.00 0.00 31.00 31.28 1w36 h PRO 755 CO 0.79 0.69 -0.31 1.19 -0.23 0.00 0.00 178.00 180.13 1w36 n PHE 756 N -4.49 2.29 0.95 1.56 0.99 -1.26 -3.79 117.46 113.71 1w36 n PHE 756 Ca 0.14 -2.19 0.02 0.00 -0.00 0.00 0.00 57.45 55.41 1w36 n PHE 756 Cb 0.18 -0.58 0.12 0.00 -1.00 0.00 0.00 39.48 38.20 1w36 n PHE 756 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.76 178.27 1w36 n ILE 757 N -0.87 0.00 0.63 4.37 0.13 -1.21 -3.05 119.36 119.36 1w36 n ILE 757 Ca 0.44 0.00 0.07 0.00 -1.10 0.00 0.00 62.75 62.16 1w36 n ILE 757 Cb 0.91 -0.39 -0.09 0.00 -0.84 0.00 0.00 39.64 39.23 1w36 n ILE 757 CO 0.00 0.00 0.00 0.41 2.80 0.00 0.00 176.55 179.76 1w36 n THR 758 N -0.63 0.00 -1.48 9.51 -1.04 -1.26 -4.56 114.28 114.83 1w36 n THR 758 Ca 0.03 -0.17 -0.35 0.00 -2.04 0.00 0.00 64.05 61.52 1w36 n THR 758 Cb 0.01 0.90 0.09 0.00 -1.82 0.00 0.00 70.33 69.51 1w36 n THR 758 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1w36 s ASN 759 N -2.60 4.18 0.00 8.00 0.01 -1.17 -4.74 114.94 118.62 1w36 s ASN 759 Ca 0.04 2.50 0.00 0.00 -0.71 0.00 0.00 52.86 54.69 1w36 s ASN 759 Cb 0.11 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.17 1w36 s ASN 759 CO 0.63 -2.28 0.00 2.22 -1.51 0.00 0.00 177.10 176.16 1w36 n PHE 760 N -2.51 0.00 -0.47 2.20 -1.74 -1.26 -4.81 117.46 108.86 1w36 n PHE 760 Ca 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.04 1w36 n PHE 760 Cb 0.49 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.49 1w36 n PHE 760 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 1w36 n ARG 761 N -0.66 0.00 -2.30 3.97 1.74 -1.26 -5.03 116.66 113.12 1w36 n ARG 761 Ca 0.00 0.19 -0.40 0.00 -0.77 0.00 0.00 57.85 56.87 1w36 n ARG 761 Cb 0.00 -0.28 -0.03 0.00 -1.02 0.00 0.00 32.46 31.13 1w36 n ARG 761 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1w36 s VAL 762 N 0.00 3.13 -0.07 1.55 1.01 -1.26 -4.96 120.40 119.80 1w36 s VAL 762 Ca 0.00 1.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.74 1w36 s VAL 762 Cb 0.00 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1w36 s VAL 762 CO 0.00 0.20 1.15 -1.58 0.00 0.00 0.00 175.10 174.87 1w36 s GLN 763 N -1.88 4.37 -0.01 2.72 -0.44 -1.26 -4.90 119.66 118.26 1w36 s GLN 763 Ca 0.51 1.60 0.11 0.00 -2.50 0.00 0.00 55.36 55.08 1w36 s GLN 763 Cb -0.34 -3.56 -0.14 0.00 -1.64 0.00 0.00 33.01 27.34 1w36 s GLN 763 CO 0.44 -0.42 0.38 0.39 0.50 0.00 0.00 175.29 176.57 1w36 n GLU 764 N 5.18 2.35 -2.78 1.67 -0.58 -1.26 -4.60 120.64 120.62 1w36 n GLU 764 Ca 0.10 -0.04 -0.38 0.00 -0.42 0.00 0.00 57.16 56.42 1w36 n GLU 764 Cb 0.47 -1.10 -0.06 0.00 -0.57 0.00 0.00 31.44 30.18 1w36 n GLU 764 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1w36 s GLN 765 N -2.28 4.71 -1.25 3.49 -0.21 -1.26 -4.96 119.66 117.89 1w36 s GLN 765 Ca 0.01 1.39 -0.10 0.00 0.02 0.00 0.00 55.36 56.68 1w36 s GLN 765 Cb 0.08 -3.05 0.17 0.00 1.00 0.00 0.00 33.01 31.21 1w36 s GLN 765 CO 0.45 0.41 1.74 0.00 -2.12 0.00 0.00 175.29 175.76 1w36 n ALA 766 N 1.05 4.95 -4.00 6.09 0.00 -1.26 -4.79 120.51 122.55 1w36 n ALA 766 Ca -0.00 -4.32 -0.31 0.00 0.00 0.00 0.00 53.44 48.81 1w36 n ALA 766 Cb 0.49 -2.98 -0.15 0.00 0.00 0.00 0.00 19.45 16.81 1w36 n ALA 766 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1w36 s PHE 767 N 0.59 3.09 0.31 0.00 5.36 -1.26 -2.25 117.98 123.81 1w36 s PHE 767 Ca 0.40 -2.33 0.03 0.00 -0.96 0.00 0.00 56.93 54.07 1w36 s PHE 767 Cb 0.06 -2.10 -0.04 0.00 -0.34 0.00 0.00 43.02 40.60 1w36 s PHE 767 CO 0.01 -0.87 0.15 1.52 -1.46 0.00 0.00 175.22 174.56 1w36 s TYR 768 N 1.15 1.64 -0.12 10.12 -0.85 -0.90 -4.70 117.35 123.70 1w36 s TYR 768 Ca -0.02 -1.32 -0.03 0.00 -0.52 0.00 0.00 57.07 55.18 1w36 s TYR 768 Cb -0.19 -0.92 -0.03 0.00 0.38 0.00 0.00 41.96 41.19 1w36 s TYR 768 CO -0.07 -0.45 0.00 -1.01 -1.52 0.00 0.00 175.55 172.50 1w36 s HIS 769 N -3.55 3.15 0.08 -3.49 3.76 -1.26 0.15 115.29 114.13 1w36 s HIS 769 Ca 0.34 0.05 -0.31 0.00 -0.15 0.00 0.00 55.06 55.00 1w36 s HIS 769 Cb 0.05 -1.88 -0.07 0.00 1.11 0.00 0.00 32.58 31.79 1w36 s HIS 769 CO 0.17 0.29 1.41 0.34 -0.85 0.00 0.00 174.74 176.10 1w36 s ASP 770 N -0.35 6.82 0.10 1.40 -1.08 -0.05 -4.89 116.67 118.62 1w36 s ASP 770 Ca 0.07 2.27 0.12 0.00 -0.52 0.00 0.00 52.55 54.49 1w36 s ASP 770 Cb -0.12 -2.58 0.56 0.00 -1.46 0.00 0.00 42.92 39.32 1w36 s ASP 770 CO 0.02 -0.69 1.38 0.54 0.52 0.00 0.00 175.17 176.95 1w36 n ARG 771 N 4.50 0.06 -0.07 4.34 3.00 -1.26 -1.21 116.66 126.02 1w36 n ARG 771 Ca 0.12 0.43 -0.15 0.00 -0.01 0.00 0.00 57.85 58.25 1w36 n ARG 771 Cb 0.43 -1.64 -0.05 0.00 0.00 0.00 0.00 32.46 31.20 1w36 n ARG 771 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1w36 n HIS 772 N -1.75 0.00 1.02 -1.55 8.25 -1.26 -4.70 115.22 115.22 1w36 n HIS 772 Ca 0.01 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.61 1w36 n HIS 772 Cb 0.10 -0.51 0.53 0.00 1.12 0.00 0.00 29.99 31.23 1w36 n HIS 772 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1w36 n SER 773 N -3.76 0.13 -1.83 0.41 3.41 -1.22 -4.93 113.62 105.83 1w36 n SER 773 Ca -0.27 0.29 -0.19 0.00 -0.26 0.00 0.00 58.87 58.44 1w36 n SER 773 Cb 0.64 -0.31 -0.06 0.00 -0.26 0.00 0.00 64.21 64.22 1w36 n SER 773 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1w36 n PHE 774 N -1.49 -0.42 -3.81 7.33 0.99 -0.35 -4.97 117.46 114.75 1w36 n PHE 774 Ca 0.07 0.00 -0.28 0.00 -0.00 0.00 0.00 57.45 57.24 1w36 n PHE 774 Cb 0.34 -3.41 -0.03 0.00 -1.00 0.00 0.00 39.48 35.37 1w36 n PHE 774 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.76 175.55 1w36 s GLU 775 N -4.08 3.49 -0.21 -1.08 2.02 -1.26 -4.66 118.70 112.91 1w36 s GLU 775 Ca 0.00 -0.43 -0.25 0.00 0.02 0.00 0.00 54.97 54.31 1w36 s GLU 775 Cb 0.00 -2.91 -0.01 0.00 0.10 0.00 0.00 34.13 31.31 1w36 s GLU 775 CO 0.00 0.48 0.84 0.00 0.02 0.00 0.00 175.26 176.60 1w36 s ALA 776 N -1.76 3.60 -0.00 5.21 0.00 -1.26 -0.87 121.76 126.68 1w36 s ALA 776 Ca 0.37 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 52.29 1w36 s ALA 776 Cb -0.11 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 1w36 s ALA 776 CO 0.28 -0.82 -0.03 0.08 0.00 0.00 0.00 175.76 175.28 1w36 s VAL 777 N 2.58 3.97 -0.23 0.00 1.01 0.12 -1.49 120.40 126.37 1w36 s VAL 777 Ca 0.37 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1w36 s VAL 777 Cb -0.16 -2.75 0.05 0.00 0.00 0.00 0.00 36.38 33.53 1w36 s VAL 777 CO 0.09 0.40 -0.10 -0.22 0.00 0.00 0.00 175.10 175.27 1w36 s LEU 778 N -1.47 2.70 -0.56 3.92 2.96 0.09 -2.11 118.68 124.21 1w36 s LEU 778 Ca 0.18 -1.10 -0.19 0.00 -0.22 0.00 0.00 54.13 52.80 1w36 s LEU 778 Cb -0.11 -1.33 0.08 0.00 0.50 0.00 0.00 46.19 45.33 1w36 s LEU 778 CO 0.09 -0.17 0.68 -0.62 -1.32 0.00 0.00 176.35 175.01 1w36 s ASP 779 N 1.30 6.20 0.00 3.68 -1.08 -0.95 -1.66 116.67 124.15 1w36 s ASP 779 Ca -0.04 -1.21 0.05 0.00 -0.52 0.00 0.00 52.55 50.82 1w36 s ASP 779 Cb -0.18 -2.30 0.28 0.00 -1.46 0.00 0.00 42.92 39.26 1w36 s ASP 779 CO -0.07 -1.04 0.84 0.18 0.52 0.00 0.00 175.17 175.61 1w36 n LEU 780 N 6.31 0.00 -3.94 -1.34 4.77 -1.26 -4.07 117.00 117.47 1w36 n LEU 780 Ca -0.08 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.60 1w36 n LEU 780 Cb 0.44 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.37 1w36 n LEU 780 CO 0.57 0.00 -0.42 0.20 -1.33 0.00 0.00 177.39 176.40 1w36 s ASN 781 N -1.53 3.78 0.00 -1.43 0.01 -1.26 -4.70 114.94 109.81 1w36 s ASN 781 Ca 0.07 -1.14 0.00 0.00 -0.71 0.00 0.00 52.86 51.08 1w36 s ASN 781 Cb 0.03 -1.16 0.00 0.00 0.41 0.00 0.00 41.25 40.53 1w36 s ASN 781 CO 0.05 -0.23 0.67 0.00 -1.51 0.00 0.00 177.10 176.08 1w36 n ALA 782 N 4.69 0.90 -1.63 0.60 0.00 -1.26 -4.80 120.51 119.01 1w36 n ALA 782 Ca -0.12 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.85 1w36 n ALA 782 Cb 0.44 -2.14 -0.04 0.00 0.00 0.00 0.00 19.45 17.70 1w36 n ALA 782 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w36 n ALA 783 N 3.78 1.17 -0.31 0.00 0.00 -1.26 -4.78 120.51 119.11 1w36 n ALA 783 Ca 0.00 0.13 0.24 0.00 0.00 0.00 0.00 53.44 53.82 1w36 n ALA 783 Cb 0.00 -2.61 0.46 0.00 0.00 0.00 0.00 19.45 17.30 1w36 n ALA 783 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1w36 n PRO 784 N 7.38 -0.06 -0.08 0.00 -0.02 -1.26 0.93 135.00 141.89 1w36 n PRO 784 Ca 0.26 1.34 0.10 0.00 -2.02 0.00 0.00 63.50 63.18 1w36 n PRO 784 Cb 0.33 -2.30 0.48 0.00 -0.02 0.00 0.00 33.50 31.98 1w36 n PRO 784 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1w36 h GLU 785 N 0.00 0.45 0.11 -0.52 4.57 -1.98 -0.14 114.58 117.07 1w36 h GLU 785 Ca 0.72 -0.03 -0.17 0.00 -1.18 0.00 0.00 59.36 58.70 1w36 h GLU 785 Cb 1.79 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 30.29 1w36 h GLU 785 CO -0.78 0.30 -0.79 0.66 -1.18 0.00 0.00 179.01 177.22 1w36 h SER 786 N 0.46 0.37 -0.53 1.04 4.64 0.21 -2.71 113.55 117.03 1w36 h SER 786 Ca 0.26 -0.93 0.06 0.00 -0.47 0.00 0.00 61.79 60.71 1w36 h SER 786 Cb 0.43 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.37 1w36 h SER 786 CO -0.07 1.37 0.36 0.58 -0.87 0.00 0.00 176.83 178.19 1w36 h VAL 787 N -0.48 0.98 -0.49 0.95 2.07 -1.16 0.55 116.25 118.67 1w36 h VAL 787 Ca -0.15 -0.16 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 1w36 h VAL 787 Cb 1.55 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 1w36 h VAL 787 CO 0.10 0.09 -0.06 0.44 0.02 0.00 0.00 177.57 178.16 1w36 h ASP 788 N 0.48 0.86 0.21 0.57 5.19 -1.07 0.31 116.42 122.96 1w36 h ASP 788 Ca 0.23 -0.25 -0.13 0.00 -0.62 0.00 0.00 57.03 56.26 1w36 h ASP 788 Cb 0.31 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.58 1w36 h ASP 788 CO -0.06 0.95 -0.50 -0.07 -3.12 0.00 0.00 179.24 176.44 1w36 h LEU 789 N 0.79 0.36 -0.22 1.55 3.38 -0.23 -2.42 115.31 118.54 1w36 h LEU 789 Ca 0.14 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1w36 h LEU 789 Cb 0.57 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1w36 h LEU 789 CO 0.03 0.81 -0.10 0.00 0.09 0.00 0.00 178.44 179.27 1w36 h ALA 790 N 1.21 0.30 -0.27 1.53 0.00 0.63 -2.84 119.26 119.82 1w36 h ALA 790 Ca 0.01 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1w36 h ALA 790 Cb 0.98 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1w36 h ALA 790 CO 0.08 0.14 0.18 0.93 0.00 0.00 0.00 179.25 180.59 1w36 h GLU 791 N 0.16 0.33 -0.23 0.00 4.39 -0.22 -0.63 114.58 118.37 1w36 h GLU 791 Ca 0.05 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 1w36 h GLU 791 Cb 0.59 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1w36 h GLU 791 CO 0.03 0.22 -0.10 0.00 -1.16 0.00 0.00 179.01 178.00 1w36 h ALA 792 N 1.83 0.33 -0.03 3.43 0.00 -1.35 -1.64 119.26 121.83 1w36 h ALA 792 Ca 0.10 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1w36 h ALA 792 Cb 0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1w36 h ALA 792 CO -0.02 0.16 0.02 0.93 0.00 0.00 0.00 179.25 180.34 1w36 h GLU 793 N 0.20 0.00 -0.17 0.00 5.08 -1.09 -1.02 114.58 117.58 1w36 h GLU 793 Ca 0.05 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1w36 h GLU 793 Cb 0.58 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1w36 h GLU 793 CO 0.03 0.00 0.10 -0.09 -1.00 0.00 0.00 179.01 178.05 1w36 h ARG 794 N 0.00 0.23 0.00 2.33 2.43 -0.15 -1.86 114.38 117.36 1w36 h ARG 794 Ca 0.01 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1w36 h ARG 794 Cb 0.06 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1w36 h ARG 794 CO -0.00 0.20 -0.55 1.37 -1.51 0.00 0.00 179.97 179.48 1w36 h LEU 795 N 0.19 0.00 -1.75 3.80 8.10 -1.33 -2.52 115.31 121.80 1w36 h LEU 795 Ca 0.06 0.00 0.29 0.00 0.11 0.00 0.00 57.88 58.34 1w36 h LEU 795 Cb 0.04 0.00 -0.06 0.00 -0.44 0.00 0.00 40.66 40.19 1w36 h LEU 795 CO -0.01 0.10 0.73 0.00 -4.11 0.00 0.00 178.44 175.16 1w36 h ALA 796 N 1.90 2.71 0.15 0.17 0.00 -0.86 0.47 119.26 123.79 1w36 h ALA 796 Ca -0.01 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.58 1w36 h ALA 796 Cb 1.09 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1w36 h ALA 796 CO 0.01 -1.05 -1.57 1.49 0.00 0.00 0.00 179.25 178.13 1w36 h GLU 797 N 0.16 0.31 0.00 0.00 4.81 -1.09 -3.26 114.58 115.50 1w36 h GLU 797 Ca 0.54 -0.53 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 1w36 h GLU 797 Cb 1.83 0.20 -0.01 0.00 0.63 0.00 0.00 28.75 31.39 1w36 h GLU 797 CO -0.12 1.19 -0.43 -0.44 -0.73 0.00 0.00 179.01 178.49 1w36 h ASP 798 N 0.08 0.00 -0.24 1.04 3.32 0.16 0.01 116.42 120.78 1w36 h ASP 798 Ca -0.27 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.68 1w36 h ASP 798 Cb 2.05 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.58 1w36 h ASP 798 CO 0.18 0.43 -0.20 -0.07 -1.72 0.00 0.00 179.24 177.86 1w36 h LEU 799 N 0.00 0.70 -0.23 1.55 3.38 -0.58 0.36 115.31 120.49 1w36 h LEU 799 Ca -0.00 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 1w36 h LEU 799 Cb 0.83 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1w36 h LEU 799 CO 0.06 0.89 0.05 0.03 0.09 0.00 0.00 178.44 179.55 1w36 h ARG 800 N 0.62 0.38 0.29 1.13 3.08 -1.48 0.35 114.38 118.76 1w36 h ARG 800 Ca 0.09 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1w36 h ARG 800 Cb 0.67 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.66 1w36 h ARG 800 CO 0.05 0.50 -0.26 -0.07 -1.07 0.00 0.00 179.97 179.12 1w36 h LEU 801 N 0.19 -0.69 -0.59 3.04 3.38 -0.57 -0.17 115.31 119.91 1w36 h LEU 801 Ca 0.07 0.06 0.12 0.00 0.09 0.00 0.00 57.88 58.22 1w36 h LEU 801 Cb 0.30 0.23 -0.10 0.00 0.09 0.00 0.00 40.66 41.18 1w36 h LEU 801 CO 0.00 -0.38 -0.01 0.25 0.09 0.00 0.00 178.44 178.39 1w36 h LEU 802 N -0.57 -0.27 -1.33 1.67 6.46 -0.07 0.53 115.31 121.73 1w36 h LEU 802 Ca -0.02 0.15 0.07 0.00 -0.12 0.00 0.00 57.88 57.96 1w36 h LEU 802 Cb 0.51 0.26 -0.05 0.00 -0.73 0.00 0.00 40.66 40.65 1w36 h LEU 802 CO -0.04 -0.11 0.51 0.22 -0.62 0.00 0.00 178.44 178.41 1w36 h TYR 803 N 0.11 0.82 -0.12 1.25 3.20 0.08 0.42 116.97 122.73 1w36 h TYR 803 Ca 0.30 0.02 -0.21 0.00 3.14 0.00 0.00 58.73 61.99 1w36 h TYR 803 Cb 0.48 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.48 1w36 h TYR 803 CO -0.36 0.42 -0.76 0.28 -1.64 0.00 0.00 178.16 176.11 1w36 h VAL 804 N 0.80 1.32 0.02 1.81 2.07 0.18 -3.21 116.25 119.25 1w36 h VAL 804 Ca 0.34 -2.05 -0.00 0.00 0.82 0.00 0.00 66.70 65.81 1w36 h VAL 804 Cb 0.29 2.04 0.00 0.00 -1.52 0.00 0.00 31.29 32.10 1w36 h VAL 804 CO -0.12 0.63 -0.01 0.00 0.02 0.00 0.00 177.57 178.09 1w36 h ALA 805 N 0.73 -0.03 0.00 1.67 0.00 0.09 -3.02 119.26 118.70 1w36 h ALA 805 Ca -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1w36 h ALA 805 Cb 1.36 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 1w36 h ALA 805 CO 0.14 -0.44 -0.06 -0.07 0.00 0.00 0.00 179.25 178.82 1w36 h LEU 806 N -0.18 0.00 0.00 0.00 4.07 -1.05 -3.19 115.31 114.97 1w36 h LEU 806 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1w36 h LEU 806 Cb 0.17 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.91 1w36 h LEU 806 CO 0.01 0.06 -0.21 0.41 -1.08 0.00 0.00 178.44 177.63 1w36 n THR 807 N -3.40 0.28 0.17 0.22 -1.04 -1.14 -4.22 114.28 105.15 1w36 n THR 807 Ca -0.02 -0.16 0.04 0.00 -2.04 0.00 0.00 64.05 61.88 1w36 n THR 807 Cb 0.21 -0.33 0.26 0.00 -1.82 0.00 0.00 70.33 68.65 1w36 n THR 807 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1w36 h ARG 808 N 0.00 0.00 -7.16 -2.82 2.47 -1.59 -3.46 114.38 101.82 1w36 h ARG 808 Ca 0.00 0.00 -0.49 0.00 -1.26 0.00 0.00 59.98 58.23 1w36 h ARG 808 Cb 0.63 0.00 0.06 0.00 -1.65 0.00 0.00 29.97 29.02 1w36 h ARG 808 CO 0.00 0.44 0.38 -1.12 0.56 0.00 0.00 179.97 180.23 1w36 s SER 809 N -6.49 5.82 -0.20 7.04 0.01 -1.26 -1.46 113.70 117.16 1w36 s SER 809 Ca 0.00 1.89 -0.14 0.00 1.31 0.00 0.00 55.95 59.01 1w36 s SER 809 Cb 0.11 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.71 1w36 s SER 809 CO 0.71 -1.14 -0.31 0.52 0.41 0.00 0.00 173.24 173.43 1w36 n VAL 810 N -1.80 1.39 -0.12 3.43 0.31 0.01 -4.80 118.33 116.75 1w36 n VAL 810 Ca 0.09 -0.10 -0.17 0.00 -0.01 0.00 0.00 64.34 64.15 1w36 n VAL 810 Cb 0.53 -2.02 -0.10 0.00 -0.91 0.00 0.00 33.84 31.33 1w36 n VAL 810 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1w36 n TRP 811 N -4.20 0.00 -3.68 3.52 7.02 -0.98 -1.44 117.44 117.69 1w36 n TRP 811 Ca -0.31 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.03 1w36 n TRP 811 Cb 0.66 -0.88 -0.07 0.00 -2.42 0.00 0.00 31.31 28.60 1w36 n TRP 811 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 1w36 s HIS 812 N -2.46 -0.28 -0.07 -5.99 5.65 -1.18 -4.51 115.29 106.46 1w36 s HIS 812 Ca -0.31 0.32 -0.06 0.00 0.25 0.00 0.00 55.06 55.26 1w36 s HIS 812 Cb 0.09 0.20 0.02 0.00 -1.18 0.00 0.00 32.58 31.71 1w36 s HIS 812 CO 0.52 -0.52 0.17 0.00 -0.65 0.00 0.00 174.74 174.26 1w36 s SER 814 N 0.31 1.41 0.11 0.00 1.04 -0.78 -1.68 113.70 114.11 1w36 s SER 814 Ca -0.02 -0.22 0.09 0.00 0.48 0.00 0.00 55.95 56.28 1w36 s SER 814 Cb -0.03 -0.57 -0.04 0.00 0.10 0.00 0.00 66.02 65.48 1w36 s SER 814 CO -0.01 0.03 -0.19 -1.48 0.98 0.00 0.00 173.24 172.57 1w36 s LEU 815 N 0.55 2.65 -0.03 2.42 -0.00 -0.86 -0.87 118.68 122.54 1w36 s LEU 815 Ca -0.10 -0.57 -0.20 0.00 -0.00 0.00 0.00 54.13 53.26 1w36 s LEU 815 Cb -0.13 -1.51 -0.05 0.00 -0.00 0.00 0.00 46.19 44.50 1w36 s LEU 815 CO 0.02 0.18 0.57 -0.83 -0.00 0.00 0.00 176.35 176.29 1w36 s GLY 816 N -2.09 2.56 0.04 -3.48 0.00 -0.37 -0.72 107.32 103.27 1w36 s GLY 816 Ca 0.17 -0.02 0.06 0.00 0.00 0.00 0.00 44.72 44.94 1w36 s GLY 816 CO 0.09 0.75 -0.18 0.14 0.00 0.00 0.00 173.10 173.90 1w36 s VAL 817 N -0.02 1.45 0.03 1.40 1.01 0.38 -4.21 120.40 120.44 1w36 s VAL 817 Ca 0.30 -1.11 -0.15 0.00 0.00 0.00 0.00 61.98 61.03 1w36 s VAL 817 Cb -0.17 -1.28 0.02 0.00 0.00 0.00 0.00 36.38 34.95 1w36 s VAL 817 CO 0.16 0.14 0.32 0.00 0.00 0.00 0.00 175.10 175.72 1w36 s ALA 818 N -0.80 -0.76 0.00 5.51 0.00 -1.26 -1.60 121.76 122.85 1w36 s ALA 818 Ca 0.05 0.14 -0.04 0.00 0.00 0.00 0.00 51.96 52.12 1w36 s ALA 818 Cb -0.08 0.25 -0.17 0.00 0.00 0.00 0.00 23.12 23.12 1w36 s ALA 818 CO 0.01 -0.38 2.52 -0.35 0.00 0.00 0.00 175.76 177.57 1w36 n PRO 819 N 0.76 1.30 -1.55 0.00 -0.04 -1.26 -4.92 135.00 129.29 1w36 n PRO 819 Ca -0.19 -0.62 -0.52 0.00 -0.04 0.00 0.00 63.50 62.13 1w36 n PRO 819 Cb 0.59 -1.77 -0.06 0.00 -0.04 0.00 0.00 33.50 32.22 1w36 n PRO 819 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1w36 n LEU 820 N 2.55 1.03 -4.00 1.53 4.77 -1.26 -3.87 117.00 117.75 1w36 n LEU 820 Ca 0.26 1.14 -0.17 0.00 -0.03 0.00 0.00 56.01 57.21 1w36 n LEU 820 Cb 0.60 -1.12 -0.14 0.00 -2.33 0.00 0.00 43.42 40.43 1w36 n LEU 820 CO 0.14 -1.45 -0.42 -0.69 -1.33 0.00 0.00 177.39 173.65 1w36 s VAL 821 N 0.07 0.57 0.00 4.08 1.01 -0.31 -2.52 120.40 123.30 1w36 s VAL 821 Ca 0.81 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.39 1w36 s VAL 821 Cb -1.00 -0.50 0.00 0.00 0.00 0.00 0.00 36.38 34.89 1w36 s VAL 821 CO 0.51 0.09 0.00 0.54 0.00 0.00 0.00 175.10 176.25 1w36 n ARG 822 N 2.72 1.53 -1.67 2.72 1.74 -1.26 -4.54 116.66 117.90 1w36 n ARG 822 Ca -0.14 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.48 1w36 n ARG 822 Cb 0.57 -0.87 -0.04 0.00 -1.02 0.00 0.00 32.46 31.11 1w36 n ARG 822 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1w36 n ARG 823 N -1.90 2.16 -0.12 5.56 0.63 -1.26 -4.79 116.66 116.93 1w36 n ARG 823 Ca 0.00 0.78 -0.02 0.00 -0.92 0.00 0.00 57.85 57.68 1w36 n ARG 823 Cb 0.37 -2.52 0.02 0.00 0.45 0.00 0.00 32.46 30.77 1w36 n ARG 823 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1w36 n ARG 824 N 3.09 1.13 -2.95 -0.14 3.00 -1.26 -4.73 116.66 114.80 1w36 n ARG 824 Ca 0.15 -0.30 -0.41 0.00 -0.01 0.00 0.00 57.85 57.29 1w36 n ARG 824 Cb 0.30 -1.13 -0.04 0.00 0.00 0.00 0.00 32.46 31.58 1w36 n ARG 824 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1w36 s GLY 825 N 0.74 2.25 -0.63 -0.13 0.00 -1.26 -4.94 107.32 103.35 1w36 s GLY 825 Ca 0.06 0.03 -0.26 0.00 0.00 0.00 0.00 44.72 44.55 1w36 s GLY 825 CO 0.01 1.50 2.41 -0.35 0.00 0.00 0.00 173.10 176.68 1w36 s ASP 826 N 1.08 4.18 0.00 1.64 -1.08 -1.26 -4.31 116.67 116.92 1w36 s ASP 826 Ca 0.37 0.60 0.00 0.00 -0.52 0.00 0.00 52.55 53.01 1w36 s ASP 826 Cb -0.17 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.77 1w36 s ASP 826 CO 0.14 -3.35 0.00 1.17 0.52 0.00 0.00 175.17 173.65 1w36 n LYS 827 N 8.93 -0.28 -1.07 4.34 3.00 -1.26 -4.75 118.16 127.06 1w36 n LYS 827 Ca 0.41 -0.14 -0.21 0.00 -0.00 0.00 0.00 58.31 58.38 1w36 n LYS 827 Cb 0.50 0.25 0.02 0.00 0.00 0.00 0.00 35.03 35.80 1w36 n LYS 827 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1w36 n LYS 828 N -0.52 2.03 -1.20 1.64 5.02 -1.26 -4.54 118.16 119.33 1w36 n LYS 828 Ca 0.00 -1.94 -0.02 0.00 -2.02 0.00 0.00 58.31 54.33 1w36 n LYS 828 Cb 0.00 -1.80 -0.01 0.00 -0.02 0.00 0.00 35.03 33.20 1w36 n LYS 828 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1w36 n GLY 829 N 0.29 0.52 0.00 0.72 0.00 -1.26 -5.01 105.19 100.45 1w36 n GLY 829 Ca 0.38 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1w36 n GLY 829 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w36 n ASP 830 N 1.62 0.00 -2.80 1.61 8.00 -1.26 -4.28 116.55 119.44 1w36 n ASP 830 Ca -0.02 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.47 1w36 n ASP 830 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 1w36 n ASP 830 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1w36 n THR 831 N 0.00 -8.97 -1.07 -3.53 -2.24 -1.26 -4.32 114.28 92.88 1w36 n THR 831 Ca 0.00 -0.06 -0.25 0.00 -2.27 0.00 0.00 64.05 61.48 1w36 n THR 831 Cb 0.00 -6.49 -0.08 0.00 -2.10 0.00 0.00 70.33 61.66 1w36 n THR 831 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1w36 n ASP 832 N -1.45 6.60 0.18 3.42 5.68 -1.05 -4.04 116.55 125.90 1w36 n ASP 832 Ca 0.02 -2.47 0.07 0.00 -0.50 0.00 0.00 54.79 51.91 1w36 n ASP 832 Cb 0.48 -1.39 0.20 0.00 -1.14 0.00 0.00 41.12 39.27 1w36 n ASP 832 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1w36 h VAL 833 N 2.65 0.61 0.00 2.12 2.07 -1.86 -3.07 116.25 118.76 1w36 h VAL 833 Ca 0.53 -1.63 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1w36 h VAL 833 Cb 0.75 2.13 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 1w36 h VAL 833 CO 1.08 0.31 0.00 0.00 0.02 0.00 0.00 177.57 178.98 1w36 n HIS 834 N -3.26 0.00 -0.28 1.57 1.44 -1.26 -2.56 115.22 110.87 1w36 n HIS 834 Ca 0.02 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.81 1w36 n HIS 834 Cb 0.60 0.00 0.22 0.00 0.12 0.00 0.00 29.99 30.93 1w36 n HIS 834 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1w36 n GLN 835 N -0.81 2.86 -4.31 -1.40 6.02 -1.16 -4.30 117.38 114.28 1w36 n GLN 835 Ca 0.08 -2.32 -0.25 0.00 -0.01 0.00 0.00 57.00 54.50 1w36 n GLN 835 Cb 0.04 -1.41 -0.08 0.00 1.02 0.00 0.00 30.24 29.80 1w36 n GLN 835 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1w36 s SER 836 N -1.02 4.33 0.07 1.08 1.04 -1.06 -4.87 113.70 113.27 1w36 s SER 836 Ca 0.34 -0.65 -0.34 0.00 0.48 0.00 0.00 55.95 55.78 1w36 s SER 836 Cb 0.18 -0.74 -0.18 0.00 0.10 0.00 0.00 66.02 65.38 1w36 s SER 836 CO 0.22 0.05 1.52 0.00 0.98 0.00 0.00 173.24 176.01 1w36 h ALA 837 N 2.38 -1.25 -0.90 5.32 0.00 -1.87 0.13 119.26 123.08 1w36 h ALA 837 Ca -0.45 -0.23 0.14 0.00 0.00 0.00 0.00 54.91 54.37 1w36 h ALA 837 Cb 1.23 0.58 -0.07 0.00 0.00 0.00 0.00 17.79 19.53 1w36 h ALA 837 CO 0.58 -1.21 0.58 1.25 0.00 0.00 0.00 179.25 180.45 1w36 h LEU 838 N -1.12 0.66 -0.67 0.00 7.12 -1.90 0.15 115.31 119.56 1w36 h LEU 838 Ca -0.10 0.04 -0.12 0.00 0.13 0.00 0.00 57.88 57.83 1w36 h LEU 838 Cb 0.90 -0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 40.93 1w36 h LEU 838 CO 0.09 0.33 -0.24 1.23 -0.13 0.00 0.00 178.44 179.72 1w36 h GLY 839 N 0.70 0.84 1.79 3.75 0.00 -1.59 -2.12 103.07 106.44 1w36 h GLY 839 Ca 0.45 -0.73 -0.09 0.00 0.00 0.00 0.00 47.33 46.96 1w36 h GLY 839 CO -0.21 0.67 -0.31 -0.09 0.00 0.00 0.00 176.54 176.60 1w36 h ARG 840 N 0.67 0.25 0.18 4.80 2.43 0.21 -2.05 114.38 120.87 1w36 h ARG 840 Ca 0.09 -0.09 -0.31 0.00 -0.81 0.00 0.00 59.98 58.85 1w36 h ARG 840 Cb 0.76 -0.01 0.03 0.00 -0.42 0.00 0.00 29.97 30.33 1w36 h ARG 840 CO 0.06 0.54 -1.35 -0.07 -1.51 0.00 0.00 179.97 177.64 1w36 h LEU 841 N 0.22 0.83 0.21 3.80 3.38 -1.25 -1.40 115.31 121.09 1w36 h LEU 841 Ca 0.03 -0.83 -0.01 0.00 0.09 0.00 0.00 57.88 57.16 1w36 h LEU 841 Cb 0.66 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1w36 h LEU 841 CO 0.05 1.63 -0.10 -0.07 0.09 0.00 0.00 178.44 180.04 1w36 h LEU 842 N 0.21 -0.24 -2.65 1.67 3.38 -1.26 -2.96 115.31 113.46 1w36 h LEU 842 Ca -0.21 -0.15 -0.16 0.00 0.09 0.00 0.00 57.88 57.44 1w36 h LEU 842 Cb 2.03 0.06 -0.10 0.00 0.09 0.00 0.00 40.66 42.75 1w36 h LEU 842 CO 0.25 0.02 0.20 0.00 0.09 0.00 0.00 178.44 179.01 1w36 n GLN 843 N -5.12 1.87 -1.56 1.13 6.02 -0.78 -4.81 117.38 114.13 1w36 n GLN 843 Ca -0.09 -1.32 0.00 0.00 -0.01 0.00 0.00 57.00 55.58 1w36 n GLN 843 Cb 0.21 -1.60 0.00 0.00 1.02 0.00 0.00 30.24 29.86 1w36 n GLN 843 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1w36 n LYS 844 N -0.07 -1.77 0.00 -1.09 5.02 -1.11 -2.05 118.16 117.08 1w36 n LYS 844 Ca 0.22 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1w36 n LYS 844 Cb 0.91 -3.98 0.00 0.00 -0.02 0.00 0.00 35.03 31.94 1w36 n LYS 844 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1w36 n GLY 845 N -0.20 2.92 3.76 0.72 0.00 -0.55 -4.96 105.19 106.88 1w36 n GLY 845 Ca 0.00 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1w36 n GLY 845 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1w36 s GLU 846 N 0.00 4.41 0.76 1.61 -1.05 -0.87 -4.91 118.70 118.65 1w36 s GLU 846 Ca 0.00 2.11 -0.15 0.00 -0.15 0.00 0.00 54.97 56.78 1w36 s GLU 846 Cb 0.00 -3.13 0.05 0.00 -0.44 0.00 0.00 34.13 30.62 1w36 s GLU 846 CO 0.00 -0.15 1.22 -1.25 0.95 0.00 0.00 175.26 176.03 1w36 s PRO 847 N -1.21 1.94 0.28 -4.83 0.04 -1.26 -4.78 135.00 125.18 1w36 s PRO 847 Ca 0.51 1.81 0.03 0.00 0.04 0.00 0.00 61.00 63.38 1w36 s PRO 847 Cb -0.38 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1w36 s PRO 847 CO 0.46 -2.00 0.18 -0.65 0.04 0.00 0.00 177.00 175.04 1w36 s GLN 848 N -3.95 1.53 0.70 4.56 -1.52 -1.26 -5.08 119.66 114.64 1w36 s GLN 848 Ca 0.75 -1.87 -0.11 0.00 -1.95 0.00 0.00 55.36 52.18 1w36 s GLN 848 Cb -0.30 0.09 0.01 0.00 -0.22 0.00 0.00 33.01 32.59 1w36 s GLN 848 CO 0.47 -0.48 1.06 0.34 -0.25 0.00 0.00 175.29 176.43 1w36 s ASP 849 N -3.32 5.32 0.51 5.90 -1.08 -1.26 -4.34 116.67 118.41 1w36 s ASP 849 Ca 0.38 1.65 0.19 0.00 -0.52 0.00 0.00 52.55 54.24 1w36 s ASP 849 Cb 0.05 -2.50 1.30 0.00 -1.46 0.00 0.00 42.92 40.31 1w36 s ASP 849 CO 0.19 -1.48 2.11 0.00 0.52 0.00 0.00 175.17 176.51 1w36 h ALA 850 N -0.69 1.76 0.00 3.66 0.00 -1.85 0.76 119.26 122.91 1w36 h ALA 850 Ca -0.44 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1w36 h ALA 850 Cb 1.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1w36 h ALA 850 CO 0.56 0.09 -0.74 0.00 0.00 0.00 0.00 179.25 179.16 1w36 n ALA 851 N -2.47 3.07 0.26 0.00 0.00 -1.26 -3.51 120.51 116.61 1w36 n ALA 851 Ca -0.03 -0.30 0.16 0.00 0.00 0.00 0.00 53.44 53.27 1w36 n ALA 851 Cb 0.15 -1.11 0.57 0.00 0.00 0.00 0.00 19.45 19.06 1w36 n ALA 851 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1w36 h GLY 852 N 4.53 0.00 0.23 0.00 0.00 -1.18 -2.92 103.07 103.73 1w36 h GLY 852 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1w36 h GLY 852 CO 0.00 0.00 -0.11 -2.00 0.00 0.00 0.00 176.54 174.43 1w36 h LEU 853 N 0.00 -0.27 -1.11 3.11 6.46 -1.54 -2.98 115.31 118.98 1w36 h LEU 853 Ca -0.00 0.01 0.42 0.00 -0.12 0.00 0.00 57.88 58.19 1w36 h LEU 853 Cb 0.63 0.07 -0.16 0.00 -0.73 0.00 0.00 40.66 40.46 1w36 h LEU 853 CO 0.00 -0.09 0.64 -0.09 -0.62 0.00 0.00 178.44 178.28 1w36 h ARG 854 N -0.51 0.04 0.00 1.25 2.43 -1.70 0.84 114.38 116.73 1w36 h ARG 854 Ca -0.03 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1w36 h ARG 854 Cb 0.24 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1w36 h ARG 854 CO 0.05 0.03 0.00 1.79 -1.51 0.00 0.00 179.97 180.33 1w36 h THR 855 N 0.04 0.00 0.15 0.20 1.35 -1.51 -2.29 112.91 110.86 1w36 h THR 855 Ca 0.84 -0.70 -0.32 0.00 -0.55 0.00 0.00 66.41 65.68 1w36 h THR 855 Cb 2.33 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 70.43 1w36 h THR 855 CO -0.66 0.00 -1.59 0.00 -0.25 0.00 0.00 175.52 173.01 1w36 h ILE 857 N 0.09 0.71 -0.48 0.00 2.04 -1.40 -2.41 117.51 116.05 1w36 h ILE 857 Ca -0.27 -0.24 0.09 0.00 1.00 0.00 0.00 64.86 65.43 1w36 h ILE 857 Cb 2.06 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 38.95 1w36 h ILE 857 CO 0.18 0.05 0.33 -0.33 0.00 0.00 0.00 178.15 178.38 1w36 h GLU 858 N -0.56 0.28 -0.35 2.37 5.08 -1.52 -2.64 114.58 117.24 1w36 h GLU 858 Ca -0.04 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1w36 h GLU 858 Cb 0.41 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 1w36 h GLU 858 CO 0.07 0.19 0.12 0.00 -1.00 0.00 0.00 179.01 178.39 1w36 h ALA 859 N 1.75 0.40 -2.51 3.43 0.00 -1.21 -3.32 119.26 117.80 1w36 h ALA 859 Ca 0.22 0.04 -0.73 0.00 0.00 0.00 0.00 54.91 54.44 1w36 h ALA 859 Cb 0.50 0.03 -0.27 0.00 0.00 0.00 0.00 17.79 18.05 1w36 h ALA 859 CO -0.05 -0.28 -0.37 -0.48 0.00 0.00 0.00 179.25 178.08 1w36 s LEU 860 N -10.32 5.62 0.00 0.00 2.34 -0.99 -4.94 118.68 110.39 1w36 s LEU 860 Ca -0.13 -1.66 0.00 0.00 0.06 0.00 0.00 54.13 52.40 1w36 s LEU 860 Cb 0.12 -2.07 0.00 0.00 -0.56 0.00 0.00 46.19 43.67 1w36 s LEU 860 CO 0.71 -0.67 0.79 0.00 -1.06 0.00 0.00 176.35 176.12 1w36 s ASP 862 N -0.78 4.63 0.00 0.00 1.01 -1.10 -4.19 116.67 116.24 1w36 s ASP 862 Ca 0.00 -0.35 0.00 0.00 0.71 0.00 0.00 52.55 52.91 1w36 s ASP 862 Cb 0.00 -0.96 0.00 0.00 1.01 0.00 0.00 42.92 42.97 1w36 s ASP 862 CO 0.00 0.15 0.00 -0.67 0.21 0.00 0.00 175.17 174.86 1w36 n ASP 863 N 0.41 0.00 0.00 0.27 -0.08 -1.26 -2.67 116.55 113.22 1w36 n ASP 863 Ca -0.12 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.16 1w36 n ASP 863 Cb 0.53 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.99 1w36 n ASP 863 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1w36 n ASP 864 N 0.08 0.00 -4.39 1.67 8.00 -1.26 -4.92 116.55 115.73 1w36 n ASP 864 Ca 0.00 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.18 1w36 n ASP 864 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 40.96 1w36 n ASP 864 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1w36 s ILE 865 N 0.00 2.70 0.17 0.53 1.01 -1.09 0.21 121.20 124.73 1w36 s ILE 865 Ca 0.00 -0.85 -0.21 0.00 0.00 0.00 0.00 60.65 59.60 1w36 s ILE 865 Cb 0.00 -2.04 0.05 0.00 0.01 0.00 0.00 42.46 40.48 1w36 s ILE 865 CO 0.00 0.58 0.56 0.00 0.00 0.00 0.00 174.94 176.08 1w36 s ALA 866 N -0.44 -1.33 0.18 9.38 0.00 -0.50 -2.73 121.76 126.33 1w36 s ALA 866 Ca 0.05 0.20 0.01 0.00 0.00 0.00 0.00 51.96 52.22 1w36 s ALA 866 Cb -0.12 0.84 -0.05 0.00 0.00 0.00 0.00 23.12 23.80 1w36 s ALA 866 CO 0.02 -0.77 0.03 1.67 0.00 0.00 0.00 175.76 176.70 1w36 s TRP 867 N -3.79 1.24 0.26 0.00 1.48 -1.26 0.06 118.94 116.92 1w36 s TRP 867 Ca 0.04 -1.08 -0.11 0.00 -1.06 0.00 0.00 56.10 53.89 1w36 s TRP 867 Cb -0.01 -0.71 -0.00 0.00 -1.16 0.00 0.00 33.47 31.59 1w36 s TRP 867 CO -0.09 -0.27 0.48 -0.65 -4.06 0.00 0.00 176.95 172.36 1w36 s GLN 868 N -3.95 1.61 0.14 3.25 -0.21 -0.75 -4.92 119.66 114.83 1w36 s GLN 868 Ca 0.27 -1.34 0.02 0.00 0.02 0.00 0.00 55.36 54.33 1w36 s GLN 868 Cb 0.06 0.47 -0.04 0.00 1.00 0.00 0.00 33.01 34.51 1w36 s GLN 868 CO 0.06 -0.67 0.27 0.95 -2.12 0.00 0.00 175.29 173.78 1w36 s THR 869 N -3.83 5.31 -0.64 -0.19 -4.23 -1.26 -1.27 115.64 109.52 1w36 s THR 869 Ca 0.24 -0.66 -0.15 0.00 -1.18 0.00 0.00 61.69 59.93 1w36 s THR 869 Cb -0.01 -3.72 -0.15 0.00 1.34 0.00 0.00 72.50 69.97 1w36 s THR 869 CO 0.11 -0.07 1.72 0.00 -0.54 0.00 0.00 174.62 175.84 1w36 n ALA 870 N -0.44 0.39 -2.64 3.99 0.00 -1.03 -4.54 120.51 116.24 1w36 n ALA 870 Ca -0.07 -1.58 -0.42 0.00 0.00 0.00 0.00 53.44 51.38 1w36 n ALA 870 Cb 0.54 -2.18 -0.03 0.00 0.00 0.00 0.00 19.45 17.77 1w36 n ALA 870 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1w36 s GLN 871 N 7.12 3.18 1.28 0.00 -1.52 -1.26 -4.93 119.66 123.53 1w36 s GLN 871 Ca 0.55 -0.39 -0.16 0.00 -1.95 0.00 0.00 55.36 53.41 1w36 s GLN 871 Cb -0.10 -4.19 0.32 0.00 -0.22 0.00 0.00 33.01 28.83 1w36 s GLN 871 CO 0.14 -2.04 0.93 0.25 -0.25 0.00 0.00 175.29 174.32 1w36 n THR 872 N 6.26 0.00 -3.59 -0.19 -2.24 -1.26 -4.85 114.28 108.41 1w36 n THR 872 Ca 0.01 -0.35 -0.07 0.00 -2.27 0.00 0.00 64.05 61.37 1w36 n THR 872 Cb 0.48 -0.98 -0.02 0.00 -2.10 0.00 0.00 70.33 67.71 1w36 n THR 872 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1w36 s GLY 873 N -2.55 -0.39 -0.10 3.38 0.00 -1.26 -5.02 107.32 101.38 1w36 s GLY 873 Ca 0.68 0.70 -0.22 0.00 0.00 0.00 0.00 44.72 45.88 1w36 s GLY 873 CO 0.63 0.22 0.52 -0.35 0.00 0.00 0.00 173.10 174.12 1w36 s ASP 874 N -2.65 -0.49 0.00 1.64 2.15 -1.26 -4.94 116.67 111.12 1w36 s ASP 874 Ca 0.08 0.68 0.00 0.00 0.43 0.00 0.00 52.55 53.73 1w36 s ASP 874 Cb -0.01 0.69 0.00 0.00 -0.30 0.00 0.00 42.92 43.30 1w36 s ASP 874 CO -0.05 -0.41 0.00 -3.20 -0.17 0.00 0.00 175.17 171.34 1w36 n ASN 875 N 1.71 0.00 0.14 -0.34 5.15 -1.26 -5.03 115.26 115.63 1w36 n ASN 875 Ca -0.18 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.80 1w36 n ASN 875 Cb 0.56 0.00 0.01 0.00 -0.53 0.00 0.00 39.78 39.82 1w36 n ASN 875 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 1w36 n GLN 876 N 0.00 0.01 -2.26 1.20 7.27 -1.26 -4.67 117.38 117.67 1w36 n GLN 876 Ca 0.00 0.41 -0.28 0.00 0.07 0.00 0.00 57.00 57.21 1w36 n GLN 876 Cb 0.00 -2.24 0.03 0.00 2.41 0.00 0.00 30.24 30.44 1w36 n GLN 876 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1w36 s PRO 877 N -2.87 2.94 -0.31 3.69 0.04 -1.26 -3.98 135.00 133.25 1w36 s PRO 877 Ca -0.00 0.14 0.18 0.00 0.04 0.00 0.00 61.00 61.36 1w36 s PRO 877 Cb 0.00 -2.20 0.46 0.00 0.04 0.00 0.00 34.50 32.80 1w36 s PRO 877 CO 0.00 -0.77 1.18 1.87 0.04 0.00 0.00 177.00 179.33 1w36 n TRP 878 N -2.69 0.11 -0.43 0.56 -0.00 -1.25 -4.88 117.44 108.86 1w36 n TRP 878 Ca 0.05 -2.20 0.00 0.00 -0.00 0.00 0.00 57.50 55.35 1w36 n TRP 878 Cb 0.57 0.31 0.00 0.00 -0.00 0.00 0.00 31.31 32.20 1w36 n TRP 878 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 1w36 n GLN 879 N -0.64 0.00 -4.97 5.87 6.02 -1.26 -4.85 117.38 117.54 1w36 n GLN 879 Ca 0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.72 1w36 n GLN 879 Cb 0.83 -0.50 -0.15 0.00 1.02 0.00 0.00 30.24 31.43 1w36 n GLN 879 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1w36 s VAL 880 N 1.20 1.85 0.10 5.09 0.11 -1.26 -5.09 120.40 122.40 1w36 s VAL 880 Ca 0.00 -1.12 0.01 0.00 -2.93 0.00 0.00 61.98 57.94 1w36 s VAL 880 Cb 0.00 -1.56 0.01 0.00 -1.53 0.00 0.00 36.38 33.30 1w36 s VAL 880 CO 0.00 0.41 0.07 0.59 -3.33 0.00 0.00 175.10 172.84 1w36 n ASN 881 N 2.20 1.43 -1.81 3.54 3.02 -1.26 -5.16 115.26 117.22 1w36 n ASN 881 Ca -0.16 -1.36 -0.06 0.00 -0.03 0.00 0.00 54.58 52.96 1w36 n ASN 881 Cb 0.52 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.67 1w36 n ASN 881 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1w36 n ASP 882 N -1.87 0.09 -3.61 6.41 5.68 -1.26 -5.17 116.55 116.83 1w36 n ASP 882 Ca -0.01 -1.67 -0.06 0.00 -0.50 0.00 0.00 54.79 52.55 1w36 n ASP 882 Cb 0.12 0.46 -0.04 0.00 -1.14 0.00 0.00 41.12 40.52 1w36 n ASP 882 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1w36 s VAL 883 N -2.31 0.00 -0.29 2.12 1.01 -1.26 -5.19 120.40 114.48 1w36 s VAL 883 Ca 0.11 0.00 -0.17 0.00 0.00 0.00 0.00 61.98 61.91 1w36 s VAL 883 Cb 0.01 -1.00 0.12 0.00 0.00 0.00 0.00 36.38 35.51 1w36 s VAL 883 CO 0.08 0.00 0.89 -0.55 0.00 0.00 0.00 175.10 175.51 1w36 s SER 884 N -1.19 -0.64 -0.43 3.32 0.15 -1.26 -5.11 113.70 108.55 1w36 s SER 884 Ca 0.04 1.05 0.02 0.00 0.70 0.00 0.00 55.95 57.76 1w36 s SER 884 Cb -0.01 1.23 0.14 0.00 -1.71 0.00 0.00 66.02 65.67 1w36 s SER 884 CO -0.03 -0.17 0.24 0.42 1.20 0.00 0.00 173.24 174.90 1w36 s THR 885 N 1.27 1.21 -1.28 6.45 -4.23 -1.26 -5.05 115.64 112.75 1w36 s THR 885 Ca -0.08 -2.44 -0.18 0.00 -1.18 0.00 0.00 61.69 57.81 1w36 s THR 885 Cb -0.04 -1.85 0.03 0.00 1.34 0.00 0.00 72.50 71.98 1w36 s THR 885 CO -0.15 -0.92 1.87 0.00 -0.54 0.00 0.00 174.62 174.88 1w36 n ALA 886 N 3.60 3.60 -2.99 3.99 0.00 -1.26 -4.88 120.51 122.56 1w36 n ALA 886 Ca 0.10 -3.69 -0.44 0.00 0.00 0.00 0.00 53.44 49.41 1w36 n ALA 886 Cb 0.35 -3.58 0.00 0.00 0.00 0.00 0.00 19.45 16.23 1w36 n ALA 886 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1w36 n GLU 887 N 7.90 3.71 -4.57 0.00 -0.58 -1.26 -4.98 120.64 120.85 1w36 n GLU 887 Ca 0.49 -4.16 -0.26 0.00 -0.42 0.00 0.00 57.16 52.81 1w36 n GLU 887 Cb 0.45 -2.74 -0.11 0.00 -0.57 0.00 0.00 31.44 28.47 1w36 n GLU 887 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1w36 s LEU 888 N -0.61 2.58 -0.08 -4.62 1.43 -1.26 -5.15 118.68 110.95 1w36 s LEU 888 Ca 0.36 -1.40 -0.32 0.00 -1.03 0.00 0.00 54.13 51.73 1w36 s LEU 888 Cb -0.02 -0.69 0.13 0.00 0.03 0.00 0.00 46.19 45.65 1w36 s LEU 888 CO -0.00 -0.55 1.31 0.54 0.23 0.00 0.00 176.35 177.88 1w36 s ASN 889 N -3.64 -0.06 0.07 2.29 6.03 -1.26 -5.17 114.94 113.19 1w36 s ASN 889 Ca 0.33 -0.08 0.09 0.00 -1.03 0.00 0.00 52.86 52.17 1w36 s ASN 889 Cb 0.09 0.12 -0.03 0.00 -3.03 0.00 0.00 41.25 38.40 1w36 s ASN 889 CO 0.16 -0.22 -0.23 0.00 -2.03 0.00 0.00 177.10 174.78 1w36 s ALA 890 N -2.33 1.98 0.18 3.54 0.00 -1.26 -5.09 121.76 118.78 1w36 s ALA 890 Ca 0.13 -1.22 -0.32 0.00 0.00 0.00 0.00 51.96 50.56 1w36 s ALA 890 Cb 0.04 -0.35 -0.11 0.00 0.00 0.00 0.00 23.12 22.70 1w36 s ALA 890 CO -0.04 0.44 1.64 0.15 0.00 0.00 0.00 175.76 177.95 1w36 s LYS 891 N -1.52 4.18 -0.05 0.00 1.02 -1.26 -5.00 119.74 117.11 1w36 s LYS 891 Ca 0.09 2.47 0.04 0.00 0.02 0.00 0.00 55.97 58.59 1w36 s LYS 891 Cb -0.10 -3.14 -0.02 0.00 -0.52 0.00 0.00 37.83 34.05 1w36 s LYS 891 CO 0.03 -0.67 -0.16 0.95 -0.92 0.00 0.00 175.35 174.58 1w36 s THR 892 N 1.23 2.93 0.00 2.17 -4.23 -1.26 -5.10 115.64 111.39 1w36 s THR 892 Ca 0.72 -0.77 -0.16 0.00 -1.18 0.00 0.00 61.69 60.31 1w36 s THR 892 Cb -0.46 -2.14 -0.06 0.00 1.34 0.00 0.00 72.50 71.18 1w36 s THR 892 CO 0.32 0.59 0.43 -1.48 -0.54 0.00 0.00 174.62 173.94 1w36 s LEU 893 N -0.68 4.47 -0.02 4.79 -0.00 -1.26 -4.97 118.68 121.00 1w36 s LEU 893 Ca 0.10 0.99 0.22 0.00 -0.00 0.00 0.00 54.13 55.45 1w36 s LEU 893 Cb -0.11 -2.63 0.68 0.00 -0.00 0.00 0.00 46.19 44.13 1w36 s LEU 893 CO 0.00 0.30 1.57 0.00 -0.00 0.00 0.00 176.35 178.22 1w36 n GLN 894 N 1.95 2.93 -2.17 1.48 1.13 -1.26 -4.93 117.38 116.52 1w36 n GLN 894 Ca -0.13 -2.73 -0.27 0.00 -1.94 0.00 0.00 57.00 51.93 1w36 n GLN 894 Cb 0.52 -1.64 0.13 0.00 0.11 0.00 0.00 30.24 29.36 1w36 n GLN 894 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1w36 s ARG 895 N -1.16 1.38 0.06 -1.09 3.52 -1.26 -5.10 118.95 115.30 1w36 s ARG 895 Ca 0.50 -0.52 -0.05 0.00 -0.13 0.00 0.00 55.73 55.53 1w36 s ARG 895 Cb 0.27 -2.06 -0.02 0.00 -1.56 0.00 0.00 34.95 31.59 1w36 s ARG 895 CO 0.32 -1.82 0.09 -0.48 -0.81 0.00 0.00 175.30 172.61 1w36 s LEU 896 N -5.52 1.87 0.11 -0.88 0.05 -1.26 -5.08 118.68 107.98 1w36 s LEU 896 Ca 0.68 -0.72 -0.32 0.00 0.05 0.00 0.00 54.13 53.82 1w36 s LEU 896 Cb -0.06 0.64 -0.11 0.00 -2.05 0.00 0.00 46.19 44.61 1w36 s LEU 896 CO 0.48 -0.62 1.58 -0.65 -0.55 0.00 0.00 176.35 176.59 1w36 h PRO 897 N 3.16 -0.64 0.00 1.48 0.11 -2.02 -3.45 132.00 130.63 1w36 h PRO 897 Ca -0.34 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1w36 h PRO 897 Cb 1.18 0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1w36 h PRO 897 CO 0.57 -0.43 0.00 0.41 -0.21 0.00 0.00 178.00 178.35 1w36 n GLY 898 N -1.47 0.32 3.44 -0.55 0.00 -1.26 -4.75 105.19 100.92 1w36 n GLY 898 Ca -0.07 0.66 -0.27 0.00 0.00 0.00 0.00 46.02 46.34 1w36 n GLY 898 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w36 s ASP 899 N -4.00 3.50 -0.07 1.61 1.01 -1.26 -5.14 116.67 112.31 1w36 s ASP 899 Ca 0.00 -0.87 0.02 0.00 0.71 0.00 0.00 52.55 52.41 1w36 s ASP 899 Cb 0.00 -0.28 0.01 0.00 1.01 0.00 0.00 42.92 43.66 1w36 s ASP 899 CO 0.00 0.11 -0.12 0.54 0.21 0.00 0.00 175.17 175.91 1w36 s ASN 900 N -2.78 1.88 -0.19 0.27 4.22 -1.26 -5.11 114.94 111.97 1w36 s ASN 900 Ca 0.22 -0.31 -0.09 0.00 -2.14 0.00 0.00 52.86 50.53 1w36 s ASN 900 Cb -0.08 -0.86 -0.05 0.00 1.28 0.00 0.00 41.25 41.55 1w36 s ASN 900 CO 0.11 0.02 0.13 0.86 -2.04 0.00 0.00 177.10 176.17 1w36 s TRP 901 N 0.77 3.42 0.30 1.54 -0.11 -1.26 -3.23 118.94 120.37 1w36 s TRP 901 Ca -0.13 0.34 -0.00 0.00 1.22 0.00 0.00 56.10 57.53 1w36 s TRP 901 Cb -0.16 -2.12 -0.02 0.00 -1.50 0.00 0.00 33.47 29.68 1w36 s TRP 901 CO 0.03 0.34 0.35 1.03 -4.62 0.00 0.00 176.95 174.07 1w36 s ARG 902 N 0.16 1.69 -0.27 5.86 0.52 -0.54 -4.94 118.95 121.42 1w36 s ARG 902 Ca 0.09 -1.77 0.03 0.00 -0.52 0.00 0.00 55.73 53.56 1w36 s ARG 902 Cb -0.11 0.38 0.07 0.00 0.52 0.00 0.00 34.95 35.80 1w36 s ARG 902 CO -0.01 -0.65 -0.07 0.08 0.02 0.00 0.00 175.30 174.67 1w36 s VAL 903 N -3.49 2.09 0.29 3.52 1.01 -1.26 -0.72 120.40 121.84 1w36 s VAL 903 Ca 0.35 -1.73 0.02 0.00 0.00 0.00 0.00 61.98 60.61 1w36 s VAL 903 Cb 0.02 -2.30 0.02 0.00 0.00 0.00 0.00 36.38 34.12 1w36 s VAL 903 CO 0.20 -0.17 0.14 0.35 0.00 0.00 0.00 175.10 175.61 1w36 n THR 904 N 4.43 0.00 -2.60 3.92 -2.24 -0.93 -4.89 114.28 111.98 1w36 n THR 904 Ca -0.10 -1.21 -0.02 0.00 -2.27 0.00 0.00 64.05 60.45 1w36 n THR 904 Cb 0.42 -0.06 0.04 0.00 -2.10 0.00 0.00 70.33 68.63 1w36 n THR 904 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1w36 n SER 905 N -1.63 -0.81 -2.41 3.42 3.41 -1.26 0.09 113.62 114.43 1w36 n SER 905 Ca -0.05 -1.58 -0.06 0.00 -0.26 0.00 0.00 58.87 56.92 1w36 n SER 905 Cb 0.34 0.52 0.03 0.00 -0.26 0.00 0.00 64.21 64.83 1w36 n SER 905 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w36 n TYR 906 N -0.55 -1.39 -1.26 7.33 -0.00 -1.26 -4.81 117.16 115.22 1w36 n TYR 906 Ca -0.12 0.50 0.00 0.00 -0.00 0.00 0.00 57.90 58.28 1w36 n TYR 906 Cb 0.66 -3.25 0.00 0.00 -0.00 0.00 0.00 39.34 36.74 1w36 n TYR 906 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.86 175.73 1w36 n SER 907 N -2.17 0.00 0.06 2.98 3.41 -1.26 -4.57 113.62 112.06 1w36 n SER 907 Ca -0.03 -0.28 -0.04 0.00 -0.26 0.00 0.00 58.87 58.27 1w36 n SER 907 Cb 0.55 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.68 1w36 n SER 907 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1w36 h GLY 908 N 0.00 0.39 0.00 5.00 0.00 -1.97 -3.36 103.07 103.13 1w36 h GLY 908 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1w36 h GLY 908 CO 0.00 0.34 0.00 -0.10 0.00 0.00 0.00 176.54 176.78 1w36 n LEU 909 N -4.03 0.00 -3.48 3.11 -0.00 -1.26 -4.30 117.00 107.04 1w36 n LEU 909 Ca -0.01 0.00 -0.26 0.00 -0.00 0.00 0.00 56.01 55.73 1w36 n LEU 909 Cb 0.49 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.77 1w36 n LEU 909 CO 0.43 0.00 1.68 0.00 -0.00 0.00 0.00 177.39 179.50 1w36 n GLN 910 N 0.00 0.00 -1.03 1.96 6.02 -1.26 -4.88 117.38 118.19 1w36 n GLN 910 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.64 1w36 n GLN 910 Cb 0.00 -1.01 0.08 0.00 1.02 0.00 0.00 30.24 30.33 1w36 n GLN 910 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1w36 n GLN 911 N 5.69 0.00 -0.11 -1.09 1.13 -1.26 -4.77 117.38 116.96 1w36 n GLN 911 Ca 0.52 0.04 -0.07 0.00 -1.94 0.00 0.00 57.00 55.55 1w36 n GLN 911 Cb 0.06 -1.69 0.07 0.00 0.11 0.00 0.00 30.24 28.79 1w36 n GLN 911 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1w36 n ARG 912 N -0.57 -1.51 0.00 -1.09 5.12 -1.26 -4.36 116.66 112.99 1w36 n ARG 912 Ca 0.07 -0.33 0.00 0.00 -1.93 0.00 0.00 57.85 55.66 1w36 n ARG 912 Cb 0.52 -0.51 0.00 0.00 -1.16 0.00 0.00 32.46 31.31 1w36 n ARG 912 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1w36 n GLY 913 N -1.03 1.62 0.00 -0.13 0.00 -1.26 -4.78 105.19 99.61 1w36 n GLY 913 Ca 0.03 -0.33 0.07 0.00 0.00 0.00 0.00 46.02 45.79 1w36 n GLY 913 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1w36 n HIS 914 N 0.00 0.00 -1.69 1.61 8.25 -1.26 -4.64 115.22 117.48 1w36 n HIS 914 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 1w36 n HIS 914 Cb 0.00 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 1w36 n HIS 914 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1w36 n GLY 915 N 0.47 1.62 3.87 -1.41 0.00 -1.26 -0.10 105.19 108.38 1w36 n GLY 915 Ca 0.10 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.83 1w36 n GLY 915 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1w36 n ILE 916 N 4.58 0.00 0.11 -0.61 5.41 -1.26 -4.78 119.36 122.80 1w36 n ILE 916 Ca 0.18 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.83 1w36 n ILE 916 Cb 0.36 0.00 -0.06 0.00 -0.71 0.00 0.00 39.64 39.23 1w36 n ILE 916 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1w36 h ALA 917 N 0.00 -0.35 0.00 -1.39 0.00 -0.77 -0.19 119.26 116.56 1w36 h ALA 917 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1w36 h ALA 917 Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1w36 h ALA 917 CO 0.00 -0.39 0.00 0.37 0.00 0.00 0.00 179.25 179.23 1w36 h GLN 918 N -0.96 0.00 0.00 0.00 5.75 -1.73 -2.62 115.11 115.56 1w36 h GLN 918 Ca -0.04 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 1w36 h GLN 918 Cb 0.48 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.03 1w36 h GLN 918 CO 0.06 0.00 -0.18 -0.44 -2.65 0.00 0.00 178.83 175.62 1w36 h ASP 919 N 0.00 0.00 -0.01 -0.69 3.32 -1.78 -3.25 116.42 114.00 1w36 h ASP 919 Ca 0.00 -0.76 -0.15 0.00 0.02 0.00 0.00 57.03 56.15 1w36 h ASP 919 Cb 0.14 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1w36 h ASP 919 CO 0.00 0.98 -0.48 -0.07 -1.72 0.00 0.00 179.24 177.95 1w36 h LEU 920 N -1.00 0.62 -7.16 1.55 3.38 -0.89 -3.39 115.31 108.42 1w36 h LEU 920 Ca -0.05 -0.30 -0.58 0.00 0.09 0.00 0.00 57.88 57.04 1w36 h LEU 920 Cb 0.87 -0.18 -0.40 0.00 0.09 0.00 0.00 40.66 41.05 1w36 h LEU 920 CO -0.03 1.00 -0.76 -0.04 0.09 0.00 0.00 178.44 178.71 1w36 s MET 921 N -4.11 0.72 0.54 1.13 -1.94 -1.00 -5.02 119.30 109.62 1w36 s MET 921 Ca -0.07 -1.05 0.21 0.00 -1.71 0.00 0.00 55.69 53.06 1w36 s MET 921 Cb 0.12 -1.99 1.42 0.00 2.01 0.00 0.00 34.83 36.38 1w36 s MET 921 CO 0.83 -0.97 2.14 -1.35 -0.01 0.00 0.00 175.02 175.67 1w36 h PRO 922 N 8.09 0.00 -0.11 2.03 0.11 -1.77 -3.14 132.00 137.22 1w36 h PRO 922 Ca -0.14 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.92 1w36 h PRO 922 Cb 1.02 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 1w36 h PRO 922 CO 0.47 0.00 -0.33 0.54 -0.21 0.00 0.00 178.00 178.47 1w36 n ARG 923 N -4.33 1.67 -1.99 1.05 1.74 -1.26 -4.97 116.66 108.55 1w36 n ARG 923 Ca -0.01 -3.21 -0.38 0.00 -0.77 0.00 0.00 57.85 53.48 1w36 n ARG 923 Cb 0.18 -1.67 0.01 0.00 -1.02 0.00 0.00 32.46 29.96 1w36 n ARG 923 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1w36 s LEU 924 N -3.21 4.01 -0.69 0.55 0.20 -1.18 -4.80 118.68 113.55 1w36 s LEU 924 Ca 0.39 2.61 -0.06 0.00 0.69 0.00 0.00 54.13 57.77 1w36 s LEU 924 Cb 0.37 -4.14 -0.05 0.00 -0.43 0.00 0.00 46.19 41.94 1w36 s LEU 924 CO -0.04 -1.17 1.85 -0.67 -0.29 0.00 0.00 176.35 176.03 1w36 n ASP 925 N -0.51 3.64 0.28 3.68 4.64 -1.26 -4.65 116.55 122.37 1w36 n ASP 925 Ca 0.07 -2.28 0.03 0.00 -1.38 0.00 0.00 54.79 51.23 1w36 n ASP 925 Cb 0.45 -0.96 0.07 0.00 -1.04 0.00 0.00 41.12 39.65 1w36 n ASP 925 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 1w36 h VAL 926 N 3.66 0.00 0.00 5.18 2.07 -1.93 0.19 116.25 125.42 1w36 h VAL 926 Ca 0.38 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.90 1w36 h VAL 926 Cb 0.17 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 1w36 h VAL 926 CO 1.40 0.00 0.00 0.47 0.02 0.00 0.00 177.57 179.46 1w36 n ASP 927 N -2.59 0.61 -5.02 0.57 8.00 -1.26 -4.84 116.55 112.03 1w36 n ASP 927 Ca 0.02 0.57 -0.19 0.00 0.71 0.00 0.00 54.79 55.91 1w36 n ASP 927 Cb 1.03 -0.73 0.04 0.00 -0.02 0.00 0.00 41.12 41.44 1w36 n ASP 927 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1w36 s ALA 928 N -3.10 4.61 0.00 2.24 0.00 0.66 -4.96 121.76 121.20 1w36 s ALA 928 Ca 0.10 -1.93 0.00 0.00 0.00 0.00 0.00 51.96 50.14 1w36 s ALA 928 Cb 0.13 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.70 1w36 s ALA 928 CO 0.55 -0.62 0.00 0.00 0.00 0.00 0.00 175.76 175.68 1w36 n ALA 929 N -2.09 0.00 0.00 0.00 0.00 -1.26 -4.57 120.51 112.58 1w36 n ALA 929 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1w36 n ALA 929 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1w36 n ALA 929 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w36 n GLY 930 N -0.50 0.50 1.96 0.00 0.00 -1.26 -4.76 105.19 101.14 1w36 n GLY 930 Ca 0.00 -2.22 -0.17 0.00 0.00 0.00 0.00 46.02 43.63 1w36 n GLY 930 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1w36 n VAL 931 N 1.80 0.00 -3.77 1.61 0.31 -1.26 -4.68 118.33 112.34 1w36 n VAL 931 Ca 0.00 -1.27 -0.13 0.00 -0.01 0.00 0.00 64.34 62.93 1w36 n VAL 931 Cb 0.00 0.19 -0.10 0.00 -0.91 0.00 0.00 33.84 33.02 1w36 n VAL 931 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1w36 s ALA 932 N -2.46 -0.76 0.00 3.52 0.00 -1.26 -4.87 121.76 115.92 1w36 s ALA 932 Ca 0.02 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.53 1w36 s ALA 932 Cb -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1w36 s ALA 932 CO 0.01 -0.21 0.00 -1.13 0.00 0.00 0.00 175.76 174.43 1w36 n SER 933 N 1.99 0.00 -2.72 0.00 3.41 -1.26 -5.00 113.62 110.04 1w36 n SER 933 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 1w36 n SER 933 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1w36 n SER 933 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1w36 n VAL 934 N 0.00 0.00 -0.77 -3.33 0.31 -1.26 -3.85 118.33 109.43 1w36 n VAL 934 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.40 1w36 n VAL 934 Cb 0.00 -1.30 0.11 0.00 -0.91 0.00 0.00 33.84 31.74 1w36 n VAL 934 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1w36 n VAL 935 N 3.36 1.66 0.29 2.52 0.31 -1.26 -4.85 118.33 120.36 1w36 n VAL 935 Ca 0.00 -1.90 0.14 0.00 -0.01 0.00 0.00 64.34 62.57 1w36 n VAL 935 Cb 0.00 -0.04 0.76 0.00 -0.91 0.00 0.00 33.84 33.66 1w36 n VAL 935 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1w36 h GLU 936 N 0.12 0.00 0.00 5.55 4.81 -1.99 -3.47 114.58 119.60 1w36 h GLU 936 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1w36 h GLU 936 Cb 0.89 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.27 1w36 h GLU 936 CO 0.01 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 178.68 1w36 n GLU 937 N -2.70 0.00 0.00 1.92 1.02 -1.26 -4.47 120.64 115.16 1w36 n GLU 937 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1w36 n GLU 937 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.72 1w36 n GLU 937 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1w36 n PRO 938 N 0.03 0.00 -3.49 3.49 -0.04 -1.26 -4.33 135.00 129.40 1w36 n PRO 938 Ca 0.00 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.25 1w36 n PRO 938 Cb 0.00 -0.41 -0.13 0.00 -0.04 0.00 0.00 33.50 32.92 1w36 n PRO 938 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1w36 s THR 939 N 0.00 -0.26 -0.18 0.52 -4.23 -1.26 -5.12 115.64 105.10 1w36 s THR 939 Ca 0.00 -0.39 -0.35 0.00 -1.18 0.00 0.00 61.69 59.78 1w36 s THR 939 Cb 0.00 -0.83 -0.12 0.00 1.34 0.00 0.00 72.50 72.89 1w36 s THR 939 CO 0.00 -0.42 1.96 0.18 -0.54 0.00 0.00 174.62 175.80 1w36 n LEU 940 N 5.30 3.04 -4.30 4.79 4.77 -1.26 -5.00 117.00 124.33 1w36 n LEU 940 Ca -0.05 0.81 -0.23 0.00 -0.03 0.00 0.00 56.01 56.52 1w36 n LEU 940 Cb 0.47 -1.33 -0.12 0.00 -2.33 0.00 0.00 43.42 40.10 1w36 n LEU 940 CO 0.05 -0.29 -0.50 0.42 -1.33 0.00 0.00 177.39 175.75 1w36 s THR 941 N 5.03 1.73 -1.42 -5.08 -4.23 -1.26 -4.87 115.64 105.54 1w36 s THR 941 Ca 0.98 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 1w36 s THR 941 Cb -0.75 -1.67 0.00 0.00 1.34 0.00 0.00 72.50 71.43 1w36 s THR 941 CO 0.52 -0.18 0.51 -2.65 -0.54 0.00 0.00 174.62 172.28 1w36 n PRO 942 N 0.74 0.00 0.05 3.99 -0.02 -1.26 -0.65 135.00 137.84 1w36 n PRO 942 Ca -0.17 0.09 0.12 0.00 -2.02 0.00 0.00 63.50 61.52 1w36 n PRO 942 Cb 0.55 -1.52 0.08 0.00 -0.02 0.00 0.00 33.50 32.59 1w36 n PRO 942 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1w36 n HIS 943 N -1.01 0.45 -0.86 6.00 8.25 -1.26 -3.82 115.22 122.97 1w36 n HIS 943 Ca 0.00 0.13 0.08 0.00 -0.26 0.00 0.00 57.72 57.67 1w36 n HIS 943 Cb 0.02 -0.58 0.39 0.00 1.12 0.00 0.00 29.99 30.94 1w36 n HIS 943 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1w36 n GLN 944 N -2.10 4.58 -2.86 -0.41 6.02 0.17 -4.88 117.38 117.91 1w36 n GLN 944 Ca 0.02 -3.10 -0.41 0.00 -0.01 0.00 0.00 57.00 53.50 1w36 n GLN 944 Cb 0.45 -2.18 -0.04 0.00 1.02 0.00 0.00 30.24 29.50 1w36 n GLN 944 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 1w36 s PHE 945 N -2.61 3.61 -0.11 1.08 5.36 -1.25 -4.90 117.98 119.16 1w36 s PHE 945 Ca 0.53 1.48 -0.14 0.00 -0.96 0.00 0.00 56.93 57.85 1w36 s PHE 945 Cb 0.40 -2.98 -0.06 0.00 -0.34 0.00 0.00 43.02 40.04 1w36 s PHE 945 CO 0.17 0.02 0.44 -0.35 -1.46 0.00 0.00 175.22 174.04 1w36 n PRO 946 N 3.92 0.00 -2.82 10.12 -0.04 -1.26 -4.88 135.00 140.04 1w36 n PRO 946 Ca 0.03 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.19 1w36 n PRO 946 Cb 0.51 -0.45 -0.03 0.00 -0.04 0.00 0.00 33.50 33.49 1w36 n PRO 946 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1w36 s ARG 947 N 0.65 3.75 0.00 0.54 3.52 -1.26 -4.68 118.95 121.46 1w36 s ARG 947 Ca 0.31 0.43 0.00 0.00 -0.13 0.00 0.00 55.73 56.34 1w36 s ARG 947 Cb -0.43 -2.39 0.00 0.00 -1.56 0.00 0.00 34.95 30.57 1w36 s ARG 947 CO 0.23 -0.06 0.00 0.41 -0.81 0.00 0.00 175.30 175.07 1w36 n GLY 948 N -1.42 -1.02 0.14 8.12 0.00 -1.26 -4.75 105.19 105.00 1w36 n GLY 948 Ca 0.02 -2.22 -0.16 0.00 0.00 0.00 0.00 46.02 43.66 1w36 n GLY 948 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w36 h ALA 949 N 0.00 0.14 -0.38 4.61 0.00 -1.82 0.31 119.26 122.13 1w36 h ALA 949 Ca 0.00 -0.48 0.06 0.00 0.00 0.00 0.00 54.91 54.50 1w36 h ALA 949 Cb 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 1w36 h ALA 949 CO 0.00 0.26 0.04 1.03 0.00 0.00 0.00 179.25 180.58 1w36 h SER 950 N -0.08 -0.06 0.50 0.00 0.87 -1.93 0.94 113.55 113.79 1w36 h SER 950 Ca -0.03 0.07 -0.17 0.00 -1.23 0.00 0.00 61.79 60.44 1w36 h SER 950 Cb 1.06 0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 63.12 1w36 h SER 950 CO 0.08 0.00 -0.73 1.55 -0.53 0.00 0.00 176.83 177.20 1w36 h PRO 951 N 0.16 0.19 -0.27 2.24 0.13 -1.85 -2.48 132.00 130.12 1w36 h PRO 951 Ca 0.18 -0.16 -0.02 0.00 -0.87 0.00 0.00 66.00 65.13 1w36 h PRO 951 Cb 0.24 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.39 1w36 h PRO 951 CO -0.27 0.84 0.11 0.78 -0.23 0.00 0.00 178.00 179.23 1w36 h GLY 952 N 1.72 0.43 2.00 1.56 0.00 0.22 -2.11 103.07 106.89 1w36 h GLY 952 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1w36 h GLY 952 CO 0.11 0.22 0.00 -1.30 0.00 0.00 0.00 176.54 175.57 1w36 n THR 953 N -4.77 0.78 -0.09 4.70 -2.24 0.32 -2.18 114.28 110.79 1w36 n THR 953 Ca -0.03 0.12 -0.11 0.00 -2.27 0.00 0.00 64.05 61.77 1w36 n THR 953 Cb 0.13 -1.05 -0.04 0.00 -2.10 0.00 0.00 70.33 67.27 1w36 n THR 953 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1w36 h PHE 954 N 0.00 0.56 0.62 4.78 3.57 -0.91 -2.25 116.94 123.31 1w36 h PHE 954 Ca 0.00 -0.11 -0.03 0.00 3.53 0.00 0.00 57.97 61.36 1w36 h PHE 954 Cb 0.44 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.05 1w36 h PHE 954 CO 0.00 0.69 -0.35 -0.07 -2.23 0.00 0.00 178.31 176.35 1w36 h LEU 955 N 0.27 -0.86 -0.92 0.59 3.38 -1.12 -2.11 115.31 114.55 1w36 h LEU 955 Ca 0.07 0.04 0.20 0.00 0.09 0.00 0.00 57.88 58.28 1w36 h LEU 955 Cb 0.49 0.24 -0.17 0.00 0.09 0.00 0.00 40.66 41.30 1w36 h LEU 955 CO 0.02 -0.55 -0.17 1.41 0.09 0.00 0.00 178.44 179.24 1w36 n HIS 956 N -4.57 0.39 -0.20 1.13 8.25 -1.10 0.25 115.22 119.36 1w36 n HIS 956 Ca -0.11 1.11 -0.03 0.00 -0.26 0.00 0.00 57.72 58.43 1w36 n HIS 956 Cb 0.36 -1.07 0.04 0.00 1.12 0.00 0.00 29.99 30.44 1w36 n HIS 956 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1w36 h SER 957 N 0.00 -0.88 -0.65 0.41 0.87 -0.99 -1.34 113.55 110.97 1w36 h SER 957 Ca 0.47 0.21 0.09 0.00 -1.23 0.00 0.00 61.79 61.32 1w36 h SER 957 Cb 0.79 0.48 -0.11 0.00 -0.44 0.00 0.00 62.40 63.12 1w36 h SER 957 CO -0.92 -0.26 -0.49 -0.07 -0.53 0.00 0.00 176.83 174.56 1w36 h LEU 958 N -0.09 -1.69 0.00 2.23 4.07 0.39 0.27 115.31 120.48 1w36 h LEU 958 Ca 0.27 0.27 0.00 0.00 0.08 0.00 0.00 57.88 58.49 1w36 h LEU 958 Cb 0.52 0.76 0.00 0.00 1.08 0.00 0.00 40.66 43.01 1w36 h LEU 958 CO -0.66 -0.33 0.00 0.49 -1.08 0.00 0.00 178.44 176.86 1w36 n PHE 959 N -5.38 0.00 -0.03 1.13 3.72 -0.56 -3.83 117.46 112.51 1w36 n PHE 959 Ca 0.01 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.27 1w36 n PHE 959 Cb 0.34 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.77 1w36 n PHE 959 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1w36 h GLU 960 N 0.00 0.09 -3.39 -1.08 5.08 0.12 -3.40 114.58 111.99 1w36 h GLU 960 Ca 0.00 -0.08 -0.59 0.00 -1.00 0.00 0.00 59.36 57.69 1w36 h GLU 960 Cb 0.00 0.02 -0.40 0.00 0.50 0.00 0.00 28.75 28.87 1w36 h GLU 960 CO 0.00 0.76 -0.75 0.16 -1.00 0.00 0.00 179.01 178.18 1w36 s ASP 961 N -6.05 3.90 0.45 1.42 3.84 -1.25 -4.92 116.67 114.07 1w36 s ASP 961 Ca -0.16 -1.98 0.03 0.00 -0.00 0.00 0.00 52.55 50.44 1w36 s ASP 961 Cb 0.01 -0.93 -0.02 0.00 -1.38 0.00 0.00 42.92 40.60 1w36 s ASP 961 CO 0.71 -0.37 0.07 -0.76 -0.00 0.00 0.00 175.17 174.82 1w36 s LEU 962 N 1.19 2.17 -0.61 2.11 1.43 -1.26 -5.03 118.68 118.68 1w36 s LEU 962 Ca 0.13 -1.64 0.05 0.00 -1.03 0.00 0.00 54.13 51.63 1w36 s LEU 962 Cb -0.20 -0.42 0.33 0.00 0.03 0.00 0.00 46.19 45.93 1w36 s LEU 962 CO -0.16 -0.86 0.98 0.47 0.23 0.00 0.00 176.35 177.01 1w36 n ASP 963 N -1.25 4.60 -0.12 2.29 9.92 -1.26 -4.91 116.55 125.82 1w36 n ASP 963 Ca -0.11 -3.68 0.12 0.00 -0.53 0.00 0.00 54.79 50.59 1w36 n ASP 963 Cb 0.66 -0.60 0.22 0.00 -0.64 0.00 0.00 41.12 40.76 1w36 n ASP 963 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1w36 n PHE 964 N -0.18 0.43 0.32 1.24 0.99 -1.26 -0.15 117.46 118.86 1w36 n PHE 964 Ca 0.32 0.43 -0.17 0.00 -0.00 0.00 0.00 57.45 58.03 1w36 n PHE 964 Cb 0.38 -0.89 -0.09 0.00 -1.00 0.00 0.00 39.48 37.88 1w36 n PHE 964 CO 0.00 0.00 0.00 1.79 -0.00 0.00 0.00 176.76 178.55 1w36 h THR 965 N 0.00 0.00 -4.06 4.37 1.35 -1.77 -3.39 112.91 109.41 1w36 h THR 965 Ca 0.31 0.00 -0.46 0.00 -0.55 0.00 0.00 66.41 65.72 1w36 h THR 965 Cb 0.84 0.00 0.13 0.00 -1.73 0.00 0.00 68.15 67.39 1w36 h THR 965 CO -0.28 0.00 0.38 -1.10 -0.25 0.00 0.00 175.52 174.27 1w36 s GLN 966 N -5.54 1.25 0.60 4.72 -0.21 0.79 -4.97 119.66 116.31 1w36 s GLN 966 Ca -0.16 -0.28 -0.13 0.00 0.02 0.00 0.00 55.36 54.81 1w36 s GLN 966 Cb 0.03 -1.94 -0.04 0.00 1.00 0.00 0.00 33.01 32.06 1w36 s GLN 966 CO 0.53 -2.00 1.02 -1.25 -2.12 0.00 0.00 175.29 171.48 1w36 s PRO 967 N -5.69 3.58 -0.24 2.91 0.04 -1.26 -4.89 135.00 129.45 1w36 s PRO 967 Ca 0.69 0.86 -0.29 0.00 0.04 0.00 0.00 61.00 62.30 1w36 s PRO 967 Cb -0.07 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 1w36 s PRO 967 CO 0.50 -0.58 1.42 0.08 0.04 0.00 0.00 177.00 178.47 1w36 s VAL 968 N -2.97 3.97 0.23 -0.36 1.01 -1.26 -5.00 120.40 116.02 1w36 s VAL 968 Ca 0.57 1.11 -0.30 0.00 0.00 0.00 0.00 61.98 63.37 1w36 s VAL 968 Cb -0.11 -3.94 -0.09 0.00 0.00 0.00 0.00 36.38 32.23 1w36 s VAL 968 CO 0.47 -0.35 1.27 -0.62 0.00 0.00 0.00 175.10 175.87 1w36 s ASP 969 N 3.22 6.95 0.10 3.32 -1.08 -1.26 -4.90 116.67 123.01 1w36 s ASP 969 Ca 0.62 2.41 0.07 0.00 -0.52 0.00 0.00 52.55 55.13 1w36 s ASP 969 Cb -0.21 -2.62 -0.22 0.00 -1.46 0.00 0.00 42.92 38.42 1w36 s ASP 969 CO 0.24 -0.46 1.20 -0.65 0.52 0.00 0.00 175.17 176.03 1w36 h PRO 970 N 4.84 0.01 -0.74 4.34 0.11 -1.98 -3.19 132.00 135.38 1w36 h PRO 970 Ca -0.46 -0.03 0.11 0.00 0.11 0.00 0.00 66.00 65.74 1w36 h PRO 970 Cb 1.22 0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.26 1w36 h PRO 970 CO 0.74 0.96 0.36 -0.91 -0.21 0.00 0.00 178.00 178.93 1w36 h ASN 971 N 0.00 0.44 -0.34 -2.05 2.35 -1.99 0.17 115.58 114.16 1w36 h ASN 971 Ca -0.05 0.08 0.04 0.00 -0.55 0.00 0.00 56.30 55.82 1w36 h ASN 971 Cb 1.81 0.01 -0.04 0.00 0.05 0.00 0.00 38.32 40.15 1w36 h ASN 971 CO 0.13 0.23 0.10 -0.25 -1.65 0.00 0.00 177.43 175.99 1w36 h TRP 972 N 0.58 0.18 -0.60 1.19 7.01 -1.97 -1.60 115.95 120.74 1w36 h TRP 972 Ca 0.38 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.34 1w36 h TRP 972 Cb 0.47 -0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.47 1w36 h TRP 972 CO -0.12 0.07 0.13 0.28 -2.79 0.00 0.00 178.44 176.01 1w36 h VAL 973 N 0.24 1.25 -0.76 2.65 2.07 -1.06 -0.47 116.25 120.17 1w36 h VAL 973 Ca 0.16 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1w36 h VAL 973 Cb 0.14 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 1w36 h VAL 973 CO -0.17 0.35 0.49 0.08 0.02 0.00 0.00 177.57 178.33 1w36 h ARG 974 N 0.88 1.01 -0.55 1.57 0.11 -0.40 -0.40 114.38 116.61 1w36 h ARG 974 Ca 0.18 -0.07 -0.09 0.00 0.10 0.00 0.00 59.98 60.10 1w36 h ARG 974 Cb 0.38 -0.22 -0.02 0.00 1.11 0.00 0.00 29.97 31.22 1w36 h ARG 974 CO 0.01 0.69 -0.02 1.49 0.10 0.00 0.00 179.97 182.23 1w36 h GLU 975 N 1.04 0.96 -0.55 0.08 4.81 -0.76 0.75 114.58 120.91 1w36 h GLU 975 Ca 0.28 -0.30 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1w36 h GLU 975 Cb -0.09 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 1w36 h GLU 975 CO -0.06 0.96 0.21 0.87 -0.73 0.00 0.00 179.01 180.26 1w36 h LYS 976 N 0.88 0.83 -0.09 1.92 6.56 -0.11 0.62 116.57 127.18 1w36 h LYS 976 Ca 0.16 -0.16 -0.16 0.00 -1.06 0.00 0.00 60.65 59.42 1w36 h LYS 976 Cb 0.54 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 32.06 1w36 h LYS 976 CO 0.03 0.73 -0.65 -0.07 -2.06 0.00 0.00 179.45 177.43 1w36 h LEU 977 N 0.75 0.40 -0.54 2.94 3.38 -0.66 -1.72 115.31 119.86 1w36 h LEU 977 Ca 0.18 -0.24 -0.15 0.00 0.09 0.00 0.00 57.88 57.76 1w36 h LEU 977 Cb 0.22 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1w36 h LEU 977 CO -0.01 0.94 -0.39 -0.08 0.09 0.00 0.00 178.44 179.00 1w36 h GLU 978 N 0.25 0.76 0.00 1.13 4.81 0.74 0.21 114.58 122.48 1w36 h GLU 978 Ca -0.01 -0.39 -0.18 0.00 -0.13 0.00 0.00 59.36 58.65 1w36 h GLU 978 Cb 1.19 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 1w36 h GLU 978 CO 0.11 1.01 -0.86 -0.07 -0.73 0.00 0.00 179.01 178.47 1w36 h LEU 979 N 0.62 0.00 -0.76 1.64 3.38 -0.80 -3.11 115.31 116.29 1w36 h LEU 979 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1w36 h LEU 979 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1w36 h LEU 979 CO 0.09 0.82 0.00 0.61 0.09 0.00 0.00 178.44 180.04 1w36 n GLY 980 N 1.31 -0.14 2.09 0.83 0.00 -0.66 -4.92 105.19 103.71 1w36 n GLY 980 Ca -0.00 -0.34 -0.07 0.00 0.00 0.00 0.00 46.02 45.62 1w36 n GLY 980 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w36 n GLY 981 N 1.05 0.49 3.56 -0.02 0.00 -1.13 -5.05 105.19 104.08 1w36 n GLY 981 Ca 0.16 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 1w36 n GLY 981 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1w36 s PHE 982 N -3.01 2.56 0.25 1.61 0.40 0.73 -5.04 117.98 115.49 1w36 s PHE 982 Ca 0.15 -0.25 -0.30 0.00 -0.60 0.00 0.00 56.93 55.93 1w36 s PHE 982 Cb -0.07 -1.20 -0.09 0.00 0.51 0.00 0.00 43.02 42.17 1w36 s PHE 982 CO 0.18 0.58 1.30 -1.21 0.70 0.00 0.00 175.22 176.77 1w36 s GLU 983 N -3.16 4.40 0.40 0.44 2.02 -1.26 -4.14 118.70 117.38 1w36 s GLU 983 Ca 0.27 2.09 0.13 0.00 0.02 0.00 0.00 54.97 57.48 1w36 s GLU 983 Cb -0.07 -3.15 0.95 0.00 0.10 0.00 0.00 34.13 31.95 1w36 s GLU 983 CO 0.16 -0.20 1.90 0.77 0.02 0.00 0.00 175.26 177.91 1w36 h SER 984 N 4.60 0.51 0.00 -0.19 0.02 -1.91 -2.63 113.55 113.95 1w36 h SER 984 Ca -0.46 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 1w36 h SER 984 Cb 1.22 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1w36 h SER 984 CO 0.73 0.26 0.00 0.00 -1.14 0.00 0.00 176.83 176.68 1w36 n GLN 985 N -4.51 0.00 0.01 3.45 3.00 -1.26 -0.78 117.38 117.29 1w36 n GLN 985 Ca 0.16 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.26 1w36 n GLN 985 Cb 0.50 -1.22 -0.05 0.00 0.00 0.00 0.00 30.24 29.47 1w36 n GLN 985 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1w36 n TRP 986 N -0.64 0.15 -0.23 1.08 7.02 -0.99 -4.46 117.44 119.37 1w36 n TRP 986 Ca 0.00 0.04 0.04 0.00 -1.02 0.00 0.00 57.50 56.56 1w36 n TRP 986 Cb 0.00 -0.35 0.14 0.00 -2.42 0.00 0.00 31.31 28.67 1w36 n TRP 986 CO 0.00 0.00 0.00 1.05 -2.02 0.00 0.00 177.69 176.72 1w36 h GLU 987 N 0.00 0.13 0.04 -0.99 -0.00 -1.21 0.12 114.58 112.67 1w36 h GLU 987 Ca 0.00 -0.01 0.01 0.00 -0.00 0.00 0.00 59.36 59.36 1w36 h GLU 987 Cb 0.74 -0.03 -0.02 0.00 -0.00 0.00 0.00 28.75 29.44 1w36 h GLU 987 CO 0.00 0.09 -0.09 -1.35 -0.00 0.00 0.00 179.01 177.65 1w36 h PRO 988 N 0.13 -0.18 -0.16 1.06 0.11 -1.83 0.23 132.00 131.37 1w36 h PRO 988 Ca 0.38 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.42 1w36 h PRO 988 Cb 0.64 0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 1w36 h PRO 988 CO -0.59 -0.12 -0.24 0.28 -0.21 0.00 0.00 178.00 177.13 1w36 h VAL 989 N -0.18 1.24 0.01 3.15 2.07 -1.62 -3.06 116.25 117.86 1w36 h VAL 989 Ca 0.02 -1.12 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 1w36 h VAL 989 Cb 0.20 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1w36 h VAL 989 CO -0.07 0.34 -0.01 0.25 0.02 0.00 0.00 177.57 178.11 1w36 h LEU 990 N 0.26 -0.01 -0.82 2.57 5.85 -0.36 -2.57 115.31 120.23 1w36 h LEU 990 Ca 0.04 -0.74 0.11 0.00 0.84 0.00 0.00 57.88 58.14 1w36 h LEU 990 Cb 0.57 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.53 1w36 h LEU 990 CO 0.04 0.83 0.44 0.00 -0.34 0.00 0.00 178.44 179.42 1w36 h THR 991 N -0.96 0.83 0.00 1.05 1.03 -1.07 0.57 112.91 114.36 1w36 h THR 991 Ca -0.00 -0.24 -0.02 0.00 -0.01 0.00 0.00 66.41 66.14 1w36 h THR 991 Cb 0.75 0.07 -0.00 0.00 -1.07 0.00 0.00 68.15 67.90 1w36 h THR 991 CO 0.00 0.13 -0.09 -0.08 -0.01 0.00 0.00 175.52 175.47 1w36 h GLU 992 N 0.70 0.00 0.20 0.00 4.81 -1.62 -2.50 114.58 116.18 1w36 h GLU 992 Ca 0.42 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 59.32 1w36 h GLU 992 Cb 0.47 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.87 1w36 h GLU 992 CO -0.29 0.09 -1.49 2.35 -0.73 0.00 0.00 179.01 178.94 1w36 h TRP 993 N 0.00 0.78 0.55 0.92 7.01 0.34 -3.17 115.95 122.38 1w36 h TRP 993 Ca -0.00 -0.57 -0.03 0.00 2.11 0.00 0.00 58.89 60.41 1w36 h TRP 993 Cb 0.33 -0.03 0.01 0.00 -2.10 0.00 0.00 29.16 27.37 1w36 h TRP 993 CO 0.00 1.50 -0.26 0.82 -2.79 0.00 0.00 178.44 177.71 1w36 h ILE 994 N 0.12 0.36 0.06 2.65 2.04 0.16 -2.24 117.51 120.65 1w36 h ILE 994 Ca -0.25 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.32 1w36 h ILE 994 Cb 2.10 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 38.60 1w36 h ILE 994 CO 0.23 0.04 -0.46 0.71 0.00 0.00 0.00 178.15 178.67 1w36 h THR 995 N -0.96 0.10 -0.93 -0.27 1.35 -1.67 0.43 112.91 110.95 1w36 h THR 995 Ca -0.08 0.00 0.23 0.00 -0.55 0.00 0.00 66.41 66.01 1w36 h THR 995 Cb 0.64 0.10 -0.17 0.00 -1.73 0.00 0.00 68.15 66.98 1w36 h THR 995 CO 0.12 0.00 -0.05 0.00 -0.25 0.00 0.00 175.52 175.34 1w36 h ALA 996 N -0.23 0.94 0.00 6.62 0.00 -1.58 2.21 119.26 127.22 1w36 h ALA 996 Ca 0.02 0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1w36 h ALA 996 Cb 0.70 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1w36 h ALA 996 CO -0.30 -0.49 0.00 -0.24 0.00 0.00 0.00 179.25 178.23 1w36 h VAL 997 N 0.03 0.00 0.01 0.00 3.04 -0.30 -3.05 116.25 115.98 1w36 h VAL 997 Ca 0.52 -0.61 -0.00 0.00 -1.01 0.00 0.00 66.70 65.60 1w36 h VAL 997 Cb 0.97 1.58 0.00 0.00 -2.01 0.00 0.00 31.29 31.84 1w36 h VAL 997 CO -0.89 0.00 -0.00 -0.07 -1.01 0.00 0.00 177.57 175.60 1w36 h LEU 998 N 0.00 -0.01 -1.55 3.16 3.38 0.77 -3.36 115.31 117.70 1w36 h LEU 998 Ca 0.00 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 57.25 1w36 h LEU 998 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1w36 h LEU 998 CO 0.00 0.84 0.00 0.00 0.09 0.00 0.00 178.44 179.37 1w36 n GLN 999 N -4.67 0.96 -3.61 1.13 6.02 0.15 -2.46 117.38 114.89 1w36 n GLN 999 Ca -0.08 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.64 1w36 n GLN 999 Cb 0.35 -1.23 -0.03 0.00 1.02 0.00 0.00 30.24 30.36 1w36 n GLN 999 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1w36 s ALA 1000N -0.42 3.78 -0.88 -1.58 0.00 -1.16 -4.98 121.76 116.53 1w36 s ALA 1000Ca 0.00 -0.78 -0.20 0.00 0.00 0.00 0.00 51.96 50.98 1w36 s ALA 1000Cb 0.00 -2.06 0.11 0.00 0.00 0.00 0.00 23.12 21.17 1w36 s ALA 1000CO 0.00 0.38 1.11 -1.25 0.00 0.00 0.00 175.76 176.00 1w36 s PRO 1001N -3.41 3.49 0.04 0.00 0.04 -1.26 -3.34 135.00 130.56 1w36 s PRO 1001Ca 0.40 -1.53 -0.20 0.00 0.04 0.00 0.00 61.00 59.71 1w36 s PRO 1001Cb -0.11 -4.80 -0.10 0.00 0.04 0.00 0.00 34.50 29.53 1w36 s PRO 1001CO 0.29 -1.81 1.30 -0.07 0.04 0.00 0.00 177.00 176.76 1w36 h LEU 1002N 10.74 -0.66 -3.72 -3.56 4.07 -1.91 -3.32 115.31 116.95 1w36 h LEU 1002Ca 0.06 0.04 -0.49 0.00 0.08 0.00 0.00 57.88 57.57 1w36 h LEU 1002Cb 1.03 0.19 -0.31 0.00 1.08 0.00 0.00 40.66 42.65 1w36 h LEU 1002CO 1.14 -0.41 -0.20 0.59 -1.08 0.00 0.00 178.44 178.49 1w36 n ASN 1003N -3.96 5.04 0.00 -0.43 3.02 -1.26 -4.94 115.26 112.72 1w36 n ASN 1003Ca -0.08 -3.77 0.00 0.00 -0.03 0.00 0.00 54.58 50.70 1w36 n ASN 1003Cb 0.27 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 38.86 1w36 n ASN 1003CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1w36 n GLU 1004N -0.87 0.00 -2.63 3.52 1.02 -1.25 -4.72 120.64 115.71 1w36 n GLU 1004Ca 0.46 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 57.18 1w36 n GLU 1004Cb 0.90 -0.23 -0.02 0.00 -0.02 0.00 0.00 31.44 32.07 1w36 n GLU 1004CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1w36 s THR 1005N 0.00 4.12 0.00 2.62 -4.23 -1.26 -4.73 115.64 112.15 1w36 s THR 1005Ca 0.00 -1.14 0.00 0.00 -1.18 0.00 0.00 61.69 59.37 1w36 s THR 1005Cb 0.00 -5.03 0.00 0.00 1.34 0.00 0.00 72.50 68.81 1w36 s THR 1005CO 0.00 -1.88 0.00 0.61 -0.54 0.00 0.00 174.62 172.81 1w36 n GLY 1006N 6.34 1.72 7.00 3.99 0.00 -1.26 -4.95 105.19 118.03 1w36 n GLY 1006Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1w36 n GLY 1006CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1w36 n VAL 1007N 0.00 0.00 -2.40 1.61 0.31 -1.26 -4.80 118.33 111.78 1w36 n VAL 1007Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 1w36 n VAL 1007Cb 0.00 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 32.92 1w36 n VAL 1007CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1w36 n SER 1008N 2.50 -6.62 -0.39 4.52 2.88 -1.21 -4.36 113.62 110.94 1w36 n SER 1008Ca 0.00 1.66 0.34 0.00 -1.33 0.00 0.00 58.87 59.54 1w36 n SER 1008Cb 0.00 -4.76 0.61 0.00 -0.75 0.00 0.00 64.21 59.31 1w36 n SER 1008CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1w36 h LEU 1009N 4.28 0.30 -1.01 2.46 3.38 -1.65 0.15 115.31 123.23 1w36 h LEU 1009Ca -0.12 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1w36 h LEU 1009Cb 0.28 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1w36 h LEU 1009CO 0.00 -0.27 0.13 -1.54 0.09 0.00 0.00 178.44 176.85 1w36 n SER 1010N -4.93 0.39 -1.10 -0.43 3.41 -1.20 -0.96 113.62 108.80 1w36 n SER 1010Ca 0.37 0.63 0.11 0.00 -0.26 0.00 0.00 58.87 59.72 1w36 n SER 1010Cb 1.34 -0.64 0.27 0.00 -0.26 0.00 0.00 64.21 64.92 1w36 n SER 1010CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w36 n GLN 1011N -2.05 2.41 -3.57 4.33 6.02 0.53 -3.94 117.38 121.11 1w36 n GLN 1011Ca -0.01 -2.16 -0.41 0.00 -0.01 0.00 0.00 57.00 54.41 1w36 n GLN 1011Cb 0.15 -1.49 -0.11 0.00 1.02 0.00 0.00 30.24 29.81 1w36 n GLN 1011CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1w36 s LEU 1012N -1.21 4.81 0.81 1.08 1.43 -0.13 -5.06 118.68 120.41 1w36 s LEU 1012Ca 0.40 -1.00 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 1w36 s LEU 1012Cb 0.22 -2.05 0.09 0.00 0.03 0.00 0.00 46.19 44.48 1w36 s LEU 1012CO 0.29 -0.40 1.17 -0.94 0.23 0.00 0.00 176.35 176.70 1w36 s SER 1013N 1.58 4.39 0.06 2.29 1.04 -1.26 -4.38 113.70 117.42 1w36 s SER 1013Ca 0.02 0.66 -0.14 0.00 0.48 0.00 0.00 55.95 56.97 1w36 s SER 1013Cb -0.19 -1.12 -0.05 0.00 0.10 0.00 0.00 66.02 64.76 1w36 s SER 1013CO 0.07 -1.95 1.23 0.00 0.98 0.00 0.00 173.24 173.58 1w36 h ALA 1014N -1.04 -0.52 0.00 5.32 0.00 -1.96 -1.80 119.26 119.26 1w36 h ALA 1014Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1w36 h ALA 1014Cb 1.32 0.87 0.00 0.00 0.00 0.00 0.00 17.79 19.98 1w36 h ALA 1014CO 0.62 -0.63 0.78 0.00 0.00 0.00 0.00 179.25 180.01 1w36 h ARG 1015N -0.18 0.00 -0.01 0.00 -0.00 -2.04 0.15 114.38 112.30 1w36 h ARG 1015Ca 0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.51 1w36 h ARG 1015Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.23 1w36 h ARG 1015CO -0.25 0.00 -0.31 0.09 0.00 0.00 0.00 179.97 179.51 1w36 n ASN 1016N -2.06 1.66 -4.64 7.04 3.02 -0.68 -4.99 115.26 114.62 1w36 n ASN 1016Ca -0.00 -1.33 -0.27 0.00 -0.03 0.00 0.00 54.58 52.95 1w36 n ASN 1016Cb 0.78 0.44 -0.08 0.00 -0.61 0.00 0.00 39.78 40.30 1w36 n ASN 1016CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1w36 s LYS 1017N -1.84 2.32 -0.16 3.52 1.02 0.54 -0.96 119.74 124.17 1w36 s LYS 1017Ca 0.14 -1.11 -0.04 0.00 0.02 0.00 0.00 55.97 54.97 1w36 s LYS 1017Cb 0.13 -2.32 0.07 0.00 -0.52 0.00 0.00 37.83 35.18 1w36 s LYS 1017CO 0.39 0.46 0.16 -1.14 -0.92 0.00 0.00 175.35 174.29 1w36 s GLN 1018N -2.82 0.10 0.30 1.68 2.00 0.00 -4.97 119.66 115.96 1w36 s GLN 1018Ca 0.26 0.18 -0.12 0.00 -2.00 0.00 0.00 55.36 53.68 1w36 s GLN 1018Cb -0.09 -1.22 -0.08 0.00 0.80 0.00 0.00 33.01 32.42 1w36 s GLN 1018CO 0.17 -0.58 0.67 0.08 -0.50 0.00 0.00 175.29 175.14 1w36 s VAL 1019N 2.25 4.80 -0.27 1.34 1.01 -1.26 -2.31 120.40 125.96 1w36 s VAL 1019Ca 0.04 0.69 -0.24 0.00 0.00 0.00 0.00 61.98 62.48 1w36 s VAL 1019Cb -0.15 -3.64 0.04 0.00 0.00 0.00 0.00 36.38 32.63 1w36 s VAL 1019CO -0.09 -0.21 0.40 -0.62 0.00 0.00 0.00 175.10 174.57 1w36 n GLU 1020N -0.47 -1.18 -3.56 2.72 1.02 -1.03 -4.92 120.64 113.22 1w36 n GLU 1020Ca 0.02 0.95 -0.32 0.00 -0.02 0.00 0.00 57.16 57.79 1w36 n GLU 1020Cb 0.53 -1.32 -0.05 0.00 -0.02 0.00 0.00 31.44 30.58 1w36 n GLU 1020CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1w36 s MET 1021N -1.60 3.71 -0.12 3.49 1.75 -0.93 -4.83 119.30 120.78 1w36 s MET 1021Ca 0.23 0.09 0.02 0.00 -1.25 0.00 0.00 55.69 54.78 1w36 s MET 1021Cb -0.02 -2.81 0.01 0.00 2.84 0.00 0.00 34.83 34.85 1w36 s MET 1021CO 0.52 0.44 -0.17 -2.00 -0.65 0.00 0.00 175.02 173.16 1w36 s GLU 1022N -2.55 2.42 0.25 4.11 2.12 -1.26 -1.45 118.70 122.34 1w36 s GLU 1022Ca 0.41 -0.63 0.10 0.00 0.36 0.00 0.00 54.97 55.22 1w36 s GLU 1022Cb -0.12 -2.05 -0.05 0.00 0.26 0.00 0.00 34.13 32.17 1w36 s GLU 1022CO 0.22 -0.08 -0.12 -0.59 -0.54 0.00 0.00 175.26 174.16 1w36 s PHE 1023N 1.02 2.50 -0.15 5.30 -0.71 -0.73 -5.00 117.98 120.21 1w36 s PHE 1023Ca -0.05 -0.27 -0.02 0.00 -1.04 0.00 0.00 56.93 55.55 1w36 s PHE 1023Cb -0.15 -1.14 0.05 0.00 -1.21 0.00 0.00 43.02 40.57 1w36 s PHE 1023CO -0.03 0.62 -0.00 0.71 -1.34 0.00 0.00 175.22 175.18 1w36 s TYR 1024N -2.20 1.15 -0.30 3.49 2.02 -1.26 -2.91 117.35 117.34 1w36 s TYR 1024Ca 0.28 -0.74 -0.07 0.00 -0.37 0.00 0.00 57.07 56.18 1w36 s TYR 1024Cb -0.07 -1.06 0.01 0.00 -0.40 0.00 0.00 41.96 40.45 1w36 s TYR 1024CO 0.16 -0.53 0.09 -0.51 -1.57 0.00 0.00 175.55 173.18 1w36 s LEU 1025N 1.82 3.90 0.42 -1.29 1.02 -1.09 -4.92 118.68 118.53 1w36 s LEU 1025Ca 0.01 -0.74 -0.24 0.00 0.02 0.00 0.00 54.13 53.19 1w36 s LEU 1025Cb -0.15 -1.89 -0.08 0.00 0.02 0.00 0.00 46.19 44.09 1w36 s LEU 1025CO -0.07 -0.20 1.12 -2.16 0.02 0.00 0.00 176.35 175.05 1w36 s PRO 1026N 1.50 3.97 -0.43 1.29 0.04 -1.26 -0.92 135.00 139.19 1w36 s PRO 1026Ca 0.02 1.68 0.02 0.00 0.04 0.00 0.00 61.00 62.76 1w36 s PRO 1026Cb -0.17 -2.51 0.14 0.00 0.04 0.00 0.00 34.50 32.00 1w36 s PRO 1026CO 0.03 -0.35 0.26 0.96 0.04 0.00 0.00 177.00 177.94 1w36 s ILE 1027N -1.57 0.98 0.89 0.56 -4.36 -0.84 -4.87 121.20 111.99 1w36 s ILE 1027Ca 0.60 -2.42 -0.15 0.00 -0.26 0.00 0.00 60.65 58.42 1w36 s ILE 1027Cb -0.26 -1.69 0.21 0.00 1.25 0.00 0.00 42.46 41.97 1w36 s ILE 1027CO 0.32 -0.98 1.20 -0.24 0.24 0.00 0.00 174.94 175.49 1w36 n SER 1028N 3.50 0.03 -2.50 4.36 2.88 -1.25 -1.75 113.62 118.90 1w36 n SER 1028Ca 0.13 -1.43 -0.01 0.00 -1.33 0.00 0.00 58.87 56.24 1w36 n SER 1028Cb 0.37 -0.92 -0.01 0.00 -0.75 0.00 0.00 64.21 62.90 1w36 n SER 1028CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1w36 n GLU 1029N -3.59 -1.93 -0.94 -1.46 1.02 -1.26 -4.65 120.64 107.84 1w36 n GLU 1029Ca 0.15 1.51 -0.31 0.00 -0.02 0.00 0.00 57.16 58.50 1w36 n GLU 1029Cb 0.52 -1.95 -0.01 0.00 -0.02 0.00 0.00 31.44 29.99 1w36 n GLU 1029CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1w36 n PRO 1030N 2.12 0.00 -3.41 3.49 -0.04 -1.26 -4.85 135.00 131.04 1w36 n PRO 1030Ca -0.06 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 62.96 1w36 n PRO 1030Cb 0.10 -0.70 -0.05 0.00 -0.04 0.00 0.00 33.50 32.80 1w36 n PRO 1030CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1w36 s LEU 1031N 2.75 6.19 -0.34 1.53 2.96 -1.12 -4.88 118.68 125.77 1w36 s LEU 1031Ca 0.43 -2.24 -0.29 0.00 -0.22 0.00 0.00 54.13 51.81 1w36 s LEU 1031Cb -0.52 -2.13 0.02 0.00 0.50 0.00 0.00 46.19 44.06 1w36 s LEU 1031CO 0.43 -0.67 1.09 -0.63 -1.32 0.00 0.00 176.35 175.24 1w36 s ILE 1032N 0.88 4.46 0.52 6.68 1.09 -1.26 -3.85 121.20 129.71 1w36 s ILE 1032Ca 0.10 1.66 0.46 0.00 -1.10 0.00 0.00 60.65 61.78 1w36 s ILE 1032Cb -0.21 -4.43 0.68 0.00 -1.06 0.00 0.00 42.46 37.44 1w36 s ILE 1032CO -0.03 -0.54 1.45 0.00 -0.10 0.00 0.00 174.94 175.72 1w36 n ALA 1033N 7.01 1.75 0.02 9.38 0.00 -1.26 -0.58 120.51 136.83 1w36 n ALA 1033Ca 0.12 0.60 -0.01 0.00 0.00 0.00 0.00 53.44 54.15 1w36 n ALA 1033Cb 0.47 -1.05 -0.00 0.00 0.00 0.00 0.00 19.45 18.87 1w36 n ALA 1033CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1w36 h SER 1034N 0.00 -0.05 -0.45 0.00 4.64 -1.91 -2.98 113.55 112.80 1w36 h SER 1034Ca 0.86 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 62.32 1w36 h SER 1034Cb 3.52 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 65.60 1w36 h SER 1034CO -0.01 0.00 0.86 1.56 -0.87 0.00 0.00 176.83 178.38 1w36 h GLN 1035N -0.14 0.00 0.00 4.77 4.20 -1.25 1.67 115.11 124.35 1w36 h GLN 1035Ca -0.01 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 1w36 h GLN 1035Cb 0.05 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 1w36 h GLN 1035CO 0.01 0.00 -1.31 -0.11 -0.67 0.00 0.00 178.83 176.75 1w36 n LEU 1036N -3.06 0.81 0.11 1.46 7.94 -0.97 -4.10 117.00 119.19 1w36 n LEU 1036Ca 0.09 0.34 -0.13 0.00 -1.11 0.00 0.00 56.01 55.20 1w36 n LEU 1036Cb 1.02 0.03 -0.08 0.00 0.53 0.00 0.00 43.42 44.92 1w36 n LEU 1036CO 0.16 0.03 0.64 -0.78 -1.11 0.00 0.00 177.39 176.33 1w36 h ASP 1037N 0.00 -0.23 -0.51 1.96 1.82 0.26 -2.33 116.42 117.39 1w36 h ASP 1037Ca -0.11 -0.19 0.06 0.00 -0.39 0.00 0.00 57.03 56.40 1w36 h ASP 1037Cb 1.37 0.06 -0.09 0.00 0.68 0.00 0.00 39.33 41.36 1w36 h ASP 1037CO 0.03 0.07 -0.55 0.71 -1.61 0.00 0.00 179.24 177.89 1w36 h THR 1038N -0.55 0.00 0.00 2.25 1.35 -1.65 -0.11 112.91 114.21 1w36 h THR 1038Ca -0.03 0.00 -0.07 0.00 -0.55 0.00 0.00 66.41 65.76 1w36 h THR 1038Cb 0.41 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 66.82 1w36 h THR 1038CO 0.05 0.00 -0.35 0.17 -0.25 0.00 0.00 175.52 175.13 1w36 h LEU 1039N -0.30 0.00 -0.73 3.87 -0.00 -1.75 -1.67 115.31 114.73 1w36 h LEU 1039Ca 0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.92 1w36 h LEU 1039Cb 0.54 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.16 1w36 h LEU 1039CO -0.64 0.35 0.25 0.40 -0.00 0.00 0.00 178.44 178.80 1w36 h ILE 1040N 0.00 1.26 0.46 0.15 1.08 -0.72 -2.72 117.51 117.02 1w36 h ILE 1040Ca -0.00 -0.86 -0.02 0.00 -0.39 0.00 0.00 64.86 63.59 1w36 h ILE 1040Cb 0.88 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 35.08 1w36 h ILE 1040CO 0.05 0.34 -0.22 0.03 -0.69 0.00 0.00 178.15 177.65 1w36 h ARG 1041N 1.07 -0.59 -0.80 2.37 3.08 -0.52 -1.76 114.38 117.22 1w36 h ARG 1041Ca 0.24 0.04 0.08 0.00 0.07 0.00 0.00 59.98 60.41 1w36 h ARG 1041Cb 0.27 0.14 -0.10 0.00 0.08 0.00 0.00 29.97 30.36 1w36 h ARG 1041CO -0.01 -0.40 -0.46 1.04 -1.07 0.00 0.00 179.97 179.07 1w36 n GLN 1042N -3.71 -0.34 0.09 0.04 6.02 -0.68 -1.99 117.38 116.81 1w36 n GLN 1042Ca -0.08 1.21 0.12 0.00 -0.01 0.00 0.00 57.00 58.25 1w36 n GLN 1042Cb 0.24 -1.79 0.28 0.00 1.02 0.00 0.00 30.24 30.00 1w36 n GLN 1042CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 1w36 h PHE 1043N 0.00 0.00 -3.25 1.08 -1.00 -1.55 -3.45 116.94 108.77 1w36 h PHE 1043Ca 0.14 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 60.25 1w36 h PHE 1043Cb 0.34 0.00 -0.32 0.00 3.61 0.00 0.00 35.95 39.58 1w36 h PHE 1043CO -0.82 0.00 -0.82 0.34 -1.61 0.00 0.00 178.31 175.40 1w36 s ASP 1044N -4.47 3.51 0.39 2.17 2.15 -0.66 -4.73 116.67 115.03 1w36 s ASP 1044Ca 0.08 -0.51 0.16 0.00 0.43 0.00 0.00 52.55 52.70 1w36 s ASP 1044Cb 0.12 -1.53 0.80 0.00 -0.30 0.00 0.00 42.92 42.01 1w36 s ASP 1044CO 0.66 0.07 1.83 1.55 -0.17 0.00 0.00 175.17 179.12 1w36 h PRO 1045N 7.39 0.00 0.31 4.34 0.13 -1.88 -3.13 132.00 139.17 1w36 h PRO 1045Ca -0.34 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.78 1w36 h PRO 1045Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1w36 h PRO 1045CO 0.57 0.35 -0.15 1.25 -0.23 0.00 0.00 178.00 179.79 1w36 h LEU 1046N 0.00 -0.35 -0.36 1.56 6.46 -1.93 -3.15 115.31 117.53 1w36 h LEU 1046Ca -0.00 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.62 1w36 h LEU 1046Cb 0.68 0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.70 1w36 h LEU 1046CO 0.05 0.12 0.00 -1.54 -0.62 0.00 0.00 178.44 176.44 1w36 n SER 1047N -5.06 0.16 0.21 1.25 3.41 -1.22 -1.39 113.62 110.98 1w36 n SER 1047Ca -0.07 -0.90 0.10 0.00 -0.26 0.00 0.00 58.87 57.74 1w36 n SER 1047Cb 0.24 -0.08 0.27 0.00 -0.26 0.00 0.00 64.21 64.38 1w36 n SER 1047CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w36 h ALA 1048N 1.74 0.92 -0.49 7.33 0.00 -1.50 -3.30 119.26 123.96 1w36 h ALA 1048Ca 0.00 -0.15 -0.63 0.00 0.00 0.00 0.00 54.91 54.13 1w36 h ALA 1048Cb 0.08 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1w36 h ALA 1048CO 0.00 0.20 2.28 0.41 0.00 0.00 0.00 179.25 182.14 1w36 n GLY 1049N 0.79 2.81 1.40 0.00 0.00 -0.48 -4.86 105.19 104.84 1w36 n GLY 1049Ca 0.02 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1w36 n GLY 1049CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w36 n PRO 1051N 1.37 0.16 0.00 0.00 -0.02 -1.26 -4.93 135.00 130.32 1w36 n PRO 1051Ca 0.00 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1w36 n PRO 1051Cb 0.06 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1w36 n PRO 1051CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1w36 n PRO 1052N -1.94 0.00 -4.26 0.52 -0.04 -1.26 -4.69 135.00 123.33 1w36 n PRO 1052Ca 0.06 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.16 1w36 n PRO 1052Cb 0.39 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.82 1w36 n PRO 1052CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1w36 n LEU 1053N 0.00 -1.57 -0.34 1.53 -0.00 -1.26 -4.83 117.00 110.53 1w36 n LEU 1053Ca 0.00 -1.07 0.11 0.00 -0.00 0.00 0.00 56.01 55.06 1w36 n LEU 1053Cb 0.00 -1.99 0.50 0.00 -0.00 0.00 0.00 43.42 41.93 1w36 n LEU 1053CO 0.00 0.28 0.84 -1.84 -0.00 0.00 0.00 177.39 176.68 1w36 n GLU 1054N -4.34 1.46 -3.08 1.47 0.28 -1.26 -4.86 120.64 110.30 1w36 n GLU 1054Ca 0.02 -0.68 -0.15 0.00 -0.16 0.00 0.00 57.16 56.19 1w36 n GLU 1054Cb 0.52 -1.39 -0.02 0.00 1.43 0.00 0.00 31.44 31.98 1w36 n GLU 1054CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1w36 n PHE 1055N -0.12 -0.12 -4.23 -1.84 -1.74 -1.26 -4.93 117.46 103.22 1w36 n PHE 1055Ca 0.17 -1.25 -0.17 0.00 -0.56 0.00 0.00 57.45 55.64 1w36 n PHE 1055Cb 0.24 -0.20 -0.13 0.00 1.52 0.00 0.00 39.48 40.91 1w36 n PHE 1055CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1w36 s MET 1056N -3.04 0.68 0.00 3.97 0.23 -1.26 -4.62 119.30 115.26 1w36 s MET 1056Ca 0.07 -0.59 0.00 0.00 -1.03 0.00 0.00 55.69 54.14 1w36 s MET 1056Cb -0.01 -0.61 0.00 0.00 -1.53 0.00 0.00 34.83 32.68 1w36 s MET 1056CO 0.04 0.15 0.00 1.04 -2.03 0.00 0.00 175.02 174.22 1w36 n GLN 1057N 2.09 0.00 -3.58 3.16 6.02 -1.26 -4.97 117.38 118.84 1w36 n GLN 1057Ca -0.18 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.64 1w36 n GLN 1057Cb 0.56 0.00 -0.14 0.00 1.02 0.00 0.00 30.24 31.68 1w36 n GLN 1057CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1w36 s VAL 1058N 0.00 -0.30 0.39 5.09 1.01 -1.25 -4.92 120.40 120.42 1w36 s VAL 1058Ca 0.00 0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.12 1w36 s VAL 1058Cb 0.00 -0.51 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 1w36 s VAL 1058CO 0.00 -0.04 0.57 -0.13 0.00 0.00 0.00 175.10 175.50 1w36 s ARG 1059N 2.32 3.08 0.00 2.72 0.52 -1.20 -2.80 118.95 123.59 1w36 s ARG 1059Ca 0.04 -0.76 0.00 0.00 -0.52 0.00 0.00 55.73 54.49 1w36 s ARG 1059Cb -0.14 -2.69 0.00 0.00 0.52 0.00 0.00 34.95 32.64 1w36 s ARG 1059CO -0.09 -0.11 0.00 0.41 0.02 0.00 0.00 175.30 175.53 1w36 n GLY 1060N -1.86 0.49 3.25 -3.53 0.00 -0.72 -1.46 105.19 101.36 1w36 n GLY 1060Ca 0.01 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 1w36 n GLY 1060CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1w36 s MET 1061N 0.00 1.36 -0.26 1.61 -1.94 0.10 -2.00 119.30 118.18 1w36 s MET 1061Ca 0.00 -1.69 -0.04 0.00 -1.71 0.00 0.00 55.69 52.25 1w36 s MET 1061Cb 0.00 0.30 0.09 0.00 2.01 0.00 0.00 34.83 37.23 1w36 s MET 1061CO 0.00 -0.47 0.11 -1.17 -0.01 0.00 0.00 175.02 173.48 1w36 s LEU 1062N -3.20 0.62 0.76 -0.03 2.96 -0.10 -2.18 118.68 117.51 1w36 s LEU 1062Ca 0.38 -1.12 -0.12 0.00 -0.22 0.00 0.00 54.13 53.06 1w36 s LEU 1062Cb 0.05 -0.36 0.05 0.00 0.50 0.00 0.00 46.19 46.43 1w36 s LEU 1062CO 0.15 -0.41 1.14 -0.54 -1.32 0.00 0.00 176.35 175.37 1w36 s LYS 1063N 2.07 2.37 0.00 1.98 1.02 0.11 -2.68 119.74 124.61 1w36 s LYS 1063Ca 0.07 0.29 0.00 0.00 0.02 0.00 0.00 55.97 56.35 1w36 s LYS 1063Cb -0.16 -1.98 0.00 0.00 -0.52 0.00 0.00 37.83 35.17 1w36 s LYS 1063CO -0.28 -1.35 0.00 0.41 -0.92 0.00 0.00 175.35 173.22 1w36 n GLY 1064N -3.12 1.64 3.39 -3.33 0.00 -1.15 -4.45 105.19 98.17 1w36 n GLY 1064Ca 0.07 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.39 1w36 n GLY 1064CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1w36 s PHE 1065N -2.00 2.35 -0.20 1.61 0.40 -1.26 -1.78 117.98 117.10 1w36 s PHE 1065Ca 0.00 -0.37 -0.00 0.00 -0.60 0.00 0.00 56.93 55.96 1w36 s PHE 1065Cb 0.00 -1.31 0.02 0.00 0.51 0.00 0.00 43.02 42.24 1w36 s PHE 1065CO 0.00 0.28 -0.15 0.42 0.70 0.00 0.00 175.22 176.48 1w36 s ILE 1066N -1.00 2.45 0.28 0.64 -1.09 -0.53 -4.92 121.20 117.03 1w36 s ILE 1066Ca 0.14 -0.87 0.02 0.00 -2.23 0.00 0.00 60.65 57.70 1w36 s ILE 1066Cb -0.10 -2.09 0.27 0.00 -1.58 0.00 0.00 42.46 38.95 1w36 s ILE 1066CO 0.05 0.45 1.77 0.44 -1.23 0.00 0.00 174.94 176.43 1w36 h ASP 1067N 7.98 0.66 -3.33 3.58 3.32 -1.89 -2.39 116.42 124.35 1w36 h ASP 1067Ca -0.42 0.09 0.04 0.00 0.02 0.00 0.00 57.03 56.76 1w36 h ASP 1067Cb 1.14 -0.02 -0.25 0.00 0.22 0.00 0.00 39.33 40.41 1w36 h ASP 1067CO 0.62 0.27 0.38 -0.22 -1.72 0.00 0.00 179.24 178.57 1w36 s LEU 1068N -10.33 -0.52 -0.10 1.55 2.96 -1.15 -2.59 118.68 108.52 1w36 s LEU 1068Ca -0.12 0.99 -0.00 0.00 -0.22 0.00 0.00 54.13 54.78 1w36 s LEU 1068Cb 0.23 2.00 0.02 0.00 0.50 0.00 0.00 46.19 48.94 1w36 s LEU 1068CO 0.79 -0.17 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.89 1w36 s VAL 1069N 0.31 0.92 0.24 1.68 1.01 -0.98 0.11 120.40 123.70 1w36 s VAL 1069Ca 0.02 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.76 1w36 s VAL 1069Cb -0.05 -0.95 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 1w36 s VAL 1069CO -0.05 0.34 0.08 0.72 0.00 0.00 0.00 175.10 176.19 1w36 s PHE 1070N 1.56 1.46 0.01 5.22 -0.71 -1.07 -0.82 117.98 123.63 1w36 s PHE 1070Ca 0.01 -1.17 0.06 0.00 -1.04 0.00 0.00 56.93 54.80 1w36 s PHE 1070Cb -0.13 -0.85 -0.02 0.00 -1.21 0.00 0.00 43.02 40.82 1w36 s PHE 1070CO -0.06 -0.33 -0.18 -0.98 -1.34 0.00 0.00 175.22 172.33 1w36 s ARG 1071N -4.02 1.37 -0.62 1.99 1.70 -0.14 0.48 118.95 119.71 1w36 s ARG 1071Ca 0.36 -0.73 0.06 0.00 -0.47 0.00 0.00 55.73 54.95 1w36 s ARG 1071Cb 0.07 -1.37 0.27 0.00 -0.57 0.00 0.00 34.95 33.35 1w36 s ARG 1071CO 0.12 0.37 0.78 1.58 -1.08 0.00 0.00 175.30 177.07 1w36 n HIS 1072N 2.35 3.57 -2.89 5.89 -0.00 0.03 -4.93 115.22 119.24 1w36 n HIS 1072Ca -0.16 -4.10 -0.02 0.00 0.46 0.00 0.00 57.72 53.90 1w36 n HIS 1072Cb 0.54 -0.54 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1w36 n HIS 1072CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1w36 n GLU 1073N 0.64 -2.45 -1.15 1.57 -0.58 -1.26 -4.61 120.64 112.79 1w36 n GLU 1073Ca 0.30 2.13 0.00 0.00 -0.42 0.00 0.00 57.16 59.17 1w36 n GLU 1073Cb 0.41 -4.04 0.00 0.00 -0.57 0.00 0.00 31.44 27.24 1w36 n GLU 1073CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1w36 n GLY 1074N 0.77 -4.40 0.07 0.62 0.00 -1.26 -5.05 105.19 95.94 1w36 n GLY 1074Ca 0.01 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1w36 n GLY 1074CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w36 n ARG 1075N 0.22 0.00 -4.15 1.61 5.12 -1.13 -5.03 116.66 113.30 1w36 n ARG 1075Ca 0.00 0.04 -0.33 0.00 -1.93 0.00 0.00 57.85 55.62 1w36 n ARG 1075Cb 0.00 -0.03 -0.08 0.00 -1.16 0.00 0.00 32.46 31.20 1w36 n ARG 1075CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 1w36 s TYR 1076N 0.00 3.26 0.13 -1.55 4.12 0.25 -0.79 117.35 122.76 1w36 s TYR 1076Ca 0.00 0.21 0.07 0.00 0.02 0.00 0.00 57.07 57.37 1w36 s TYR 1076Cb 0.00 -1.75 -0.04 0.00 -1.52 0.00 0.00 41.96 38.66 1w36 s TYR 1076CO 0.00 0.54 -0.17 0.71 0.02 0.00 0.00 175.55 176.65 1w36 s TYR 1077N -1.13 1.61 -0.34 2.71 1.51 0.18 -3.80 117.35 118.09 1w36 s TYR 1077Ca 0.21 -0.49 -0.07 0.00 -1.01 0.00 0.00 57.07 55.71 1w36 s TYR 1077Cb -0.12 -0.84 0.04 0.00 -0.11 0.00 0.00 41.96 40.93 1w36 s TYR 1077CO 0.11 0.21 0.11 -0.51 -1.11 0.00 0.00 175.55 174.37 1w36 s LEU 1078N -2.34 4.36 0.16 -1.29 1.02 -1.26 -2.60 118.68 116.72 1w36 s LEU 1078Ca 0.10 -1.15 0.05 0.00 0.02 0.00 0.00 54.13 53.15 1w36 s LEU 1078Cb -0.07 -1.88 -0.04 0.00 0.02 0.00 0.00 46.19 44.23 1w36 s LEU 1078CO 0.04 -0.33 0.13 -0.22 0.02 0.00 0.00 176.35 175.99 1w36 s LEU 1079N 1.41 3.82 -0.18 1.79 2.96 0.30 -0.76 118.68 128.02 1w36 s LEU 1079Ca -0.01 -0.11 -0.04 0.00 -0.22 0.00 0.00 54.13 53.75 1w36 s LEU 1079Cb -0.20 -2.43 0.09 0.00 0.50 0.00 0.00 46.19 44.15 1w36 s LEU 1079CO 0.03 0.08 0.25 -0.62 -1.32 0.00 0.00 176.35 174.77 1w36 s ASP 1080N -3.04 0.89 0.19 3.68 -1.08 -1.09 -2.92 116.67 113.31 1w36 s ASP 1080Ca 0.31 0.11 -0.29 0.00 -0.52 0.00 0.00 52.55 52.15 1w36 s ASP 1080Cb -0.10 0.56 -0.08 0.00 -1.46 0.00 0.00 42.92 41.84 1w36 s ASP 1080CO 0.23 -0.29 0.93 -0.31 0.52 0.00 0.00 175.17 176.25 1w36 s TYR 1081N 2.38 3.92 -0.23 -5.34 1.51 -1.26 -2.08 117.35 116.25 1w36 s TYR 1081Ca 0.06 1.84 -0.02 0.00 -1.01 0.00 0.00 57.07 57.94 1w36 s TYR 1081Cb -0.14 -2.98 0.07 0.00 -0.11 0.00 0.00 41.96 38.80 1w36 s TYR 1081CO -0.11 0.38 0.04 0.15 -1.11 0.00 0.00 175.55 174.90 1w36 s LYS 1082N -0.76 0.78 0.29 -0.62 1.02 -0.63 -4.94 119.74 114.88 1w36 s LYS 1082Ca 0.42 -0.65 -0.18 0.00 0.02 0.00 0.00 55.97 55.59 1w36 s LYS 1082Cb -0.25 -2.12 -0.09 0.00 -0.52 0.00 0.00 37.83 34.85 1w36 s LYS 1082CO 0.31 -0.73 0.75 -1.54 -0.92 0.00 0.00 175.35 173.22 1w36 s SER 1083N 1.75 6.92 -0.24 2.83 1.04 -1.26 -1.47 113.70 123.27 1w36 s SER 1083Ca 0.01 1.38 -0.28 0.00 0.48 0.00 0.00 55.95 57.55 1w36 s SER 1083Cb -0.17 -2.41 0.15 0.00 0.10 0.00 0.00 66.02 63.69 1w36 s SER 1083CO -0.13 -0.11 1.16 0.20 0.98 0.00 0.00 173.24 175.34 1w36 s ASN 1084N -1.98 -0.27 0.00 7.02 -0.87 -1.26 -4.78 114.94 112.80 1w36 s ASN 1084Ca 0.50 0.39 0.00 0.00 -1.57 0.00 0.00 52.86 52.18 1w36 s ASN 1084Cb -0.13 0.36 0.00 0.00 -0.02 0.00 0.00 41.25 41.46 1w36 s ASN 1084CO 0.19 -0.18 0.00 -2.67 -2.57 0.00 0.00 177.10 171.87 1w36 n TRP 1085N 1.20 0.00 -3.51 2.20 2.14 -1.26 -4.77 117.44 113.45 1w36 n TRP 1085Ca -0.09 0.00 -0.40 0.00 2.07 0.00 0.00 57.50 59.08 1w36 n TRP 1085Cb 0.57 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 31.03 1w36 n TRP 1085CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1w36 s LEU 1086N -1.78 5.92 -1.12 5.67 1.43 -1.26 -4.93 118.68 122.60 1w36 s LEU 1086Ca 0.00 -3.56 -0.06 0.00 -1.03 0.00 0.00 54.13 49.48 1w36 s LEU 1086Cb 0.00 -2.04 0.28 0.00 0.03 0.00 0.00 46.19 44.46 1w36 s LEU 1086CO 0.00 -0.26 1.44 0.61 0.23 0.00 0.00 176.35 178.37 1w36 n GLY 1087N 2.64 4.80 6.44 -3.19 0.00 -1.26 -4.98 105.19 109.64 1w36 n GLY 1087Ca 0.21 -2.55 0.00 0.00 0.00 0.00 0.00 46.02 43.68 1w36 n GLY 1087CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1w36 n GLU 1088N 2.17 0.00 -4.08 1.61 -0.58 -1.26 -4.58 120.64 113.91 1w36 n GLU 1088Ca 0.28 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.90 1w36 n GLU 1088Cb 0.35 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.17 1w36 n GLU 1088CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1w36 s ASP 1089N -3.88 0.39 0.00 1.62 1.01 -1.26 -4.82 116.67 109.73 1w36 s ASP 1089Ca 0.00 -1.26 0.00 0.00 0.71 0.00 0.00 52.55 52.00 1w36 s ASP 1089Cb 0.00 0.57 0.00 0.00 1.01 0.00 0.00 42.92 44.50 1w36 s ASP 1089CO 0.00 -1.14 0.00 -1.54 0.21 0.00 0.00 175.17 172.70 1w36 n SER 1090N -0.79 0.00 0.20 0.27 3.41 -1.26 -1.09 113.62 114.37 1w36 n SER 1090Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1w36 n SER 1090Cb 0.63 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.58 1w36 n SER 1090CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1w36 h SER 1091N 0.00 0.00 -0.10 4.04 4.64 -1.96 0.28 113.55 120.44 1w36 h SER 1091Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1w36 h SER 1091Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1w36 h SER 1091CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1w36 n ALA 1092N -1.31 2.43 -1.82 5.18 0.00 -0.25 -4.56 120.51 120.18 1w36 n ALA 1092Ca -0.00 -0.73 -0.16 0.00 0.00 0.00 0.00 53.44 52.55 1w36 n ALA 1092Cb 0.80 -0.55 0.08 0.00 0.00 0.00 0.00 19.45 19.79 1w36 n ALA 1092CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1w36 n TYR 1093N 0.90 2.01 -4.15 0.00 4.02 0.97 -4.37 117.16 116.54 1w36 n TYR 1093Ca 0.11 -2.06 -0.32 0.00 -0.01 0.00 0.00 57.90 55.61 1w36 n TYR 1093Cb 0.41 -0.42 -0.07 0.00 -0.02 0.00 0.00 39.34 39.24 1w36 n TYR 1093CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1w36 s THR 1094N -4.18 4.48 0.17 -0.72 -4.23 -1.26 -1.21 115.64 108.69 1w36 s THR 1094Ca 0.48 -0.57 0.10 0.00 -1.18 0.00 0.00 61.69 60.52 1w36 s THR 1094Cb 0.41 -3.06 0.15 0.00 1.34 0.00 0.00 72.50 71.34 1w36 s THR 1094CO 0.01 0.30 0.40 0.00 -0.54 0.00 0.00 174.62 174.79 1w36 n GLN 1095N 1.07 0.00 -0.01 3.99 1.13 -1.26 -0.83 117.38 121.47 1w36 n GLN 1095Ca -0.12 0.30 -0.01 0.00 -1.94 0.00 0.00 57.00 55.23 1w36 n GLN 1095Cb 0.52 -0.74 -0.00 0.00 0.11 0.00 0.00 30.24 30.14 1w36 n GLN 1095CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 1w36 h GLN 1096N 0.00 0.00 -0.77 -1.09 4.20 -1.96 -3.03 115.11 112.45 1w36 h GLN 1096Ca 0.19 0.00 0.23 0.00 0.06 0.00 0.00 58.65 59.13 1w36 h GLN 1096Cb 0.94 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 28.58 1w36 h GLN 1096CO -0.00 0.00 0.09 0.00 -0.67 0.00 0.00 178.83 178.25 1w36 n ALA 1097N -2.47 0.47 0.36 3.87 0.00 -0.01 0.23 120.51 122.95 1w36 n ALA 1097Ca -0.01 0.82 -0.14 0.00 0.00 0.00 0.00 53.44 54.11 1w36 n ALA 1097Cb 0.04 -0.64 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 1w36 n ALA 1097CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1w36 h MET 1098N 0.00 -0.88 -0.55 0.00 2.86 -1.63 0.39 114.93 115.11 1w36 h MET 1098Ca 0.50 0.06 0.16 0.00 -2.06 0.00 0.00 59.70 58.36 1w36 h MET 1098Cb 1.11 0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.94 1w36 h MET 1098CO -0.71 -0.59 0.73 0.00 1.06 0.00 0.00 176.91 177.40 1w36 h ALA 1099N -1.48 2.31 0.19 6.32 0.00 0.25 0.37 119.26 127.22 1w36 h ALA 1099Ca -0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1w36 h ALA 1099Cb 0.70 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1w36 h ALA 1099CO 0.15 -1.01 -0.09 0.00 0.00 0.00 0.00 179.25 178.30 1w36 h ALA 1100N 1.07 -0.47 -0.96 0.00 0.00 0.48 -3.19 119.26 116.18 1w36 h ALA 1100Ca 0.26 -0.06 0.28 0.00 0.00 0.00 0.00 54.91 55.40 1w36 h ALA 1100Cb 1.71 0.10 -0.14 0.00 0.00 0.00 0.00 17.79 19.46 1w36 h ALA 1100CO -0.00 -0.46 0.48 0.00 0.00 0.00 0.00 179.25 179.27 1w36 h ALA 1101N -1.61 1.72 -1.01 0.00 0.00 0.19 0.75 119.26 119.31 1w36 h ALA 1101Ca -0.03 0.19 0.22 0.00 0.00 0.00 0.00 54.91 55.29 1w36 h ALA 1101Cb 0.20 0.17 -0.12 0.00 0.00 0.00 0.00 17.79 18.04 1w36 h ALA 1101CO 0.04 -0.48 0.60 0.52 0.00 0.00 0.00 179.25 179.94 1w36 h MET 1102N 0.34 0.64 0.03 0.00 2.86 -0.44 -1.44 114.93 116.93 1w36 h MET 1102Ca 0.66 -0.04 -0.26 0.00 -2.06 0.00 0.00 59.70 58.00 1w36 h MET 1102Cb 1.42 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.90 1w36 h MET 1102CO -0.59 0.42 -1.40 1.96 1.06 0.00 0.00 176.91 178.36 1w36 h GLN 1103N 0.65 0.06 -0.34 1.72 4.20 0.50 -0.34 115.11 121.58 1w36 h GLN 1103Ca 0.62 -0.11 0.06 0.00 0.06 0.00 0.00 58.65 59.27 1w36 h GLN 1103Cb 1.10 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.87 1w36 h GLN 1103CO -0.43 0.85 0.02 0.00 -0.67 0.00 0.00 178.83 178.60 1w36 h ALA 1104N 0.86 0.32 -0.55 3.87 0.00 -0.60 -1.30 119.26 121.86 1w36 h ALA 1104Ca -0.17 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1w36 h ALA 1104Cb 1.92 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.85 1w36 h ALA 1104CO 0.12 -0.39 0.00 0.72 0.00 0.00 0.00 179.25 179.70 1w36 n HIS 1105N -5.15 1.97 -3.48 0.00 8.25 -0.74 -4.92 115.22 111.15 1w36 n HIS 1105Ca 0.01 -0.68 -0.25 0.00 -0.26 0.00 0.00 57.72 56.53 1w36 n HIS 1105Cb 0.17 -0.49 -0.05 0.00 1.12 0.00 0.00 29.99 30.74 1w36 n HIS 1105CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1w36 n ARG 1106N 0.60 -1.33 0.18 -0.41 5.12 -0.49 -4.73 116.66 115.60 1w36 n ARG 1106Ca 0.26 0.08 0.14 0.00 -1.93 0.00 0.00 57.85 56.41 1w36 n ARG 1106Cb 1.15 -3.87 0.74 0.00 -1.16 0.00 0.00 32.46 29.32 1w36 n ARG 1106CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1w36 h TYR 1107N -0.51 0.00 -1.04 -1.55 0.99 -1.34 -0.94 116.97 112.58 1w36 h TYR 1107Ca -0.35 0.00 0.27 0.00 2.00 0.00 0.00 58.73 60.65 1w36 h TYR 1107Cb 1.06 0.00 -0.08 0.00 1.00 0.00 0.00 36.73 38.71 1w36 h TYR 1107CO 0.64 0.00 0.69 0.38 -0.00 0.00 0.00 178.16 179.87 1w36 h ASP 1108N 0.00 0.34 -0.52 3.88 2.03 -1.85 1.08 116.42 121.38 1w36 h ASP 1108Ca 0.09 0.06 -0.02 0.00 -0.73 0.00 0.00 57.03 56.43 1w36 h ASP 1108Cb 0.39 0.01 -0.03 0.00 -0.83 0.00 0.00 39.33 38.87 1w36 h ASP 1108CO -0.00 0.07 0.25 0.25 -1.03 0.00 0.00 179.24 178.78 1w36 h LEU 1109N 0.30 0.71 0.12 0.15 6.46 -1.52 -2.88 115.31 118.65 1w36 h LEU 1109Ca 0.57 -0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 58.25 1w36 h LEU 1109Cb 1.63 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 41.38 1w36 h LEU 1109CO -0.22 0.62 -0.06 -0.61 -0.62 0.00 0.00 178.44 177.55 1w36 h GLN 1110N 0.78 -0.16 0.00 1.25 4.15 0.11 -1.90 115.11 119.33 1w36 h GLN 1110Ca 0.19 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.62 1w36 h GLN 1110Cb 0.11 0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.84 1w36 h GLN 1110CO -0.02 -0.11 0.00 0.66 -1.93 0.00 0.00 178.83 177.43 1w36 n TYR 1111N -5.16 0.00 -0.30 3.99 4.02 -1.08 0.82 117.16 119.44 1w36 n TYR 1111Ca -0.08 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.79 1w36 n TYR 1111Cb 0.09 -0.48 0.04 0.00 -0.02 0.00 0.00 39.34 38.97 1w36 n TYR 1111CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1w36 h GLN 1112N 0.00 -0.06 0.67 -0.72 4.20 -1.58 0.50 115.11 118.13 1w36 h GLN 1112Ca 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1w36 h GLN 1112Cb 0.00 0.01 0.01 0.00 0.30 0.00 0.00 27.48 27.80 1w36 h GLN 1112CO 0.00 -0.04 -0.32 -0.07 -0.67 0.00 0.00 178.83 177.72 1w36 h LEU 1113N -0.07 -0.77 -0.86 1.46 3.38 -0.66 -0.66 115.31 117.14 1w36 h LEU 1113Ca 0.31 0.02 0.16 0.00 0.09 0.00 0.00 57.88 58.46 1w36 h LEU 1113Cb 0.58 0.20 -0.10 0.00 0.09 0.00 0.00 40.66 41.43 1w36 h LEU 1113CO -0.85 -0.53 0.43 1.88 0.09 0.00 0.00 178.44 179.46 1w36 h TYR 1114N -0.94 0.74 -0.15 1.13 0.99 0.16 -0.77 116.97 118.14 1w36 h TYR 1114Ca -0.09 0.04 -0.21 0.00 2.00 0.00 0.00 58.73 60.46 1w36 h TYR 1114Cb 0.70 -0.20 0.01 0.00 1.00 0.00 0.00 36.73 38.24 1w36 h TYR 1114CO -0.02 0.13 -0.75 1.79 -0.00 0.00 0.00 178.16 179.31 1w36 h THR 1115N 0.58 1.29 -0.75 -2.88 1.35 0.15 0.34 112.91 112.99 1w36 h THR 1115Ca 0.48 -1.98 0.17 0.00 -0.55 0.00 0.00 66.41 64.54 1w36 h THR 1115Cb 0.74 1.97 -0.05 0.00 -1.73 0.00 0.00 68.15 69.09 1w36 h THR 1115CO -0.40 0.62 0.51 0.25 -0.25 0.00 0.00 175.52 176.26 1w36 h LEU 1116N 0.50 0.26 0.12 3.87 6.46 -0.18 0.77 115.31 127.11 1w36 h LEU 1116Ca -0.04 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.73 1w36 h LEU 1116Cb 1.37 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 41.26 1w36 h LEU 1116CO 0.15 0.13 -0.06 0.00 -0.62 0.00 0.00 178.44 178.04 1w36 h ALA 1117N 1.65 -0.16 -0.14 1.25 0.00 -0.40 -2.36 119.26 119.09 1w36 h ALA 1117Ca 0.37 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1w36 h ALA 1117Cb 1.05 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1w36 h ALA 1117CO -0.09 -0.30 0.05 1.25 0.00 0.00 0.00 179.25 180.15 1w36 h LEU 1118N -0.75 0.17 0.00 0.00 6.46 0.12 0.44 115.31 121.75 1w36 h LEU 1118Ca -0.02 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 1w36 h LEU 1118Cb 0.54 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.43 1w36 h LEU 1118CO 0.03 0.17 0.00 1.57 -0.62 0.00 0.00 178.44 179.59 1w36 n HIS 1119N -4.46 0.00 -0.33 1.25 -0.00 0.24 -0.03 115.22 111.89 1w36 n HIS 1119Ca -0.01 0.00 0.08 0.00 0.46 0.00 0.00 57.72 58.25 1w36 n HIS 1119Cb 0.12 -0.11 0.17 0.00 -0.12 0.00 0.00 29.99 30.05 1w36 n HIS 1119CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1w36 n ARG 1120N -0.88 -0.08 0.15 1.57 5.12 -0.89 0.19 116.66 121.83 1w36 n ARG 1120Ca 0.00 1.43 -0.14 0.00 -1.93 0.00 0.00 57.85 57.21 1w36 n ARG 1120Cb 0.00 -2.18 -0.07 0.00 -1.16 0.00 0.00 32.46 29.05 1w36 n ARG 1120CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 1w36 h TYR 1121N 0.00 -0.34 -1.01 -1.55 3.20 -0.84 -1.40 116.97 115.03 1w36 h TYR 1121Ca 0.48 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.36 1w36 h TYR 1121Cb 0.83 0.12 -0.05 0.00 1.54 0.00 0.00 36.73 39.17 1w36 h TYR 1121CO -0.64 -0.21 0.67 -0.07 -1.64 0.00 0.00 178.16 176.27 1w36 h LEU 1122N -0.33 1.16 -1.78 2.82 3.38 0.35 -0.16 115.31 120.74 1w36 h LEU 1122Ca -0.02 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1w36 h LEU 1122Cb 0.28 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1w36 h LEU 1122CO 0.02 0.83 -0.08 -0.09 0.09 0.00 0.00 178.44 179.22 1w36 h ARG 1123N 1.36 0.04 0.16 1.13 2.43 -0.06 0.05 114.38 119.49 1w36 h ARG 1123Ca 0.37 -0.01 -0.31 0.00 -0.81 0.00 0.00 59.98 59.23 1w36 h ARG 1123Cb -0.15 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1w36 h ARG 1123CO -0.08 0.12 -1.48 1.25 -1.51 0.00 0.00 179.97 178.27 1w36 h HIS 1124N 0.04 0.60 0.00 2.20 2.76 -0.13 -3.40 115.15 117.21 1w36 h HIS 1124Ca 0.01 -0.44 -0.01 0.00 -2.20 0.00 0.00 60.37 57.74 1w36 h HIS 1124Cb 0.17 -0.02 -0.00 0.00 1.55 0.00 0.00 27.41 29.10 1w36 h HIS 1124CO 0.00 1.43 -0.09 0.00 -1.30 0.00 0.00 177.93 177.97 1w36 h ARG 1125N 0.09 0.00 -6.16 5.26 2.47 -0.59 -3.43 114.38 112.02 1w36 h ARG 1125Ca -0.23 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 57.96 1w36 h ARG 1125Cb 2.05 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 30.32 1w36 h ARG 1125CO 0.20 0.17 1.26 0.42 0.56 0.00 0.00 179.97 182.57 1w36 s ILE 1126N -1.74 3.51 -0.06 2.04 1.09 -0.04 -4.93 121.20 121.06 1w36 s ILE 1126Ca -0.05 0.38 -0.29 0.00 -1.10 0.00 0.00 60.65 59.58 1w36 s ILE 1126Cb -0.00 -4.10 -0.08 0.00 -1.06 0.00 0.00 42.46 37.22 1w36 s ILE 1126CO 0.14 -0.98 2.07 0.00 -0.10 0.00 0.00 174.94 176.07 1w36 n ALA 1127N 11.33 1.65 -2.45 9.38 0.00 -1.26 -3.02 120.51 136.14 1w36 n ALA 1127Ca 0.17 0.04 -0.02 0.00 0.00 0.00 0.00 53.44 53.63 1w36 n ALA 1127Cb 0.50 -2.77 0.00 0.00 0.00 0.00 0.00 19.45 17.18 1w36 n ALA 1127CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1w36 n ASP 1128N 9.10 -5.80 -4.44 0.00 2.03 -1.26 -5.07 116.55 111.10 1w36 n ASP 1128Ca 0.24 0.12 -0.27 0.00 0.52 0.00 0.00 54.79 55.40 1w36 n ASP 1128Cb 0.42 -3.82 -0.11 0.00 -0.72 0.00 0.00 41.12 36.89 1w36 n ASP 1128CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1w36 s TYR 1129N -2.60 2.33 -0.05 -0.67 6.14 -1.17 -5.14 117.35 116.20 1w36 s TYR 1129Ca 0.07 -0.35 0.02 0.00 0.64 0.00 0.00 57.07 57.45 1w36 s TYR 1129Cb -0.02 -1.15 0.01 0.00 0.42 0.00 0.00 41.96 41.23 1w36 s TYR 1129CO 0.49 0.51 -0.08 0.34 0.64 0.00 0.00 175.55 177.45 1w36 s ASP 1130N -2.71 1.25 0.26 4.32 -1.08 -1.26 -5.00 116.67 112.45 1w36 s ASP 1130Ca 0.21 -0.19 -0.09 0.00 -0.52 0.00 0.00 52.55 51.96 1w36 s ASP 1130Cb -0.08 -0.53 0.42 0.00 -1.46 0.00 0.00 42.92 41.27 1w36 s ASP 1130CO 0.10 0.01 1.59 0.22 0.52 0.00 0.00 175.17 177.61 1w36 h TYR 1131N 6.89 -0.37 -0.39 -5.34 3.20 -1.99 -1.21 116.97 117.77 1w36 h TYR 1131Ca -0.35 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.60 1w36 h TYR 1131Cb 1.17 0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.74 1w36 h TYR 1131CO 0.48 -0.36 0.00 0.39 -1.64 0.00 0.00 178.16 177.03 1w36 n GLU 1132N -5.52 3.14 0.00 1.82 1.02 -1.26 -1.50 120.64 118.33 1w36 n GLU 1132Ca 0.14 -1.91 0.00 0.00 -0.02 0.00 0.00 57.16 55.37 1w36 n GLU 1132Cb 0.47 -1.84 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 1w36 n GLU 1132CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1w36 n HIS 1133N 0.50 0.00 0.00 -0.32 8.25 -0.49 -4.79 115.22 118.37 1w36 n HIS 1133Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.63 1w36 n HIS 1133Cb 0.74 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.85 1w36 n HIS 1133CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1w36 n HIS 1134N -1.00 0.00 0.00 4.41 8.25 -1.03 -4.43 115.22 121.42 1w36 n HIS 1134Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1w36 n HIS 1134Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1w36 n HIS 1134CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1w36 n PHE 1135N -1.24 0.00 -3.16 4.41 -0.00 -0.56 0.85 117.46 117.75 1w36 n PHE 1135Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.38 1w36 n PHE 1135Cb 0.21 0.00 0.03 0.00 -0.00 0.00 0.00 39.48 39.72 1w36 n PHE 1135CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1w36 n GLY 1136N 4.46 -1.21 0.00 7.13 0.00 -1.26 -3.11 105.19 111.20 1w36 n GLY 1136Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1w36 n GLY 1136CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w36 n GLY 1137N -1.56 4.92 2.39 -0.02 0.00 -1.25 -4.77 105.19 104.90 1w36 n GLY 1137Ca -0.03 -1.26 -0.04 0.00 0.00 0.00 0.00 46.02 44.69 1w36 n GLY 1137CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1w36 n VAL 1138N 0.00-10.74 -4.36 1.61 0.31 -1.18 -4.39 118.33 99.58 1w36 n VAL 1138Ca 0.00 2.07 -0.21 0.00 -0.01 0.00 0.00 64.34 66.19 1w36 n VAL 1138Cb 0.00 -6.04 -0.13 0.00 -0.91 0.00 0.00 33.84 26.76 1w36 n VAL 1138CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1w36 s ILE 1139N -0.71 1.28 -0.23 2.52 -1.09 0.06 -2.54 121.20 120.49 1w36 s ILE 1139Ca -0.18 -1.16 -0.03 0.00 -2.23 0.00 0.00 60.65 57.05 1w36 s ILE 1139Cb 0.01 -1.17 0.08 0.00 -1.58 0.00 0.00 42.46 39.80 1w36 s ILE 1139CO 0.63 -0.01 0.08 -0.31 -1.23 0.00 0.00 174.94 174.10 1w36 s TYR 1140N -0.96 0.87 -0.75 3.97 4.12 0.64 -2.67 117.35 122.59 1w36 s TYR 1140Ca 0.03 -0.94 -0.19 0.00 0.02 0.00 0.00 57.07 55.98 1w36 s TYR 1140Cb -0.09 -1.08 0.12 0.00 -1.52 0.00 0.00 41.96 39.40 1w36 s TYR 1140CO 0.02 -0.69 0.90 -0.51 0.02 0.00 0.00 175.55 175.28 1w36 s LEU 1141N 1.91 5.29 -0.89 -1.29 1.43 -0.88 -1.56 118.68 122.68 1w36 s LEU 1141Ca 0.04 -1.72 -0.25 0.00 -1.03 0.00 0.00 54.13 51.17 1w36 s LEU 1141Cb -0.17 -2.34 0.01 0.00 0.03 0.00 0.00 46.19 43.72 1w36 s LEU 1141CO -0.18 -1.09 1.62 -0.36 0.23 0.00 0.00 176.35 176.58 1w36 s PHE 1142N 2.59 2.17 0.30 0.29 0.40 -0.38 -1.60 117.98 121.75 1w36 s PHE 1142Ca 0.21 -0.08 0.22 0.00 -0.60 0.00 0.00 56.93 56.68 1w36 s PHE 1142Cb -0.15 -4.42 1.04 0.00 0.51 0.00 0.00 43.02 40.01 1w36 s PHE 1142CO -0.00 -1.95 1.11 1.28 0.70 0.00 0.00 175.22 176.36 1w36 n LEU 1143N 10.96 0.16 -4.92 -0.37 4.77 -0.55 -4.26 117.00 122.80 1w36 n LEU 1143Ca 0.29 1.02 -0.27 0.00 -0.03 0.00 0.00 56.01 57.01 1w36 n LEU 1143Cb 0.50 -0.50 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1w36 n LEU 1143CO 0.66 -1.11 0.66 -0.13 -1.33 0.00 0.00 177.39 176.14 1w36 s ARG 1144N -4.82 2.24 -1.00 3.23 0.52 -1.26 -4.13 118.95 113.72 1w36 s ARG 1144Ca -0.05 -0.09 -0.00 0.00 -0.52 0.00 0.00 55.73 55.06 1w36 s ARG 1144Cb 0.22 -2.11 0.00 0.00 0.52 0.00 0.00 34.95 33.58 1w36 s ARG 1144CO 0.58 -1.28 0.06 0.41 0.02 0.00 0.00 175.30 175.09 1w36 n GLY 1145N -3.01 -0.11 2.91 -3.53 0.00 -1.26 -4.75 105.19 95.45 1w36 n GLY 1145Ca 0.08 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 1w36 n GLY 1145CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w36 s VAL 1146N -2.65 1.51 0.17 1.61 1.01 -1.26 -2.71 120.40 118.09 1w36 s VAL 1146Ca 0.03 -1.41 0.07 0.00 0.00 0.00 0.00 61.98 60.67 1w36 s VAL 1146Cb -0.01 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 1w36 s VAL 1146CO 0.04 -0.28 0.03 -1.81 0.00 0.00 0.00 175.10 173.08 1w36 s ASP 1147N 1.37 4.93 0.40 3.32 1.01 -1.26 -4.75 116.67 121.69 1w36 s ASP 1147Ca -0.01 -0.34 0.08 0.00 0.71 0.00 0.00 52.55 53.00 1w36 s ASP 1147Cb -0.19 -1.11 0.85 0.00 1.01 0.00 0.00 42.92 43.49 1w36 s ASP 1147CO -0.10 0.08 2.01 0.11 0.21 0.00 0.00 175.17 177.48 1w36 h LYS 1148N 2.62 0.58 -2.11 8.23 6.56 -1.94 -3.33 116.57 127.18 1w36 h LYS 1148Ca -0.47 -0.03 -0.58 0.00 -1.06 0.00 0.00 60.65 58.51 1w36 h LYS 1148Cb 1.20 -0.13 -0.40 0.00 -0.57 0.00 0.00 32.23 32.33 1w36 h LYS 1148CO 0.59 0.38 -0.92 0.39 -2.06 0.00 0.00 179.45 177.83 1w36 n GLU 1149N -4.47 1.29 -2.68 3.15 -0.58 -1.26 -4.80 120.64 111.29 1w36 n GLU 1149Ca 0.07 -3.71 -0.05 0.00 -0.42 0.00 0.00 57.16 53.05 1w36 n GLU 1149Cb 0.19 -1.60 0.07 0.00 -0.57 0.00 0.00 31.44 29.53 1w36 n GLU 1149CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1w36 n HIS 1150N 1.32 -1.20 -0.69 -0.32 8.25 -1.25 -5.16 115.22 116.17 1w36 n HIS 1150Ca 0.24 -1.18 -0.30 0.00 -0.26 0.00 0.00 57.72 56.22 1w36 n HIS 1150Cb 0.48 1.34 0.14 0.00 1.12 0.00 0.00 29.99 33.07 1w36 n HIS 1150CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1w36 n PRO 1151N -0.11 -1.49 -0.85 -0.41 -0.04 -1.26 -2.70 135.00 128.14 1w36 n PRO 1151Ca -0.11 -0.43 0.00 0.00 -0.04 0.00 0.00 63.50 62.92 1w36 n PRO 1151Cb 0.73 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 1w36 n PRO 1151CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1w36 n GLN 1152N -1.19 -1.27 -3.94 0.54 6.02 -1.26 -4.90 117.38 111.37 1w36 n GLN 1152Ca 0.01 0.32 -0.35 0.00 -0.01 0.00 0.00 57.00 56.98 1w36 n GLN 1152Cb 0.58 -4.71 -0.14 0.00 1.02 0.00 0.00 30.24 26.99 1w36 n GLN 1152CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 1w36 s GLN 1153N -1.57 2.53 0.00 -1.09 0.74 -1.10 -4.13 119.66 115.04 1w36 s GLN 1153Ca 0.00 -1.19 0.00 0.00 0.05 0.00 0.00 55.36 54.22 1w36 s GLN 1153Cb 0.00 -3.10 0.00 0.00 1.10 0.00 0.00 33.01 31.01 1w36 s GLN 1153CO 0.00 -0.55 0.00 0.41 -0.55 0.00 0.00 175.29 174.60 1w36 n GLY 1154N 4.62 2.37 3.82 2.59 0.00 -0.35 -4.29 105.19 113.96 1w36 n GLY 1154Ca -0.14 -0.47 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 1w36 n GLY 1154CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1w36 s ILE 1155N -1.34 4.95 -0.03 -0.61 -4.36 -1.26 -1.25 121.20 117.30 1w36 s ILE 1155Ca 0.00 -0.36 0.02 0.00 -0.26 0.00 0.00 60.65 60.04 1w36 s ILE 1155Cb 0.00 -3.30 0.01 0.00 1.25 0.00 0.00 42.46 40.42 1w36 s ILE 1155CO 0.00 0.31 -0.06 -0.47 0.24 0.00 0.00 174.94 174.97 1w36 s TYR 1156N -1.26 0.73 0.02 1.37 5.04 -0.60 -4.83 117.35 117.81 1w36 s TYR 1156Ca 0.25 -0.18 0.05 0.00 -2.44 0.00 0.00 57.07 54.75 1w36 s TYR 1156Cb -0.12 -0.59 -0.02 0.00 0.35 0.00 0.00 41.96 41.59 1w36 s TYR 1156CO 0.17 -0.13 -0.14 0.99 -1.34 0.00 0.00 175.55 175.10 1w36 s THR 1157N 0.50 1.13 0.16 4.34 2.01 -1.26 -0.26 115.64 122.27 1w36 s THR 1157Ca -0.07 -0.82 -0.05 0.00 0.31 0.00 0.00 61.69 61.06 1w36 s THR 1157Cb -0.10 -0.98 -0.02 0.00 0.01 0.00 0.00 72.50 71.40 1w36 s THR 1157CO 0.00 0.15 0.19 -0.89 -0.69 0.00 0.00 174.62 173.38 1w36 s THR 1158N -0.61 0.06 -0.42 -0.82 2.01 -1.05 -5.04 115.64 109.77 1w36 s THR 1158Ca 0.04 -1.68 0.08 0.00 0.31 0.00 0.00 61.69 60.43 1w36 s THR 1158Cb -0.07 -2.05 0.28 0.00 0.01 0.00 0.00 72.50 70.67 1w36 s THR 1158CO 0.00 -0.29 0.76 -1.14 -0.69 0.00 0.00 174.62 173.27 1w36 n ARG 1159N -0.19 0.84 0.00 4.92 3.00 -1.26 -4.30 116.66 119.67 1w36 n ARG 1159Ca -0.05 -2.68 0.00 0.00 -0.00 0.00 0.00 57.85 55.12 1w36 n ARG 1159Cb 0.64 -1.36 0.00 0.00 0.00 0.00 0.00 32.46 31.73 1w36 n ARG 1159CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1w36 n PRO 1160N 1.02 0.00 0.03 -0.14 -0.02 -1.26 -4.61 135.00 130.03 1w36 n PRO 1160Ca 0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1w36 n PRO 1160Cb 0.61 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.09 1w36 n PRO 1160CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1w36 n ASN 1161N 0.00 0.00 0.00 2.55 4.13 -1.26 -4.69 115.26 115.99 1w36 n ASN 1161Ca 0.00 0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.31 1w36 n ASN 1161Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1w36 n ASN 1161CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1w36 n ALA 1162N -0.83 0.00 0.41 5.41 0.00 -1.26 -4.06 120.51 120.18 1w36 n ALA 1162Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1w36 n ALA 1162Cb 0.43 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.76 1w36 n ALA 1162CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w36 n GLY 1163N -1.12 -0.73 0.06 0.00 0.00 -1.26 -3.80 105.19 98.33 1w36 n GLY 1163Ca 0.00 -0.46 -0.05 0.00 0.00 0.00 0.00 46.02 45.51 1w36 n GLY 1163CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1w36 h LEU 1164N 0.00 0.00 -0.80 0.99 6.46 -1.90 -3.18 115.31 116.88 1w36 h LEU 1164Ca 0.00 -0.22 0.16 0.00 -0.12 0.00 0.00 57.88 57.70 1w36 h LEU 1164Cb 0.62 0.00 -0.15 0.00 -0.73 0.00 0.00 40.66 40.39 1w36 h LEU 1164CO 0.00 0.70 -0.21 0.40 -0.62 0.00 0.00 178.44 178.71 1w36 h ILE 1165N -1.00 0.19 0.00 4.05 1.08 -1.90 0.48 117.51 120.41 1w36 h ILE 1165Ca -0.02 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.45 1w36 h ILE 1165Cb 0.36 0.19 0.00 0.00 -3.07 0.00 0.00 36.82 34.30 1w36 h ILE 1165CO -0.01 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.45 1w36 n ALA 1166N -3.33 -0.11 -0.26 1.87 0.00 -1.25 0.15 120.51 117.59 1w36 n ALA 1166Ca 0.11 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.57 1w36 n ALA 1166Cb 0.41 0.32 0.15 0.00 0.00 0.00 0.00 19.45 20.32 1w36 n ALA 1166CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1w36 h LEU 1167N 0.00 0.50 0.18 0.00 3.38 -1.30 -2.08 115.31 115.99 1w36 h LEU 1167Ca 0.00 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1w36 h LEU 1167Cb 0.00 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1w36 h LEU 1167CO 0.00 0.28 -0.22 -0.03 0.09 0.00 0.00 178.44 178.56 1w36 h MET 1168N 0.63 -0.43 -0.54 1.13 4.05 0.50 0.75 114.93 121.02 1w36 h MET 1168Ca 0.37 0.03 0.10 0.00 -0.28 0.00 0.00 59.70 59.91 1w36 h MET 1168Cb 0.39 0.10 -0.08 0.00 -0.80 0.00 0.00 31.60 31.21 1w36 h MET 1168CO -0.27 -0.29 0.08 0.22 0.23 0.00 0.00 176.91 176.88 1w36 h ASP 1169N -0.45 -0.07 0.28 1.39 -0.00 0.20 0.53 116.42 118.30 1w36 h ASP 1169Ca 0.01 0.11 0.00 0.00 -0.00 0.00 0.00 57.03 57.15 1w36 h ASP 1169Cb 0.44 0.16 0.00 0.00 -0.00 0.00 0.00 39.33 39.93 1w36 h ASP 1169CO -0.08 -0.01 -0.03 -1.84 -0.00 0.00 0.00 179.24 177.28 1w36 n GLU 1170N -5.16 0.78 0.22 0.28 0.28 -0.83 -2.33 120.64 113.88 1w36 n GLU 1170Ca 0.07 -0.13 0.12 0.00 -0.16 0.00 0.00 57.16 57.06 1w36 n GLU 1170Cb 0.28 -1.50 0.29 0.00 1.43 0.00 0.00 31.44 31.95 1w36 n GLU 1170CO 0.00 0.00 0.00 1.98 -0.16 0.00 0.00 177.13 178.95 1w36 h MET 1171N 0.32 0.00 0.06 3.44 4.05 0.58 0.19 114.93 123.58 1w36 h MET 1171Ca 0.00 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1w36 h MET 1171Cb 0.22 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.02 1w36 h MET 1171CO 0.00 0.07 -0.03 0.35 0.23 0.00 0.00 176.91 177.53 1w36 h PHE 1172N 0.00 -0.08 0.00 1.39 3.57 -1.05 -3.40 116.94 117.37 1w36 h PHE 1172Ca -0.00 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 1w36 h PHE 1172Cb 0.91 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.67 1w36 h PHE 1172CO 0.00 -0.05 -0.12 0.00 -2.23 0.00 0.00 178.31 175.91 1w36 h ALA 1173N -1.86 0.92 0.00 2.41 0.00 -1.64 -3.34 119.26 115.76 1w36 h ALA 1173Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1w36 h ALA 1173Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1w36 h ALA 1173CO 0.01 0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.82