#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 -4.59 6.12 3.41 -1.21 -4.26 113.62 113.09 1w36 n SER 2 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.27 1w36 n SER 2 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 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 -0.97 5.43 -0.28 4.04 2.15 -1.26 -4.78 116.67 121.01 1w36 s ASP 3 Ca 0.00 0.02 -0.01 0.00 0.43 0.00 0.00 52.55 52.99 1w36 s ASP 3 Cb 0.00 -1.93 0.00 0.00 -0.30 0.00 0.00 42.92 40.70 1w36 s ASP 3 CO 0.00 0.16 0.02 0.52 -0.17 0.00 0.00 175.17 175.70 1w36 n VAL 4 N 3.63-11.51 -1.07 1.11 0.31 -1.26 -4.93 118.33 104.62 1w36 n VAL 4 Ca -0.17 1.81 -0.35 0.00 -0.01 0.00 0.00 64.34 65.62 1w36 n VAL 4 Cb 0.52 -6.72 0.02 0.00 -0.91 0.00 0.00 33.84 26.75 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 0.74 -4.13 -1.87 3.52 0.00 -1.26 -4.80 120.51 112.71 1w36 n ALA 5 Ca -0.03 -0.34 -0.38 0.00 0.00 0.00 0.00 53.44 52.69 1w36 n ALA 5 Cb 0.05 -1.21 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 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 -1.41 4.60 -1.02 0.00 2.12 -1.18 -4.72 118.70 117.09 1w36 s GLU 6 Ca 0.46 1.26 -0.24 0.00 0.36 0.00 0.00 54.97 56.81 1w36 s GLU 6 Cb -0.33 -3.05 -0.07 0.00 0.26 0.00 0.00 34.13 30.95 1w36 s GLU 6 CO 0.70 0.43 1.95 0.99 -0.54 0.00 0.00 175.26 178.79 1w36 s THR 7 N -1.38 3.48 -0.37 -1.70 2.01 -1.26 -1.56 115.64 114.86 1w36 s THR 7 Ca 0.43 -0.60 -0.34 0.00 0.31 0.00 0.00 61.69 61.50 1w36 s THR 7 Cb -0.21 -4.23 -0.14 0.00 0.01 0.00 0.00 72.50 67.92 1w36 s THR 7 CO 0.26 -0.94 1.29 -0.11 -0.69 0.00 0.00 174.62 174.43 1w36 n LEU 8 N 14.30 0.79 -4.19 4.42 -0.00 -0.69 -4.90 117.00 126.73 1w36 n LEU 8 Ca 0.42 0.76 -0.40 0.00 -0.00 0.00 0.00 56.01 56.79 1w36 n LEU 8 Cb 0.47 -0.65 -0.07 0.00 -0.00 0.00 0.00 43.42 43.16 1w36 n LEU 8 CO 0.63 -0.60 0.11 -0.62 -0.00 0.00 0.00 177.39 176.91 1w36 s ASP 9 N 2.85 5.77 0.09 1.96 -1.08 -1.26 -4.89 116.67 120.11 1w36 s ASP 9 Ca 0.80 -2.48 -0.11 0.00 -0.52 0.00 0.00 52.55 50.24 1w36 s ASP 9 Cb -1.10 -1.99 0.04 0.00 -1.46 0.00 0.00 42.92 38.40 1w36 s ASP 9 CO 0.57 -0.53 0.72 -2.65 0.52 0.00 0.00 175.17 173.79 1w36 n PRO 10 N 4.12 -0.16 0.24 4.34 -0.02 -1.26 -0.28 135.00 141.98 1w36 n PRO 10 Ca 0.04 0.71 0.16 0.00 -2.02 0.00 0.00 63.50 62.39 1w36 n PRO 10 Cb 0.41 -1.05 0.87 0.00 -0.02 0.00 0.00 33.50 33.71 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 -2.94 2.45 3.38 -1.98 -2.34 115.31 113.87 1w36 h LEU 11 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1w36 h LEU 11 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1w36 h LEU 11 CO -0.45 0.00 0.00 -1.14 0.09 0.00 0.00 178.44 176.94 1w36 n ARG 12 N -3.80 2.87 -2.20 1.13 3.00 0.62 -4.67 116.66 113.61 1w36 n ARG 12 Ca -0.00 -2.04 -0.42 0.00 -0.00 0.00 0.00 57.85 55.38 1w36 n ARG 12 Cb 0.23 -1.28 -0.03 0.00 0.00 0.00 0.00 32.46 31.38 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 -1.21 4.28 -0.54 6.15 2.96 -0.88 -4.82 118.68 124.61 1w36 s LEU 13 Ca 0.21 2.04 -0.26 0.00 -0.22 0.00 0.00 54.13 55.90 1w36 s LEU 13 Cb 0.12 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 43.21 1w36 s LEU 13 CO 0.12 -0.81 2.24 -2.16 -1.32 0.00 0.00 176.35 174.42 1w36 s PRO 14 N 3.36 2.24 0.00 0.98 0.04 -1.26 -4.76 135.00 135.60 1w36 s PRO 14 Ca 0.65 1.11 -0.02 0.00 0.04 0.00 0.00 61.00 62.78 1w36 s PRO 14 Cb -0.29 -4.54 -0.09 0.00 0.04 0.00 0.00 34.50 29.62 1w36 s PRO 14 CO 0.24 -3.17 1.58 1.28 0.04 0.00 0.00 177.00 176.97 1w36 n LEU 15 N 15.08 2.24 -3.84 -3.56 4.77 -0.32 -4.63 117.00 126.75 1w36 n LEU 15 Ca 0.32 -1.48 -0.28 0.00 -0.03 0.00 0.00 56.01 54.54 1w36 n LEU 15 Cb 0.54 -0.57 -0.16 0.00 -2.33 0.00 0.00 43.42 40.89 1w36 n LEU 15 CO 0.70 0.43 -0.40 0.00 -1.33 0.00 0.00 177.39 176.80 1w36 s GLN 16 N 1.89 1.13 0.00 3.23 1.03 -1.26 -4.46 119.66 121.22 1w36 s GLN 16 Ca 0.21 -0.48 0.00 0.00 0.04 0.00 0.00 55.36 55.13 1w36 s GLN 16 Cb 0.10 -2.00 0.00 0.00 0.03 0.00 0.00 33.01 31.14 1w36 s GLN 16 CO 0.00 -0.50 0.00 0.41 -2.54 0.00 0.00 175.29 172.66 1w36 n GLY 17 N 4.93 0.00 3.01 2.60 0.00 -0.12 -4.88 105.19 110.74 1w36 n GLY 17 Ca -0.10 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.17 -1.55 -4.21 1.61 0.00 -1.24 -4.66 120.64 110.42 1w36 n GLU 18 Ca 0.00 1.55 -0.20 0.00 0.00 0.00 0.00 57.16 58.50 1w36 n GLU 18 Cb 0.00 -2.36 -0.16 0.00 0.00 0.00 0.00 31.44 28.92 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 -0.98 0.89 -0.43 3.44 1.81 -0.39 -4.43 118.95 118.86 1w36 s ARG 19 Ca -0.02 -0.13 -0.12 0.00 -1.72 0.00 0.00 55.73 53.74 1w36 s ARG 19 Cb 0.00 -0.87 0.07 0.00 -0.45 0.00 0.00 34.95 33.70 1w36 s ARG 19 CO 0.26 -0.07 0.30 -1.17 -0.68 0.00 0.00 175.30 173.94 1w36 s LEU 20 N 0.86 5.27 -0.34 2.53 2.96 0.41 -0.96 118.68 129.41 1w36 s LEU 20 Ca -0.12 -1.36 -0.12 0.00 -0.22 0.00 0.00 54.13 52.32 1w36 s LEU 20 Cb -0.15 -2.07 -0.00 0.00 0.50 0.00 0.00 46.19 44.47 1w36 s LEU 20 CO 0.01 -0.56 0.21 -0.63 -1.32 0.00 0.00 176.35 174.06 1w36 s ILE 21 N 1.53 4.93 -0.41 6.68 1.01 0.44 -1.58 121.20 133.79 1w36 s ILE 21 Ca 0.03 -0.43 -0.22 0.00 0.00 0.00 0.00 60.65 60.03 1w36 s ILE 21 Cb -0.23 -3.58 0.02 0.00 0.01 0.00 0.00 42.46 38.68 1w36 s ILE 21 CO 0.05 -0.05 0.72 -0.70 0.00 0.00 0.00 174.94 174.96 1w36 s GLU 22 N 1.65 3.49 -0.61 2.79 2.12 0.10 -1.99 118.70 126.25 1w36 s GLU 22 Ca 0.05 -0.07 -0.09 0.00 0.36 0.00 0.00 54.97 55.21 1w36 s GLU 22 Cb -0.18 -3.89 0.16 0.00 0.26 0.00 0.00 34.13 30.48 1w36 s GLU 22 CO 0.08 -0.97 0.49 0.00 -0.54 0.00 0.00 175.26 174.33 1w36 s ALA 23 N 3.02 3.64 1.14 6.30 0.00 0.05 -1.98 121.76 133.94 1w36 s ALA 23 Ca 0.27 -2.94 -0.16 0.00 0.00 0.00 0.00 51.96 49.13 1w36 s ALA 23 Cb -0.13 -2.99 0.24 0.00 0.00 0.00 0.00 23.12 20.24 1w36 s ALA 23 CO 0.19 -2.06 0.54 0.43 0.00 0.00 0.00 175.76 174.86 1w36 n SER 24 N 4.31 -3.39 -4.72 0.00 7.64 -1.26 -4.57 113.62 111.63 1w36 n SER 24 Ca 0.02 -0.55 -0.42 0.00 1.01 0.00 0.00 58.87 58.93 1w36 n SER 24 Cb 0.42 -0.84 -0.03 0.00 -1.01 0.00 0.00 64.21 62.75 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 -2.08 3.68 -1.11 -0.43 0.00 -1.26 -2.93 121.76 117.63 1w36 s ALA 25 Ca 0.45 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.64 1w36 s ALA 25 Cb -0.08 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1w36 s ALA 25 CO 0.38 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 175.85 1w36 n GLY 26 N 3.63 -0.01 0.00 0.00 0.00 -1.26 -4.84 105.19 102.71 1w36 n GLY 26 Ca 0.13 -0.36 0.11 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.88 0.00 0.00 2.61 -2.24 -1.15 -1.73 114.28 107.90 1w36 n THR 27 Ca -0.15 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1w36 n THR 27 Cb 0.60 0.78 0.00 0.00 -2.10 0.00 0.00 70.33 69.60 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 1.50 1.39 0.33 3.38 0.00 -1.26 -4.75 105.19 105.77 1w36 n GLY 28 Ca 0.04 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.27 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 0.75 0.04 0.03 1.61 3.11 -1.92 0.35 116.57 120.54 1w36 h LYS 29 Ca 0.00 -0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1w36 h LYS 29 Cb 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.22 1w36 h LYS 29 CO 0.00 0.03 -0.01 1.79 -2.81 0.00 0.00 179.45 178.44 1w36 h THR 30 N 0.04 1.31 -1.00 1.00 1.35 -2.00 -1.34 112.91 112.28 1w36 h THR 30 Ca 0.69 -1.09 0.10 0.00 -0.55 0.00 0.00 66.41 65.56 1w36 h THR 30 Cb 1.60 2.04 -0.08 0.00 -1.73 0.00 0.00 68.15 69.98 1w36 h THR 30 CO -0.83 0.28 0.64 -0.26 -0.25 0.00 0.00 175.52 175.10 1w36 h PHE 31 N -0.52 1.15 0.18 4.73 -1.00 -0.82 -2.34 116.94 118.32 1w36 h PHE 31 Ca -0.00 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.80 1w36 h PHE 31 Cb 0.48 -0.37 0.00 0.00 3.61 0.00 0.00 35.95 39.67 1w36 h PHE 31 CO 0.09 0.51 -0.09 1.15 -1.61 0.00 0.00 178.31 178.37 1w36 h THR 32 N 1.05 0.90 -0.48 -1.55 2.02 -0.80 -1.90 112.91 112.17 1w36 h THR 32 Ca 0.47 -0.40 0.05 0.00 0.77 0.00 0.00 66.41 67.30 1w36 h THR 32 Cb 0.37 1.15 -0.08 0.00 -1.74 0.00 0.00 68.15 67.85 1w36 h THR 32 CO -0.22 0.09 -0.46 0.40 0.37 0.00 0.00 175.52 175.70 1w36 h ILE 33 N -0.43 0.00 -0.81 3.11 2.04 -0.73 -1.04 117.51 119.65 1w36 h ILE 33 Ca -0.02 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.91 1w36 h ILE 33 Cb 0.34 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.32 1w36 h ILE 33 CO 0.04 0.00 -0.48 0.00 0.00 0.00 0.00 178.15 177.71 1w36 n ALA 34 N -3.07 -0.52 -0.08 1.87 0.00 -0.96 -0.35 120.51 117.41 1w36 n ALA 34 Ca -0.01 0.69 -0.07 0.00 0.00 0.00 0.00 53.44 54.04 1w36 n ALA 34 Cb 0.25 -0.03 -0.05 0.00 0.00 0.00 0.00 19.45 19.63 1w36 n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w36 h ALA 35 N 0.23 -0.53 -0.86 0.00 0.00 -0.70 -0.10 119.26 117.31 1w36 h ALA 35 Ca 0.13 0.00 0.20 0.00 0.00 0.00 0.00 54.91 55.25 1w36 h ALA 35 Cb 0.33 0.94 -0.16 0.00 0.00 0.00 0.00 17.79 18.91 1w36 h ALA 35 CO -0.76 -0.67 -0.05 -0.07 0.00 0.00 0.00 179.25 177.71 1w36 h LEU 36 N -0.19 -0.51 -0.37 0.00 4.07 0.27 0.40 115.31 118.98 1w36 h LEU 36 Ca 0.04 0.24 0.08 0.00 0.08 0.00 0.00 57.88 58.32 1w36 h LEU 36 Cb 0.30 0.44 -0.07 0.00 1.08 0.00 0.00 40.66 42.40 1w36 h LEU 36 CO -0.32 -0.26 -0.13 0.22 -1.08 0.00 0.00 178.44 176.88 1w36 h TYR 37 N 0.05 -0.29 0.23 1.13 3.20 0.11 -0.64 116.97 120.75 1w36 h TYR 37 Ca 0.47 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.37 1w36 h TYR 37 Cb 0.86 0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.32 1w36 h TYR 37 CO -0.52 -0.20 -0.11 -0.07 -1.64 0.00 0.00 178.16 175.62 1w36 h LEU 38 N -0.05 -0.26 -0.64 2.82 3.38 0.10 -1.61 115.31 119.05 1w36 h LEU 38 Ca 0.18 -0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.17 1w36 h LEU 38 Cb 0.33 0.07 -0.10 0.00 0.09 0.00 0.00 40.66 41.04 1w36 h LEU 38 CO -0.41 -0.12 -0.54 0.03 0.09 0.00 0.00 178.44 177.50 1w36 h ARG 39 N -0.39 -0.22 -0.84 1.13 2.47 -0.27 -1.70 114.38 114.56 1w36 h ARG 39 Ca -0.03 0.02 0.11 0.00 -1.26 0.00 0.00 59.98 58.82 1w36 h ARG 39 Cb 0.30 0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 28.61 1w36 h ARG 39 CO 0.05 -0.15 0.54 -0.07 0.56 0.00 0.00 179.97 180.91 1w36 h LEU 40 N -0.23 0.66 -0.70 3.04 3.38 -0.70 -1.44 115.31 119.34 1w36 h LEU 40 Ca 0.13 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 1w36 h LEU 40 Cb 0.53 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1w36 h LEU 40 CO -0.73 0.38 0.19 -0.07 0.09 0.00 0.00 178.44 178.29 1w36 h LEU 41 N 0.73 1.04 -3.65 1.67 3.38 -0.37 -2.23 115.31 115.89 1w36 h LEU 41 Ca 0.40 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 1w36 h LEU 41 Cb 0.55 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1w36 h LEU 41 CO -0.17 1.00 0.13 0.18 0.09 0.00 0.00 178.44 179.67 1w36 n LEU 42 N -4.27 5.87 -2.53 1.67 4.77 -0.99 -3.68 117.00 117.85 1w36 n LEU 42 Ca 0.05 -3.09 -0.10 0.00 -0.03 0.00 0.00 56.01 52.85 1w36 n LEU 42 Cb 0.25 -0.71 -0.02 0.00 -2.33 0.00 0.00 43.42 40.61 1w36 n LEU 42 CO 0.42 0.72 -0.04 0.61 -1.33 0.00 0.00 177.39 177.78 1w36 n GLY 43 N 0.20 -0.35 1.80 -0.72 0.00 -0.61 -4.88 105.19 100.63 1w36 n GLY 43 Ca 0.34 0.02 -0.16 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.26 0.00 0.00 0.99 4.32 -0.80 -4.59 117.00 114.67 1w36 n LEU 44 Ca 0.03 -0.59 0.00 0.00 -0.02 0.00 0.00 56.01 55.43 1w36 n LEU 44 Cb 0.36 -0.52 0.00 0.00 -1.62 0.00 0.00 43.42 41.64 1w36 n LEU 44 CO 0.22 -1.67 0.00 0.61 -1.22 0.00 0.00 177.39 175.32 1w36 n GLY 45 N -1.47 0.45 0.00 -0.72 0.00 -1.26 -4.10 105.19 98.09 1w36 n GLY 45 Ca 0.08 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.32 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 0.57 0.01 -0.02 0.00 -1.26 -4.75 105.19 99.73 1w36 n GLY 46 Ca 0.00 0.25 0.11 0.00 0.00 0.00 0.00 46.02 46.38 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 0.64 -1.14 1.61 3.41 -1.26 -3.28 113.62 113.60 1w36 n SER 47 Ca 0.00 -0.38 0.11 0.00 -0.26 0.00 0.00 58.87 58.34 1w36 n SER 47 Cb 0.00 0.51 0.27 0.00 -0.26 0.00 0.00 64.21 64.72 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 -1.58 2.42 -1.99 7.33 0.00 -1.26 -4.94 120.51 120.49 1w36 n ALA 48 Ca 0.04 -1.03 -0.24 0.00 0.00 0.00 0.00 53.44 52.21 1w36 n ALA 48 Cb 0.36 -0.93 0.05 0.00 0.00 0.00 0.00 19.45 18.93 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 -1.35 3.43 0.13 0.00 0.00 -1.20 -1.17 121.76 121.59 1w36 s ALA 49 Ca 0.41 -1.01 -0.14 0.00 0.00 0.00 0.00 51.96 51.21 1w36 s ALA 49 Cb 0.23 -2.42 -0.07 0.00 0.00 0.00 0.00 23.12 20.85 1w36 s ALA 49 CO 0.31 -1.01 0.53 0.12 0.00 0.00 0.00 175.76 175.71 1w36 s PHE 50 N -3.03 3.62 0.20 0.00 5.36 -1.26 -4.54 117.98 118.33 1w36 s PHE 50 Ca 0.58 1.04 -0.07 0.00 -0.96 0.00 0.00 56.93 57.52 1w36 s PHE 50 Cb -0.11 -2.35 0.30 0.00 -0.34 0.00 0.00 43.02 40.52 1w36 s PHE 50 CO 0.43 0.46 1.13 -2.30 -1.46 0.00 0.00 175.22 173.47 1w36 n PRO 51 N 0.91 -0.09 -4.32 10.12 -0.01 -1.26 -4.67 135.00 135.68 1w36 n PRO 51 Ca -0.06 1.13 -0.17 0.00 -0.01 0.00 0.00 63.50 64.39 1w36 n PRO 51 Cb 0.52 -1.68 -0.10 0.00 -0.01 0.00 0.00 33.50 32.23 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 -5.86 1.35 0.03 -0.52 1.70 -1.26 -5.12 118.95 109.26 1w36 s ARG 52 Ca -0.11 -1.70 -0.25 0.00 -0.47 0.00 0.00 55.73 53.21 1w36 s ARG 52 Cb 0.19 -0.47 -0.05 0.00 -0.57 0.00 0.00 34.95 34.04 1w36 s ARG 52 CO 0.55 -0.17 0.75 -1.25 -1.08 0.00 0.00 175.30 174.11 1w36 s PRO 53 N -3.92 4.48 0.42 3.89 0.04 -1.26 -4.57 135.00 134.08 1w36 s PRO 53 Ca 0.31 1.04 0.08 0.00 0.04 0.00 0.00 61.00 62.46 1w36 s PRO 53 Cb 0.07 -3.37 0.01 0.00 0.04 0.00 0.00 34.50 31.25 1w36 s PRO 53 CO 0.10 0.27 0.58 -0.51 0.04 0.00 0.00 177.00 177.47 1w36 s LEU 54 N 0.01 3.65 0.38 -3.56 1.43 -0.86 -4.92 118.68 114.81 1w36 s LEU 54 Ca 0.38 -0.40 0.08 0.00 -1.03 0.00 0.00 54.13 53.16 1w36 s LEU 54 Cb -0.20 -2.67 -0.03 0.00 0.03 0.00 0.00 46.19 43.32 1w36 s LEU 54 CO 0.22 -0.77 0.31 -0.89 0.23 0.00 0.00 176.35 175.45 1w36 s THR 55 N -2.36 3.03 0.21 5.49 2.01 -1.26 -4.45 115.64 118.31 1w36 s THR 55 Ca 0.55 -1.41 -0.09 0.00 0.31 0.00 0.00 61.69 61.06 1w36 s THR 55 Cb -0.10 -3.07 0.15 0.00 0.01 0.00 0.00 72.50 69.49 1w36 s THR 55 CO 0.33 -0.09 1.78 0.58 -0.69 0.00 0.00 174.62 176.54 1w36 h VAL 56 N 1.19 0.88 0.00 3.82 2.07 -1.96 -0.18 116.25 122.07 1w36 h VAL 56 Ca -0.43 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1w36 h VAL 56 Cb 1.26 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 1w36 h VAL 56 CO 0.59 0.11 0.00 -0.62 0.02 0.00 0.00 177.57 177.66 1w36 n GLU 57 N -4.87 0.78 0.00 1.57 4.71 -1.26 -2.85 120.64 118.72 1w36 n GLU 57 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.24 1w36 n GLU 57 Cb 0.23 -1.20 0.00 0.00 -1.01 0.00 0.00 31.44 29.45 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 -0.18 3.56 -2.84 3.49 1.02 -0.11 -4.81 120.64 120.78 1w36 n GLU 58 Ca 0.00 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.71 1w36 n GLU 58 Cb 0.10 -0.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.99 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 -1.46 4.40 -0.09 -4.62 1.43 -1.02 -3.97 118.68 113.35 1w36 s LEU 59 Ca 0.00 -1.20 -0.30 0.00 -1.03 0.00 0.00 54.13 51.61 1w36 s LEU 59 Cb 0.00 -2.43 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 1w36 s LEU 59 CO 0.00 -1.39 1.09 -0.22 0.23 0.00 0.00 176.35 176.06 1w36 s LEU 60 N 3.94 4.25 -0.11 1.79 0.20 -0.69 -4.29 118.68 123.77 1w36 s LEU 60 Ca 0.26 1.65 -0.01 0.00 0.69 0.00 0.00 54.13 56.72 1w36 s LEU 60 Cb -0.13 -3.56 0.03 0.00 -0.43 0.00 0.00 46.19 42.10 1w36 s LEU 60 CO 0.05 -0.51 -0.05 -0.69 -0.29 0.00 0.00 176.35 174.86 1w36 s VAL 61 N 2.15 0.86 -0.10 1.68 1.01 -0.74 0.13 120.40 125.39 1w36 s VAL 61 Ca 0.51 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 1w36 s VAL 61 Cb -0.21 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 1w36 s VAL 61 CO 0.19 0.29 -0.03 0.68 0.00 0.00 0.00 175.10 176.22 1w36 s VAL 62 N 1.77 3.99 0.36 2.92 -7.23 0.09 -1.77 120.40 120.53 1w36 s VAL 62 Ca 0.04 -0.36 0.04 0.00 -1.81 0.00 0.00 61.98 59.89 1w36 s VAL 62 Cb -0.13 -2.68 -0.06 0.00 0.56 0.00 0.00 36.38 34.07 1w36 s VAL 62 CO -0.07 0.58 0.05 -0.89 -0.31 0.00 0.00 175.10 174.45 1w36 s THR 63 N -0.56 1.29 -0.15 5.32 2.01 -0.09 -1.49 115.64 121.97 1w36 s THR 63 Ca 0.09 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.09 1w36 s THR 63 Cb -0.12 -2.75 -0.23 0.00 0.01 0.00 0.00 72.50 69.41 1w36 s THR 63 CO 0.02 0.00 0.22 0.33 -0.69 0.00 0.00 174.62 174.50 1w36 n PHE 64 N -0.80 0.79 -3.15 4.92 7.35 -1.26 -2.57 117.46 122.74 1w36 n PHE 64 Ca -0.04 0.19 -0.29 0.00 -0.76 0.00 0.00 57.45 56.55 1w36 n PHE 64 Cb 0.67 -1.11 -0.03 0.00 0.35 0.00 0.00 39.48 39.35 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 -2.55 4.94 0.16 -2.13 2.01 -1.26 -4.75 115.64 112.07 1w36 s THR 65 Ca -0.22 0.23 -0.03 0.00 0.31 0.00 0.00 61.69 61.98 1w36 s THR 65 Cb 0.07 -3.74 -0.12 0.00 0.01 0.00 0.00 72.50 68.72 1w36 s THR 65 CO 0.74 -0.42 1.40 -0.08 -0.69 0.00 0.00 174.62 175.57 1w36 h GLU 66 N 1.44 0.43 0.00 4.92 4.57 -2.00 -2.48 114.58 121.46 1w36 h GLU 66 Ca -0.48 -0.37 -0.07 0.00 -1.18 0.00 0.00 59.36 57.26 1w36 h GLU 66 Cb 1.19 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.85 1w36 h GLU 66 CO 0.65 1.01 -0.34 0.00 -1.18 0.00 0.00 179.01 179.16 1w36 h ALA 67 N 0.87 1.09 0.13 2.92 0.00 -2.00 -2.81 119.26 119.47 1w36 h ALA 67 Ca -0.04 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1w36 h ALA 67 Cb 1.36 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1w36 h ALA 67 CO 0.13 0.42 -0.06 0.00 0.00 0.00 0.00 179.25 179.74 1w36 h ALA 68 N 1.66 -0.17 -0.46 0.00 0.00 -1.84 -2.24 119.26 116.21 1w36 h ALA 68 Ca -0.00 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.73 1w36 h ALA 68 Cb 0.78 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1w36 h ALA 68 CO 0.04 -0.33 0.18 1.79 0.00 0.00 0.00 179.25 180.94 1w36 h THR 69 N -0.70 0.88 0.20 0.00 1.35 -1.47 0.15 112.91 113.32 1w36 h THR 69 Ca -0.02 -0.13 0.01 0.00 -0.55 0.00 0.00 66.41 65.73 1w36 h THR 69 Cb 0.52 0.48 -0.04 0.00 -1.73 0.00 0.00 68.15 67.38 1w36 h THR 69 CO 0.03 0.07 -0.46 0.00 -0.25 0.00 0.00 175.52 174.90 1w36 h ALA 70 N 1.29 -0.89 0.18 6.62 0.00 -1.50 0.47 119.26 125.43 1w36 h ALA 70 Ca 0.21 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1w36 h ALA 70 Cb 0.19 0.76 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 1w36 h ALA 70 CO -0.20 -1.06 -0.49 1.49 0.00 0.00 0.00 179.25 178.99 1w36 h GLU 71 N -0.75 -0.71 -0.77 0.00 4.81 -0.90 0.19 114.58 116.44 1w36 h GLU 71 Ca -0.00 0.05 0.15 0.00 -0.13 0.00 0.00 59.36 59.42 1w36 h GLU 71 Cb 0.74 0.16 -0.14 0.00 0.63 0.00 0.00 28.75 30.14 1w36 h GLU 71 CO -0.22 -0.48 -0.26 1.25 -0.73 0.00 0.00 179.01 178.58 1w36 h LEU 72 N -0.74 -0.93 -0.98 1.64 7.12 -0.40 0.50 115.31 121.51 1w36 h LEU 72 Ca -0.02 0.25 0.00 0.00 0.13 0.00 0.00 57.88 58.24 1w36 h LEU 72 Cb 0.72 0.55 -0.05 0.00 -0.53 0.00 0.00 40.66 41.35 1w36 h LEU 72 CO -0.23 -0.28 0.62 0.03 -0.13 0.00 0.00 178.44 178.45 1w36 h ARG 73 N -0.04 1.31 -0.53 1.25 3.08 0.66 -0.28 114.38 119.83 1w36 h ARG 73 Ca 0.34 -0.10 -0.10 0.00 0.07 0.00 0.00 59.98 60.19 1w36 h ARG 73 Cb 0.58 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1w36 h ARG 73 CO -0.81 0.89 -0.06 0.78 -1.07 0.00 0.00 179.97 179.71 1w36 h GLY 74 N 1.34 1.05 1.11 0.04 0.00 0.26 -2.29 103.07 104.58 1w36 h GLY 74 Ca 0.35 -0.82 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 1w36 h GLY 74 CO -0.07 0.75 0.09 -0.09 0.00 0.00 0.00 176.54 177.22 1w36 h ARG 75 N 0.84 1.08 -0.18 4.80 9.65 0.37 -3.13 114.38 127.81 1w36 h ARG 75 Ca 0.14 -0.29 -0.21 0.00 -1.10 0.00 0.00 59.98 58.52 1w36 h ARG 75 Cb 0.61 -0.12 0.01 0.00 -1.39 0.00 0.00 29.97 29.07 1w36 h ARG 75 CO 0.04 1.00 -0.70 0.82 2.80 0.00 0.00 179.97 183.92 1w36 h ILE 76 N 1.01 1.28 0.00 1.20 2.04 -0.99 -2.44 117.51 119.61 1w36 h ILE 76 Ca 0.20 -1.90 0.00 0.00 1.00 0.00 0.00 64.86 64.15 1w36 h ILE 76 Cb 0.45 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 38.46 1w36 h ILE 76 CO 0.02 0.61 0.01 -0.09 0.00 0.00 0.00 178.15 178.69 1w36 h ARG 77 N 0.53 0.00 0.01 2.37 2.43 -1.39 -1.94 114.38 116.39 1w36 h ARG 77 Ca -0.04 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 58.95 1w36 h ARG 77 Cb 1.33 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.86 1w36 h ARG 77 CO 0.15 0.00 -0.96 1.03 -1.51 0.00 0.00 179.97 178.68 1w36 h SER 78 N 0.00 0.04 -1.00 -3.80 0.87 -1.44 -3.02 113.55 105.20 1w36 h SER 78 Ca 0.00 -0.67 0.03 0.00 -1.23 0.00 0.00 61.79 59.92 1w36 h SER 78 Cb 0.02 -0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 61.91 1w36 h SER 78 CO 0.00 1.38 0.66 0.78 -0.53 0.00 0.00 176.83 179.12 1w36 h ASN 79 N -0.92 1.11 0.05 6.23 2.35 -0.95 -0.26 115.58 123.19 1w36 h ASN 79 Ca -0.26 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1w36 h ASN 79 Cb 1.28 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 39.39 1w36 h ASN 79 CO -0.13 0.76 -0.05 0.40 -1.65 0.00 0.00 177.43 176.77 1w36 h ILE 80 N 1.29 0.00 -1.42 2.81 2.04 -1.52 0.45 117.51 121.15 1w36 h ILE 80 Ca 0.39 0.00 0.46 0.00 1.00 0.00 0.00 64.86 66.72 1w36 h ILE 80 Cb -0.02 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 35.94 1w36 h ILE 80 CO -0.12 0.00 0.95 1.57 0.00 0.00 0.00 178.15 180.55 1w36 n HIS 81 N -2.53 0.48 -0.08 1.37 -0.00 -1.02 0.43 115.22 113.87 1w36 n HIS 81 Ca -0.01 0.48 -0.12 0.00 0.46 0.00 0.00 57.72 58.53 1w36 n HIS 81 Cb 0.04 -0.92 -0.07 0.00 -0.12 0.00 0.00 29.99 28.92 1w36 n HIS 81 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 1w36 h GLU 82 N 0.00 0.00 -0.79 1.57 5.08 -0.50 -2.81 114.58 117.13 1w36 h GLU 82 Ca 0.83 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 59.40 1w36 h GLU 82 Cb 2.84 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 32.05 1w36 h GLU 82 CO -0.32 0.58 0.56 1.25 -1.00 0.00 0.00 179.01 180.07 1w36 h LEU 83 N -1.00 0.13 -0.15 1.33 6.46 0.12 0.15 115.31 122.36 1w36 h LEU 83 Ca -0.13 0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.60 1w36 h LEU 83 Cb 0.82 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.74 1w36 h LEU 83 CO -0.08 0.06 -0.08 -0.09 -0.62 0.00 0.00 178.44 177.63 1w36 h ARG 84 N 0.14 0.31 0.06 1.25 2.43 -0.11 -2.84 114.38 115.61 1w36 h ARG 84 Ca 0.39 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1w36 h ARG 84 Cb 1.33 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.87 1w36 h ARG 84 CO -0.06 0.64 -0.03 0.82 -1.51 0.00 0.00 179.97 179.84 1w36 h ILE 85 N -0.03 1.00 0.00 1.20 2.04 -0.53 -0.61 117.51 120.58 1w36 h ILE 85 Ca 0.03 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1w36 h ILE 85 Cb 0.55 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 1w36 h ILE 85 CO 0.02 0.05 0.00 0.00 0.00 0.00 0.00 178.15 178.22 1w36 n ALA 86 N -2.17 1.30 -0.02 1.87 0.00 -0.02 0.77 120.51 122.24 1w36 n ALA 86 Ca -0.08 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.39 1w36 n ALA 86 Cb 0.10 -0.87 -0.09 0.00 0.00 0.00 0.00 19.45 18.58 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 0.63 -0.61 0.00 3.38 0.70 -3.27 115.31 116.14 1w36 h LEU 88 Ca -0.10 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 56.95 1w36 h LEU 88 Cb 0.92 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1w36 h LEU 88 CO 0.01 1.60 0.00 0.03 0.09 0.00 0.00 178.44 180.17 1w36 h ARG 89 N -0.10 0.00 -0.20 1.13 3.08 -1.55 -3.47 114.38 113.27 1w36 h ARG 89 Ca -0.24 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.75 1w36 h ARG 89 Cb 1.93 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.95 1w36 h ARG 89 CO 0.19 0.00 -0.06 0.39 -1.07 0.00 0.00 179.97 179.42 1w36 n GLU 90 N -2.55 -1.89 -3.84 0.04 1.02 -1.17 -4.90 120.64 107.34 1w36 n GLU 90 Ca 0.03 0.54 -0.12 0.00 -0.02 0.00 0.00 57.16 57.58 1w36 n GLU 90 Cb 0.34 -4.76 -0.13 0.00 -0.02 0.00 0.00 31.44 26.87 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 -1.14 -0.00 -0.03 2.62 -4.23 -1.22 -5.00 115.64 106.63 1w36 s THR 91 Ca 0.00 0.01 -0.01 0.00 -1.18 0.00 0.00 61.69 60.51 1w36 s THR 91 Cb 0.00 -0.13 0.03 0.00 1.34 0.00 0.00 72.50 73.74 1w36 s THR 91 CO 0.00 0.01 0.07 -0.89 -0.54 0.00 0.00 174.62 173.26 1w36 s THR 92 N 0.12 -0.04 -0.63 3.99 2.01 -1.26 -4.71 115.64 115.12 1w36 s THR 92 Ca -0.01 0.15 0.06 0.00 0.31 0.00 0.00 61.69 62.20 1w36 s THR 92 Cb -0.01 -0.12 0.26 0.00 0.01 0.00 0.00 72.50 72.64 1w36 s THR 92 CO -0.00 0.06 0.77 0.47 -0.69 0.00 0.00 174.62 175.23 1w36 n ASP 93 N 3.89 3.84 -3.35 3.53 8.00 -1.26 -4.70 116.55 126.50 1w36 n ASP 93 Ca -0.23 -3.47 0.02 0.00 0.71 0.00 0.00 54.79 51.81 1w36 n ASP 93 Cb 0.53 -0.66 -0.04 0.00 -0.02 0.00 0.00 41.12 40.94 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 -2.60 -0.50 0.00 -2.24 -0.87 -1.26 -5.13 114.94 102.34 1w36 s ASN 94 Ca 0.41 0.65 0.00 0.00 -1.57 0.00 0.00 52.86 52.35 1w36 s ASN 94 Cb 0.17 1.56 0.00 0.00 -0.02 0.00 0.00 41.25 42.95 1w36 s ASN 94 CO -0.03 -0.10 0.00 -2.65 -2.57 0.00 0.00 177.10 171.76 1w36 n PRO 95 N 4.96 0.00 -0.08 -0.60 -0.02 -1.26 -3.37 135.00 134.62 1w36 n PRO 95 Ca -0.08 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.37 1w36 n PRO 95 Cb 0.53 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.99 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 -0.21 -0.20 2.45 0.00 -1.26 -0.28 117.00 117.50 1w36 n LEU 96 Ca 0.00 0.58 0.23 0.00 0.00 0.00 0.00 56.01 56.82 1w36 n LEU 96 Cb 0.00 -0.16 0.61 0.00 0.00 0.00 0.00 43.42 43.87 1w36 n LEU 96 CO 0.00 -0.40 1.24 1.88 0.00 0.00 0.00 177.39 180.11 1w36 h TYR 97 N 0.00 0.28 0.42 1.96 -1.99 -1.98 -1.48 116.97 114.18 1w36 h TYR 97 Ca 0.03 0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 1w36 h TYR 97 Cb 0.08 -0.09 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1w36 h TYR 97 CO -0.42 0.07 -0.20 1.49 -0.00 0.00 0.00 178.16 179.10 1w36 h GLU 98 N 0.21 -0.55 -0.90 4.88 4.81 -0.65 0.15 114.58 122.53 1w36 h GLU 98 Ca 0.44 0.04 0.15 0.00 -0.13 0.00 0.00 59.36 59.86 1w36 h GLU 98 Cb 1.41 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 30.84 1w36 h GLU 98 CO -0.10 -0.24 0.58 -0.09 -0.73 0.00 0.00 179.01 178.43 1w36 h ARG 99 N -0.90 0.69 -0.14 1.92 2.43 -1.34 0.10 114.38 117.15 1w36 h ARG 99 Ca -0.06 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.05 1w36 h ARG 99 Cb 0.56 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1w36 h ARG 99 CO 0.10 0.45 -0.00 -0.07 -1.51 0.00 0.00 179.97 178.94 1w36 h LEU 100 N 0.71 0.24 -0.79 3.80 3.38 -1.21 -2.70 115.31 118.73 1w36 h LEU 100 Ca 0.46 -0.32 0.13 0.00 0.09 0.00 0.00 57.88 58.24 1w36 h LEU 100 Cb 0.73 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 41.32 1w36 h LEU 100 CO -0.22 0.50 0.38 -0.07 0.09 0.00 0.00 178.44 179.12 1w36 h LEU 101 N -0.03 0.45 -1.29 1.67 3.38 0.16 0.19 115.31 119.84 1w36 h LEU 101 Ca 0.04 0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.20 1w36 h LEU 101 Cb 0.38 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.09 1w36 h LEU 101 CO 0.01 0.20 0.54 -0.33 0.09 0.00 0.00 178.44 178.95 1w36 h GLU 102 N 0.57 0.76 0.00 1.13 5.08 -0.74 -1.55 114.58 119.83 1w36 h GLU 102 Ca 0.42 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.62 1w36 h GLU 102 Cb 0.58 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1w36 h GLU 102 CO -0.35 0.50 -0.55 1.49 -1.00 0.00 0.00 179.01 179.10 1w36 h GLU 103 N 0.78 0.00 -7.15 2.33 4.57 -0.35 -3.46 114.58 111.31 1w36 h GLU 103 Ca 0.39 0.00 -0.52 0.00 -1.18 0.00 0.00 59.36 58.05 1w36 h GLU 103 Cb 0.44 0.00 0.12 0.00 -0.16 0.00 0.00 28.75 29.15 1w36 h GLU 103 CO -0.16 0.55 0.42 0.42 -1.18 0.00 0.00 179.01 179.06 1w36 s ILE 104 N -3.20 2.79 -0.14 2.32 1.01 -0.55 -4.88 121.20 118.55 1w36 s ILE 104 Ca 0.02 0.43 0.03 0.00 0.00 0.00 0.00 60.65 61.12 1w36 s ILE 104 Cb 0.10 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.50 1w36 s ILE 104 CO 0.74 -0.17 0.14 0.47 0.00 0.00 0.00 174.94 176.12 1w36 n ASP 105 N -2.08 0.18 -2.81 3.58 9.92 -1.26 -4.86 116.55 119.22 1w36 n ASP 105 Ca 0.12 -0.59 -0.10 0.00 -0.53 0.00 0.00 54.79 53.69 1w36 n ASP 105 Cb 0.51 0.96 0.04 0.00 -0.64 0.00 0.00 41.12 41.98 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 -1.01 -2.36 -0.22 -2.24 -0.08 -1.26 -5.01 116.55 104.36 1w36 n ASP 106 Ca 0.01 -3.29 0.19 0.00 -1.51 0.00 0.00 54.79 50.18 1w36 n ASP 106 Cb 0.04 1.50 0.35 0.00 2.34 0.00 0.00 41.12 45.35 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 1.39 -0.04 -0.30 -0.67 4.01 -1.26 0.18 118.16 121.46 1w36 n LYS 107 Ca 0.10 0.95 0.03 0.00 -0.51 0.00 0.00 58.31 58.88 1w36 n LYS 107 Cb 0.63 -1.65 0.23 0.00 -0.51 0.00 0.00 35.03 33.72 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 1.34 1.48 0.03 7.82 0.00 -1.96 -1.69 119.26 126.28 1w36 h ALA 108 Ca 0.53 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.32 1w36 h ALA 108 Cb 1.36 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.87 1w36 h ALA 108 CO -0.54 0.40 -0.36 0.37 0.00 0.00 0.00 179.25 179.12 1w36 h GLN 109 N 1.07 0.20 -0.33 0.00 4.15 0.15 -3.28 115.11 117.06 1w36 h GLN 109 Ca 0.38 -0.25 0.05 0.00 0.77 0.00 0.00 58.65 59.61 1w36 h GLN 109 Cb 0.13 0.08 -0.08 0.00 0.21 0.00 0.00 27.48 27.82 1w36 h GLN 109 CO -0.13 1.02 -0.48 0.00 -1.93 0.00 0.00 178.83 177.31 1w36 h ALA 110 N 0.19 -0.62 0.00 3.38 0.00 -1.22 0.38 119.26 121.38 1w36 h ALA 110 Ca -0.05 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1w36 h ALA 110 Cb 1.17 0.96 0.00 0.00 0.00 0.00 0.00 17.79 19.92 1w36 h ALA 110 CO 0.07 -0.96 0.67 0.00 0.00 0.00 0.00 179.25 179.03 1w36 h ALA 111 N 0.15 1.65 0.02 0.00 0.00 -1.38 0.50 119.26 120.18 1w36 h ALA 111 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.62 1w36 h ALA 111 Cb 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 1w36 h ALA 111 CO -0.54 -0.65 -2.40 0.94 0.00 0.00 0.00 179.25 176.60 1w36 n GLN 112 N -2.59 0.66 0.12 0.00 -0.06 0.12 -2.68 117.38 112.95 1w36 n GLN 112 Ca -0.01 0.18 -0.13 0.00 -2.00 0.00 0.00 57.00 55.04 1w36 n GLN 112 Cb 0.69 -1.55 -0.07 0.00 -4.06 0.00 0.00 30.24 25.25 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 -0.07 -0.25 -0.05 3.69 6.55 0.15 -1.85 115.95 124.12 1w36 h TRP 113 Ca -0.56 -0.00 0.04 0.00 0.95 0.00 0.00 58.89 59.31 1w36 h TRP 113 Cb 1.89 0.09 -0.05 0.00 -0.86 0.00 0.00 29.16 30.23 1w36 h TRP 113 CO 0.03 -0.15 -0.30 -0.07 -1.05 0.00 0.00 178.44 176.89 1w36 h LEU 114 N -0.25 -0.91 -1.71 -4.49 3.38 -0.41 -0.65 115.31 110.28 1w36 h LEU 114 Ca -0.02 0.13 0.29 0.00 0.09 0.00 0.00 57.88 58.37 1w36 h LEU 114 Cb 0.21 0.37 -0.07 0.00 0.09 0.00 0.00 40.66 41.27 1w36 h LEU 114 CO 0.02 -0.36 0.72 0.25 0.09 0.00 0.00 178.44 179.16 1w36 h LEU 115 N -0.42 0.21 -0.06 1.67 5.85 -1.28 0.20 115.31 121.48 1w36 h LEU 115 Ca 0.07 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 1w36 h LEU 115 Cb 0.53 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1w36 h LEU 115 CO -0.28 0.05 -0.12 -0.07 -0.34 0.00 0.00 178.44 177.67 1w36 h LEU 116 N 0.19 0.21 -0.85 2.25 3.38 -0.30 -2.68 115.31 117.50 1w36 h LEU 116 Ca 0.54 -0.56 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1w36 h LEU 116 Cb 1.77 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 42.40 1w36 h LEU 116 CO -0.13 0.73 0.53 0.00 0.09 0.00 0.00 178.44 179.66 1w36 h ALA 117 N 0.48 1.16 -0.44 1.53 0.00 0.26 -0.77 119.26 121.47 1w36 h ALA 117 Ca 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1w36 h ALA 117 Cb 0.70 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1w36 h ALA 117 CO 0.03 0.30 0.26 1.49 0.00 0.00 0.00 179.25 181.32 1w36 h GLU 118 N 0.99 0.50 0.00 0.00 4.81 -0.86 -1.08 114.58 118.93 1w36 h GLU 118 Ca 0.36 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.51 1w36 h GLU 118 Cb 0.13 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1w36 h GLU 118 CO -0.16 0.33 -0.26 0.00 -0.73 0.00 0.00 179.01 178.19 1w36 h ARG 119 N 0.51 0.00 0.00 1.92 3.08 -0.84 -3.03 114.38 116.02 1w36 h ARG 119 Ca 0.18 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.02 1w36 h ARG 119 Cb 0.03 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 1w36 h ARG 119 CO -0.09 0.26 -1.00 1.96 -1.07 0.00 0.00 179.97 180.03 1w36 h GLN 120 N 0.00 0.00 -0.94 0.04 1.08 -0.47 -3.39 115.11 111.42 1w36 h GLN 120 Ca -0.00 0.00 0.28 0.00 -1.45 0.00 0.00 58.65 57.48 1w36 h GLN 120 Cb 0.50 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.88 1w36 h GLN 120 CO 0.03 0.97 0.66 -1.33 -0.95 0.00 0.00 178.83 178.22 1w36 n MET 121 N -3.34 -0.01 0.00 1.46 2.81 -0.48 -0.41 117.12 117.16 1w36 n MET 121 Ca -0.00 0.58 0.00 0.00 -1.81 0.00 0.00 57.70 56.47 1w36 n MET 121 Cb 0.94 -1.29 0.00 0.00 -0.71 0.00 0.00 33.22 32.16 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 -3.18 0.07 -0.42 7.83 3.85 -1.26 -1.66 116.55 121.77 1w36 n ASP 122 Ca 0.22 -0.50 0.00 0.00 -0.71 0.00 0.00 54.79 53.81 1w36 n ASP 122 Cb 0.98 -0.03 0.00 0.00 -1.35 0.00 0.00 41.12 40.72 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 -0.27 0.00 -1.66 0.11 1.02 0.45 -5.10 120.64 115.20 1w36 n GLU 123 Ca 0.00 -0.35 -0.42 0.00 -0.02 0.00 0.00 57.16 56.37 1w36 n GLU 123 Cb 0.02 -0.19 0.00 0.00 -0.02 0.00 0.00 31.44 31.25 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 0.00 0.73 -1.06 0.62 0.00 -0.67 -4.57 120.51 115.56 1w36 n ALA 124 Ca 0.00 0.30 -0.27 0.00 0.00 0.00 0.00 53.44 53.47 1w36 n ALA 124 Cb 0.56 -2.17 -0.06 0.00 0.00 0.00 0.00 19.45 17.78 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 -0.08 6.44 -3.33 0.00 0.00 -1.13 -4.75 120.51 117.66 1w36 n ALA 125 Ca 0.07 -2.63 -0.38 0.00 0.00 0.00 0.00 53.44 50.51 1w36 n ALA 125 Cb 0.37 -2.97 -0.12 0.00 0.00 0.00 0.00 19.45 16.73 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 2.12 3.70 0.33 0.00 1.01 -1.26 -1.78 120.40 124.51 1w36 s VAL 126 Ca 0.61 -1.26 0.03 0.00 0.00 0.00 0.00 61.98 61.35 1w36 s VAL 126 Cb 0.20 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1w36 s VAL 126 CO -0.04 -0.25 0.11 -0.36 0.00 0.00 0.00 175.10 174.56 1w36 s PHE 127 N 1.37 1.75 0.51 5.22 0.08 -0.73 -5.00 117.98 121.17 1w36 s PHE 127 Ca -0.01 -1.18 0.01 0.00 0.12 0.00 0.00 56.93 55.88 1w36 s PHE 127 Cb -0.20 -1.08 0.02 0.00 -0.57 0.00 0.00 43.02 41.19 1w36 s PHE 127 CO 0.02 -0.26 0.72 0.95 -0.10 0.00 0.00 175.22 176.55 1w36 s THR 128 N -3.44 3.17 0.39 0.64 -4.23 -1.26 -0.91 115.64 110.00 1w36 s THR 128 Ca 0.33 -0.63 0.09 0.00 -1.18 0.00 0.00 61.69 60.30 1w36 s THR 128 Cb 0.06 -3.17 0.30 0.00 1.34 0.00 0.00 72.50 71.03 1w36 s THR 128 CO 0.15 -0.12 1.97 0.40 -0.54 0.00 0.00 174.62 176.49 1w36 h ILE 129 N 0.23 0.98 -0.02 2.99 1.08 -1.79 0.21 117.51 121.18 1w36 h ILE 129 Ca -0.43 -0.21 -0.23 0.00 -0.39 0.00 0.00 64.86 63.59 1w36 h ILE 129 Cb 1.28 0.31 0.01 0.00 -3.07 0.00 0.00 36.82 35.34 1w36 h ILE 129 CO 0.54 0.11 -0.92 0.45 -0.69 0.00 0.00 178.15 177.64 1w36 h HIS 130 N 0.62 0.74 -0.26 1.37 3.86 -1.92 -2.19 115.15 117.38 1w36 h HIS 130 Ca 0.29 -0.39 -0.02 0.00 -1.16 0.00 0.00 60.37 59.09 1w36 h HIS 130 Cb 0.33 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 1w36 h HIS 130 CO -0.00 1.20 0.07 0.78 0.86 0.00 0.00 177.93 180.84 1w36 h GLY 131 N 1.00 0.44 1.03 2.45 0.00 -1.55 -1.20 103.07 105.23 1w36 h GLY 131 Ca -0.08 -0.27 0.06 0.00 0.00 0.00 0.00 47.33 47.04 1w36 h GLY 131 CO 0.17 0.25 0.49 -2.75 0.00 0.00 0.00 176.54 174.70 1w36 h PHE 132 N 0.25 0.80 -0.06 5.60 3.04 -0.62 -2.61 116.94 123.33 1w36 h PHE 132 Ca 0.08 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.02 1w36 h PHE 132 Cb 0.27 -0.26 -0.00 0.00 2.56 0.00 0.00 35.95 38.51 1w36 h PHE 132 CO 0.01 0.42 -0.08 0.00 -2.02 0.00 0.00 178.31 176.65 1w36 h GLN 134 N -0.31 0.00 0.08 0.00 3.07 -1.14 0.54 115.11 117.36 1w36 h GLN 134 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.74 1w36 h GLN 134 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.17 1w36 h GLN 134 CO 0.02 0.00 -0.04 -0.09 0.09 0.00 0.00 178.83 178.81 1w36 h ARG 135 N 0.00 -0.11 -0.84 0.06 2.43 -1.43 -0.99 114.38 113.51 1w36 h ARG 135 Ca 0.00 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.24 1w36 h ARG 135 Cb 0.35 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.87 1w36 h ARG 135 CO 0.00 0.30 0.55 0.52 -1.51 0.00 0.00 179.97 179.83 1w36 h MET 136 N -0.97 0.93 0.13 0.20 2.86 -1.24 -2.15 114.93 114.69 1w36 h MET 136 Ca -0.01 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1w36 h MET 136 Cb 0.45 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1w36 h MET 136 CO 0.02 0.61 -0.07 -0.07 1.06 0.00 0.00 176.91 178.46 1w36 h LEU 137 N 0.95 -0.18 -1.44 1.22 4.07 -0.92 -3.04 115.31 115.98 1w36 h LEU 137 Ca 0.36 0.01 0.32 0.00 0.08 0.00 0.00 57.88 58.65 1w36 h LEU 137 Cb 0.18 0.05 -0.10 0.00 1.08 0.00 0.00 40.66 41.88 1w36 h LEU 137 CO -0.13 -0.11 0.74 0.78 -1.08 0.00 0.00 178.44 178.64 1w36 h ASN 138 N -0.18 0.34 0.32 -0.43 4.21 -1.04 -1.77 115.58 117.04 1w36 h ASN 138 Ca -0.02 0.09 -0.02 0.00 1.21 0.00 0.00 56.30 57.57 1w36 h ASN 138 Cb 0.15 0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.39 1w36 h ASN 138 CO 0.02 0.00 -0.16 0.25 -1.29 0.00 0.00 177.43 176.26 1w36 h LEU 139 N 0.27 -0.37 -4.52 1.61 5.85 -1.41 -3.23 115.31 113.51 1w36 h LEU 139 Ca 0.65 -0.18 -0.57 0.00 0.84 0.00 0.00 57.88 58.63 1w36 h LEU 139 Cb 1.88 0.10 -0.21 0.00 0.37 0.00 0.00 40.66 42.80 1w36 h LEU 139 CO -0.30 0.05 0.62 0.59 -0.34 0.00 0.00 178.44 179.06 1w36 n ASN 140 N -5.11 6.86 -0.12 1.25 3.02 -0.84 -4.74 115.26 115.59 1w36 n ASN 140 Ca -0.09 -3.41 0.27 0.00 -0.03 0.00 0.00 54.58 51.31 1w36 n ASN 140 Cb 0.27 -1.15 0.72 0.00 -0.61 0.00 0.00 39.78 39.01 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 2.77 2.69 -0.10 5.41 0.00 -1.36 -1.59 119.26 127.09 1w36 h ALA 141 Ca 0.45 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 55.16 1w36 h ALA 141 Cb 0.55 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1w36 h ALA 141 CO 1.08 -1.03 -0.66 0.74 0.00 0.00 0.00 179.25 179.38 1w36 h PHE 142 N 0.00 0.52 -0.00 0.00 0.05 -1.87 0.19 116.94 115.82 1w36 h PHE 142 Ca 0.38 -0.21 -0.01 0.00 3.82 0.00 0.00 57.97 61.94 1w36 h PHE 142 Cb 1.61 -0.09 0.00 0.00 2.00 0.00 0.00 35.95 39.47 1w36 h PHE 142 CO 0.00 0.94 -0.05 0.93 -0.18 0.00 0.00 178.31 179.95 1w36 h GLU 143 N 0.28 0.04 0.00 1.51 3.07 -1.66 -3.31 114.58 114.50 1w36 h GLU 143 Ca -0.02 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.36 58.76 1w36 h GLU 143 Cb 1.21 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 29.12 1w36 h GLU 143 CO 0.11 0.78 -0.23 0.66 -1.40 0.00 0.00 179.01 178.93 1w36 h SER 144 N -0.69 0.00 0.00 1.42 4.64 -1.47 -3.47 113.55 113.98 1w36 h SER 144 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1w36 h SER 144 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1w36 h SER 144 CO 0.01 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.81 1w36 n GLY 145 N -0.84 0.66 3.72 -0.77 0.00 0.60 -4.96 105.19 103.59 1w36 n GLY 145 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.30 1.80 0.32 1.61 -1.94 -0.87 -5.02 119.30 114.90 1w36 s MET 146 Ca 0.00 1.53 -0.06 0.00 -1.71 0.00 0.00 55.69 55.45 1w36 s MET 146 Cb 0.00 -1.82 -0.05 0.00 2.01 0.00 0.00 34.83 34.97 1w36 s MET 146 CO 0.00 -2.05 0.60 -0.51 -0.01 0.00 0.00 175.02 173.05 1w36 s LEU 147 N -5.83 4.00 0.43 -0.03 1.43 -1.26 -4.84 118.68 112.57 1w36 s LEU 147 Ca 0.68 0.78 0.23 0.00 -1.03 0.00 0.00 54.13 54.79 1w36 s LEU 147 Cb -0.24 -3.62 0.33 0.00 0.03 0.00 0.00 46.19 42.70 1w36 s LEU 147 CO 0.52 -0.25 1.60 -0.26 0.23 0.00 0.00 176.35 178.19 1w36 h PHE 148 N 1.51 0.00 -3.27 0.29 -1.00 -1.96 -3.39 116.94 109.11 1w36 h PHE 148 Ca -0.48 0.00 -0.63 0.00 2.81 0.00 0.00 57.97 59.67 1w36 h PHE 148 Cb 1.19 0.00 -0.41 0.00 3.61 0.00 0.00 35.95 40.35 1w36 h PHE 148 CO 0.58 0.02 -0.68 -1.21 -1.61 0.00 0.00 178.31 175.41 1w36 s GLU 149 N -3.20 1.63 0.21 1.51 2.02 -1.26 -5.09 118.70 114.51 1w36 s GLU 149 Ca 0.07 -2.25 0.05 0.00 0.02 0.00 0.00 54.97 52.86 1w36 s GLU 149 Cb 0.05 -2.91 -0.04 0.00 0.10 0.00 0.00 34.13 31.34 1w36 s GLU 149 CO 0.67 -1.10 0.23 -0.65 0.02 0.00 0.00 175.26 174.43 1w36 s GLN 150 N 0.15 3.11 -0.18 1.61 -1.52 -1.26 -5.00 119.66 116.57 1w36 s GLN 150 Ca 0.16 -0.87 0.01 0.00 -1.95 0.00 0.00 55.36 52.71 1w36 s GLN 150 Cb -0.24 -2.72 0.02 0.00 -0.22 0.00 0.00 33.01 29.85 1w36 s GLN 150 CO -0.02 0.45 -0.19 -0.65 -0.25 0.00 0.00 175.29 174.62 1w36 s GLN 151 N -3.58 3.00 -0.82 2.91 -0.21 -0.97 -5.02 119.66 114.98 1w36 s GLN 151 Ca 0.33 -0.83 -0.25 0.00 0.02 0.00 0.00 55.36 54.63 1w36 s GLN 151 Cb -0.09 -2.59 -0.05 0.00 1.00 0.00 0.00 33.01 31.28 1w36 s GLN 151 CO 0.26 -0.21 1.98 -1.17 -2.12 0.00 0.00 175.29 174.03 1w36 s LEU 152 N 1.30 3.17 0.33 2.90 1.98 -1.26 -1.23 118.68 125.87 1w36 s LEU 152 Ca 0.05 -0.34 -0.29 0.00 -2.89 0.00 0.00 54.13 50.66 1w36 s LEU 152 Cb -0.13 -2.55 -0.12 0.00 0.66 0.00 0.00 46.19 44.05 1w36 s LEU 152 CO -0.13 -2.76 1.43 0.00 -1.89 0.00 0.00 176.35 173.00 1w36 n ILE 153 N 7.81 1.71 -0.12 6.68 0.13 0.23 -4.86 119.36 130.94 1w36 n ILE 153 Ca 0.36 -0.43 -0.25 0.00 -1.10 0.00 0.00 62.75 61.34 1w36 n ILE 153 Cb 0.48 -1.78 -0.08 0.00 -0.84 0.00 0.00 39.64 37.42 1w36 n ILE 153 CO 0.00 0.00 0.00 -1.84 2.80 0.00 0.00 176.55 177.51 1w36 n GLU 154 N 0.96 0.54 0.00 9.51 0.00 -1.26 -4.39 120.64 126.00 1w36 n GLU 154 Ca 0.05 0.23 0.00 0.00 0.00 0.00 0.00 57.16 57.44 1w36 n GLU 154 Cb 0.37 -1.41 0.00 0.00 0.00 0.00 0.00 31.44 30.40 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 -4.20 0.00 0.00 -1.84 5.75 -1.26 -4.92 116.55 110.08 1w36 n ASP 155 Ca -0.45 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.33 1w36 n ASP 155 Cb 0.80 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.89 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 0.06 0.11 1.02 -1.26 -4.93 120.64 115.63 1w36 n GLU 156 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 1w36 n GLU 156 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.29 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 0.12 0.88 1.62 4.64 -1.99 -2.34 113.55 116.48 1w36 h SER 157 Ca 0.00 -0.15 -0.20 0.00 -0.47 0.00 0.00 61.79 60.97 1w36 h SER 157 Cb 0.00 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 1w36 h SER 157 CO 0.00 1.12 -1.21 -0.07 -0.87 0.00 0.00 176.83 175.80 1w36 h LEU 158 N 0.02 0.00 -0.59 5.97 3.38 -1.99 -2.27 115.31 119.83 1w36 h LEU 158 Ca -0.10 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 1w36 h LEU 158 Cb 1.87 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.61 1w36 h LEU 158 CO 0.14 0.77 -0.19 0.25 0.09 0.00 0.00 178.44 179.49 1w36 h LEU 159 N 0.00 0.94 0.01 1.67 7.12 -1.95 -1.48 115.31 121.61 1w36 h LEU 159 Ca -0.13 -0.34 -0.00 0.00 0.13 0.00 0.00 57.88 57.54 1w36 h LEU 159 Cb 1.70 -0.26 0.00 0.00 -0.53 0.00 0.00 40.66 41.57 1w36 h LEU 159 CO 0.08 1.10 -0.01 -0.09 -0.13 0.00 0.00 178.44 179.39 1w36 h ARG 160 N 0.80 -0.02 -0.33 1.25 2.43 -1.44 -2.34 114.38 114.74 1w36 h ARG 160 Ca 0.11 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.33 1w36 h ARG 160 Cb 0.74 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.26 1w36 h ARG 160 CO 0.06 0.35 0.06 -0.92 -1.51 0.00 0.00 179.97 178.01 1w36 h TYR 161 N -0.38 0.11 -0.79 2.20 3.20 -1.30 -0.45 116.97 119.56 1w36 h TYR 161 Ca -0.00 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1w36 h TYR 161 Cb 0.37 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.60 1w36 h TYR 161 CO 0.05 0.02 0.46 0.37 -1.64 0.00 0.00 178.16 177.42 1w36 h GLN 162 N 0.18 1.07 -0.55 1.82 4.15 -1.29 -0.35 115.11 120.14 1w36 h GLN 162 Ca 0.15 -0.10 -0.08 0.00 0.77 0.00 0.00 58.65 59.39 1w36 h GLN 162 Cb 0.17 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 1w36 h GLN 162 CO -0.20 0.76 0.03 0.00 -1.93 0.00 0.00 178.83 177.50 1w36 h ALA 163 N 1.42 1.03 -0.43 3.38 0.00 -0.77 -1.01 119.26 122.87 1w36 h ALA 163 Ca 0.28 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1w36 h ALA 163 Cb -0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1w36 h ALA 163 CO -0.05 0.61 -0.02 0.00 0.00 0.00 0.00 179.25 179.79 1w36 h ALA 165 N 1.31 0.16 -0.89 0.00 0.00 -0.63 -2.42 119.26 116.79 1w36 h ALA 165 Ca 0.13 -0.45 0.19 0.00 0.00 0.00 0.00 54.91 54.78 1w36 h ALA 165 Cb 0.45 -0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.11 1w36 h ALA 165 CO 0.02 0.23 0.42 -0.44 0.00 0.00 0.00 179.25 179.49 1w36 h ASP 166 N -0.07 0.43 0.34 0.00 5.19 -0.92 0.33 116.42 121.71 1w36 h ASP 166 Ca -0.02 0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.51 1w36 h ASP 166 Cb 0.99 0.08 -0.01 0.00 0.18 0.00 0.00 39.33 40.57 1w36 h ASP 166 CO 0.07 0.09 -0.26 0.15 -3.12 0.00 0.00 179.24 176.17 1w36 h PHE 167 N 0.50 -0.70 -0.55 4.55 3.57 -0.65 -1.11 116.94 122.55 1w36 h PHE 167 Ca 0.53 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 62.07 1w36 h PHE 167 Cb 0.92 0.26 -0.05 0.00 2.79 0.00 0.00 35.95 39.87 1w36 h PHE 167 CO -0.11 -0.39 0.29 2.35 -2.23 0.00 0.00 178.31 178.22 1w36 h TRP 168 N -0.60 0.54 0.50 0.41 7.01 -0.56 -0.67 115.95 122.58 1w36 h TRP 168 Ca -0.03 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 60.98 1w36 h TRP 168 Cb 0.53 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.41 1w36 h TRP 168 CO -0.14 0.27 -0.40 0.00 -2.79 0.00 0.00 178.44 175.38 1w36 h ARG 169 N 0.57 -0.84 0.00 2.65 3.08 -0.20 0.63 114.38 120.27 1w36 h ARG 169 Ca 0.24 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.35 1w36 h ARG 169 Cb 0.13 0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1w36 h ARG 169 CO -0.16 -0.56 0.00 2.89 -1.07 0.00 0.00 179.97 181.07 1w36 n ARG 170 N -4.87 0.14 0.00 0.04 1.85 -0.44 -2.35 116.66 111.03 1w36 n ARG 170 Ca -0.11 0.17 0.02 0.00 -1.00 0.00 0.00 57.85 56.94 1w36 n ARG 170 Cb 0.38 -1.50 -0.02 0.00 -1.05 0.00 0.00 32.46 30.27 1w36 n ARG 170 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1w36 n HIS 171 N -1.36 0.00 0.00 2.89 8.25 -0.28 -4.79 115.22 119.92 1w36 n HIS 171 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1w36 n HIS 171 Cb 0.14 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.25 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 -1.52 0.00 0.00 0.99 -1.48 0.94 116.97 115.90 1w36 h TYR 173 Ca 0.00 0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.80 1w36 h TYR 173 Cb 0.93 0.70 0.00 0.00 1.00 0.00 0.00 36.73 39.36 1w36 h TYR 173 CO 0.00 -0.48 0.18 -0.35 -0.00 0.00 0.00 178.16 177.52 1w36 n PRO 174 N -5.16 0.03 -2.30 4.88 -0.04 -1.26 -4.72 135.00 126.42 1w36 n PRO 174 Ca -0.04 0.41 -0.40 0.00 -0.04 0.00 0.00 63.50 63.42 1w36 n PRO 174 Cb 0.33 -1.78 -0.03 0.00 -0.04 0.00 0.00 33.50 31.98 1w36 n PRO 174 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1w36 s LEU 175 N -3.12 4.46 0.13 1.53 1.43 0.32 -5.02 118.68 118.42 1w36 s LEU 175 Ca -0.00 2.46 -0.30 0.00 -1.03 0.00 0.00 54.13 55.25 1w36 s LEU 175 Cb 0.01 -3.67 -0.06 0.00 0.03 0.00 0.00 46.19 42.50 1w36 s LEU 175 CO 0.04 -0.36 0.99 -2.16 0.23 0.00 0.00 176.35 175.09 1w36 s PRO 176 N -1.68 4.68 0.06 1.29 0.04 -1.26 -4.66 135.00 133.47 1w36 s PRO 176 Ca 0.48 1.51 0.02 0.00 0.04 0.00 0.00 61.00 63.04 1w36 s PRO 176 Cb -0.35 -3.35 0.19 0.00 0.04 0.00 0.00 34.50 31.02 1w36 s PRO 176 CO 0.46 0.18 0.31 -2.13 0.04 0.00 0.00 177.00 175.86 1w36 n ARG 177 N 2.70 -0.01 0.21 4.56 3.00 -1.26 -0.33 116.66 125.53 1w36 n ARG 177 Ca 0.02 0.28 -0.15 0.00 -0.00 0.00 0.00 57.85 58.01 1w36 n ARG 177 Cb 0.48 -0.47 -0.08 0.00 0.00 0.00 0.00 32.46 32.39 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 -0.49 -0.00 -0.14 4.11 -1.92 0.41 114.58 116.54 1w36 h GLU 178 Ca 0.14 0.03 -0.00 0.00 0.07 0.00 0.00 59.36 59.60 1w36 h GLU 178 Cb 0.31 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1w36 h GLU 178 CO -0.17 -0.23 0.00 0.82 0.07 0.00 0.00 179.01 179.50 1w36 h ILE 179 N -0.70 1.14 -0.69 -1.06 2.04 -1.01 -2.99 117.51 114.25 1w36 h ILE 179 Ca -0.05 -0.42 0.13 0.00 1.00 0.00 0.00 64.86 65.52 1w36 h ILE 179 Cb 0.49 1.43 -0.13 0.00 -0.74 0.00 0.00 36.82 37.87 1w36 h ILE 179 CO 0.09 0.11 -0.21 0.00 0.00 0.00 0.00 178.15 178.13 1w36 h ALA 180 N 0.82 0.37 -0.49 1.87 0.00 -1.32 0.61 119.26 121.12 1w36 h ALA 180 Ca 0.00 0.25 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1w36 h ALA 180 Cb 0.18 0.59 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1w36 h ALA 180 CO -0.00 -0.47 0.32 0.37 0.00 0.00 0.00 179.25 179.47 1w36 h GLN 181 N -0.03 0.57 0.40 0.00 4.15 -0.85 0.19 115.11 119.54 1w36 h GLN 181 Ca 0.32 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.69 1w36 h GLN 181 Cb 0.53 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.09 1w36 h GLN 181 CO -0.72 0.37 -0.19 0.28 -1.93 0.00 0.00 178.83 176.64 1w36 h VAL 182 N 0.58 0.60 0.29 2.39 2.07 0.31 -1.83 116.25 120.65 1w36 h VAL 182 Ca 0.19 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1w36 h VAL 182 Cb 0.04 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 1w36 h VAL 182 CO -0.05 0.06 -0.45 0.58 0.02 0.00 0.00 177.57 177.73 1w36 h VAL 183 N -0.71 0.10 -1.16 2.57 2.07 -0.65 -0.89 116.25 117.58 1w36 h VAL 183 Ca -0.05 0.00 0.42 0.00 0.82 0.00 0.00 66.70 67.89 1w36 h VAL 183 Cb 0.50 0.10 -0.15 0.00 -1.52 0.00 0.00 31.29 30.22 1w36 h VAL 183 CO 0.09 0.00 0.70 0.15 0.02 0.00 0.00 177.57 178.53 1w36 h PHE 184 N -0.80 0.70 0.00 1.57 3.57 -0.52 1.19 116.94 122.64 1w36 h PHE 184 Ca -0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 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 -0.32 -0.33 0.00 0.39 -2.23 0.00 0.00 178.31 175.83 1w36 n GLU 185 N -4.98 0.20 -0.04 1.11 1.02 -0.36 -3.08 120.64 114.52 1w36 n GLU 185 Ca 0.38 0.30 -0.20 0.00 -0.02 0.00 0.00 57.16 57.62 1w36 n GLU 185 Cb 1.35 -1.80 -0.13 0.00 -0.02 0.00 0.00 31.44 30.83 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 -2.16 1.68 -3.72 2.62 -1.04 0.40 -4.92 114.28 107.15 1w36 n THR 186 Ca 0.04 -0.64 -0.12 0.00 -2.04 0.00 0.00 64.05 61.29 1w36 n THR 186 Cb 0.32 -1.59 -0.12 0.00 -1.82 0.00 0.00 70.33 67.12 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 -2.55 -0.45 0.27 -1.42 0.52 -0.37 -5.04 118.94 109.90 1w36 s TRP 187 Ca -0.25 1.00 0.20 0.00 0.02 0.00 0.00 56.10 57.07 1w36 s TRP 187 Cb 0.07 0.14 0.90 0.00 -1.15 0.00 0.00 33.47 33.43 1w36 s TRP 187 CO 0.72 -0.28 1.84 0.87 0.02 0.00 0.00 176.95 180.13 1w36 h LYS 188 N 7.08 0.00 -1.83 4.98 1.57 -1.83 -3.33 116.57 123.21 1w36 h LYS 188 Ca -0.38 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 58.66 1w36 h LYS 188 Cb 1.17 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.38 1w36 h LYS 188 CO 0.34 0.30 0.69 0.20 -0.57 0.00 0.00 179.45 180.41 1w36 s GLY 189 N -4.30 -0.33 0.49 3.86 0.00 -1.26 -4.94 107.32 100.84 1w36 s GLY 189 Ca -0.01 0.44 0.30 0.00 0.00 0.00 0.00 44.72 45.45 1w36 s GLY 189 CO 0.67 0.17 1.81 -0.56 0.00 0.00 0.00 173.10 175.18 1w36 h PRO 190 N 2.00 0.13 -0.73 2.90 0.13 -1.91 0.82 132.00 135.33 1w36 h PRO 190 Ca -0.28 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.85 1w36 h PRO 190 Cb 1.21 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 1w36 h PRO 190 CO 0.27 0.08 0.48 0.37 -0.23 0.00 0.00 178.00 178.98 1w36 h GLN 191 N 0.13 0.95 0.00 0.86 5.75 -1.96 -1.45 115.11 119.39 1w36 h GLN 191 Ca 0.55 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.96 1w36 h GLN 191 Cb 1.92 -0.21 -0.00 0.00 1.07 0.00 0.00 27.48 30.25 1w36 h GLN 191 CO -0.10 0.63 -0.16 0.00 -2.65 0.00 0.00 178.83 176.55 1w36 h ALA 192 N 1.27 1.02 0.38 3.38 0.00 -1.25 -0.68 119.26 123.39 1w36 h ALA 192 Ca 0.27 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1w36 h ALA 192 Cb -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1w36 h ALA 192 CO -0.07 0.20 -0.18 1.25 0.00 0.00 0.00 179.25 180.45 1w36 h LEU 193 N 0.00 -0.43 -0.88 0.00 6.46 -1.04 -2.92 115.31 116.51 1w36 h LEU 193 Ca -0.00 0.01 0.24 0.00 -0.12 0.00 0.00 57.88 58.01 1w36 h LEU 193 Cb 0.68 0.11 -0.15 0.00 -0.73 0.00 0.00 40.66 40.57 1w36 h LEU 193 CO 0.02 -0.11 0.19 0.25 -0.62 0.00 0.00 178.44 178.17 1w36 h LEU 194 N -0.91 -0.10 -1.91 2.25 6.46 -1.26 0.88 115.31 120.73 1w36 h LEU 194 Ca -0.05 0.21 0.14 0.00 -0.12 0.00 0.00 57.88 58.06 1w36 h LEU 194 Cb 0.39 0.31 -0.03 0.00 -0.73 0.00 0.00 40.66 40.60 1w36 h LEU 194 CO 0.08 -0.20 0.39 -0.09 -0.62 0.00 0.00 178.44 178.01 1w36 h ARG 195 N 0.16 0.09 0.00 1.25 2.43 -1.03 0.51 114.38 117.80 1w36 h ARG 195 Ca 0.55 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.71 1w36 h ARG 195 Cb 1.11 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1w36 h ARG 195 CO -0.70 0.06 -0.41 -0.25 -1.51 0.00 0.00 179.97 177.16 1w36 n ASP 196 N -4.41 0.65 0.00 -3.80 9.92 0.30 -4.43 116.55 114.78 1w36 n ASP 196 Ca 0.10 0.22 0.00 0.00 -0.53 0.00 0.00 54.79 54.57 1w36 n ASP 196 Cb 0.56 -0.11 0.00 0.00 -0.64 0.00 0.00 41.12 40.93 1w36 n ASP 196 CO 0.00 0.00 0.00 2.30 0.13 0.00 0.00 177.20 179.63 1w36 n ILE 197 N -2.02 0.00 -0.32 0.53 -5.35 -0.30 -4.86 119.36 107.03 1w36 n ILE 197 Ca 0.04 -0.13 0.22 0.00 -0.27 0.00 0.00 62.75 62.61 1w36 n ILE 197 Cb 0.42 0.78 0.43 0.00 -1.74 0.00 0.00 39.64 39.53 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 0.22 -0.02 7.28 -1.24 -0.26 -0.58 115.58 120.98 1w36 h ASN 198 Ca 0.00 0.22 0.02 0.00 0.71 0.00 0.00 56.30 57.25 1w36 h ASN 198 Cb 0.00 0.24 -0.06 0.00 0.73 0.00 0.00 38.32 39.24 1w36 h ASN 198 CO 0.00 -0.24 -0.52 -0.09 -1.29 0.00 0.00 177.43 175.29 1w36 h ARG 199 N 0.18 -0.62 0.00 6.67 2.43 -1.89 -3.37 114.38 117.78 1w36 h ARG 199 Ca 0.70 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.91 1w36 h ARG 199 Cb 1.61 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.30 1w36 h ARG 199 CO -0.70 -0.41 0.00 0.66 -1.51 0.00 0.00 179.97 178.01 1w36 n TYR 200 N -5.35 -2.13 0.00 2.20 0.53 -0.22 -2.61 117.16 109.57 1w36 n TYR 200 Ca -0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.81 1w36 n TYR 200 Cb 0.38 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.69 1w36 n TYR 200 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 1w36 n LEU 201 N 0.00 0.00 -4.38 7.72 4.77 -1.26 -4.89 117.00 118.96 1w36 n LEU 201 Ca 0.00 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.64 1w36 n LEU 201 Cb 0.00 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 1w36 n LEU 201 CO 0.00 0.00 -0.41 -1.10 -1.33 0.00 0.00 177.39 174.55 1w36 s GLN 202 N 0.00 3.45 2.44 3.23 -0.21 -1.07 -4.95 119.66 122.55 1w36 s GLN 202 Ca 0.00 -0.63 0.00 0.00 0.02 0.00 0.00 55.36 54.75 1w36 s GLN 202 Cb 0.00 -2.81 0.00 0.00 1.00 0.00 0.00 33.01 31.20 1w36 s GLN 202 CO 0.00 0.10 0.00 0.41 -2.12 0.00 0.00 175.29 173.68 1w36 n GLY 203 N 3.89 -0.21 3.66 3.09 0.00 -1.26 -4.76 105.19 109.59 1w36 n GLY 203 Ca -0.18 -1.03 -0.50 0.00 0.00 0.00 0.00 46.02 44.31 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 -0.29 1.72 -2.27 1.61 1.02 -1.26 -4.90 120.64 116.27 1w36 n GLU 204 Ca 0.00 0.63 -0.42 0.00 -0.02 0.00 0.00 57.16 57.35 1w36 n GLU 204 Cb 0.00 -2.36 -0.03 0.00 -0.02 0.00 0.00 31.44 29.03 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 1.90 3.51 1.00 0.62 0.00 -1.26 -4.92 121.76 122.60 1w36 s ALA 205 Ca 0.86 1.01 -0.12 0.00 0.00 0.00 0.00 51.96 53.72 1w36 s ALA 205 Cb -0.82 -3.50 0.19 0.00 0.00 0.00 0.00 23.12 18.99 1w36 s ALA 205 CO 0.48 -0.54 1.08 -1.25 0.00 0.00 0.00 175.76 175.53 1w36 s PRO 206 N 1.09 0.43 0.24 0.00 0.04 -1.26 -4.98 135.00 130.56 1w36 s PRO 206 Ca 0.62 0.94 -0.18 0.00 0.04 0.00 0.00 61.00 62.42 1w36 s PRO 206 Cb -0.34 -1.70 -0.08 0.00 0.04 0.00 0.00 34.50 32.42 1w36 s PRO 206 CO 0.30 -2.84 0.72 0.08 0.04 0.00 0.00 177.00 175.29 1w36 s VAL 207 N -2.73 4.61 -0.30 -0.36 1.01 0.26 -4.85 120.40 118.04 1w36 s VAL 207 Ca 0.66 1.18 -0.13 0.00 0.00 0.00 0.00 61.98 63.69 1w36 s VAL 207 Cb -0.21 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1w36 s VAL 207 CO 0.60 0.12 0.26 -0.63 0.00 0.00 0.00 175.10 175.44 1w36 s ILE 208 N -1.62 5.26 -0.00 2.22 1.01 -1.26 -0.08 121.20 126.72 1w36 s ILE 208 Ca 0.45 0.15 -0.30 0.00 0.00 0.00 0.00 60.65 60.95 1w36 s ILE 208 Cb -0.15 -3.64 -0.06 0.00 0.01 0.00 0.00 42.46 38.62 1w36 s ILE 208 CO 0.20 0.14 1.48 -0.75 0.00 0.00 0.00 174.94 176.01 1w36 s LYS 209 N 1.84 4.25 -0.78 2.79 2.20 -0.85 -3.61 119.74 125.58 1w36 s LYS 209 Ca 0.09 2.06 -0.04 0.00 -0.36 0.00 0.00 55.97 57.72 1w36 s LYS 209 Cb -0.16 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.48 1w36 s LYS 209 CO 0.11 -0.65 0.70 0.00 -0.36 0.00 0.00 175.35 175.15 1w36 n ALA 210 N 5.70 -2.17 -1.29 3.13 0.00 -1.26 -4.45 120.51 120.18 1w36 n ALA 210 Ca 0.14 0.08 -0.29 0.00 0.00 0.00 0.00 53.44 53.38 1w36 n ALA 210 Cb 0.43 -3.85 0.17 0.00 0.00 0.00 0.00 19.45 16.19 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 -3.83 0.55 0.71 0.00 0.04 -1.24 -4.97 135.00 126.28 1w36 s PRO 211 Ca 0.27 0.40 -0.11 0.00 0.04 0.00 0.00 61.00 61.61 1w36 s PRO 211 Cb -0.04 -1.76 0.02 0.00 0.04 0.00 0.00 34.50 32.76 1w36 s PRO 211 CO 0.60 -2.62 1.07 -2.14 0.04 0.00 0.00 177.00 173.95 1w36 s PRO 212 N -5.08 2.77 0.19 0.56 0.02 -1.26 -4.90 135.00 127.29 1w36 s PRO 212 Ca 0.65 0.99 -0.32 0.00 0.02 0.00 0.00 61.00 62.34 1w36 s PRO 212 Cb -0.17 -1.97 -0.12 0.00 0.02 0.00 0.00 34.50 32.26 1w36 s PRO 212 CO 0.56 -1.23 1.75 -2.30 -0.33 0.00 0.00 177.00 175.45 1w36 n PRO 213 N -3.22 2.76 0.00 5.54 -0.02 -1.26 -4.67 135.00 134.13 1w36 n PRO 213 Ca 0.08 1.00 0.00 0.00 -2.02 0.00 0.00 63.50 62.55 1w36 n PRO 213 Cb 0.53 -2.85 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 1w36 n PRO 213 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1w36 n ASP 214 N 4.33 0.00 0.00 2.55 2.03 -1.26 -1.92 116.55 122.28 1w36 n ASP 214 Ca 0.17 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.48 1w36 n ASP 214 Cb 0.35 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.75 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 0.47 0.00 -4.17 1.67 5.68 -1.26 -5.12 116.55 113.82 1w36 n ASP 215 Ca 0.00 0.00 -0.54 0.00 -0.50 0.00 0.00 54.79 53.75 1w36 n ASP 215 Cb 0.00 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 39.91 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 -0.09 0.00 -3.15 0.11 1.02 -0.81 -4.93 120.64 112.80 1w36 n GLU 216 Ca 0.00 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.95 1w36 n GLU 216 Cb 0.00 -1.35 0.01 0.00 -0.02 0.00 0.00 31.44 30.08 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 -0.08 3.50 0.12 2.62 -4.23 -1.26 -4.95 115.64 111.36 1w36 s THR 217 Ca 0.82 -0.91 -0.20 0.00 -1.18 0.00 0.00 61.69 60.22 1w36 s THR 217 Cb -1.15 -3.21 -0.07 0.00 1.34 0.00 0.00 72.50 69.40 1w36 s THR 217 CO 0.53 -0.10 1.76 0.25 -0.54 0.00 0.00 174.62 176.52 1w36 h LEU 218 N 0.66 0.13 -0.85 4.79 6.46 -1.99 -2.30 115.31 122.20 1w36 h LEU 218 Ca -0.43 0.01 0.14 0.00 -0.12 0.00 0.00 57.88 57.47 1w36 h LEU 218 Cb 1.27 -0.02 -0.14 0.00 -0.73 0.00 0.00 40.66 41.04 1w36 h LEU 218 CO 0.50 0.10 -0.37 0.00 -0.62 0.00 0.00 178.44 178.05 1w36 h ALA 219 N 1.09 0.08 -0.05 1.25 0.00 -1.99 -0.66 119.26 118.97 1w36 h ALA 219 Ca 0.07 0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1w36 h ALA 219 Cb 0.01 0.93 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1w36 h ALA 219 CO -0.05 -0.64 0.00 0.43 0.00 0.00 0.00 179.25 178.99 1w36 n SER 220 N -5.46 0.00 -0.35 0.00 7.64 -0.89 -1.93 113.62 112.63 1w36 n SER 220 Ca 0.08 0.99 0.08 0.00 1.01 0.00 0.00 58.87 61.03 1w36 n SER 220 Cb 0.38 -0.49 0.17 0.00 -1.01 0.00 0.00 64.21 63.27 1w36 n SER 220 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1w36 n ARG 221 N -2.05 -0.09 -0.03 1.43 3.00 -1.05 0.43 116.66 118.30 1w36 n ARG 221 Ca 0.00 1.50 -0.11 0.00 -0.00 0.00 0.00 57.85 59.24 1w36 n ARG 221 Cb 0.00 -2.28 -0.05 0.00 0.00 0.00 0.00 32.46 30.13 1w36 n ARG 221 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1w36 h HIS 222 N 0.00 -1.12 0.00 -0.14 2.76 -1.03 0.13 115.15 115.75 1w36 h HIS 222 Ca 0.50 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.72 1w36 h HIS 222 Cb 0.84 0.52 0.00 0.00 1.55 0.00 0.00 27.41 30.32 1w36 h HIS 222 CO -0.69 -0.45 0.00 0.00 -1.30 0.00 0.00 177.93 175.50 1w36 n ALA 223 N -2.94 -0.05 -0.26 5.26 0.00 0.17 0.31 120.51 123.00 1w36 n ALA 223 Ca -0.03 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.49 1w36 n ALA 223 Cb 0.35 0.29 0.17 0.00 0.00 0.00 0.00 19.45 20.26 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 -1.77 -0.06 0.16 0.00 6.02 -0.75 -0.30 117.38 120.66 1w36 n GLN 224 Ca 0.00 1.12 -0.13 0.00 -0.01 0.00 0.00 57.00 57.98 1w36 n GLN 224 Cb 0.00 -1.73 -0.08 0.00 1.02 0.00 0.00 30.24 29.45 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 0.69 -0.25 5.09 1.08 0.64 -1.28 117.51 123.48 1w36 h ILE 225 Ca 0.41 -0.59 0.06 0.00 -0.39 0.00 0.00 64.86 64.35 1w36 h ILE 225 Cb 0.77 0.99 -0.08 0.00 -3.07 0.00 0.00 36.82 35.43 1w36 h ILE 225 CO -0.72 0.11 -0.34 0.58 -0.69 0.00 0.00 178.15 177.10 1w36 h VAL 226 N -0.75 0.24 -0.80 1.67 2.07 0.24 0.59 116.25 119.50 1w36 h VAL 226 Ca -0.04 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.59 1w36 h VAL 226 Cb 0.50 0.24 -0.06 0.00 -1.52 0.00 0.00 31.29 30.46 1w36 h VAL 226 CO 0.07 0.00 0.52 0.00 0.02 0.00 0.00 177.57 178.18 1w36 h ALA 227 N 0.53 1.81 -0.06 1.67 0.00 -0.69 0.43 119.26 122.94 1w36 h ALA 227 Ca 0.13 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1w36 h ALA 227 Cb 0.55 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1w36 h ALA 227 CO -0.44 0.01 -0.52 0.00 0.00 0.00 0.00 179.25 178.30 1w36 h ARG 228 N 0.69 0.17 -0.00 0.00 3.08 0.14 -3.00 114.38 115.46 1w36 h ARG 228 Ca 0.38 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.32 1w36 h ARG 228 Cb 0.53 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1w36 h ARG 228 CO -0.15 0.65 -0.03 0.82 -1.07 0.00 0.00 179.97 180.19 1w36 h ILE 229 N 0.14 1.56 -0.45 2.04 2.04 0.14 -3.34 117.51 119.63 1w36 h ILE 229 Ca 0.00 -1.68 -0.12 0.00 1.00 0.00 0.00 64.86 64.07 1w36 h ILE 229 Cb 0.96 2.68 -0.01 0.00 -0.74 0.00 0.00 36.82 39.71 1w36 h ILE 229 CO 0.08 0.44 -0.18 -0.78 0.00 0.00 0.00 178.15 177.71 1w36 h ASP 230 N -0.67 0.93 -0.45 1.72 1.82 -0.36 -2.31 116.42 117.10 1w36 h ASP 230 Ca -0.00 -0.39 0.13 0.00 -0.39 0.00 0.00 57.03 56.38 1w36 h ASP 230 Cb 0.73 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.47 1w36 h ASP 230 CO 0.01 1.11 0.41 0.71 -1.61 0.00 0.00 179.24 179.87 1w36 h THR 231 N 0.75 0.49 0.00 2.25 1.35 -1.68 3.03 112.91 119.10 1w36 h THR 231 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 1w36 h THR 231 Cb 0.74 0.68 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1w36 h THR 231 CO 0.06 0.00 -0.63 0.52 -0.25 0.00 0.00 175.52 175.22 1w36 n VAL 232 N -3.93 0.08 0.30 6.82 0.31 -1.07 -3.15 118.33 117.68 1w36 n VAL 232 Ca 0.08 -0.07 0.12 0.00 -0.01 0.00 0.00 64.34 64.46 1w36 n VAL 232 Cb 0.61 0.24 0.17 0.00 -0.91 0.00 0.00 33.84 33.95 1w36 n VAL 232 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1w36 h LYS 233 N 0.00 0.00 0.00 5.55 1.57 0.59 -3.31 116.57 120.97 1w36 h LYS 233 Ca 0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1w36 h LYS 233 Cb 0.57 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 1w36 h LYS 233 CO 0.00 0.00 -0.89 1.96 -0.57 0.00 0.00 179.45 179.95 1w36 h GLN 234 N 0.00 0.00 -1.06 3.15 4.20 -0.72 -3.06 115.11 117.61 1w36 h GLN 234 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1w36 h GLN 234 Cb 0.93 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.71 1w36 h GLN 234 CO 0.00 0.99 0.00 1.04 -0.67 0.00 0.00 178.83 180.19 1w36 n GLN 235 N -4.49 0.52 0.00 1.46 6.02 -1.19 -1.30 117.38 118.41 1w36 n GLN 235 Ca -0.26 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.73 1w36 n GLN 235 Cb 0.62 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.63 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 0.52 0.00 0.81 1.08 -0.00 -1.25 -4.68 117.44 113.93 1w36 n TRP 236 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.50 57.54 1w36 n TRP 236 Cb 0.21 0.00 0.25 0.00 -0.00 0.00 0.00 31.31 31.76 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 -0.04 0.41 -3.00 5.87 1.74 -0.42 -2.77 116.66 118.44 1w36 n ARG 237 Ca 0.00 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.82 1w36 n ARG 237 Cb 0.00 -1.32 -0.04 0.00 -1.02 0.00 0.00 32.46 30.08 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 -0.82 3.90 -0.85 0.55 8.00 -1.23 -4.77 116.55 121.33 1w36 n ASP 238 Ca 0.06 -3.57 0.05 0.00 0.71 0.00 0.00 54.79 52.05 1w36 n ASP 238 Cb 0.03 -0.57 0.18 0.00 -0.02 0.00 0.00 41.12 40.74 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 -0.11 2.65 0.07 2.24 0.00 -1.12 -4.19 120.51 120.04 1w36 n ALA 239 Ca 0.30 -0.76 -0.12 0.00 0.00 0.00 0.00 53.44 52.86 1w36 n ALA 239 Cb 0.43 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.81 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 2.20 0.00 -0.17 0.00 2.07 -1.89 -3.23 116.25 115.23 1w36 h VAL 240 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1w36 h VAL 240 Cb 0.71 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1w36 h VAL 240 CO 0.07 0.00 -0.14 1.23 0.02 0.00 0.00 177.57 178.75 1w36 h GLY 241 N -0.54 0.43 -7.17 2.17 0.00 -2.01 -3.43 103.07 92.52 1w36 h GLY 241 Ca 0.00 -0.42 -0.55 0.00 0.00 0.00 0.00 47.33 46.36 1w36 h GLY 241 CO -0.23 0.38 1.62 1.18 0.00 0.00 0.00 176.54 179.49 1w36 n GLU 242 N -4.54 0.54 -0.16 4.80 1.02 -1.22 -4.00 120.64 117.07 1w36 n GLU 242 Ca -0.06 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1w36 n GLU 242 Cb 0.36 -2.28 0.00 0.00 -0.02 0.00 0.00 31.44 29.50 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 11.72 0.00 -1.00 -4.62 4.77 -1.26 -4.95 117.00 121.66 1w36 n LEU 243 Ca 0.51 -0.36 -0.09 0.00 -0.03 0.00 0.00 56.01 56.05 1w36 n LEU 243 Cb 0.22 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 1w36 n LEU 243 CO 0.83 0.64 -0.23 0.47 -1.33 0.00 0.00 177.39 177.76 1w36 n ASP 244 N 0.00 -1.16 0.00 -1.43 8.00 -1.26 -5.09 116.55 115.62 1w36 n ASP 244 Ca 0.00 0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.61 1w36 n ASP 244 Cb 0.19 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 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 -0.48 0.00 -1.63 2.24 0.00 -1.26 -4.97 120.51 114.41 1w36 n ALA 245 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 1w36 n ALA 245 Cb 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.54 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 -0.12 3.62 0.00 0.00 4.77 -1.26 -5.02 117.00 118.99 1w36 n LEU 246 Ca 0.00 0.68 0.00 0.00 -0.03 0.00 0.00 56.01 56.66 1w36 n LEU 246 Cb 0.00 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 39.61 1w36 n LEU 246 CO 0.00 -0.17 0.00 2.30 -1.33 0.00 0.00 177.39 178.19 1w36 n ILE 247 N 6.21 0.00 0.00 -0.08 -6.64 -1.26 -4.93 119.36 112.66 1w36 n ILE 247 Ca 0.25 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 61.23 1w36 n ILE 247 Cb 0.38 -0.12 0.00 0.00 -1.44 0.00 0.00 39.64 38.46 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 -1.17 0.00 0.07 6.28 -0.58 -1.26 -5.08 120.64 118.90 1w36 n GLU 248 Ca 0.00 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.70 1w36 n GLU 248 Cb 0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 30.85 1w36 n GLU 248 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1w36 h SER 249 N 0.00 -0.22 -0.54 1.62 4.64 -2.01 -3.37 113.55 113.66 1w36 h SER 249 Ca 0.00 0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.38 1w36 h SER 249 Cb 0.00 0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.08 1w36 h SER 249 CO 0.00 0.14 -0.34 0.77 -0.87 0.00 0.00 176.83 176.53 1w36 h SER 250 N -0.85 -1.24 -1.66 4.97 4.64 -2.03 -3.34 113.55 114.05 1w36 h SER 250 Ca -0.03 0.19 -0.63 0.00 -0.47 0.00 0.00 61.79 60.85 1w36 h SER 250 Cb 0.20 0.54 -0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1w36 h SER 250 CO 0.04 -0.14 1.33 0.61 -0.87 0.00 0.00 176.83 177.80 1w36 n GLY 251 N -1.15 0.97 0.08 -0.77 0.00 -1.26 -4.93 105.19 98.13 1w36 n GLY 251 Ca 0.01 0.87 -0.00 0.00 0.00 0.00 0.00 46.02 46.89 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 6.64 0.00 -0.37 -0.61 3.06 -1.26 -4.69 119.36 122.13 1w36 n ILE 252 Ca 0.32 -0.04 0.08 0.00 -2.50 0.00 0.00 62.75 60.60 1w36 n ILE 252 Cb 0.31 -0.93 0.23 0.00 0.54 0.00 0.00 39.64 39.79 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 -2.87 3.53 -1.90 9.51 8.00 -1.26 -3.63 116.55 127.93 1w36 n ASP 253 Ca 0.00 -2.17 -0.10 0.00 0.71 0.00 0.00 54.79 53.23 1w36 n ASP 253 Cb 0.01 -0.37 0.22 0.00 -0.02 0.00 0.00 41.12 40.96 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 0.77 2.91 0.12 -1.24 5.12 -1.26 -3.27 116.66 119.80 1w36 n ARG 254 Ca 0.18 -2.57 0.11 0.00 -1.93 0.00 0.00 57.85 53.64 1w36 n ARG 254 Cb 0.59 -2.05 0.02 0.00 -1.16 0.00 0.00 32.46 29.86 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 1.80 0.00 0.00 5.56 3.08 -1.98 -3.07 114.38 119.77 1w36 h ARG 255 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.38 1w36 h ARG 255 Cb 2.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.31 1w36 h ARG 255 CO 0.73 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 181.27 1w36 n LYS 256 N -2.74 0.09 -0.06 0.04 5.02 -1.20 0.92 118.16 120.22 1w36 n LYS 256 Ca 0.00 0.22 -0.04 0.00 -2.02 0.00 0.00 58.31 56.47 1w36 n LYS 256 Cb 0.55 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 34.04 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 -0.43 2.13 0.05 -1.81 -3.34 116.94 113.54 1w36 h PHE 257 Ca 0.00 0.00 0.09 0.00 3.82 0.00 0.00 57.97 61.88 1w36 h PHE 257 Cb 0.19 0.00 -0.09 0.00 2.00 0.00 0.00 35.95 38.04 1w36 h PHE 257 CO 0.00 0.18 -0.25 -0.91 -0.18 0.00 0.00 178.31 177.15 1w36 h ASN 258 N -1.00 -0.83 0.00 2.17 2.35 -1.01 -3.27 115.58 113.98 1w36 h ASN 258 Ca -0.02 0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1w36 h ASN 258 Cb 0.37 0.43 0.00 0.00 0.05 0.00 0.00 38.32 39.17 1w36 h ASN 258 CO -0.01 -0.27 0.00 0.54 -1.65 0.00 0.00 177.43 176.04 1w36 n ARG 259 N -5.40 0.00 -0.16 0.81 1.74 0.26 -2.71 116.66 111.21 1w36 n ARG 259 Ca 0.03 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.20 1w36 n ARG 259 Cb 0.32 -0.28 0.19 0.00 -1.02 0.00 0.00 32.46 31.67 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 0.03 -0.39 0.55 3.41 -1.25 -0.50 113.62 115.46 1w36 n SER 260 Ca 0.00 0.78 -0.04 0.00 -0.26 0.00 0.00 58.87 59.35 1w36 n SER 260 Cb 0.00 -0.32 -0.00 0.00 -0.26 0.00 0.00 64.21 63.63 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 -1.65 1.01 4.04 2.35 -1.56 1.84 115.58 121.60 1w36 h ASN 261 Ca 0.32 0.32 -0.21 0.00 -0.55 0.00 0.00 56.30 56.18 1w36 h ASN 261 Cb 0.76 0.82 -0.03 0.00 0.05 0.00 0.00 38.32 39.91 1w36 h ASN 261 CO -0.40 -0.27 -1.00 1.56 -1.65 0.00 0.00 177.43 175.66 1w36 h GLN 262 N -0.00 0.00 -0.97 0.81 4.20 -0.87 -1.43 115.11 116.84 1w36 h GLN 262 Ca 0.29 0.00 0.05 0.00 0.06 0.00 0.00 58.65 59.05 1w36 h GLN 262 Cb 0.54 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.26 1w36 h GLN 262 CO -0.97 0.95 0.63 0.00 -0.67 0.00 0.00 178.83 178.77 1w36 h ALA 263 N 1.03 1.31 -0.18 3.87 0.00 -0.08 0.71 119.26 125.92 1w36 h ALA 263 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1w36 h ALA 263 Cb 1.76 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1w36 h ALA 263 CO 0.12 0.48 0.00 1.63 0.00 0.00 0.00 179.25 181.48 1w36 n LYS 264 N -4.49 1.64 -0.62 0.00 5.02 0.59 -3.49 118.16 116.81 1w36 n LYS 264 Ca 0.14 -0.97 -0.12 0.00 -2.02 0.00 0.00 58.31 55.33 1w36 n LYS 264 Cb 0.13 -1.35 0.08 0.00 -0.02 0.00 0.00 35.03 33.87 1w36 n LYS 264 CO 0.00 0.00 0.00 -2.67 -0.52 0.00 0.00 177.40 174.21 1w36 n TRP 265 N 0.21 1.49 -2.81 2.13 4.27 0.25 -4.40 117.44 118.58 1w36 n TRP 265 Ca 0.15 -1.23 -0.32 0.00 -3.89 0.00 0.00 57.50 52.21 1w36 n TRP 265 Cb 0.29 -0.62 -0.02 0.00 -1.36 0.00 0.00 31.31 29.60 1w36 n TRP 265 CO 0.00 0.00 0.00 -0.89 -2.29 0.00 0.00 177.69 174.51 1w36 n ILE 266 N -0.24 4.09 -1.70 -1.67 2.08 -1.23 -4.96 119.36 115.74 1w36 n ILE 266 Ca 0.29 -5.68 -0.02 0.00 0.56 0.00 0.00 62.75 57.91 1w36 n ILE 266 Cb 1.02 -1.44 0.01 0.00 -0.75 0.00 0.00 39.64 38.48 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 -0.20 0.05 -2.29 4.38 10.43 -1.26 -4.91 116.55 122.74 1w36 n ASP 267 Ca 0.37 -1.05 -0.23 0.00 2.57 0.00 0.00 54.79 56.45 1w36 n ASP 267 Cb 0.35 -0.05 -0.05 0.00 1.84 0.00 0.00 41.12 43.21 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 -1.14 2.21 0.00 -1.24 3.00 -1.26 -4.97 118.16 114.76 1w36 n LYS 268 Ca 0.01 -2.00 0.00 0.00 -0.00 0.00 0.00 58.31 56.32 1w36 n LYS 268 Cb 0.04 -2.00 0.00 0.00 0.00 0.00 0.00 35.03 33.07 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 0.94 0.00 0.00 3.15 5.41 -1.26 -4.91 119.36 122.69 1w36 n ILE 269 Ca 0.43 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.18 1w36 n ILE 269 Cb 0.60 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.53 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 4.52 0.00 -3.75 4.38 7.64 -1.26 -5.02 113.62 120.13 1w36 n SER 270 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.72 1w36 n SER 270 Cb 0.00 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.04 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 -2.56 0.09 -1.83 -0.43 0.00 -1.26 -3.69 121.76 112.07 1w36 s ALA 271 Ca 0.00 0.31 0.20 0.00 0.00 0.00 0.00 51.96 52.46 1w36 s ALA 271 Cb 0.00 -0.32 1.13 0.00 0.00 0.00 0.00 23.12 23.92 1w36 s ALA 271 CO 0.00 -0.18 1.58 0.91 0.00 0.00 0.00 175.76 178.08 1w36 n TRP 272 N 4.38 0.00 -2.52 0.00 5.03 -1.26 -4.78 117.44 118.29 1w36 n TRP 272 Ca -0.24 0.00 -0.33 0.00 3.03 0.00 0.00 57.50 59.96 1w36 n TRP 272 Cb 0.50 -0.08 -0.04 0.00 -1.03 0.00 0.00 31.31 30.66 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 -2.17 2.94 -0.36 6.99 0.00 -1.26 -5.03 121.76 122.87 1w36 s ALA 273 Ca 0.26 0.43 0.06 0.00 0.00 0.00 0.00 51.96 52.71 1w36 s ALA 273 Cb 0.13 -3.19 0.19 0.00 0.00 0.00 0.00 23.12 20.25 1w36 s ALA 273 CO 0.25 -0.24 0.66 -1.21 0.00 0.00 0.00 175.76 175.22 1w36 s GLU 274 N -3.51 0.68 1.00 0.00 2.02 -1.26 -5.12 118.70 112.50 1w36 s GLU 274 Ca 0.63 0.01 -0.17 0.00 0.02 0.00 0.00 54.97 55.46 1w36 s GLU 274 Cb -0.13 0.14 -0.13 0.00 0.10 0.00 0.00 34.13 34.11 1w36 s GLU 274 CO 0.23 -1.06 -0.72 0.39 0.02 0.00 0.00 175.26 174.12 1w36 n GLU 275 N 4.70 -0.04 -1.81 1.61 -0.58 -1.26 -4.66 120.64 118.59 1w36 n GLU 275 Ca 0.09 -0.01 -0.42 0.00 -0.42 0.00 0.00 57.16 56.40 1w36 n GLU 275 Cb 0.57 -1.08 -0.03 0.00 -0.57 0.00 0.00 31.44 30.32 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 -2.16 4.02 -0.61 3.49 0.41 -1.26 -4.90 118.70 117.69 1w36 s GLU 276 Ca 0.41 2.33 0.05 0.00 -0.41 0.00 0.00 54.97 57.35 1w36 s GLU 276 Cb -0.17 -4.12 0.32 0.00 -1.78 0.00 0.00 34.13 28.39 1w36 s GLU 276 CO 0.81 -1.07 0.95 0.25 -0.49 0.00 0.00 175.26 175.71 1w36 n THR 277 N 5.83 3.09 0.05 3.63 -2.24 -1.26 -4.88 114.28 118.50 1w36 n THR 277 Ca 0.20 -5.54 -0.02 0.00 -2.27 0.00 0.00 64.05 56.41 1w36 n THR 277 Cb 0.42 -1.54 -0.01 0.00 -2.10 0.00 0.00 70.33 67.11 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 3.26 -0.14 -1.00 3.42 2.35 -1.99 -3.38 115.58 118.11 1w36 h ASN 278 Ca 0.16 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 56.04 1w36 h ASN 278 Cb 0.52 0.04 -0.14 0.00 0.05 0.00 0.00 38.32 38.79 1w36 h ASN 278 CO 0.84 0.01 -0.48 0.77 -1.65 0.00 0.00 177.43 176.92 1w36 h SER 279 N -0.38 -1.76 0.00 5.81 4.64 -1.99 -2.71 113.55 117.17 1w36 h SER 279 Ca -0.02 0.32 -0.06 0.00 -0.47 0.00 0.00 61.79 61.56 1w36 h SER 279 Cb 0.12 0.85 -0.02 0.00 -0.31 0.00 0.00 62.40 63.04 1w36 h SER 279 CO 0.03 -0.26 -0.05 -1.22 -0.87 0.00 0.00 176.83 174.45 1w36 n TYR 280 N -5.38 0.00 0.00 4.77 4.02 -1.26 -4.41 117.16 114.91 1w36 n TYR 280 Ca 0.07 -0.85 0.00 0.00 -0.01 0.00 0.00 57.90 57.11 1w36 n TYR 280 Cb 0.34 -0.82 0.00 0.00 -0.02 0.00 0.00 39.34 38.84 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 2.16 0.00 0.00 -0.72 6.02 -1.02 -4.96 117.38 118.86 1w36 n GLN 281 Ca 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 1w36 n GLN 281 Cb 0.48 -0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.74 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 -0.31 0.00 -0.01 1.08 -0.00 -1.26 -4.42 117.00 112.08 1w36 n LEU 282 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 55.83 1w36 n LEU 282 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.34 1w36 n LEU 282 CO 0.00 0.00 0.22 1.55 -0.00 0.00 0.00 177.39 179.16 1w36 h PRO 283 N 0.00 0.78 0.00 1.96 0.13 -1.93 -3.27 132.00 129.67 1w36 h PRO 283 Ca 0.00 -0.68 -0.01 0.00 -0.87 0.00 0.00 66.00 64.44 1w36 h PRO 283 Cb 0.00 0.15 -0.00 0.00 0.13 0.00 0.00 31.00 31.28 1w36 h PRO 283 CO 0.00 1.28 -1.61 -0.85 -0.23 0.00 0.00 178.00 176.59 1w36 n GLU 284 N -3.92 0.64 -0.31 0.86 0.28 -1.26 -3.84 120.64 113.08 1w36 n GLU 284 Ca -0.08 -0.06 0.17 0.00 -0.16 0.00 0.00 57.16 57.02 1w36 n GLU 284 Cb 0.78 -1.65 0.34 0.00 1.43 0.00 0.00 31.44 32.35 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 -0.06 0.36 -1.84 4.64 -1.78 1.28 113.55 116.15 1w36 h SER 285 Ca -0.02 0.23 -0.25 0.00 -0.47 0.00 0.00 61.79 61.28 1w36 h SER 285 Cb 1.04 0.32 0.01 0.00 -0.31 0.00 0.00 62.40 63.46 1w36 h SER 285 CO 0.00 -0.25 -1.05 -0.07 -0.87 0.00 0.00 176.83 174.60 1w36 h LEU 286 N 0.13 0.57 0.00 5.97 3.38 -1.69 -3.09 115.31 120.58 1w36 h LEU 286 Ca 0.62 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1w36 h LEU 286 Cb 1.33 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1w36 h LEU 286 CO -0.74 1.31 0.00 -0.62 0.09 0.00 0.00 178.44 178.48 1w36 n GLU 287 N -3.71 0.37 -2.73 1.13 1.02 0.37 -5.12 120.64 111.97 1w36 n GLU 287 Ca -0.08 0.07 -0.02 0.00 -0.02 0.00 0.00 57.16 57.11 1w36 n GLU 287 Cb 0.89 -1.50 0.10 0.00 -0.02 0.00 0.00 31.44 30.91 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 -1.15 1.45 0.00 3.49 5.02 0.25 -5.03 118.16 122.20 1w36 n LYS 288 Ca 0.10 -2.17 0.00 0.00 -2.02 0.00 0.00 58.31 54.22 1w36 n LYS 288 Cb 0.09 -0.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.70 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 -1.04 0.00 0.00 1.97 -0.02 -1.26 -4.90 135.00 129.75 1w36 n PRO 305 Ca -0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1w36 n PRO 305 Cb 0.85 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.33 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 -4.39 -0.52 1.74 -1.26 -4.85 116.66 107.38 1w36 n ARG 306 Ca 0.00 0.00 -0.19 0.00 -0.77 0.00 0.00 57.85 56.89 1w36 n ARG 306 Cb 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.34 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 -0.93 1.79 0.00 -1.55 3.76 -1.26 -4.93 115.29 112.17 1w36 s HIS 307 Ca 0.00 -1.05 0.00 0.00 -0.15 0.00 0.00 55.06 53.86 1w36 s HIS 307 Cb 0.00 -1.12 0.00 0.00 1.11 0.00 0.00 32.58 32.57 1w36 s HIS 307 CO 0.00 -0.13 0.00 -0.35 -0.85 0.00 0.00 174.74 173.41 1w36 n PRO 308 N -0.59 3.53 -2.06 8.40 -0.04 -1.26 -5.06 135.00 137.92 1w36 n PRO 308 Ca -0.01 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.04 1w36 n PRO 308 Cb 0.66 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 34.12 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 7.88 -2.64 1.53 4.77 -1.26 -4.48 117.00 122.79 1w36 n LEU 309 Ca 0.00 -4.88 -0.11 0.00 -0.03 0.00 0.00 56.01 50.99 1w36 n LEU 309 Cb 0.00 -1.37 0.03 0.00 -2.33 0.00 0.00 43.42 39.75 1w36 n LEU 309 CO 0.00 1.99 -0.08 2.22 -1.33 0.00 0.00 177.39 180.19 1w36 n PHE 310 N 1.90 1.41 1.38 -1.77 -0.00 -1.26 -4.77 117.46 114.34 1w36 n PHE 310 Ca 0.59 -2.80 0.04 0.00 -0.00 0.00 0.00 57.45 55.29 1w36 n PHE 310 Cb 0.26 -0.34 0.13 0.00 -0.00 0.00 0.00 39.48 39.52 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 -0.13 1.46 0.00 3.97 1.02 -1.26 -2.81 120.64 122.89 1w36 n GLU 311 Ca 0.12 -0.72 0.13 0.00 -0.02 0.00 0.00 57.16 56.68 1w36 n GLU 311 Cb 0.80 -1.18 0.41 0.00 -0.02 0.00 0.00 31.44 31.46 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 0.07 3.09 -0.00 0.62 0.00 -1.26 -3.20 120.51 119.82 1w36 n ALA 312 Ca 0.08 -0.34 -0.04 0.00 0.00 0.00 0.00 53.44 53.13 1w36 n ALA 312 Cb 0.17 -1.19 -0.11 0.00 0.00 0.00 0.00 19.45 18.32 1w36 n ALA 312 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1w36 n ILE 313 N -0.97 1.34 -0.22 0.00 5.41 -1.12 -2.20 119.36 121.60 1w36 n ILE 313 Ca 0.11 -0.74 -0.05 0.00 1.00 0.00 0.00 62.75 63.06 1w36 n ILE 313 Cb 0.33 -0.82 0.10 0.00 -0.71 0.00 0.00 39.64 38.54 1w36 n ILE 313 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1w36 h ASP 314 N 0.00 0.98 0.67 4.38 5.19 -1.74 -2.69 116.42 123.21 1w36 h ASP 314 Ca -0.24 -0.19 -0.16 0.00 -0.62 0.00 0.00 57.03 55.82 1w36 h ASP 314 Cb 1.79 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 41.03 1w36 h ASP 314 CO 0.06 0.93 -0.74 1.56 -3.12 0.00 0.00 179.24 177.93 1w36 h GLN 315 N 1.00 0.05 -0.02 3.56 4.20 -1.59 -3.24 115.11 119.07 1w36 h GLN 315 Ca 0.21 -0.05 -0.21 0.00 0.06 0.00 0.00 58.65 58.66 1w36 h GLN 315 Cb 0.32 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 1w36 h GLN 315 CO -0.00 0.76 -0.88 -0.07 -0.67 0.00 0.00 178.83 177.97 1w36 h LEU 316 N 0.03 0.49 -0.59 1.46 3.38 -1.23 -3.24 115.31 115.61 1w36 h LEU 316 Ca -0.01 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1w36 h LEU 316 Cb 1.30 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1w36 h LEU 316 CO 0.10 1.16 0.00 0.18 0.09 0.00 0.00 178.44 179.97 1w36 n LEU 317 N -3.76 0.86 -0.04 1.67 4.77 -1.03 -3.93 117.00 115.55 1w36 n LEU 317 Ca -0.06 -0.43 -0.03 0.00 -0.03 0.00 0.00 56.01 55.47 1w36 n LEU 317 Cb 0.80 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.78 1w36 n LEU 317 CO 0.50 0.21 -0.20 0.00 -1.33 0.00 0.00 177.39 176.57 1w36 n ALA 318 N -0.05 0.26 -1.80 -1.18 0.00 -1.22 -4.91 120.51 111.60 1w36 n ALA 318 Ca 0.06 -0.32 -0.42 0.00 0.00 0.00 0.00 53.44 52.76 1w36 n ALA 318 Cb 0.14 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.57 1w36 n ALA 318 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1w36 s GLU 319 N -1.66 4.16 0.31 0.00 -1.05 -1.25 -4.95 118.70 114.26 1w36 s GLU 319 Ca -0.08 2.46 0.05 0.00 -0.15 0.00 0.00 54.97 57.24 1w36 s GLU 319 Cb 0.01 -3.98 0.84 0.00 -0.44 0.00 0.00 34.13 30.56 1w36 s GLU 319 CO 0.13 -0.88 1.51 -2.30 0.95 0.00 0.00 175.26 174.66 1w36 n PRO 320 N 6.97 -0.07 -2.64 -4.83 -0.02 -1.26 -4.93 135.00 128.21 1w36 n PRO 320 Ca 0.18 1.42 -0.05 0.00 -2.02 0.00 0.00 63.50 63.03 1w36 n PRO 320 Cb 0.41 -2.31 0.01 0.00 -0.02 0.00 0.00 33.50 31.59 1w36 n PRO 320 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1w36 n LEU 321 N -5.39 -6.74 -3.48 2.45 4.77 -1.26 -5.06 117.00 102.30 1w36 n LEU 321 Ca 0.25 0.35 -0.10 0.00 -0.03 0.00 0.00 56.01 56.48 1w36 n LEU 321 Cb 0.83 -2.97 -0.02 0.00 -2.33 0.00 0.00 43.42 38.93 1w36 n LEU 321 CO -0.06 -1.76 0.57 -0.55 -1.33 0.00 0.00 177.39 174.26 1w36 s SER 322 N -2.42 -0.46 -0.01 -1.43 0.15 -1.26 -4.99 113.70 103.28 1w36 s SER 322 Ca 0.17 0.05 0.16 0.00 0.70 0.00 0.00 55.95 57.02 1w36 s SER 322 Cb -0.05 0.47 -0.20 0.00 -1.71 0.00 0.00 66.02 64.53 1w36 s SER 322 CO 0.63 -0.74 0.54 0.00 1.20 0.00 0.00 173.24 174.87 1w36 n ILE 323 N -0.21 0.00 -0.02 6.45 0.13 -1.26 -4.81 119.36 119.64 1w36 n ILE 323 Ca -0.12 -0.23 -0.01 0.00 -1.10 0.00 0.00 62.75 61.30 1w36 n ILE 323 Cb 0.63 0.65 -0.00 0.00 -0.84 0.00 0.00 39.64 40.07 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 -1.65 -0.02 -0.27 9.51 0.63 -1.26 -1.40 116.66 122.21 1w36 n ARG 324 Ca 0.01 0.90 0.05 0.00 -0.92 0.00 0.00 57.85 57.89 1w36 n ARG 324 Cb 0.32 -1.35 0.28 0.00 0.45 0.00 0.00 32.46 32.16 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 0.92 6.15 2.03 -1.87 0.59 116.42 125.05 1w36 h ASP 325 Ca 0.01 0.01 -0.05 0.00 -0.73 0.00 0.00 57.03 56.27 1w36 h ASP 325 Cb 0.02 -0.16 0.01 0.00 -0.83 0.00 0.00 39.33 38.37 1w36 h ASP 325 CO -0.05 0.51 -0.44 0.25 -1.03 0.00 0.00 179.24 178.48 1w36 h LEU 326 N 0.92 -1.05 0.33 0.15 7.12 -1.76 -0.42 115.31 120.60 1w36 h LEU 326 Ca 0.37 0.04 -0.01 0.00 0.13 0.00 0.00 57.88 58.41 1w36 h LEU 326 Cb 0.27 0.27 -0.02 0.00 -0.53 0.00 0.00 40.66 40.65 1w36 h LEU 326 CO -0.14 -0.71 -0.40 0.58 -0.13 0.00 0.00 178.44 177.64 1w36 h VAL 327 N -1.31 0.00 -0.28 1.05 2.07 -0.98 -1.49 116.25 115.32 1w36 h VAL 327 Ca -0.13 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.42 1w36 h VAL 327 Cb 0.95 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1w36 h VAL 327 CO 0.21 0.00 -0.17 -0.38 0.02 0.00 0.00 177.57 177.25 1w36 n ILE 328 N -4.78 -0.19 -0.32 4.57 5.41 0.18 0.62 119.36 124.85 1w36 n ILE 328 Ca -0.09 1.56 0.08 0.00 1.00 0.00 0.00 62.75 65.30 1w36 n ILE 328 Cb 0.35 -2.01 0.19 0.00 -0.71 0.00 0.00 39.64 37.46 1w36 n ILE 328 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1w36 h THR 329 N 0.00 0.11 -0.73 1.39 2.02 -0.98 0.33 112.91 115.04 1w36 h THR 329 Ca 0.04 -0.01 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 1w36 h THR 329 Cb 0.12 0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 1w36 h THR 329 CO -0.26 0.00 0.31 0.03 0.37 0.00 0.00 175.52 175.97 1w36 h ARG 330 N 0.03 1.08 0.55 6.66 -0.00 0.13 -2.85 114.38 119.98 1w36 h ARG 330 Ca 0.49 -0.18 -0.02 0.00 -0.50 0.00 0.00 59.98 59.77 1w36 h ARG 330 Cb 0.89 -0.18 -0.01 0.00 0.00 0.00 0.00 29.97 30.66 1w36 h ARG 330 CO -0.88 0.88 -0.43 0.00 0.00 0.00 0.00 179.97 179.54 1w36 h ALA 331 N 1.15 -1.01 -0.22 0.04 0.00 0.15 0.13 119.26 119.50 1w36 h ALA 331 Ca 0.25 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1w36 h ALA 331 Cb 0.18 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1w36 h ALA 331 CO -0.02 -1.10 -0.13 1.37 0.00 0.00 0.00 179.25 179.36 1w36 h LEU 332 N -0.96 0.34 -0.33 0.00 -0.00 -1.47 2.66 115.31 115.56 1w36 h LEU 332 Ca -0.06 -0.08 -0.01 0.00 -0.00 0.00 0.00 57.88 57.73 1w36 h LEU 332 Cb 0.81 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 41.36 1w36 h LEU 332 CO 0.00 0.51 0.16 0.00 -0.00 0.00 0.00 178.44 179.11 1w36 h ALA 333 N 1.53 0.42 0.14 0.17 0.00 -1.34 -2.57 119.26 117.61 1w36 h ALA 333 Ca 0.06 -0.09 -0.28 0.00 0.00 0.00 0.00 54.91 54.61 1w36 h ALA 333 Cb 0.44 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 18.13 1w36 h ALA 333 CO 0.03 -0.02 -1.16 1.49 0.00 0.00 0.00 179.25 179.58 1w36 h GLU 334 N 0.40 0.55 -0.33 0.00 4.81 0.45 -3.14 114.58 117.32 1w36 h GLU 334 Ca 0.11 -0.77 -0.02 0.00 -0.13 0.00 0.00 59.36 58.55 1w36 h GLU 334 Cb 0.11 0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1w36 h GLU 334 CO -0.02 1.35 0.11 0.82 -0.73 0.00 0.00 179.01 180.54 1w36 h ILE 335 N 0.12 1.14 0.68 2.32 2.04 0.46 -1.10 117.51 123.16 1w36 h ILE 335 Ca -0.18 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 1w36 h ILE 335 Cb 1.86 0.77 0.01 0.00 -0.74 0.00 0.00 36.82 38.72 1w36 h ILE 335 CO 0.22 0.17 -0.33 0.03 0.00 0.00 0.00 178.15 178.24 1w36 h ARG 336 N 0.46 -0.88 0.00 2.37 3.08 -1.51 -2.57 114.38 115.33 1w36 h ARG 336 Ca 0.11 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1w36 h ARG 336 Cb 0.13 0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1w36 h ARG 336 CO -0.01 -0.56 0.00 1.05 -1.07 0.00 0.00 179.97 179.38 1w36 h GLU 337 N -1.03 0.00 0.21 0.04 4.11 -1.39 -0.10 114.58 116.42 1w36 h GLU 337 Ca -0.09 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.33 1w36 h GLU 337 Cb 0.73 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1w36 h GLU 337 CO 0.15 0.00 -0.10 1.15 0.07 0.00 0.00 179.01 180.28 1w36 h THR 338 N 0.00 0.87 -0.38 -1.06 2.02 -1.06 0.83 112.91 114.13 1w36 h THR 338 Ca 0.00 -0.72 0.08 0.00 0.77 0.00 0.00 66.41 66.54 1w36 h THR 338 Cb 0.25 1.28 -0.09 0.00 -1.74 0.00 0.00 68.15 67.85 1w36 h THR 338 CO 0.00 0.15 -0.21 0.58 0.37 0.00 0.00 175.52 176.42 1w36 h VAL 339 N -0.66 0.40 0.33 3.16 2.07 -0.95 0.11 116.25 120.71 1w36 h VAL 339 Ca -0.03 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1w36 h VAL 339 Cb 0.47 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1w36 h VAL 339 CO 0.05 0.00 -0.39 0.00 0.02 0.00 0.00 177.57 177.25 1w36 h ALA 340 N 1.09 -1.03 -0.58 1.67 0.00 -0.96 0.86 119.26 120.32 1w36 h ALA 340 Ca 0.19 -0.13 0.12 0.00 0.00 0.00 0.00 54.91 55.08 1w36 h ALA 340 Cb 0.44 0.66 -0.10 0.00 0.00 0.00 0.00 17.79 18.79 1w36 h ALA 340 CO -0.47 -1.07 0.02 0.00 0.00 0.00 0.00 179.25 177.73 1w36 h ARG 341 N -0.73 0.13 -0.13 0.00 3.08 -0.30 0.07 114.38 116.51 1w36 h ARG 341 Ca -0.04 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.04 1w36 h ARG 341 Cb 0.65 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.63 1w36 h ARG 341 CO -0.08 0.09 -0.13 1.49 -1.07 0.00 0.00 179.97 180.26 1w36 h GLU 342 N 0.14 -0.15 -0.82 0.04 4.57 -0.52 -0.22 114.58 117.62 1w36 h GLU 342 Ca 0.30 0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.55 1w36 h GLU 342 Cb 0.47 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.05 1w36 h GLU 342 CO -0.48 -0.10 0.53 0.87 -1.18 0.00 0.00 179.01 178.65 1w36 h LYS 343 N -0.16 0.87 0.67 1.92 1.57 0.96 -1.46 116.57 120.94 1w36 h LYS 343 Ca 0.09 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 1w36 h LYS 343 Cb 0.29 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.41 1w36 h LYS 343 CO -0.22 0.58 -0.32 0.00 -0.57 0.00 0.00 179.45 178.91 1w36 h ARG 344 N 0.90 -0.87 -0.90 3.15 3.08 0.02 0.82 114.38 120.57 1w36 h ARG 344 Ca 0.35 0.06 0.22 0.00 0.07 0.00 0.00 59.98 60.68 1w36 h ARG 344 Cb 0.22 0.20 -0.17 0.00 0.08 0.00 0.00 29.97 30.30 1w36 h ARG 344 CO -0.12 -0.58 -0.05 -0.09 -1.07 0.00 0.00 179.97 178.05 1w36 h ARG 345 N -1.15 0.04 0.00 0.04 2.43 -0.81 0.93 114.38 115.87 1w36 h ARG 345 Ca -0.09 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.03 1w36 h ARG 345 Cb 0.69 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 1w36 h ARG 345 CO 0.15 0.02 -0.20 0.00 -1.51 0.00 0.00 179.97 178.44 1w36 h ARG 346 N 0.04 0.00 -0.93 0.20 3.08 -1.30 -3.47 114.38 112.00 1w36 h ARG 346 Ca 0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.55 1w36 h ARG 346 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1w36 h ARG 346 CO -0.85 0.20 0.00 0.41 -1.07 0.00 0.00 179.97 178.65 1w36 n GLY 347 N -0.26 0.81 3.60 0.04 0.00 0.32 -4.98 105.19 104.72 1w36 n GLY 347 Ca -0.01 -0.43 -0.27 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.20 1.93 -0.09 1.61 2.02 0.23 -2.28 118.70 118.92 1w36 s GLU 348 Ca 0.00 -2.12 -0.04 0.00 0.02 0.00 0.00 54.97 52.83 1w36 s GLU 348 Cb 0.00 -1.37 0.04 0.00 0.10 0.00 0.00 34.13 32.90 1w36 s GLU 348 CO 0.00 -0.17 0.20 -1.17 0.02 0.00 0.00 175.26 174.14 1w36 s LEU 349 N -3.68 0.56 0.00 1.80 2.96 -0.36 -4.61 118.68 115.34 1w36 s LEU 349 Ca 0.29 0.41 0.05 0.00 -0.22 0.00 0.00 54.13 54.66 1w36 s LEU 349 Cb 0.08 0.55 0.06 0.00 0.50 0.00 0.00 46.19 47.37 1w36 s LEU 349 CO 0.14 -0.16 0.46 0.61 -1.32 0.00 0.00 176.35 176.09 1w36 n GLY 350 N 4.22 1.82 0.11 7.98 0.00 -1.26 0.75 105.19 118.81 1w36 n GLY 350 Ca -0.26 -2.17 -0.18 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 -0.00 0.46 -0.11 1.61 0.05 -1.94 -3.06 116.94 113.94 1w36 h PHE 351 Ca -0.15 -0.30 0.03 0.00 3.82 0.00 0.00 57.97 61.37 1w36 h PHE 351 Cb 0.70 -0.03 -0.00 0.00 2.00 0.00 0.00 35.95 38.61 1w36 h PHE 351 CO 0.00 1.17 0.08 -0.44 -0.18 0.00 0.00 178.31 178.94 1w36 h ASP 352 N -0.38 0.00 -0.29 2.17 3.45 -1.99 -1.28 116.42 118.10 1w36 h ASP 352 Ca -0.09 0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.22 1w36 h ASP 352 Cb 1.38 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 40.15 1w36 h ASP 352 CO 0.11 0.00 -0.40 0.44 -1.57 0.00 0.00 179.24 177.82 1w36 h ASP 353 N 0.00 0.86 -0.30 6.45 3.32 -1.96 -2.15 116.42 122.64 1w36 h ASP 353 Ca 0.05 -0.50 0.04 0.00 0.02 0.00 0.00 57.03 56.64 1w36 h ASP 353 Cb 0.22 -0.24 -0.07 0.00 0.22 0.00 0.00 39.33 39.45 1w36 h ASP 353 CO -0.00 1.19 -0.54 -0.03 -1.72 0.00 0.00 179.24 178.14 1w36 h MET 354 N 0.54 -0.44 -0.01 3.56 4.05 -1.12 0.59 114.93 122.11 1w36 h MET 354 Ca 0.03 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.48 1w36 h MET 354 Cb 0.99 0.10 0.00 0.00 -0.80 0.00 0.00 31.60 31.89 1w36 h MET 354 CO 0.09 -0.29 -0.03 1.47 0.23 0.00 0.00 176.91 178.38 1w36 n LEU 355 N -5.30 0.53 -0.08 3.39 -0.00 -1.22 -2.68 117.00 111.64 1w36 n LEU 355 Ca -0.04 -0.12 -0.15 0.00 -0.00 0.00 0.00 56.01 55.70 1w36 n LEU 355 Cb 0.34 -0.06 -0.09 0.00 -0.00 0.00 0.00 43.42 43.61 1w36 n LEU 355 CO 0.03 0.09 -0.17 -1.28 -0.00 0.00 0.00 177.39 176.07 1w36 h SER 356 N 0.79 0.00 -0.12 1.45 0.87 -0.25 -3.05 113.55 113.24 1w36 h SER 356 Ca 0.00 -0.53 0.03 0.00 -1.23 0.00 0.00 61.79 60.06 1w36 h SER 356 Cb 0.25 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1w36 h SER 356 CO 0.00 1.13 0.11 0.03 -0.53 0.00 0.00 176.83 177.57 1w36 h ARG 357 N -1.00 0.00 0.00 2.24 2.47 0.05 0.19 114.38 118.33 1w36 h ARG 357 Ca -0.16 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.49 1w36 h ARG 357 Cb 0.96 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.27 1w36 h ARG 357 CO -0.10 0.00 -0.37 1.25 0.56 0.00 0.00 179.97 181.32 1w36 h LEU 358 N 0.00 0.00 0.16 3.04 6.46 -1.57 -2.00 115.31 121.40 1w36 h LEU 358 Ca 0.05 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.81 1w36 h LEU 358 Cb 0.27 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.21 1w36 h LEU 358 CO -0.00 0.37 -0.08 -0.78 -0.62 0.00 0.00 178.44 177.33 1w36 h ASP 359 N 0.00 -0.18 -0.55 1.25 3.58 -0.54 -2.90 116.42 117.06 1w36 h ASP 359 Ca -0.00 -0.34 0.16 0.00 0.42 0.00 0.00 57.03 57.27 1w36 h ASP 359 Cb 1.04 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.11 1w36 h ASP 359 CO 0.05 0.38 0.42 0.28 -2.88 0.00 0.00 179.24 177.48 1w36 h SER 360 N -0.89 0.00 0.24 2.28 0.02 -1.38 -0.21 113.55 113.61 1w36 h SER 360 Ca -0.02 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.76 1w36 h SER 360 Cb 0.51 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 1w36 h SER 360 CO 0.04 0.00 -0.66 0.00 -1.14 0.00 0.00 176.83 175.07 1w36 h ALA 361 N 1.68 0.69 -0.00 3.77 0.00 -1.35 -0.53 119.26 123.52 1w36 h ALA 361 Ca 0.26 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1w36 h ALA 361 Cb 1.10 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1w36 h ALA 361 CO -0.00 0.74 -0.11 1.28 0.00 0.00 0.00 179.25 181.16 1w36 n LEU 362 N -3.87 0.26 -0.01 0.00 4.77 -0.14 -3.43 117.00 114.59 1w36 n LEU 362 Ca -0.03 0.18 0.08 0.00 -0.03 0.00 0.00 56.01 56.20 1w36 n LEU 362 Cb 0.66 -0.29 -0.12 0.00 -2.33 0.00 0.00 43.42 41.35 1w36 n LEU 362 CO 0.47 0.05 -0.67 0.54 -1.33 0.00 0.00 177.39 176.45 1w36 n ARG 363 N -1.22 0.48 -0.69 3.23 1.74 -0.92 -4.66 116.66 114.62 1w36 n ARG 363 Ca 0.12 -0.14 -0.29 0.00 -0.77 0.00 0.00 57.85 56.77 1w36 n ARG 363 Cb 0.29 -1.36 0.25 0.00 -1.02 0.00 0.00 32.46 30.62 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 -3.72 0.85 0.18 0.55 1.04 -0.22 -4.82 113.70 107.55 1w36 s SER 364 Ca -0.05 1.22 -0.10 0.00 0.48 0.00 0.00 55.95 57.49 1w36 s SER 364 Cb 0.10 -1.87 0.06 0.00 0.10 0.00 0.00 66.02 64.41 1w36 s SER 364 CO 0.63 -4.24 1.65 -0.33 0.98 0.00 0.00 173.24 171.92 1w36 h GLU 365 N -2.65 1.03 -1.48 4.02 5.08 -1.91 -1.58 114.58 117.09 1w36 h GLU 365 Ca -0.56 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 57.49 1w36 h GLU 365 Cb 1.33 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1w36 h GLU 365 CO 0.47 1.00 0.00 -1.13 -1.00 0.00 0.00 179.01 178.35 1w36 n SER 366 N -4.23 1.13 0.03 1.42 3.41 -1.26 -3.70 113.62 110.42 1w36 n SER 366 Ca 0.03 -0.81 0.12 0.00 -0.26 0.00 0.00 58.87 57.95 1w36 n SER 366 Cb 0.32 -0.20 0.16 0.00 -0.26 0.00 0.00 64.21 64.23 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 0.75 -1.30 0.14 5.00 0.00 -0.60 -3.92 105.19 105.26 1w36 n GLY 367 Ca 0.00 -0.33 -0.22 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 0.31 -0.55 1.61 4.39 -1.83 -2.30 114.58 116.21 1w36 h GLU 368 Ca 0.00 -0.52 0.08 0.00 0.34 0.00 0.00 59.36 59.26 1w36 h GLU 368 Cb 0.64 0.20 -0.07 0.00 -0.10 0.00 0.00 28.75 29.42 1w36 h GLU 368 CO 0.00 1.25 0.18 0.28 -1.16 0.00 0.00 179.01 179.56 1w36 h VAL 369 N -0.04 0.77 0.27 3.13 2.07 -1.87 -0.99 116.25 119.59 1w36 h VAL 369 Ca -0.36 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1w36 h VAL 369 Cb 1.97 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1w36 h VAL 369 CO 0.11 0.06 -0.13 0.25 0.02 0.00 0.00 177.57 177.88 1w36 h LEU 370 N 0.35 -0.30 -0.81 2.57 5.85 -1.68 0.12 115.31 121.41 1w36 h LEU 370 Ca 0.27 -0.10 0.13 0.00 0.84 0.00 0.00 57.88 59.02 1w36 h LEU 370 Cb 0.33 0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.36 1w36 h LEU 370 CO -0.29 -0.08 0.41 0.00 -0.34 0.00 0.00 178.44 178.14 1w36 h ALA 371 N 0.16 1.18 -0.24 1.25 0.00 -1.08 -0.94 119.26 119.60 1w36 h ALA 371 Ca -0.04 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1w36 h ALA 371 Cb 0.39 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1w36 h ALA 371 CO 0.06 -0.06 0.02 0.00 0.00 0.00 0.00 179.25 179.27 1w36 h ALA 372 N 1.52 0.32 -0.07 0.00 0.00 -1.12 0.13 119.26 120.03 1w36 h ALA 372 Ca 0.43 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1w36 h ALA 372 Cb 0.55 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1w36 h ALA 372 CO -0.33 0.02 -0.21 0.00 0.00 0.00 0.00 179.25 178.73 1w36 h ALA 373 N 0.83 -0.58 -0.08 0.00 0.00 0.40 -1.25 119.26 118.58 1w36 h ALA 373 Ca 0.07 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1w36 h ALA 373 Cb 0.37 0.77 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 1w36 h ALA 373 CO 0.01 -0.66 -0.53 0.82 0.00 0.00 0.00 179.25 178.89 1w36 h ILE 374 N -0.21 0.02 -1.41 0.00 2.04 -1.16 -1.00 117.51 115.79 1w36 h ILE 374 Ca 0.02 0.00 0.41 0.00 1.00 0.00 0.00 64.86 66.29 1w36 h ILE 374 Cb 0.25 0.02 -0.08 0.00 -0.74 0.00 0.00 36.82 36.27 1w36 h ILE 374 CO -0.18 0.00 0.98 -0.09 0.00 0.00 0.00 178.15 178.87 1w36 h ARG 375 N -0.61 0.06 -0.04 2.37 2.43 -0.43 0.34 114.38 118.51 1w36 h ARG 375 Ca 0.03 -0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 58.98 1w36 h ARG 375 Cb 0.70 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 30.25 1w36 h ARG 375 CO -0.40 0.04 -0.83 1.15 -1.51 0.00 0.00 179.97 178.43 1w36 h THR 376 N 0.07 1.33 -0.19 0.20 2.02 0.03 -2.97 112.91 113.40 1w36 h THR 376 Ca 0.72 -2.11 -0.02 0.00 0.77 0.00 0.00 66.41 65.77 1w36 h THR 376 Cb 2.64 2.35 -0.01 0.00 -1.74 0.00 0.00 68.15 71.39 1w36 h THR 376 CO -0.12 0.64 0.04 -0.09 0.37 0.00 0.00 175.52 176.36 1w36 h ARG 377 N 0.26 0.30 -3.38 6.66 1.12 -0.10 -3.37 114.38 115.87 1w36 h ARG 377 Ca -0.09 -0.07 -0.65 0.00 -1.11 0.00 0.00 59.98 58.05 1w36 h ARG 377 Cb 1.49 -0.04 -0.40 0.00 -0.01 0.00 0.00 29.97 31.01 1w36 h ARG 377 CO 0.16 0.44 -0.58 -0.06 -3.11 0.00 0.00 179.97 176.83 1w36 s PHE 378 N -5.25 3.25 0.16 2.20 0.08 -0.34 -4.45 117.98 113.62 1w36 s PHE 378 Ca -0.14 -3.13 -0.12 0.00 0.12 0.00 0.00 56.93 53.66 1w36 s PHE 378 Cb 0.07 -2.87 0.04 0.00 -0.57 0.00 0.00 43.02 39.68 1w36 s PHE 378 CO 0.72 -0.74 1.64 -1.00 -0.10 0.00 0.00 175.22 175.73 1w36 h PRO 379 N 6.48 0.89 -6.02 0.24 0.13 -1.65 -3.41 132.00 128.66 1w36 h PRO 379 Ca -0.05 -0.25 -0.59 0.00 -0.87 0.00 0.00 66.00 64.24 1w36 h PRO 379 Cb 0.89 -0.10 -0.28 0.00 0.13 0.00 0.00 31.00 31.64 1w36 h PRO 379 CO 0.70 0.88 -0.85 0.54 -0.23 0.00 0.00 178.00 179.04 1w36 s VAL 380 N -5.15 1.63 -0.02 1.56 0.11 -1.26 -2.32 120.40 114.95 1w36 s VAL 380 Ca -0.12 -1.03 0.01 0.00 -2.93 0.00 0.00 61.98 57.91 1w36 s VAL 380 Cb 0.12 -1.38 0.01 0.00 -1.53 0.00 0.00 36.38 33.60 1w36 s VAL 380 CO 0.82 0.33 -0.02 0.00 -3.33 0.00 0.00 175.10 172.90 1w36 s ALA 381 N -0.63 0.31 -0.29 1.54 0.00 -0.50 -1.71 121.76 120.47 1w36 s ALA 381 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 51.96 51.93 1w36 s ALA 381 Cb -0.08 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.81 1w36 s ALA 381 CO 0.00 0.00 0.17 -1.64 0.00 0.00 0.00 175.76 174.30 1w36 s MET 382 N 0.44 3.69 -0.24 0.00 -1.94 0.34 -1.45 119.30 120.13 1w36 s MET 382 Ca -0.04 -0.49 -0.08 0.00 -1.71 0.00 0.00 55.69 53.36 1w36 s MET 382 Cb -0.07 -3.61 -0.04 0.00 2.01 0.00 0.00 34.83 33.12 1w36 s MET 382 CO -0.01 -0.28 0.10 0.42 -0.01 0.00 0.00 175.02 175.24 1w36 s ILE 383 N 1.70 4.67 0.33 2.53 -1.09 0.28 -0.73 121.20 128.89 1w36 s ILE 383 Ca 0.06 -0.05 0.07 0.00 -2.23 0.00 0.00 60.65 58.50 1w36 s ILE 383 Cb -0.16 -3.18 -0.01 0.00 -1.58 0.00 0.00 42.46 37.52 1w36 s ILE 383 CO 0.09 0.34 0.42 -0.62 -1.23 0.00 0.00 174.94 173.93 1w36 s ASP 384 N 1.40 5.80 -1.52 3.58 -1.08 -0.56 -0.86 116.67 123.43 1w36 s ASP 384 Ca 0.06 -0.26 0.00 0.00 -0.52 0.00 0.00 52.55 51.82 1w36 s ASP 384 Cb -0.15 -1.18 0.00 0.00 -1.46 0.00 0.00 42.92 40.13 1w36 s ASP 384 CO 0.05 -0.39 0.00 -0.62 0.52 0.00 0.00 175.17 174.73 1w36 n GLU 385 N -1.56 -1.35 -0.22 4.34 -0.58 -0.81 -4.70 120.64 115.76 1w36 n GLU 385 Ca -0.01 0.84 0.31 0.00 -0.42 0.00 0.00 57.16 57.88 1w36 n GLU 385 Cb 0.58 -5.13 0.63 0.00 -0.57 0.00 0.00 31.44 26.96 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 -1.64 0.67 116.94 119.23 1w36 h PHE 386 Ca -0.30 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.20 1w36 h PHE 386 Cb 0.95 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.69 1w36 h PHE 386 CO 0.42 0.00 0.04 -0.56 -2.23 0.00 0.00 178.31 175.98 1w36 h GLN 387 N 0.00 0.00 -0.97 1.11 -0.00 -1.85 -1.96 115.11 111.44 1w36 h GLN 387 Ca 0.49 0.00 -0.51 0.00 -0.00 0.00 0.00 58.65 58.63 1w36 h GLN 387 Cb 2.45 0.00 -0.30 0.00 -0.00 0.00 0.00 27.48 29.63 1w36 h GLN 387 CO -0.01 0.00 0.63 -0.25 -0.00 0.00 0.00 178.83 179.21 1w36 n ASP 388 N -2.78 3.81 -2.16 0.06 8.00 0.23 -4.55 116.55 119.15 1w36 n ASP 388 Ca -0.02 -3.62 0.00 0.00 0.71 0.00 0.00 54.79 51.85 1w36 n ASP 388 Cb 0.10 -0.83 0.00 0.00 -0.02 0.00 0.00 41.12 40.36 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 -1.14 0.00 -3.47 -3.53 -2.24 -0.74 -4.65 114.28 98.51 1w36 n THR 389 Ca 0.59 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 62.24 1w36 n THR 389 Cb 1.62 -1.76 -0.03 0.00 -2.10 0.00 0.00 70.33 68.05 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 -1.00 -0.56 0.11 3.42 -4.77 -1.26 -0.28 116.67 112.33 1w36 s ASP 390 Ca 0.00 0.25 -0.12 0.00 -3.30 0.00 0.00 52.55 49.38 1w36 s ASP 390 Cb 0.00 0.53 0.06 0.00 -1.09 0.00 0.00 42.92 42.42 1w36 s ASP 390 CO 0.00 -0.77 0.82 -0.81 0.70 0.00 0.00 175.17 175.12 1w36 n PRO 391 N 0.12 -0.17 -0.19 2.11 -0.04 -1.26 -1.09 135.00 134.47 1w36 n PRO 391 Ca -0.16 0.81 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 1w36 n PRO 391 Cb 0.62 -1.20 0.10 0.00 -0.04 0.00 0.00 33.50 32.97 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 0.21 0.22 0.54 4.20 -1.97 -0.87 115.11 117.44 1w36 h GLN 392 Ca 0.14 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 1w36 h GLN 392 Cb 0.28 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1w36 h GLN 392 CO -0.52 0.14 -0.10 1.96 -0.67 0.00 0.00 178.83 179.64 1w36 h GLN 393 N 0.22 -0.28 -0.56 1.46 4.20 -1.44 -2.16 115.11 116.54 1w36 h GLN 393 Ca 0.31 0.02 0.09 0.00 0.06 0.00 0.00 58.65 59.13 1w36 h GLN 393 Cb 0.46 0.06 -0.07 0.00 0.30 0.00 0.00 27.48 28.23 1w36 h GLN 393 CO -0.42 0.01 0.16 -0.92 -0.67 0.00 0.00 178.83 176.99 1w36 h TYR 394 N -0.57 0.26 -0.25 2.96 3.20 -1.26 0.10 116.97 121.41 1w36 h TYR 394 Ca -0.03 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1w36 h TYR 394 Cb 0.42 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 1w36 h TYR 394 CO 0.01 0.03 0.15 -0.09 -1.64 0.00 0.00 178.16 176.63 1w36 h ARG 395 N 0.31 0.34 -0.63 1.82 2.43 -1.17 0.09 114.38 117.57 1w36 h ARG 395 Ca 0.29 -0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.54 1w36 h ARG 395 Cb 0.38 -0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 29.77 1w36 h ARG 395 CO -0.33 0.27 0.16 0.82 -1.51 0.00 0.00 179.97 179.38 1w36 h ILE 396 N 0.31 0.64 -0.50 1.20 2.04 -0.38 -1.82 117.51 119.01 1w36 h ILE 396 Ca 0.09 -0.10 -0.12 0.00 1.00 0.00 0.00 64.86 65.73 1w36 h ILE 396 Cb 0.02 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 1w36 h ILE 396 CO -0.02 0.05 -0.14 -0.26 0.00 0.00 0.00 178.15 177.78 1w36 h PHE 397 N 0.29 1.10 0.01 1.37 0.05 -0.26 -2.81 116.94 116.69 1w36 h PHE 397 Ca 0.33 -0.24 -0.04 0.00 3.82 0.00 0.00 57.97 61.84 1w36 h PHE 397 Cb 0.49 -0.27 0.00 0.00 2.00 0.00 0.00 35.95 38.18 1w36 h PHE 397 CO -0.23 1.05 -0.16 0.07 -0.18 0.00 0.00 178.31 178.86 1w36 h ARG 398 N 0.83 0.09 -1.38 1.51 0.11 -0.79 -0.84 114.38 113.92 1w36 h ARG 398 Ca 0.12 -0.11 0.41 0.00 0.10 0.00 0.00 59.98 60.50 1w36 h ARG 398 Cb 0.71 0.04 -0.09 0.00 1.11 0.00 0.00 29.97 31.73 1w36 h ARG 398 CO 0.05 0.93 0.94 -0.09 0.10 0.00 0.00 179.97 181.90 1w36 h ARG 399 N -0.70 0.10 0.08 0.08 9.65 -1.42 0.42 114.38 122.59 1w36 h ARG 399 Ca -0.02 -0.01 -0.37 0.00 -1.10 0.00 0.00 59.98 58.48 1w36 h ARG 399 Cb 0.99 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 29.52 1w36 h ARG 399 CO 0.03 0.06 -2.13 -0.89 2.80 0.00 0.00 179.97 179.85 1w36 n ILE 400 N -4.40 1.68 -0.03 1.20 5.41 -1.06 -4.74 119.36 117.42 1w36 n ILE 400 Ca 0.34 -0.65 -0.00 0.00 1.00 0.00 0.00 62.75 63.44 1w36 n ILE 400 Cb 1.42 -1.57 -0.08 0.00 -0.71 0.00 0.00 39.64 38.69 1w36 n ILE 400 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1w36 n TRP 401 N -3.38 0.00 -1.70 1.39 8.01 -0.32 -4.79 117.44 116.65 1w36 n TRP 401 Ca -0.35 0.00 -0.43 0.00 -1.31 0.00 0.00 57.50 55.41 1w36 n TRP 401 Cb 1.04 -0.40 -0.01 0.00 -2.01 0.00 0.00 31.31 29.93 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 -2.17 2.25 -3.74 -5.99 -0.00 0.13 -3.13 115.22 102.57 1w36 n HIS 402 Ca -0.10 0.56 -0.28 0.00 0.46 0.00 0.00 57.72 58.36 1w36 n HIS 402 Cb 0.60 -2.41 0.01 0.00 -0.12 0.00 0.00 29.99 28.07 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 0.32 -1.42 -3.50 1.57 8.25 -1.26 -4.92 115.22 114.25 1w36 n HIS 403 Ca 0.05 0.42 -0.24 0.00 -0.26 0.00 0.00 57.72 57.69 1w36 n HIS 403 Cb 0.36 -2.22 -0.13 0.00 1.12 0.00 0.00 29.99 29.12 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 -5.45 0.21 1.06 -0.41 2.00 -1.18 -5.14 119.66 110.74 1w36 s GLN 404 Ca 0.16 -0.27 -0.14 0.00 -2.00 0.00 0.00 55.36 53.11 1w36 s GLN 404 Cb -0.09 -1.10 0.16 0.00 0.80 0.00 0.00 33.01 32.78 1w36 s GLN 404 CO 0.75 -0.94 0.66 -2.30 -0.50 0.00 0.00 175.29 172.97 1w36 n PRO 405 N 5.28 -1.33 -0.97 1.67 -0.02 -1.26 -3.20 135.00 135.18 1w36 n PRO 405 Ca -0.05 -0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.08 1w36 n PRO 405 Cb 0.45 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 1w36 n PRO 405 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1w36 n GLU 406 N -3.37 -1.01 -4.18 -0.52 -0.58 -1.26 -4.96 120.64 104.76 1w36 n GLU 406 Ca 0.05 0.25 -0.11 0.00 -0.42 0.00 0.00 57.16 56.94 1w36 n GLU 406 Cb 0.55 -4.07 -0.10 0.00 -0.57 0.00 0.00 31.44 27.25 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 -1.53 0.39 -0.06 2.62 -4.23 -1.19 -4.84 115.64 106.80 1w36 s THR 407 Ca 0.00 -1.92 -0.06 0.00 -1.18 0.00 0.00 61.69 58.53 1w36 s THR 407 Cb 0.00 -1.96 0.02 0.00 1.34 0.00 0.00 72.50 71.90 1w36 s THR 407 CO 0.00 -0.59 0.17 0.00 -0.54 0.00 0.00 174.62 173.66 1w36 s ALA 408 N -3.84 -0.42 -0.35 3.99 0.00 -0.98 -0.95 121.76 119.21 1w36 s ALA 408 Ca 0.20 0.46 0.02 0.00 0.00 0.00 0.00 51.96 52.65 1w36 s ALA 408 Cb 0.07 -0.27 0.11 0.00 0.00 0.00 0.00 23.12 23.02 1w36 s ALA 408 CO 0.00 -0.08 0.10 -1.17 0.00 0.00 0.00 175.76 174.61 1w36 s LEU 409 N 0.06 3.65 -0.31 0.00 2.96 -1.26 -1.41 118.68 122.37 1w36 s LEU 409 Ca -0.00 -2.08 -0.21 0.00 -0.22 0.00 0.00 54.13 51.62 1w36 s LEU 409 Cb -0.01 -1.31 -0.01 0.00 0.50 0.00 0.00 46.19 45.36 1w36 s LEU 409 CO 0.00 -0.37 0.65 -0.76 -1.32 0.00 0.00 176.35 174.55 1w36 s LEU 410 N 1.01 4.15 -0.36 -0.68 1.43 -0.53 -1.27 118.68 122.43 1w36 s LEU 410 Ca 0.12 0.44 -0.07 0.00 -1.03 0.00 0.00 54.13 53.58 1w36 s LEU 410 Cb -0.19 -2.84 0.05 0.00 0.03 0.00 0.00 46.19 43.23 1w36 s LEU 410 CO -0.13 -0.50 0.14 -0.76 0.23 0.00 0.00 176.35 175.33 1w36 s LEU 411 N 2.65 4.54 -0.02 1.79 1.43 -0.14 -0.56 118.68 128.39 1w36 s LEU 411 Ca 0.26 -1.26 0.06 0.00 -1.03 0.00 0.00 54.13 52.16 1w36 s LEU 411 Cb -0.15 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.16 1w36 s LEU 411 CO 0.12 -0.38 -0.19 -0.51 0.23 0.00 0.00 176.35 175.61 1w36 s ILE 412 N 1.39 2.63 -1.95 -0.59 2.07 -0.04 -0.42 121.20 124.29 1w36 s ILE 412 Ca -0.00 -0.97 0.00 0.00 -1.41 0.00 0.00 60.65 58.26 1w36 s ILE 412 Cb -0.20 -2.01 0.00 0.00 0.13 0.00 0.00 42.46 40.38 1w36 s ILE 412 CO 0.02 0.53 0.00 0.61 -1.91 0.00 0.00 174.94 174.19 1w36 n GLY 413 N 2.17 -0.62 3.19 1.50 0.00 -0.84 -1.93 105.19 108.66 1w36 n GLY 413 Ca -0.17 -0.60 0.02 0.00 0.00 0.00 0.00 46.02 45.27 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 -1.22 0.56 1.61 -1.08 -1.26 -0.77 116.67 110.50 1w36 s ASP 414 Ca 0.00 0.91 0.29 0.00 -0.52 0.00 0.00 52.55 53.23 1w36 s ASP 414 Cb 0.00 2.09 1.66 0.00 -1.46 0.00 0.00 42.92 45.21 1w36 s ASP 414 CO 0.00 -0.26 2.16 1.55 0.52 0.00 0.00 175.17 179.15 1w36 h PRO 415 N 8.02 0.00 0.00 4.34 0.13 -1.94 -0.93 132.00 141.61 1w36 h PRO 415 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1w36 h PRO 415 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1w36 h PRO 415 CO 0.24 0.06 0.00 1.63 -0.23 0.00 0.00 178.00 179.70 1w36 n LYS 416 N -3.69 0.12 -0.30 0.86 5.02 -1.26 -3.10 118.16 115.81 1w36 n LYS 416 Ca -0.02 0.19 0.08 0.00 -2.02 0.00 0.00 58.31 56.53 1w36 n LYS 416 Cb 0.16 -1.50 0.17 0.00 -0.02 0.00 0.00 35.03 33.85 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 -1.38 1.51 -2.75 1.97 6.02 -0.35 -4.59 117.38 117.81 1w36 n GLN 417 Ca 0.06 -2.86 -0.42 0.00 -0.01 0.00 0.00 57.00 53.76 1w36 n GLN 417 Cb 0.15 -1.58 -0.03 0.00 1.02 0.00 0.00 30.24 29.80 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 -3.01 3.02 -0.57 -1.58 0.00 -1.18 -4.76 121.76 113.68 1w36 s ALA 418 Ca 0.35 -2.13 0.06 0.00 0.00 0.00 0.00 51.96 50.24 1w36 s ALA 418 Cb 0.32 -4.15 0.12 0.00 0.00 0.00 0.00 23.12 19.41 1w36 s ALA 418 CO 0.00 -3.13 0.97 0.44 0.00 0.00 0.00 175.76 174.03 1w36 n ILE 419 N 6.12 0.63 -1.02 0.00 -5.35 -1.26 -4.74 119.36 113.74 1w36 n ILE 419 Ca 0.14 -0.82 -0.21 0.00 -0.27 0.00 0.00 62.75 61.60 1w36 n ILE 419 Cb 0.48 0.73 0.04 0.00 -1.74 0.00 0.00 39.64 39.15 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 0.14 1.86 0.07 4.28 4.02 -1.26 -4.60 117.16 121.67 1w36 n TYR 420 Ca 0.05 -2.17 -0.16 0.00 -0.01 0.00 0.00 57.90 55.62 1w36 n TYR 420 Cb 0.27 -1.08 -0.10 0.00 -0.02 0.00 0.00 39.34 38.42 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 1.68 -0.93 -0.84 -0.72 0.00 -1.86 -1.93 119.26 114.66 1w36 h ALA 421 Ca 0.36 -0.09 0.23 0.00 0.00 0.00 0.00 54.91 55.41 1w36 h ALA 421 Cb 0.87 0.92 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 1w36 h ALA 421 CO 0.93 -1.10 0.59 0.27 0.00 0.00 0.00 179.25 179.93 1w36 h PHE 422 N -0.68 0.16 0.07 0.00 -5.15 -1.88 -2.00 116.94 107.45 1w36 h PHE 422 Ca 0.01 0.01 -0.24 0.00 -0.20 0.00 0.00 57.97 57.54 1w36 h PHE 422 Cb 0.73 -0.05 -0.00 0.00 0.22 0.00 0.00 35.95 36.84 1w36 h PHE 422 CO -0.50 0.04 -1.10 0.00 -2.00 0.00 0.00 178.31 174.76 1w36 h ARG 423 N 0.12 0.23 0.00 6.09 3.08 -1.79 -3.47 114.38 118.64 1w36 h ARG 423 Ca 0.41 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1w36 h ARG 423 Cb 1.44 0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.61 1w36 h ARG 423 CO -0.06 1.12 0.00 0.41 -1.07 0.00 0.00 179.97 180.37 1w36 n GLY 424 N 1.31 0.39 3.67 0.04 0.00 -0.75 -5.02 105.19 104.83 1w36 n GLY 424 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 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 3.65 -0.44 4.61 0.00 -0.77 -4.72 121.76 124.08 1w36 s ALA 425 Ca 0.00 1.20 -0.11 0.00 0.00 0.00 0.00 51.96 53.05 1w36 s ALA 425 Cb 0.00 -3.76 0.08 0.00 0.00 0.00 0.00 23.12 19.44 1w36 s ALA 425 CO 0.00 -1.33 0.31 0.34 0.00 0.00 0.00 175.76 175.08 1w36 s ASP 426 N 3.28 5.80 0.51 0.00 2.15 0.62 -4.00 116.67 125.02 1w36 s ASP 426 Ca 0.79 -1.51 0.16 0.00 0.43 0.00 0.00 52.55 52.41 1w36 s ASP 426 Cb -0.40 -2.05 1.23 0.00 -0.30 0.00 0.00 42.92 41.40 1w36 s ASP 426 CO 0.35 -0.59 2.13 -0.29 -0.17 0.00 0.00 175.17 176.59 1w36 h ILE 427 N 5.99 1.02 -0.33 4.11 6.09 -1.84 -1.97 117.51 130.58 1w36 h ILE 427 Ca -0.24 -0.09 -0.16 0.00 -1.37 0.00 0.00 64.86 63.00 1w36 h ILE 427 Cb 1.09 1.03 -0.00 0.00 0.47 0.00 0.00 36.82 39.41 1w36 h ILE 427 CO 0.81 0.03 -0.41 -0.26 -3.07 0.00 0.00 178.15 175.25 1w36 h PHE 428 N 0.01 1.05 0.00 2.19 0.04 -1.92 -1.28 116.94 117.04 1w36 h PHE 428 Ca 0.00 -0.34 0.00 0.00 2.80 0.00 0.00 57.97 60.44 1w36 h PHE 428 Cb 0.04 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 37.98 1w36 h PHE 428 CO 0.00 1.15 0.00 -2.37 -0.60 0.00 0.00 178.31 176.49 1w36 n THR 429 N -4.10 0.90 0.04 -1.55 5.66 -0.77 -1.17 114.28 113.29 1w36 n THR 429 Ca -0.03 0.26 -0.20 0.00 -3.05 0.00 0.00 64.05 61.04 1w36 n THR 429 Cb 0.55 -1.16 -0.13 0.00 -1.55 0.00 0.00 70.33 68.04 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 0.62 -0.40 1.09 3.20 -1.05 -2.95 116.97 117.48 1w36 h TYR 430 Ca 0.00 -0.41 0.01 0.00 3.14 0.00 0.00 58.73 61.47 1w36 h TYR 430 Cb 0.32 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 1w36 h TYR 430 CO 0.00 1.28 0.26 0.52 -1.64 0.00 0.00 178.16 178.59 1w36 h MET 431 N -0.22 0.49 0.14 1.82 2.86 -0.12 -0.23 114.93 119.67 1w36 h MET 431 Ca -0.13 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.47 1w36 h MET 431 Cb 1.58 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 33.13 1w36 h MET 431 CO 0.15 0.33 -0.07 -0.22 1.06 0.00 0.00 176.91 178.16 1w36 h LYS 432 N 0.51 -0.19 -0.94 1.72 3.64 -1.22 -2.57 116.57 117.52 1w36 h LYS 432 Ca 0.15 0.01 0.21 0.00 -1.27 0.00 0.00 60.65 59.75 1w36 h LYS 432 Cb -0.02 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 31.77 1w36 h LYS 432 CO -0.03 0.23 0.61 0.00 -2.27 0.00 0.00 179.45 177.99 1w36 h ALA 433 N 0.05 2.12 -0.17 5.00 0.00 -1.27 1.20 119.26 126.19 1w36 h ALA 433 Ca -0.02 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1w36 h ALA 433 Cb 0.50 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1w36 h ALA 433 CO 0.03 -0.43 -0.09 -0.09 0.00 0.00 0.00 179.25 178.67 1w36 h ARG 434 N 0.47 0.26 -0.24 0.00 2.43 -0.77 -1.09 114.38 115.44 1w36 h ARG 434 Ca 0.51 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.53 1w36 h ARG 434 Cb 1.17 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1w36 h ARG 434 CO -0.23 0.36 -0.22 0.77 -1.51 0.00 0.00 179.97 179.15 1w36 h SER 435 N 0.25 0.61 0.85 -3.80 0.02 0.18 -3.28 113.55 108.38 1w36 h SER 435 Ca 0.05 -0.46 -0.08 0.00 -0.84 0.00 0.00 61.79 60.46 1w36 h SER 435 Cb 0.32 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1w36 h SER 435 CO 0.02 0.95 -0.39 -0.33 -1.14 0.00 0.00 176.83 175.93 1w36 h GLU 436 N 0.28 0.00 -5.82 3.45 5.08 -0.49 -3.43 114.58 113.65 1w36 h GLU 436 Ca 0.04 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.73 1w36 h GLU 436 Cb 0.76 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.89 1w36 h GLU 436 CO 0.05 0.39 -0.57 0.14 -1.00 0.00 0.00 179.01 178.03 1w36 s VAL 437 N -3.59 4.77 -0.06 3.13 -7.23 -0.48 -5.00 120.40 111.94 1w36 s VAL 437 Ca 0.00 -0.07 0.22 0.00 -1.81 0.00 0.00 61.98 60.32 1w36 s VAL 437 Cb 0.11 -3.04 -0.30 0.00 0.56 0.00 0.00 36.38 33.71 1w36 s VAL 437 CO 0.69 0.61 0.49 1.41 -0.31 0.00 0.00 175.10 177.99 1w36 n HIS 438 N 2.14 0.09 -2.77 2.82 8.25 -1.26 -4.82 115.22 119.66 1w36 n HIS 438 Ca -0.19 0.03 -0.43 0.00 -0.26 0.00 0.00 57.72 56.87 1w36 n HIS 438 Cb 0.54 -0.59 -0.04 0.00 1.12 0.00 0.00 29.99 31.02 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 -3.40 3.27 0.16 -1.41 0.00 -1.26 -3.32 121.76 115.80 1w36 s ALA 439 Ca -0.08 -0.63 0.05 0.00 0.00 0.00 0.00 51.96 51.31 1w36 s ALA 439 Cb 0.13 -3.66 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 1w36 s ALA 439 CO 0.89 -1.97 0.08 -1.01 0.00 0.00 0.00 175.76 173.76 1w36 s HIS 440 N 3.82 3.06 0.15 0.00 3.76 -1.26 -0.45 115.29 124.37 1w36 s HIS 440 Ca 0.40 -0.04 -0.17 0.00 -0.15 0.00 0.00 55.06 55.10 1w36 s HIS 440 Cb -0.10 -1.49 0.03 0.00 1.11 0.00 0.00 32.58 32.14 1w36 s HIS 440 CO 0.25 0.52 0.45 0.71 -0.85 0.00 0.00 174.74 175.82 1w36 s TYR 441 N -1.69 -0.18 0.03 1.40 2.02 -0.61 -3.10 117.35 115.21 1w36 s TYR 441 Ca 0.29 -0.13 -0.11 0.00 -0.37 0.00 0.00 57.07 56.75 1w36 s TYR 441 Cb -0.10 0.31 0.01 0.00 -0.40 0.00 0.00 41.96 41.78 1w36 s TYR 441 CO 0.22 -0.78 0.23 0.99 -1.57 0.00 0.00 175.55 174.64 1w36 s THR 442 N -3.83 0.10 -0.26 -0.71 2.01 -0.60 -0.72 115.64 111.63 1w36 s THR 442 Ca 0.05 -0.78 -0.13 0.00 0.31 0.00 0.00 61.69 61.14 1w36 s THR 442 Cb 0.01 -0.85 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 1w36 s THR 442 CO -0.09 -0.43 0.26 -0.76 -0.69 0.00 0.00 174.62 172.91 1w36 s LEU 443 N -1.95 4.06 0.06 4.42 1.43 -0.84 -1.70 118.68 124.17 1w36 s LEU 443 Ca -0.07 0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.24 1w36 s LEU 443 Cb -0.02 -2.25 -0.24 0.00 0.03 0.00 0.00 46.19 43.70 1w36 s LEU 443 CO -0.02 -0.07 1.05 -2.24 0.23 0.00 0.00 176.35 175.30 1w36 h ASP 444 N 7.99 0.17 -3.08 2.29 -0.00 -1.91 -3.40 116.42 118.49 1w36 h ASP 444 Ca -0.35 -0.22 -0.67 0.00 -0.00 0.00 0.00 57.03 55.79 1w36 h ASP 444 Cb 1.17 -0.06 -0.12 0.00 -0.00 0.00 0.00 39.33 40.33 1w36 h ASP 444 CO 0.62 1.18 -0.57 0.28 -0.00 0.00 0.00 179.24 180.75 1w36 s THR 445 N -2.66 4.74 -1.07 1.15 -1.32 -1.26 -1.22 115.64 114.00 1w36 s THR 445 Ca -0.03 -0.14 -0.10 0.00 -1.21 0.00 0.00 61.69 60.20 1w36 s THR 445 Cb 0.08 -3.05 0.27 0.00 -1.51 0.00 0.00 72.50 68.29 1w36 s THR 445 CO 0.84 0.56 1.07 0.21 -2.21 0.00 0.00 174.62 175.09 1w36 s ASN 446 N -1.09 7.23 1.39 8.08 3.84 -0.18 -4.36 114.94 129.84 1w36 s ASN 446 Ca 0.16 -3.43 -0.23 0.00 0.21 0.00 0.00 52.86 49.57 1w36 s ASN 446 Cb -0.12 -2.22 0.35 0.00 -0.55 0.00 0.00 41.25 38.72 1w36 s ASN 446 CO 0.05 -0.35 0.98 0.26 -2.79 0.00 0.00 177.10 175.25 1w36 s TRP 447 N -0.94 -0.56 0.00 0.43 0.51 -0.70 -3.59 118.94 114.08 1w36 s TRP 447 Ca 0.29 0.47 0.00 0.00 -2.12 0.00 0.00 56.10 54.74 1w36 s TRP 447 Cb -0.10 -3.07 0.00 0.00 -0.81 0.00 0.00 33.47 29.49 1w36 s TRP 447 CO -0.08 -4.80 0.00 0.54 -0.51 0.00 0.00 176.95 172.10 1w36 n ARG 448 N -5.46 0.00 -4.29 4.98 3.00 -1.26 -4.69 116.66 108.94 1w36 n ARG 448 Ca 0.14 0.00 -0.15 0.00 -0.01 0.00 0.00 57.85 57.83 1w36 n ARG 448 Cb 0.60 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.96 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 0.05 1.55 0.52 0.55 0.15 -1.24 -4.80 113.70 110.47 1w36 s SER 449 Ca 0.00 -1.19 -0.21 0.00 0.70 0.00 0.00 55.95 55.25 1w36 s SER 449 Cb 0.00 0.06 -0.06 0.00 -1.71 0.00 0.00 66.02 64.31 1w36 s SER 449 CO 0.00 -0.53 1.21 0.00 1.20 0.00 0.00 173.24 175.12 1w36 s ALA 450 N -3.52 2.81 0.39 5.45 0.00 -1.03 -4.63 121.76 121.23 1w36 s ALA 450 Ca 0.26 1.02 0.08 0.00 0.00 0.00 0.00 51.96 53.32 1w36 s ALA 450 Cb 0.06 -3.43 0.80 0.00 0.00 0.00 0.00 23.12 20.55 1w36 s ALA 450 CO 0.06 -0.94 1.98 -1.00 0.00 0.00 0.00 175.76 175.87 1w36 h PRO 451 N 1.56 0.41 -0.24 0.00 0.13 -1.87 -0.11 132.00 131.88 1w36 h PRO 451 Ca -0.50 -0.06 -0.20 0.00 -0.87 0.00 0.00 66.00 64.37 1w36 h PRO 451 Cb 1.27 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1w36 h PRO 451 CO 0.58 0.39 -0.63 0.78 -0.23 0.00 0.00 178.00 178.89 1w36 h GLY 452 N 0.63 0.93 0.98 1.56 0.00 -1.92 0.15 103.07 105.40 1w36 h GLY 452 Ca 0.10 -1.17 -0.01 0.00 0.00 0.00 0.00 47.33 46.26 1w36 h GLY 452 CO -0.00 1.04 -0.07 -0.33 0.00 0.00 0.00 176.54 177.18 1w36 h MET 453 N 0.61 -0.18 -0.76 4.80 2.86 -1.75 0.18 114.93 120.69 1w36 h MET 453 Ca -0.01 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1w36 h MET 453 Cb 1.25 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.91 1w36 h MET 453 CO 0.14 -0.12 0.46 0.28 1.06 0.00 0.00 176.91 178.72 1w36 h VAL 454 N -0.19 1.21 -0.16 -2.22 2.07 -0.94 -2.27 116.25 113.75 1w36 h VAL 454 Ca -0.02 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 1w36 h VAL 454 Cb 0.15 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 1w36 h VAL 454 CO 0.02 0.23 -0.02 0.78 0.02 0.00 0.00 177.57 178.60 1w36 h ASN 455 N 1.05 0.29 0.97 0.57 -0.26 -0.04 -2.48 115.58 115.68 1w36 h ASN 455 Ca 0.27 -0.33 -0.04 0.00 -0.56 0.00 0.00 56.30 55.64 1w36 h ASN 455 Cb -0.04 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.14 1w36 h ASN 455 CO -0.05 0.56 -0.20 0.77 -1.06 0.00 0.00 177.43 177.45 1w36 h SER 456 N 0.02 0.00 -0.00 5.81 4.64 -0.50 0.27 113.55 123.79 1w36 h SER 456 Ca 0.04 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 1w36 h SER 456 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1w36 h SER 456 CO 0.01 0.20 -0.10 0.58 -0.87 0.00 0.00 176.83 176.65 1w36 h VAL 457 N 0.00 1.57 -0.19 0.95 2.07 -1.40 -1.10 116.25 118.15 1w36 h VAL 457 Ca -0.00 -1.83 0.04 0.00 0.82 0.00 0.00 66.70 65.73 1w36 h VAL 457 Cb 0.73 2.77 -0.04 0.00 -1.52 0.00 0.00 31.29 33.24 1w36 h VAL 457 CO 0.03 0.49 -0.04 0.78 0.02 0.00 0.00 177.57 178.84 1w36 h ASN 458 N -0.64 -0.16 0.27 0.57 -0.26 -1.22 -0.33 115.58 113.81 1w36 h ASN 458 Ca -0.01 0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 1w36 h ASN 458 Cb 0.85 0.11 -0.04 0.00 -1.06 0.00 0.00 38.32 38.19 1w36 h ASN 458 CO 0.02 -0.06 -0.49 0.50 -1.06 0.00 0.00 177.43 176.34 1w36 h LYS 459 N 0.01 -0.79 -0.52 0.81 3.64 -0.50 -1.15 116.57 118.07 1w36 h LYS 459 Ca 0.09 0.05 0.10 0.00 -1.27 0.00 0.00 60.65 59.62 1w36 h LYS 459 Cb 0.14 0.18 -0.11 0.00 -0.41 0.00 0.00 32.23 32.03 1w36 h LYS 459 CO -0.19 -0.53 -0.32 1.25 -2.27 0.00 0.00 179.45 177.39 1w36 h LEU 460 N -0.82 -1.11 0.00 5.20 5.85 -0.63 0.13 115.31 123.93 1w36 h LEU 460 Ca -0.02 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1w36 h LEU 460 Cb 0.78 0.54 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1w36 h LEU 460 CO -0.19 -0.31 0.00 0.49 -0.34 0.00 0.00 178.44 178.09 1w36 n PHE 461 N -5.43 0.00 -0.03 1.25 3.01 -0.18 -3.35 117.46 112.73 1w36 n PHE 461 Ca 0.03 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.53 1w36 n PHE 461 Cb 0.35 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.66 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 -0.73 0.10 0.00 4.37 7.64 0.01 -4.65 113.62 120.36 1w36 n SER 462 Ca 0.11 0.04 0.00 0.00 1.01 0.00 0.00 58.87 60.03 1w36 n SER 462 Cb 0.05 1.48 0.00 0.00 -1.01 0.00 0.00 64.21 64.73 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 -2.48 0.00 -1.74 1.43 1.13 -1.09 -4.64 117.38 109.99 1w36 n GLN 463 Ca -0.13 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.63 1w36 n GLN 463 Cb 0.78 -0.18 0.18 0.00 0.11 0.00 0.00 30.24 31.12 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 0.00 1.93 0.35 5.09 -4.23 -1.26 -5.07 115.64 112.44 1w36 s THR 464 Ca 0.00 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.52 1w36 s THR 464 Cb 0.00 -2.88 -0.03 0.00 1.34 0.00 0.00 72.50 70.92 1w36 s THR 464 CO 0.00 0.00 0.55 -1.81 -0.54 0.00 0.00 174.62 172.82 1w36 s ASP 465 N -4.60 6.29 -0.67 3.99 1.11 -1.26 -4.47 116.67 117.06 1w36 s ASP 465 Ca 0.71 0.44 -0.13 0.00 0.18 0.00 0.00 52.55 53.76 1w36 s ASP 465 Cb -0.07 -2.02 0.02 0.00 1.07 0.00 0.00 42.92 41.92 1w36 s ASP 465 CO 0.53 -0.30 0.63 0.47 1.18 0.00 0.00 175.17 177.69 1w36 n ASP 466 N -1.79 -5.71 -0.12 0.27 9.92 -1.26 -4.78 116.55 113.08 1w36 n ASP 466 Ca -0.05 -0.48 -0.12 0.00 -0.53 0.00 0.00 54.79 53.61 1w36 n ASP 466 Cb 0.56 -2.48 -0.03 0.00 -0.64 0.00 0.00 41.12 38.53 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 1.47 0.50 -0.14 2.24 0.00 -1.83 -1.68 119.26 119.82 1w36 h ALA 467 Ca -0.48 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1w36 h ALA 467 Cb 1.32 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1w36 h ALA 467 CO 0.30 0.46 0.00 1.19 0.00 0.00 0.00 179.25 181.20 1w36 n PHE 468 N -4.28 0.33 -3.96 0.00 3.01 -1.26 -4.90 117.46 106.40 1w36 n PHE 468 Ca -0.02 -0.13 -0.31 0.00 1.01 0.00 0.00 57.45 58.00 1w36 n PHE 468 Cb 0.43 -0.09 -0.03 0.00 -0.01 0.00 0.00 39.48 39.78 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 0.05 -0.67 -3.08 -1.08 0.00 -0.63 -4.82 117.12 106.89 1w36 n MET 469 Ca 0.06 -0.01 0.02 0.00 0.00 0.00 0.00 57.70 57.77 1w36 n MET 469 Cb 0.29 -2.22 -0.00 0.00 0.00 0.00 0.00 33.22 31.29 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 -3.97 -1.30 0.32 3.17 2.99 -1.26 -4.96 117.98 112.97 1w36 s PHE 470 Ca 0.19 0.30 0.24 0.00 0.00 0.00 0.00 56.93 57.67 1w36 s PHE 470 Cb -0.11 0.24 1.05 0.00 0.00 0.00 0.00 43.02 44.20 1w36 s PHE 470 CO 0.77 -0.86 1.07 2.89 -0.00 0.00 0.00 175.22 179.09 1w36 n ARG 471 N 4.37 -0.02 0.06 0.44 1.85 -1.26 0.24 116.66 122.34 1w36 n ARG 471 Ca 0.09 0.84 0.08 0.00 -1.00 0.00 0.00 57.85 57.85 1w36 n ARG 471 Cb 0.58 -1.70 0.35 0.00 -1.05 0.00 0.00 32.46 30.64 1w36 n ARG 471 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1w36 n GLU 472 N -3.92 0.08 -3.44 2.89 4.71 -1.26 -3.22 120.64 116.47 1w36 n GLU 472 Ca 0.28 0.40 -0.29 0.00 -0.01 0.00 0.00 57.16 57.54 1w36 n GLU 472 Cb 1.13 -1.67 -0.08 0.00 -1.01 0.00 0.00 31.44 29.81 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 -1.82 2.62 -2.54 -3.67 5.41 0.65 -5.02 119.36 114.98 1w36 n ILE 473 Ca 0.02 -5.26 -0.35 0.00 1.00 0.00 0.00 62.75 58.16 1w36 n ILE 473 Cb 0.14 -2.12 -0.04 0.00 -0.71 0.00 0.00 39.64 36.91 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 -2.37 4.02 -0.37 0.38 0.04 -1.20 -4.33 135.00 131.17 1w36 s PRO 474 Ca 0.37 1.45 -0.09 0.00 0.04 0.00 0.00 61.00 62.77 1w36 s PRO 474 Cb 0.11 -2.36 0.04 0.00 0.04 0.00 0.00 34.50 32.34 1w36 s PRO 474 CO -0.02 -0.26 0.17 0.12 0.04 0.00 0.00 177.00 177.05 1w36 s PHE 475 N -1.79 3.26 -0.21 0.56 5.36 -1.26 -5.03 117.98 118.87 1w36 s PHE 475 Ca 0.62 -1.23 -0.06 0.00 -0.96 0.00 0.00 56.93 55.30 1w36 s PHE 475 Cb -0.20 -2.43 -0.03 0.00 -0.34 0.00 0.00 43.02 40.02 1w36 s PHE 475 CO 0.24 -0.71 0.02 0.96 -1.46 0.00 0.00 175.22 174.27 1w36 s ILE 476 N 1.47 4.09 1.06 3.12 -4.36 -1.26 -4.96 121.20 120.36 1w36 s ILE 476 Ca 0.01 -0.26 -0.18 0.00 -0.26 0.00 0.00 60.65 59.95 1w36 s ILE 476 Cb -0.20 -2.86 0.04 0.00 1.25 0.00 0.00 42.46 40.69 1w36 s ILE 476 CO 0.04 0.41 -0.12 -2.65 0.24 0.00 0.00 174.94 172.87 1w36 n PRO 477 N 4.35 -1.04 -4.08 0.37 -0.02 -1.26 -5.05 135.00 128.27 1w36 n PRO 477 Ca -0.17 -0.28 -0.09 0.00 -2.02 0.00 0.00 63.50 60.94 1w36 n PRO 477 Cb 0.52 -1.62 -0.10 0.00 -0.02 0.00 0.00 33.50 32.27 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 -2.23 0.32 0.24 -1.45 -7.23 -1.26 -5.00 120.40 103.78 1w36 s VAL 478 Ca 0.53 -1.55 -0.06 0.00 -1.81 0.00 0.00 61.98 59.09 1w36 s VAL 478 Cb -0.12 -1.17 -0.06 0.00 0.56 0.00 0.00 36.38 35.60 1w36 s VAL 478 CO 0.67 -0.80 0.51 -1.59 -0.31 0.00 0.00 175.10 173.58 1w36 s LYS 479 N -3.09 3.66 0.21 4.82 -2.85 -0.36 -4.92 119.74 117.20 1w36 s LYS 479 Ca 0.01 0.02 -0.09 0.00 -1.00 0.00 0.00 55.97 54.91 1w36 s LYS 479 Cb 0.01 -2.70 -0.07 0.00 -2.06 0.00 0.00 37.83 33.02 1w36 s LYS 479 CO -0.06 0.30 0.51 -1.54 0.10 0.00 0.00 175.35 174.66 1w36 s SER 480 N -2.85 6.61 0.63 0.03 1.04 -1.26 -1.01 113.70 116.89 1w36 s SER 480 Ca 0.44 0.86 -0.14 0.00 0.48 0.00 0.00 55.95 57.59 1w36 s SER 480 Cb -0.11 -2.20 -0.02 0.00 0.10 0.00 0.00 66.02 63.79 1w36 s SER 480 CO 0.27 -0.04 1.06 0.00 0.98 0.00 0.00 173.24 175.51 1w36 s ALA 481 N -1.76 2.69 0.02 5.32 0.00 -1.24 -4.86 121.76 121.92 1w36 s ALA 481 Ca 0.45 0.34 -0.20 0.00 0.00 0.00 0.00 51.96 52.55 1w36 s ALA 481 Cb -0.12 -3.23 -0.17 0.00 0.00 0.00 0.00 23.12 19.60 1w36 s ALA 481 CO 0.22 -0.97 1.24 0.78 0.00 0.00 0.00 175.76 177.03 1w36 h GLY 482 N 0.11 0.42 0.88 0.00 0.00 -1.97 -2.91 103.07 99.60 1w36 h GLY 482 Ca -0.46 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 46.33 1w36 h GLY 482 CO 0.57 0.48 0.46 0.07 0.00 0.00 0.00 176.54 178.12 1w36 h LYS 483 N -0.06 0.00 -0.21 4.80 2.10 -2.00 0.30 116.57 121.50 1w36 h LYS 483 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1w36 h LYS 483 Cb 0.91 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.24 1w36 h LYS 483 CO 0.06 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.60 1w36 n ASN 484 N -2.23 2.94 0.26 7.07 5.03 -1.10 -4.69 115.26 122.54 1w36 n ASN 484 Ca -0.01 -2.41 0.14 0.00 0.87 0.00 0.00 54.58 53.17 1w36 n ASN 484 Cb 0.48 -0.29 0.67 0.00 -1.02 0.00 0.00 39.78 39.62 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 1.33 0.00 -0.00 3.52 1.08 -0.38 -3.08 115.11 117.58 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 0.91 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.34 1w36 h GLN 485 CO 0.06 0.12 -0.21 0.00 -0.95 0.00 0.00 178.83 177.86 1w36 n ALA 486 N -2.21 2.86 -1.77 3.87 0.00 -1.26 -4.84 120.51 117.16 1w36 n ALA 486 Ca -0.01 -0.22 -0.41 0.00 0.00 0.00 0.00 53.44 52.80 1w36 n ALA 486 Cb 0.30 -1.32 -0.01 0.00 0.00 0.00 0.00 19.45 18.43 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 -2.92 4.37 -0.15 0.00 1.43 -1.16 0.21 118.68 120.45 1w36 s LEU 487 Ca 0.15 2.88 -0.30 0.00 -1.03 0.00 0.00 54.13 55.83 1w36 s LEU 487 Cb 0.19 -3.67 0.13 0.00 0.03 0.00 0.00 46.19 42.87 1w36 s LEU 487 CO 0.59 -0.72 1.02 0.00 0.23 0.00 0.00 176.35 177.46 1w36 s ARG 488 N -1.96 0.57 -0.18 1.70 1.70 0.30 -4.80 118.95 116.28 1w36 s ARG 488 Ca 0.51 0.05 -0.01 0.00 -0.47 0.00 0.00 55.73 55.81 1w36 s ARG 488 Cb -0.43 0.27 -0.00 0.00 -0.57 0.00 0.00 34.95 34.22 1w36 s ARG 488 CO 0.58 -0.20 -0.12 0.12 -1.08 0.00 0.00 175.30 174.60 1w36 s PHE 489 N -1.49 2.85 0.08 5.89 5.36 -1.26 -1.78 117.98 127.62 1w36 s PHE 489 Ca 0.01 -1.10 0.06 0.00 -0.96 0.00 0.00 56.93 54.94 1w36 s PHE 489 Cb -0.01 -1.97 -0.04 0.00 -0.34 0.00 0.00 43.02 40.67 1w36 s PHE 489 CO -0.01 -0.55 -0.09 0.14 -1.46 0.00 0.00 175.22 173.25 1w36 s VAL 490 N 1.11 3.46 -0.06 3.12 -7.23 -0.56 0.35 120.40 120.59 1w36 s VAL 490 Ca 0.00 -1.14 -0.03 0.00 -1.81 0.00 0.00 61.98 59.01 1w36 s VAL 490 Cb -0.14 -2.59 0.04 0.00 0.56 0.00 0.00 36.38 34.24 1w36 s VAL 490 CO -0.04 0.18 0.15 0.12 -0.31 0.00 0.00 175.10 175.20 1w36 s PHE 491 N -1.17 -0.16 -1.01 2.82 5.36 -0.97 -0.68 117.98 122.17 1w36 s PHE 491 Ca 0.21 0.48 -0.13 0.00 -0.96 0.00 0.00 56.93 56.52 1w36 s PHE 491 Cb -0.11 -0.07 0.13 0.00 -0.34 0.00 0.00 43.02 42.63 1w36 s PHE 491 CO 0.13 -0.16 0.32 1.63 -1.46 0.00 0.00 175.22 175.68 1w36 n LYS 492 N 4.10 -1.22 0.00 10.12 5.02 0.46 -3.47 118.16 133.18 1w36 n LYS 492 Ca -0.25 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 1w36 n LYS 492 Cb 0.52 -3.36 0.00 0.00 -0.02 0.00 0.00 35.03 32.18 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 -0.76 0.13 3.83 0.72 0.00 -1.26 -5.13 105.19 102.71 1w36 n GLY 493 Ca 0.06 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1w36 n GLY 493 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1w36 s GLU 494 N 0.00 2.24 0.12 1.61 1.03 -1.23 -5.02 118.70 117.45 1w36 s GLU 494 Ca 0.00 -2.08 -0.33 0.00 0.03 0.00 0.00 54.97 52.59 1w36 s GLU 494 Cb 0.00 -1.92 -0.13 0.00 -0.80 0.00 0.00 34.13 31.29 1w36 s GLU 494 CO 0.00 -0.43 1.70 0.25 -1.33 0.00 0.00 175.26 175.45 1w36 n THR 495 N -1.51 0.17 -3.30 1.83 -2.24 -1.26 -2.29 114.28 105.68 1w36 n THR 495 Ca -0.06 -0.03 -0.31 0.00 -2.27 0.00 0.00 64.05 61.37 1w36 n THR 495 Cb 0.65 -1.78 -0.05 0.00 -2.10 0.00 0.00 70.33 67.05 1w36 n THR 495 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1w36 s GLN 496 N 1.83 3.81 0.54 -0.78 -1.52 0.16 -4.92 119.66 118.77 1w36 s GLN 496 Ca 0.81 0.33 -0.18 0.00 -1.95 0.00 0.00 55.36 54.37 1w36 s GLN 496 Cb -0.61 -2.58 -0.06 0.00 -0.22 0.00 0.00 33.01 29.54 1w36 s GLN 496 CO 0.39 0.24 1.06 -1.25 -0.25 0.00 0.00 175.29 175.47 1w36 s PRO 497 N -3.06 3.53 0.52 2.91 0.04 -1.26 -4.52 135.00 133.16 1w36 s PRO 497 Ca 0.48 1.32 0.35 0.00 0.04 0.00 0.00 61.00 63.19 1w36 s PRO 497 Cb -0.11 -2.06 1.71 0.00 0.04 0.00 0.00 34.50 34.09 1w36 s PRO 497 CO 0.23 -0.65 2.05 0.00 0.04 0.00 0.00 177.00 178.66 1w36 h ALA 498 N 1.02 1.00 -2.71 8.56 0.00 -1.71 -3.41 119.26 122.00 1w36 h ALA 498 Ca -0.48 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.25 1w36 h ALA 498 Cb 1.22 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.71 1w36 h ALA 498 CO 0.58 0.00 -0.47 1.41 0.00 0.00 0.00 179.25 180.77 1w36 s MET 499 N -3.79 0.21 -0.11 0.00 -2.45 0.42 -1.87 119.30 111.72 1w36 s MET 499 Ca -0.02 0.84 0.02 0.00 -1.25 0.00 0.00 55.69 55.29 1w36 s MET 499 Cb 0.10 0.08 0.01 0.00 1.25 0.00 0.00 34.83 36.27 1w36 s MET 499 CO 0.41 -0.28 -0.18 0.21 1.05 0.00 0.00 175.02 176.22 1w36 s LYS 500 N 2.49 2.46 -0.23 4.11 2.20 -0.27 -1.38 119.74 129.11 1w36 s LYS 500 Ca 0.00 -0.66 -0.19 0.00 -0.36 0.00 0.00 55.97 54.77 1w36 s LYS 500 Cb -0.12 -2.01 -0.03 0.00 -1.51 0.00 0.00 37.83 34.17 1w36 s LYS 500 CO -0.10 0.00 0.54 -1.64 -0.36 0.00 0.00 175.35 173.79 1w36 s MET 501 N 0.79 4.13 -0.13 4.03 -1.94 0.80 -1.86 119.30 125.12 1w36 s MET 501 Ca -0.10 0.41 -0.13 0.00 -1.71 0.00 0.00 55.69 54.16 1w36 s MET 501 Cb -0.16 -3.61 -0.05 0.00 2.01 0.00 0.00 34.83 33.02 1w36 s MET 501 CO 0.01 -0.28 0.28 -1.58 -0.01 0.00 0.00 175.02 173.44 1w36 s TRP 502 N 2.07 3.52 -0.23 -0.03 0.52 -0.44 -1.24 118.94 123.10 1w36 s TRP 502 Ca 0.23 0.63 -0.00 0.00 0.02 0.00 0.00 56.10 56.98 1w36 s TRP 502 Cb -0.16 -2.26 0.06 0.00 -1.15 0.00 0.00 33.47 29.97 1w36 s TRP 502 CO 0.09 0.38 -0.02 -1.17 0.02 0.00 0.00 176.95 176.25 1w36 s LEU 503 N -0.01 2.24 0.82 2.99 2.96 0.11 -0.31 118.68 127.49 1w36 s LEU 503 Ca 0.17 -1.14 -0.14 0.00 -0.22 0.00 0.00 54.13 52.80 1w36 s LEU 503 Cb -0.13 -1.02 0.01 0.00 0.50 0.00 0.00 46.19 45.55 1w36 s LEU 503 CO 0.05 -0.27 0.58 0.23 -1.32 0.00 0.00 176.35 175.62 1w36 n MET 504 N 4.77 0.06 -2.89 1.98 2.81 -0.78 -2.39 117.12 120.68 1w36 n MET 504 Ca -0.10 0.07 -0.20 0.00 -1.81 0.00 0.00 57.70 55.66 1w36 n MET 504 Cb 0.45 -1.93 0.07 0.00 -0.71 0.00 0.00 33.22 31.09 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 -3.30 2.21 0.00 0.03 2.02 -1.26 -4.72 118.70 113.69 1w36 s GLU 505 Ca 0.63 -1.41 0.00 0.00 0.02 0.00 0.00 54.97 54.21 1w36 s GLU 505 Cb -0.29 -2.57 0.00 0.00 0.10 0.00 0.00 34.13 31.38 1w36 s GLU 505 CO 0.61 -0.94 0.00 0.41 0.02 0.00 0.00 175.26 175.35 1w36 n GLY 506 N -2.36 -4.21 0.31 -1.39 0.00 -1.26 -4.89 105.19 91.38 1w36 n GLY 506 Ca 0.14 -2.07 -0.19 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.09 0.43 -0.37 1.61 1.02 -1.26 -4.85 120.64 117.12 1w36 n GLU 507 Ca 0.00 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1w36 n GLU 507 Cb 0.00 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 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 -3.63 0.00 0.00 1.62 2.88 -1.26 -4.65 113.62 108.58 1w36 n SER 508 Ca -0.37 -0.50 0.00 0.00 -1.33 0.00 0.00 58.87 56.67 1w36 n SER 508 Cb 0.79 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.25 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 1.49 0.34 0.00 0.00 -1.26 -1.42 107.32 106.46 1w36 s GLY 510 Ca 0.00 -0.83 0.04 0.00 0.00 0.00 0.00 44.72 43.93 1w36 s GLY 510 CO 0.00 -0.68 1.94 -2.08 0.00 0.00 0.00 173.10 172.28 1w36 h VAL 511 N 0.39 1.04 -0.29 1.40 2.07 -1.87 -1.96 116.25 117.03 1w36 h VAL 511 Ca -0.47 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 66.73 1w36 h VAL 511 Cb 1.23 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1w36 h VAL 511 CO 0.60 0.16 0.11 1.23 0.02 0.00 0.00 177.57 179.69 1w36 h GLY 512 N 0.87 0.48 0.31 2.17 0.00 -1.99 -3.28 103.07 101.64 1w36 h GLY 512 Ca 0.34 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 1w36 h GLY 512 CO -0.12 0.25 -0.15 -0.55 0.00 0.00 0.00 176.54 175.97 1w36 h ASP 513 N 0.32 -0.36 -0.14 0.19 5.19 -1.88 -3.07 116.42 116.67 1w36 h ASP 513 Ca 0.10 0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.50 1w36 h ASP 513 Cb 0.20 0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.80 1w36 h ASP 513 CO -0.01 -0.24 0.20 0.00 -3.12 0.00 0.00 179.24 176.08 1w36 n TYR 514 N -3.20 0.84 0.00 4.55 4.19 -0.77 -1.03 117.16 121.74 1w36 n TYR 514 Ca -0.05 -0.10 0.00 0.00 3.31 0.00 0.00 57.90 61.06 1w36 n TYR 514 Cb 0.17 -2.30 0.00 0.00 0.49 0.00 0.00 39.34 37.69 1w36 n TYR 514 CO 0.00 0.00 0.00 1.04 0.91 0.00 0.00 176.86 178.81 1w36 n GLN 515 N 7.82 0.00 -0.22 2.98 6.02 -1.25 -4.78 117.38 127.95 1w36 n GLN 515 Ca 0.40 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 57.29 1w36 n GLN 515 Cb 0.45 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.65 1w36 n GLN 515 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.06 176.82 1w36 h SER 516 N 0.00 -1.64 0.04 1.08 0.02 -0.98 2.99 113.55 115.06 1w36 h SER 516 Ca 0.00 0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1w36 h SER 516 Cb 0.00 0.73 0.00 0.00 0.14 0.00 0.00 62.40 63.27 1w36 h SER 516 CO 0.00 -0.34 -0.02 0.00 -1.14 0.00 0.00 176.83 175.33 1w36 h THR 517 N -0.23 1.09 -0.58 -2.27 1.03 -1.51 -2.33 112.91 108.11 1w36 h THR 517 Ca 0.16 -0.41 -0.05 0.00 -0.01 0.00 0.00 66.41 66.10 1w36 h THR 517 Cb 0.56 1.36 -0.03 0.00 -1.07 0.00 0.00 68.15 68.97 1w36 h THR 517 CO -0.71 0.10 0.16 0.24 -0.01 0.00 0.00 175.52 175.31 1w36 h MET 518 N -0.23 0.89 -0.43 0.00 2.07 -1.15 -1.47 114.93 114.61 1w36 h MET 518 Ca -0.01 -0.18 -0.03 0.00 -2.07 0.00 0.00 59.70 57.42 1w36 h MET 518 Cb 0.21 -0.14 -0.02 0.00 -1.87 0.00 0.00 31.60 29.79 1w36 h MET 518 CO 0.01 0.78 0.15 0.00 1.07 0.00 0.00 176.91 178.92 1w36 h ALA 519 N 1.32 0.56 -0.62 6.32 0.00 0.53 -1.04 119.26 126.33 1w36 h ALA 519 Ca 0.19 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1w36 h ALA 519 Cb 0.28 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1w36 h ALA 519 CO -0.00 0.19 0.00 0.94 0.00 0.00 0.00 179.25 180.38 1w36 n GLN 520 N -4.59 0.00 -0.32 0.00 7.27 -0.88 -0.91 117.38 117.95 1w36 n GLN 520 Ca 0.00 0.71 0.07 0.00 0.07 0.00 0.00 57.00 57.85 1w36 n GLN 520 Cb 0.17 -1.40 0.16 0.00 2.41 0.00 0.00 30.24 31.58 1w36 n GLN 520 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 1w36 h VAL 521 N 0.00 0.11 -0.19 1.69 2.07 -1.20 -0.42 116.25 118.31 1w36 h VAL 521 Ca 0.00 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1w36 h VAL 521 Cb 0.00 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 1w36 h VAL 521 CO 0.00 0.00 0.12 0.00 0.02 0.00 0.00 177.57 177.71 1w36 h ALA 523 N 1.05 0.99 0.56 0.00 0.00 0.61 -2.27 119.26 120.20 1w36 h ALA 523 Ca 0.07 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1w36 h ALA 523 Cb 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1w36 h ALA 523 CO -0.01 0.49 -0.49 0.00 0.00 0.00 0.00 179.25 179.23 1w36 h ALA 524 N 1.23 -1.18 -0.28 0.00 0.00 -1.12 -1.70 119.26 116.21 1w36 h ALA 524 Ca 0.27 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 55.06 1w36 h ALA 524 Cb 0.01 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1w36 h ALA 524 CO -0.05 -1.19 0.36 1.96 0.00 0.00 0.00 179.25 180.33 1w36 h GLN 525 N -1.04 0.00 0.04 0.00 1.08 -1.18 0.36 115.11 114.37 1w36 h GLN 525 Ca -0.07 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1w36 h GLN 525 Cb 0.88 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.31 1w36 h GLN 525 CO -0.02 0.00 -0.02 0.82 -0.95 0.00 0.00 178.83 178.65 1w36 h ILE 526 N 0.00 1.33 -0.46 2.54 5.03 -0.74 -1.87 117.51 123.35 1w36 h ILE 526 Ca 0.13 -1.54 -0.09 0.00 -0.12 0.00 0.00 64.86 63.24 1w36 h ILE 526 Cb 0.85 2.30 -0.02 0.00 -3.03 0.00 0.00 36.82 36.92 1w36 h ILE 526 CO -0.00 0.37 -0.08 0.08 -0.68 0.00 0.00 178.15 177.84 1w36 h ARG 527 N -0.78 0.81 -0.93 2.37 -0.00 -0.52 0.71 114.38 116.04 1w36 h ARG 527 Ca -0.01 -0.26 0.15 0.00 -0.00 0.00 0.00 59.98 59.87 1w36 h ARG 527 Cb 0.65 -0.07 -0.08 0.00 -0.00 0.00 0.00 29.97 30.47 1w36 h ARG 527 CO 0.01 0.86 0.59 -0.44 -0.00 0.00 0.00 179.97 180.99 1w36 h ASP 528 N 0.73 0.69 0.23 0.08 3.32 -1.00 0.36 116.42 120.83 1w36 h ASP 528 Ca 0.13 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 1w36 h ASP 528 Cb 0.56 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1w36 h ASP 528 CO 0.03 0.33 -0.11 -0.50 -1.72 0.00 0.00 179.24 177.27 1w36 h TRP 529 N 0.71 -0.29 -0.93 4.55 6.55 -0.32 -2.98 115.95 123.25 1w36 h TRP 529 Ca 0.48 -0.01 0.24 0.00 0.95 0.00 0.00 58.89 60.56 1w36 h TRP 529 Cb 0.77 0.09 -0.13 0.00 -0.86 0.00 0.00 29.16 29.03 1w36 h TRP 529 CO -0.00 -0.08 0.44 -0.07 -1.05 0.00 0.00 178.44 177.67 1w36 h LEU 530 N -1.05 0.38 0.00 -4.49 3.38 0.13 0.99 115.31 114.64 1w36 h LEU 530 Ca -0.03 0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 1w36 h LEU 530 Cb 0.33 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1w36 h LEU 530 CO 0.05 -0.03 -0.91 0.06 0.09 0.00 0.00 178.44 177.71 1w36 h GLN 531 N 0.39 0.00 0.00 1.13 3.07 -0.46 -2.92 115.11 116.32 1w36 h GLN 531 Ca 0.60 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.34 1w36 h GLN 531 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.77 1w36 h GLN 531 CO -0.55 0.11 0.00 0.00 0.09 0.00 0.00 178.83 178.48 1w36 h ALA 532 N 1.82 1.00 0.00 0.06 0.00 -0.94 -2.66 119.26 118.54 1w36 h ALA 532 Ca -0.04 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.68 1w36 h ALA 532 Cb 1.17 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.93 1w36 h ALA 532 CO 0.02 0.00 -0.98 0.78 0.00 0.00 0.00 179.25 179.06 1w36 h GLY 533 N 3.17 0.00 1.98 0.00 0.00 -0.74 0.32 103.07 107.80 1w36 h GLY 533 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 1w36 h GLY 533 CO 0.00 0.00 -0.50 1.46 0.00 0.00 0.00 176.54 177.50 1w36 h GLN 534 N 0.00 0.02 -0.01 4.80 4.20 -1.29 -2.67 115.11 120.16 1w36 h GLN 534 Ca -0.05 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1w36 h GLN 534 Cb 1.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.47 1w36 h GLN 534 CO 0.10 0.52 -0.09 0.54 -0.67 0.00 0.00 178.83 179.23 1w36 n ARG 535 N -3.94 1.09 -0.50 1.46 1.74 -1.17 -4.95 116.66 110.39 1w36 n ARG 535 Ca -0.02 -0.51 0.00 0.00 -0.77 0.00 0.00 57.85 56.56 1w36 n ARG 535 Cb 0.52 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 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 1.22 1.07 1.00 -0.13 0.00 -1.01 -4.95 105.19 102.39 1w36 n GLY 536 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 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 2.49 -3.79 1.61 1.02 0.11 -4.60 120.64 115.48 1w36 n GLU 537 Ca 0.00 -1.68 -0.29 0.00 -0.02 0.00 0.00 57.16 55.17 1w36 n GLU 537 Cb 0.00 -1.57 -0.16 0.00 -0.02 0.00 0.00 31.44 29.70 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 -1.65 1.40 0.00 0.62 0.00 -1.15 0.18 121.76 121.16 1w36 s ALA 538 Ca 0.30 -1.15 0.07 0.00 0.00 0.00 0.00 51.96 51.18 1w36 s ALA 538 Cb 0.19 -1.37 -0.02 0.00 0.00 0.00 0.00 23.12 21.92 1w36 s ALA 538 CO 0.16 -1.32 -0.20 -0.51 0.00 0.00 0.00 175.76 173.88 1w36 s LEU 539 N 1.67 2.07 -0.29 0.00 1.43 0.15 -2.41 118.68 121.30 1w36 s LEU 539 Ca 0.01 -0.41 -0.11 0.00 -1.03 0.00 0.00 54.13 52.59 1w36 s LEU 539 Cb -0.18 -1.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.97 1w36 s LEU 539 CO -0.12 0.23 0.20 -0.76 0.23 0.00 0.00 176.35 176.12 1w36 s LEU 540 N -0.67 4.13 0.03 1.79 1.43 0.01 -1.49 118.68 123.91 1w36 s LEU 540 Ca 0.08 -0.12 0.06 0.00 -1.03 0.00 0.00 54.13 53.13 1w36 s LEU 540 Cb -0.08 -2.12 -0.02 0.00 0.03 0.00 0.00 46.19 44.00 1w36 s LEU 540 CO -0.00 -0.10 -0.19 -0.04 0.23 0.00 0.00 176.35 176.25 1w36 s MET 541 N 1.75 1.32 -0.41 1.70 -1.94 -0.73 -1.78 119.30 119.20 1w36 s MET 541 Ca 0.07 -0.85 0.03 0.00 -1.71 0.00 0.00 55.69 53.23 1w36 s MET 541 Cb -0.16 -1.39 0.12 0.00 2.01 0.00 0.00 34.83 35.41 1w36 s MET 541 CO 0.11 0.36 0.16 1.21 -0.01 0.00 0.00 175.02 176.84 1w36 s ASN 542 N -1.01 4.35 1.67 3.03 3.84 -0.90 -0.54 114.94 125.38 1w36 s ASN 542 Ca 0.06 -2.46 0.00 0.00 0.21 0.00 0.00 52.86 50.67 1w36 s ASN 542 Cb -0.08 -1.45 0.00 0.00 -0.55 0.00 0.00 41.25 39.17 1w36 s ASN 542 CO 0.01 -0.32 0.00 0.61 -2.79 0.00 0.00 177.10 174.62 1w36 n GLY 543 N 3.82 2.71 1.76 1.21 0.00 0.13 -2.52 105.19 112.30 1w36 n GLY 543 Ca 0.04 0.05 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 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 10.01 3.54 -4.34 1.61 9.92 -1.26 -4.93 116.55 131.10 1w36 n ASP 544 Ca 0.00 -3.72 -0.30 0.00 -0.53 0.00 0.00 54.79 50.25 1w36 n ASP 544 Cb 0.00 -0.74 -0.14 0.00 -0.64 0.00 0.00 41.12 39.59 1w36 n ASP 544 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1w36 s ASP 545 N -1.99 3.13 -0.08 -2.24 1.01 -1.05 -5.13 116.67 110.32 1w36 s ASP 545 Ca 0.52 -0.61 -0.17 0.00 0.71 0.00 0.00 52.55 53.00 1w36 s ASP 545 Cb 0.45 -0.27 0.04 0.00 1.01 0.00 0.00 42.92 44.15 1w36 s ASP 545 CO 0.05 0.24 0.41 0.00 0.21 0.00 0.00 175.17 176.08 1w36 s ALA 546 N -0.85 -1.04 -0.00 5.23 0.00 -1.26 -2.12 121.76 121.72 1w36 s ALA 546 Ca 0.12 0.83 -0.02 0.00 0.00 0.00 0.00 51.96 52.88 1w36 s ALA 546 Cb -0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 23.12 22.77 1w36 s ALA 546 CO 0.03 -0.25 0.05 -0.98 0.00 0.00 0.00 175.76 174.60 1w36 s ARG 547 N -0.69 0.22 0.68 0.00 1.70 -0.73 -4.96 118.95 115.17 1w36 s ARG 547 Ca -0.08 -0.22 -0.14 0.00 -0.47 0.00 0.00 55.73 54.82 1w36 s ARG 547 Cb -0.04 0.09 0.01 0.00 -0.57 0.00 0.00 34.95 34.44 1w36 s ARG 547 CO 0.04 -0.04 1.10 -1.25 -1.08 0.00 0.00 175.30 174.06 1w36 s PRO 548 N -0.69 2.73 -0.13 3.89 0.04 -1.26 -0.81 135.00 138.77 1w36 s PRO 548 Ca -0.08 1.30 -0.26 0.00 0.04 0.00 0.00 61.00 62.00 1w36 s PRO 548 Cb -0.05 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 1w36 s PRO 548 CO 0.00 -1.29 0.87 0.14 0.04 0.00 0.00 177.00 176.76 1w36 s VAL 549 N -2.51 4.88 0.51 -0.36 -7.23 -1.01 -4.80 120.40 109.87 1w36 s VAL 549 Ca 0.65 1.75 0.09 0.00 -1.81 0.00 0.00 61.98 62.65 1w36 s VAL 549 Cb -0.19 -4.18 0.05 0.00 0.56 0.00 0.00 36.38 32.62 1w36 s VAL 549 CO 0.45 0.06 0.69 -0.13 -0.31 0.00 0.00 175.10 175.86 1w36 s ARG 550 N 1.84 2.51 0.44 4.82 0.52 -1.26 -4.66 118.95 123.16 1w36 s ARG 550 Ca 0.42 -1.50 0.22 0.00 -0.52 0.00 0.00 55.73 54.35 1w36 s ARG 550 Cb -0.17 -2.67 1.01 0.00 0.52 0.00 0.00 34.95 33.64 1w36 s ARG 550 CO 0.16 -0.62 1.89 0.00 0.02 0.00 0.00 175.30 176.75 1w36 h ALA 551 N 0.39 1.16 0.00 2.13 0.00 -1.91 -2.73 119.26 118.30 1w36 h ALA 551 Ca -0.34 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1w36 h ALA 551 Cb 1.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1w36 h ALA 551 CO 0.43 0.31 0.00 -1.13 0.00 0.00 0.00 179.25 178.86 1w36 n SER 552 N -3.62 0.00 -0.03 0.00 3.41 -1.26 -2.16 113.62 109.96 1w36 n SER 552 Ca -0.01 -0.63 0.03 0.00 -0.26 0.00 0.00 58.87 58.00 1w36 n SER 552 Cb 0.38 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 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 -0.88 0.45 -4.92 4.04 10.43 -1.03 -4.90 116.55 119.75 1w36 n ASP 553 Ca 0.09 -0.72 -0.27 0.00 2.57 0.00 0.00 54.79 56.46 1w36 n ASP 553 Cb 0.04 0.90 -0.02 0.00 1.84 0.00 0.00 41.12 43.88 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 -1.54 5.06 -0.24 0.53 1.09 -0.92 -1.65 121.20 123.53 1w36 s ILE 554 Ca 0.03 -0.12 -0.18 0.00 -1.10 0.00 0.00 60.65 59.27 1w36 s ILE 554 Cb 0.05 -3.78 0.07 0.00 -1.06 0.00 0.00 42.46 37.74 1w36 s ILE 554 CO 0.26 -0.40 0.63 -0.55 -0.10 0.00 0.00 174.94 174.77 1w36 s SER 555 N -3.46 -0.74 -0.23 3.58 0.15 -0.90 -3.08 113.70 109.03 1w36 s SER 555 Ca 0.42 1.32 0.00 0.00 0.70 0.00 0.00 55.95 58.39 1w36 s SER 555 Cb -0.10 1.27 0.03 0.00 -1.71 0.00 0.00 66.02 65.50 1w36 s SER 555 CO 0.32 -0.22 -0.12 -0.69 1.20 0.00 0.00 173.24 173.73 1w36 s VAL 556 N 0.92 2.44 0.21 4.45 1.01 -0.03 -0.35 120.40 129.04 1w36 s VAL 556 Ca -0.05 -1.13 -0.22 0.00 0.00 0.00 0.00 61.98 60.58 1w36 s VAL 556 Cb -0.05 -2.21 -0.08 0.00 0.00 0.00 0.00 36.38 34.03 1w36 s VAL 556 CO -0.08 0.27 0.76 -0.76 0.00 0.00 0.00 175.10 175.29 1w36 s LEU 557 N 1.26 4.44 0.03 3.92 1.43 -0.19 -0.98 118.68 128.60 1w36 s LEU 557 Ca -0.00 1.54 -0.10 0.00 -1.03 0.00 0.00 54.13 54.54 1w36 s LEU 557 Cb -0.16 -3.49 0.01 0.00 0.03 0.00 0.00 46.19 42.57 1w36 s LEU 557 CO -0.08 0.10 0.21 0.54 0.23 0.00 0.00 176.35 177.35 1w36 s VAL 558 N -1.38 0.10 -0.71 -1.59 0.11 0.17 -4.50 120.40 112.60 1w36 s VAL 558 Ca 0.40 -0.80 0.24 0.00 -2.93 0.00 0.00 61.98 58.89 1w36 s VAL 558 Cb -0.19 -0.82 -0.00 0.00 -1.53 0.00 0.00 36.38 33.84 1w36 s VAL 558 CO 0.23 -0.44 1.27 0.54 -3.33 0.00 0.00 175.10 173.37 1w36 n ARG 559 N 0.84 0.23 -3.62 1.54 5.12 -1.26 -1.75 116.66 117.76 1w36 n ARG 559 Ca -0.20 0.04 -0.07 0.00 -1.93 0.00 0.00 57.85 55.69 1w36 n ARG 559 Cb 0.58 -1.62 -0.02 0.00 -1.16 0.00 0.00 32.46 30.24 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 -3.87 -0.33 0.34 0.55 1.04 -1.26 -4.93 113.70 105.24 1w36 s SER 560 Ca 0.07 -0.22 0.11 0.00 0.48 0.00 0.00 55.95 56.39 1w36 s SER 560 Cb 0.15 0.51 0.88 0.00 0.10 0.00 0.00 66.02 67.66 1w36 s SER 560 CO 0.74 -0.89 1.78 -0.09 0.98 0.00 0.00 173.24 175.76 1w36 h ARG 561 N 2.00 0.59 0.15 4.02 9.65 -1.96 -0.87 114.38 127.96 1w36 h ARG 561 Ca -0.25 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.59 1w36 h ARG 561 Cb 1.25 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.70 1w36 h ARG 561 CO 0.29 0.39 -0.07 1.96 2.80 0.00 0.00 179.97 185.34 1w36 h GLN 562 N 0.61 -0.20 -0.57 0.20 4.20 -1.99 -2.84 115.11 114.52 1w36 h GLN 562 Ca 0.57 0.01 0.12 0.00 0.06 0.00 0.00 58.65 59.41 1w36 h GLN 562 Cb 1.11 0.05 -0.10 0.00 0.30 0.00 0.00 27.48 28.83 1w36 h GLN 562 CO -0.35 0.22 -0.01 0.93 -0.67 0.00 0.00 178.83 178.95 1w36 h GLU 563 N -0.71 0.10 -0.84 1.46 5.08 -1.78 -0.14 114.58 117.75 1w36 h GLU 563 Ca -0.02 -0.01 0.17 0.00 -1.00 0.00 0.00 59.36 58.50 1w36 h GLU 563 Cb 0.51 -0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.63 1w36 h GLU 563 CO 0.03 0.07 0.39 0.00 -1.00 0.00 0.00 179.01 178.50 1w36 h ALA 564 N 1.52 1.26 0.57 3.43 0.00 -1.18 -0.33 119.26 124.53 1w36 h ALA 564 Ca 0.29 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.29 1w36 h ALA 564 Cb 0.46 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1w36 h ALA 564 CO -0.49 -0.19 -0.27 0.00 0.00 0.00 0.00 179.25 178.29 1w36 h ALA 565 N 1.60 -0.76 -1.62 0.00 0.00 -0.82 0.19 119.26 117.84 1w36 h ALA 565 Ca 0.48 -0.20 0.51 0.00 0.00 0.00 0.00 54.91 55.70 1w36 h ALA 565 Cb 0.76 0.30 -0.11 0.00 0.00 0.00 0.00 17.79 18.73 1w36 h ALA 565 CO -0.42 -0.82 1.10 1.96 0.00 0.00 0.00 179.25 181.07 1w36 h GLN 566 N -0.98 0.01 0.03 0.00 1.08 0.09 0.22 115.11 115.56 1w36 h GLN 566 Ca -0.08 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.12 1w36 h GLN 566 Cb 0.65 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.08 1w36 h GLN 566 CO 0.13 0.01 -0.01 0.28 -0.95 0.00 0.00 178.83 178.28 1w36 h VAL 567 N 0.01 0.11 -1.21 -0.54 2.07 -0.64 -3.02 116.25 113.03 1w36 h VAL 567 Ca 0.90 -1.06 0.36 0.00 0.82 0.00 0.00 66.70 67.73 1w36 h VAL 567 Cb 3.20 0.21 -0.11 0.00 -1.52 0.00 0.00 31.29 33.07 1w36 h VAL 567 CO -0.28 0.04 0.79 -0.09 0.02 0.00 0.00 177.57 178.05 1w36 h ARG 568 N -1.01 0.20 0.53 1.57 2.43 0.23 0.56 114.38 118.89 1w36 h ARG 568 Ca -0.00 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 1w36 h ARG 568 Cb 0.09 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1w36 h ARG 568 CO 0.01 0.13 -0.26 -0.44 -1.51 0.00 0.00 179.97 177.90 1w36 h ASP 569 N 0.20 -0.61 -0.11 -3.80 3.45 -0.88 0.30 116.42 114.97 1w36 h ASP 569 Ca 0.71 0.02 0.03 0.00 0.43 0.00 0.00 57.03 58.23 1w36 h ASP 569 Cb 2.14 0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 41.06 1w36 h ASP 569 CO -0.34 -0.21 0.13 0.00 -1.57 0.00 0.00 179.24 177.25 1w36 h ALA 570 N -1.23 1.68 0.02 3.45 0.00 -1.06 0.10 119.26 122.22 1w36 h ALA 570 Ca -0.07 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1w36 h ALA 570 Cb 0.55 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1w36 h ALA 570 CO 0.12 -0.18 -0.01 1.25 0.00 0.00 0.00 179.25 180.43 1w36 h LEU 571 N 0.00 -0.02 -1.66 0.00 5.85 -0.94 -3.25 115.31 115.29 1w36 h LEU 571 Ca 0.05 -0.74 0.16 0.00 0.84 0.00 0.00 57.88 58.18 1w36 h LEU 571 Cb 0.30 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 1w36 h LEU 571 CO -0.00 0.80 0.49 0.00 -0.34 0.00 0.00 178.44 179.39 1w36 h THR 572 N -0.92 0.77 0.00 1.05 1.03 0.84 0.54 112.91 116.23 1w36 h THR 572 Ca -0.00 -0.11 0.00 0.00 -0.01 0.00 0.00 66.41 66.28 1w36 h THR 572 Cb 0.76 0.41 0.00 0.00 -1.07 0.00 0.00 68.15 68.25 1w36 h THR 572 CO 0.00 0.06 0.00 -0.11 -0.01 0.00 0.00 175.52 175.46 1w36 n LEU 573 N -4.46 0.30 -0.42 0.00 0.00 0.24 -0.88 117.00 111.79 1w36 n LEU 573 Ca 0.14 0.60 0.05 0.00 0.00 0.00 0.00 56.01 56.80 1w36 n LEU 573 Cb 0.56 -0.59 0.13 0.00 0.00 0.00 0.00 43.42 43.52 1w36 n LEU 573 CO 0.34 -0.54 0.60 0.18 0.00 0.00 0.00 177.39 177.96 1w36 n LEU 574 N -1.86 2.77 0.00 -1.96 4.77 0.11 -4.68 117.00 116.14 1w36 n LEU 574 Ca 0.01 -2.39 0.00 0.00 -0.03 0.00 0.00 56.01 53.60 1w36 n LEU 574 Cb 0.12 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1w36 n LEU 574 CO 0.11 0.65 0.00 -0.62 -1.33 0.00 0.00 177.39 176.20 1w36 n GLU 575 N -0.31 -0.19 -2.66 3.23 1.02 -0.06 -3.83 120.64 117.84 1w36 n GLU 575 Ca 0.11 0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.88 1w36 n GLU 575 Cb 0.51 -3.36 -0.03 0.00 -0.02 0.00 0.00 31.44 28.54 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 -2.57 3.99 0.46 -3.67 1.01 -0.79 -4.95 121.20 114.68 1w36 s ILE 576 Ca 0.00 0.30 -0.25 0.00 0.00 0.00 0.00 60.65 60.70 1w36 s ILE 576 Cb 0.00 -4.79 -0.08 0.00 0.01 0.00 0.00 42.46 37.60 1w36 s ILE 576 CO 0.00 -1.59 1.33 -0.81 0.00 0.00 0.00 174.94 173.87 1w36 n PRO 577 N 8.60 1.97 -4.08 2.79 -0.04 -1.26 -3.75 135.00 139.24 1w36 n PRO 577 Ca 0.02 0.71 -0.10 0.00 -0.04 0.00 0.00 63.50 64.09 1w36 n PRO 577 Cb 0.48 -2.49 -0.08 0.00 -0.04 0.00 0.00 33.50 31.36 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 -0.60 0.14 -0.01 3.54 1.04 -1.26 -3.13 113.70 113.42 1w36 s SER 578 Ca 0.63 -1.10 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1w36 s SER 578 Cb -0.47 0.40 0.01 0.00 0.10 0.00 0.00 66.02 66.06 1w36 s SER 578 CO 0.56 -0.86 0.01 0.54 0.98 0.00 0.00 173.24 174.47 1w36 s VAL 579 N -4.04 0.01 -0.81 5.02 0.11 -0.94 -4.94 120.40 114.81 1w36 s VAL 579 Ca 0.25 0.06 -0.11 0.00 -2.93 0.00 0.00 61.98 59.24 1w36 s VAL 579 Cb 0.05 -0.06 0.21 0.00 -1.53 0.00 0.00 36.38 35.05 1w36 s VAL 579 CO 0.04 0.04 0.73 -0.47 -3.33 0.00 0.00 175.10 172.11 1w36 s TYR 580 N 0.37 3.73 0.62 1.54 5.04 -1.25 0.77 117.35 128.18 1w36 s TYR 580 Ca -0.03 -2.19 0.31 0.00 -2.44 0.00 0.00 57.07 52.72 1w36 s TYR 580 Cb -0.05 -3.70 1.72 0.00 0.35 0.00 0.00 41.96 40.28 1w36 s TYR 580 CO -0.01 -0.96 2.04 -0.07 -1.34 0.00 0.00 175.55 175.22 1w36 h LEU 581 N 7.54 0.00 -3.00 6.97 3.38 -1.71 -1.03 115.31 127.46 1w36 h LEU 581 Ca 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1w36 h LEU 581 Cb 1.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1w36 h LEU 581 CO 0.76 0.00 0.01 -1.20 0.09 0.00 0.00 178.44 178.10 1w36 n SER 582 N -3.41 4.65 -4.70 -0.43 7.64 -1.26 -4.97 113.62 111.13 1w36 n SER 582 Ca 0.01 -2.74 -0.42 0.00 1.01 0.00 0.00 58.87 56.73 1w36 n SER 582 Cb 0.37 -0.65 -0.03 0.00 -1.01 0.00 0.00 64.21 62.89 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 -0.60 6.72 -0.01 6.43 3.84 -0.39 -4.93 114.94 125.99 1w36 s ASN 583 Ca 0.42 2.39 0.14 0.00 0.21 0.00 0.00 52.86 56.02 1w36 s ASN 583 Cb 0.32 -2.58 -0.18 0.00 -0.55 0.00 0.00 41.25 38.26 1w36 s ASN 583 CO 0.12 -0.76 0.43 0.54 -2.79 0.00 0.00 177.10 174.65 1w36 n ARG 584 N 4.63 1.42 -0.99 0.43 1.74 -1.26 -4.80 116.66 117.82 1w36 n ARG 584 Ca 0.13 -0.07 -0.35 0.00 -0.77 0.00 0.00 57.85 56.79 1w36 n ARG 584 Cb 0.41 -1.24 0.07 0.00 -1.02 0.00 0.00 32.46 30.68 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 -1.67 -3.90 -4.79 0.55 8.00 -1.26 -4.75 116.55 108.72 1w36 n ASP 585 Ca -0.00 0.33 -0.22 0.00 0.71 0.00 0.00 54.79 55.60 1w36 n ASP 585 Cb 0.29 -0.97 -0.05 0.00 -0.02 0.00 0.00 41.12 40.37 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 -1.39 5.36 0.00 -2.24 1.04 -1.26 -2.91 113.70 112.30 1w36 s SER 586 Ca 0.50 -0.31 0.15 0.00 0.48 0.00 0.00 55.95 56.78 1w36 s SER 586 Cb -0.24 -1.31 0.70 0.00 0.10 0.00 0.00 66.02 65.26 1w36 s SER 586 CO 0.73 -0.03 1.47 0.52 0.98 0.00 0.00 173.24 176.92 1w36 n VAL 587 N -1.09 0.81 1.48 5.02 0.31 0.66 -2.57 118.33 122.95 1w36 n VAL 587 Ca -0.08 0.20 0.14 0.00 -0.01 0.00 0.00 64.34 64.60 1w36 n VAL 587 Cb 0.58 -0.94 0.66 0.00 -0.91 0.00 0.00 33.84 33.23 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 -1.42 0.00 -2.71 3.52 3.01 -1.26 -3.59 117.46 115.01 1w36 n PHE 588 Ca 0.05 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.32 1w36 n PHE 588 Cb 0.16 -0.17 0.00 0.00 -0.01 0.00 0.00 39.48 39.46 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 -0.94 2.27 -0.50 -1.08 0.00 -1.06 -4.43 120.64 114.89 1w36 n GLU 589 Ca 0.16 -3.97 0.08 0.00 0.00 0.00 0.00 57.16 53.43 1w36 n GLU 589 Cb 0.26 -1.82 0.28 0.00 0.00 0.00 0.00 31.44 30.16 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 -0.20 2.22 0.00 3.84 -2.24 -1.24 -4.96 114.28 111.71 1w36 n THR 590 Ca 0.25 -1.68 0.00 0.00 -2.27 0.00 0.00 64.05 60.35 1w36 n THR 590 Cb 0.68 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 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 -0.14 0.00 0.22 3.22 -0.00 -1.26 -4.25 117.00 114.79 1w36 n LEU 591 Ca 0.22 0.00 0.09 0.00 -0.00 0.00 0.00 56.01 56.32 1w36 n LEU 591 Cb 0.90 0.00 0.44 0.00 -0.00 0.00 0.00 43.42 44.76 1w36 n LEU 591 CO 0.18 0.00 0.78 -0.33 -0.00 0.00 0.00 177.39 178.02 1w36 h GLU 592 N 0.00 0.00 -0.09 1.96 3.07 -1.93 -2.54 114.58 115.06 1w36 h GLU 592 Ca 0.00 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.69 1w36 h GLU 592 Cb 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 27.92 1w36 h GLU 592 CO 0.00 0.24 -0.61 0.00 -1.40 0.00 0.00 179.01 177.24 1w36 h ALA 593 N 1.76 0.19 -0.70 3.43 0.00 -1.80 -1.84 119.26 120.30 1w36 h ALA 593 Ca -0.00 -0.55 0.05 0.00 0.00 0.00 0.00 54.91 54.41 1w36 h ALA 593 Cb 0.77 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1w36 h ALA 593 CO 0.03 0.46 0.42 1.96 0.00 0.00 0.00 179.25 182.12 1w36 h GLN 594 N 0.18 0.76 -0.57 0.00 1.08 -1.84 -0.02 115.11 114.70 1w36 h GLN 594 Ca -0.05 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 57.01 1w36 h GLN 594 Cb 1.27 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 28.51 1w36 h GLN 594 CO 0.13 0.50 -0.01 0.93 -0.95 0.00 0.00 178.83 179.43 1w36 h GLU 595 N 0.79 1.02 -0.69 1.46 5.08 -1.37 -1.31 114.58 119.56 1w36 h GLU 595 Ca 0.30 -0.33 0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1w36 h GLU 595 Cb 0.12 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 1w36 h GLU 595 CO -0.15 1.02 0.45 0.52 -1.00 0.00 0.00 179.01 179.85 1w36 h MET 596 N 0.91 0.87 -0.40 2.33 2.86 -0.39 0.21 114.93 121.32 1w36 h MET 596 Ca 0.16 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.70 1w36 h MET 596 Cb 0.57 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 1w36 h MET 596 CO 0.03 0.58 0.08 1.25 1.06 0.00 0.00 176.91 179.90 1w36 h LEU 597 N 0.90 0.62 -0.07 1.22 6.46 -0.34 0.30 115.31 124.41 1w36 h LEU 597 Ca 0.26 -0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 1w36 h LEU 597 Cb -0.06 -0.17 -0.00 0.00 -0.73 0.00 0.00 40.66 39.71 1w36 h LEU 597 CO -0.06 0.72 0.02 -0.50 -0.62 0.00 0.00 178.44 177.99 1w36 h TRP 598 N 0.51 0.11 -0.61 1.25 6.55 -0.34 -2.07 115.95 121.35 1w36 h TRP 598 Ca 0.12 -0.01 0.12 0.00 0.95 0.00 0.00 58.89 60.07 1w36 h TRP 598 Cb 0.35 -0.03 -0.09 0.00 -0.86 0.00 0.00 29.16 28.53 1w36 h TRP 598 CO 0.02 0.29 0.12 -0.07 -1.05 0.00 0.00 178.44 177.75 1w36 h LEU 599 N -0.10 -0.03 -0.13 -4.49 3.38 -0.27 0.12 115.31 113.78 1w36 h LEU 599 Ca 0.02 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1w36 h LEU 599 Cb 0.23 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1w36 h LEU 599 CO -0.00 -0.01 0.06 -0.07 0.09 0.00 0.00 178.44 178.51 1w36 h LEU 600 N 0.24 0.17 -0.68 1.67 3.38 -0.32 -0.94 115.31 118.84 1w36 h LEU 600 Ca 0.32 -0.11 0.13 0.00 0.09 0.00 0.00 57.88 58.32 1w36 h LEU 600 Cb 0.49 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.11 1w36 h LEU 600 CO -0.43 0.23 0.19 1.56 0.09 0.00 0.00 178.44 180.08 1w36 h GLN 601 N 0.09 0.31 -0.17 1.13 4.20 -0.58 0.19 115.11 120.29 1w36 h GLN 601 Ca 0.04 -0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.78 1w36 h GLN 601 Cb 0.11 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.77 1w36 h GLN 601 CO -0.01 0.20 -0.11 0.00 -0.67 0.00 0.00 178.83 178.25 1w36 h ALA 602 N 1.53 0.03 -0.47 3.87 0.00 -0.38 -2.73 119.26 121.11 1w36 h ALA 602 Ca 0.37 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 1w36 h ALA 602 Cb 0.57 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1w36 h ALA 602 CO -0.43 -0.54 0.25 0.28 0.00 0.00 0.00 179.25 178.80 1w36 h VAL 603 N -0.11 1.17 0.00 0.00 2.07 0.34 -0.93 116.25 118.80 1w36 h VAL 603 Ca 0.10 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1w36 h VAL 603 Cb 0.25 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1w36 h VAL 603 CO -0.23 0.18 0.00 0.80 0.02 0.00 0.00 177.57 178.34 1w36 n MET 604 N -4.66 0.48 0.00 1.57 0.00 0.50 -4.17 117.12 110.83 1w36 n MET 604 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.71 1w36 n MET 604 Cb 0.09 -1.24 0.00 0.00 0.00 0.00 0.00 33.22 32.07 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 -0.74 0.00 0.66 1.12 5.66 -0.94 -4.99 114.28 115.05 1w36 n THR 605 Ca 0.05 0.00 0.07 0.00 -3.05 0.00 0.00 64.05 61.13 1w36 n THR 605 Cb 0.03 0.00 0.36 0.00 -1.55 0.00 0.00 70.33 69.17 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 0.00 0.16 0.19 1.09 -0.04 -0.40 -3.05 135.00 132.96 1w36 n PRO 606 Ca 0.00 0.17 -0.15 0.00 -0.04 0.00 0.00 63.50 63.48 1w36 n PRO 606 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 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 -0.43 -5.51 0.54 4.39 -1.94 -3.38 114.58 108.25 1w36 h GLU 607 Ca 0.00 0.03 -0.31 0.00 0.34 0.00 0.00 59.36 59.41 1w36 h GLU 607 Cb 0.17 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.88 1w36 h GLU 607 CO 0.00 -0.29 0.97 1.03 -1.16 0.00 0.00 179.01 179.57 1w36 s ARG 608 N -6.12 2.47 0.00 2.33 0.52 -1.17 -4.86 118.95 112.12 1w36 s ARG 608 Ca -0.15 -0.96 0.00 0.00 -0.52 0.00 0.00 55.73 54.10 1w36 s ARG 608 Cb 0.05 -5.20 0.00 0.00 0.52 0.00 0.00 34.95 30.32 1w36 s ARG 608 CO 0.64 -3.90 0.00 -1.91 0.02 0.00 0.00 175.30 170.16 1w36 n GLU 609 N 8.40 0.00 0.05 3.54 2.13 -1.26 -0.39 120.64 133.11 1w36 n GLU 609 Ca 0.44 0.00 -0.12 0.00 0.66 0.00 0.00 57.16 58.14 1w36 n GLU 609 Cb 0.47 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 32.11 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 -0.11 0.58 4.31 -0.26 -1.94 -2.45 115.58 115.71 1w36 h ASN 610 Ca 0.00 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1w36 h ASN 610 Cb 0.00 0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.31 1w36 h ASN 610 CO 0.00 -0.06 0.00 0.71 -1.06 0.00 0.00 177.43 177.02 1w36 h THR 611 N -0.07 0.00 0.08 2.81 1.35 -1.07 -2.06 112.91 113.95 1w36 h THR 611 Ca 0.02 -0.20 -0.24 0.00 -0.55 0.00 0.00 66.41 65.44 1w36 h THR 611 Cb 0.09 0.90 -0.01 0.00 -1.73 0.00 0.00 68.15 67.41 1w36 h THR 611 CO -0.04 0.00 -1.23 0.25 -0.25 0.00 0.00 175.52 174.25 1w36 h LEU 612 N 0.00 0.27 -1.18 3.87 6.46 -1.51 -3.23 115.31 119.99 1w36 h LEU 612 Ca 0.00 -0.81 0.13 0.00 -0.12 0.00 0.00 57.88 57.08 1w36 h LEU 612 Cb 0.29 -0.09 -0.07 0.00 -0.73 0.00 0.00 40.66 40.06 1w36 h LEU 612 CO 0.00 1.53 0.59 -0.09 -0.62 0.00 0.00 178.44 179.85 1w36 h ARG 613 N -0.50 0.79 -0.21 1.25 2.43 -1.06 0.11 114.38 117.20 1w36 h ARG 613 Ca -0.28 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.83 1w36 h ARG 613 Cb 1.60 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.96 1w36 h ARG 613 CO 0.00 0.52 0.07 0.77 -1.51 0.00 0.00 179.97 179.83 1w36 h SER 614 N 0.82 0.29 -0.35 -3.80 0.02 -1.50 -0.28 113.55 108.76 1w36 h SER 614 Ca 0.46 -0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1w36 h SER 614 Cb 0.60 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1w36 h SER 614 CO -0.22 0.40 0.21 0.00 -1.14 0.00 0.00 176.83 176.07 1w36 h ALA 615 N 0.91 0.45 0.00 3.77 0.00 -1.17 -0.97 119.26 122.24 1w36 h ALA 615 Ca 0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1w36 h ALA 615 Cb 0.20 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1w36 h ALA 615 CO -0.00 -0.05 -0.06 -0.07 0.00 0.00 0.00 179.25 179.06 1w36 h LEU 616 N 0.45 0.00 -0.17 0.00 3.38 -0.64 -1.84 115.31 116.49 1w36 h LEU 616 Ca 0.12 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 1w36 h LEU 616 Cb 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1w36 h LEU 616 CO -0.02 0.06 -0.26 0.00 0.09 0.00 0.00 178.44 178.31 1w36 h ALA 617 N 1.94 0.85 -2.15 1.53 0.00 0.30 -3.41 119.26 118.31 1w36 h ALA 617 Ca -0.00 -0.24 -0.60 0.00 0.00 0.00 0.00 54.91 54.07 1w36 h ALA 617 Cb 0.17 -0.04 0.12 0.00 0.00 0.00 0.00 17.79 18.04 1w36 h ALA 617 CO 0.01 0.33 0.13 0.25 0.00 0.00 0.00 179.25 179.96 1w36 n THR 618 N -3.19 2.12 0.27 0.00 -2.24 -0.69 -4.83 114.28 105.71 1w36 n THR 618 Ca 0.03 -0.50 0.10 0.00 -2.27 0.00 0.00 64.05 61.41 1w36 n THR 618 Cb 0.61 -1.05 0.71 0.00 -2.10 0.00 0.00 70.33 68.50 1w36 n THR 618 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1w36 h SER 619 N 1.80 0.00 -0.98 3.42 4.64 -1.89 -2.15 113.55 118.39 1w36 h SER 619 Ca -0.42 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.02 1w36 h SER 619 Cb 1.34 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.35 1w36 h SER 619 CO 0.59 0.02 0.61 -0.03 -0.87 0.00 0.00 176.83 177.15 1w36 h MET 620 N 0.00 0.96 0.00 4.77 1.85 -1.94 0.09 114.93 120.66 1w36 h MET 620 Ca -0.00 -0.06 0.00 0.00 -0.61 0.00 0.00 59.70 59.03 1w36 h MET 620 Cb 0.04 -0.22 0.00 0.00 0.43 0.00 0.00 31.60 31.86 1w36 h MET 620 CO 0.00 0.63 0.00 -1.33 -0.40 0.00 0.00 176.91 175.82 1w36 n MET 621 N -4.63 0.20 -1.78 0.39 2.00 -0.81 -4.94 117.12 107.56 1w36 n MET 621 Ca 0.18 0.05 -0.20 0.00 0.00 0.00 0.00 57.70 57.73 1w36 n MET 621 Cb 0.33 -1.50 -0.07 0.00 0.00 0.00 0.00 33.22 31.98 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 1.05 1.33 3.75 3.03 0.00 0.02 -5.02 105.19 109.35 1w36 n GLY 622 Ca 0.10 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 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 -4.82 1.81 0.21 0.99 1.43 -1.26 -5.08 118.68 111.95 1w36 s LEU 623 Ca 0.00 0.93 0.07 0.00 -1.03 0.00 0.00 54.13 54.10 1w36 s LEU 623 Cb 0.00 -3.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.04 1w36 s LEU 623 CO 0.00 -2.87 0.09 0.20 0.23 0.00 0.00 176.35 174.00 1w36 s ASN 624 N -3.93 5.15 0.13 2.29 0.01 -1.26 -4.95 114.94 112.38 1w36 s ASN 624 Ca 0.65 -0.32 -0.16 0.00 -0.71 0.00 0.00 52.86 52.33 1w36 s ASN 624 Cb -0.15 -1.21 -0.00 0.00 0.41 0.00 0.00 41.25 40.30 1w36 s ASN 624 CO 0.55 0.04 1.68 0.00 -1.51 0.00 0.00 177.10 177.85 1w36 h ALA 625 N 2.17 0.52 -0.60 0.60 0.00 -1.99 0.59 119.26 120.55 1w36 h ALA 625 Ca -0.47 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 1w36 h ALA 625 Cb 1.22 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1w36 h ALA 625 CO 0.61 0.13 0.35 1.25 0.00 0.00 0.00 179.25 181.58 1w36 h LEU 626 N 0.50 0.72 0.78 0.00 7.12 -2.00 -1.91 115.31 120.53 1w36 h LEU 626 Ca 0.13 -0.04 -0.04 0.00 0.13 0.00 0.00 57.88 58.07 1w36 h LEU 626 Cb 0.19 -0.18 0.01 0.00 -0.53 0.00 0.00 40.66 40.15 1w36 h LEU 626 CO -0.01 0.56 -0.38 0.44 -0.13 0.00 0.00 178.44 178.92 1w36 h ASP 627 N 0.83 -0.89 -0.67 1.25 3.32 -1.08 -2.47 116.42 116.70 1w36 h ASP 627 Ca 0.22 0.02 0.14 0.00 0.02 0.00 0.00 57.03 57.43 1w36 h ASP 627 Cb -0.02 0.23 -0.11 0.00 0.22 0.00 0.00 39.33 39.65 1w36 h ASP 627 CO -0.04 -0.57 0.01 0.40 -1.72 0.00 0.00 179.24 177.32 1w36 h ILE 628 N -1.17 0.44 0.29 0.35 1.08 0.25 -1.52 117.51 117.24 1w36 h ILE 628 Ca -0.11 -0.04 -0.01 0.00 -0.39 0.00 0.00 64.86 64.31 1w36 h ILE 628 Cb 0.82 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 1w36 h ILE 628 CO 0.18 0.02 -0.29 -0.08 -0.69 0.00 0.00 178.15 177.28 1w36 h GLU 629 N 0.12 -0.57 -0.88 2.37 4.57 -1.35 -2.33 114.58 116.51 1w36 h GLU 629 Ca 0.36 0.04 0.17 0.00 -1.18 0.00 0.00 59.36 58.75 1w36 h GLU 629 Cb 0.60 0.13 -0.07 0.00 -0.16 0.00 0.00 28.75 29.25 1w36 h GLU 629 CO -0.58 -0.38 0.58 1.79 -1.18 0.00 0.00 179.01 179.24 1w36 h THR 630 N -0.59 0.75 0.00 0.32 1.35 -1.00 0.62 112.91 114.35 1w36 h THR 630 Ca -0.04 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 1w36 h THR 630 Cb 0.51 0.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.11 1w36 h THR 630 CO -0.04 0.10 0.00 0.25 -0.25 0.00 0.00 175.52 175.58 1w36 h LEU 631 N 0.52 0.00 0.00 3.87 6.46 -1.12 -1.81 115.31 123.23 1w36 h LEU 631 Ca 0.45 0.00 -0.16 0.00 -0.12 0.00 0.00 57.88 58.05 1w36 h LEU 631 Cb 0.96 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.86 1w36 h LEU 631 CO -0.19 0.00 -0.80 0.78 -0.62 0.00 0.00 178.44 177.60 1w36 h ASN 632 N 0.00 0.00 0.70 1.25 2.35 0.78 -3.31 115.58 117.35 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 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1w36 h ASN 632 CO 0.00 0.73 -0.94 0.59 -1.65 0.00 0.00 177.43 176.16 1w36 n ASN 633 N -3.25 0.68 -4.23 5.81 3.02 -0.88 -4.67 115.26 111.73 1w36 n ASN 633 Ca -0.00 0.05 -0.41 0.00 -0.03 0.00 0.00 54.58 54.19 1w36 n ASN 633 Cb 0.84 0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 40.53 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 -4.44 6.70 0.66 6.41 -1.08 -0.73 -4.92 116.67 119.27 1w36 s ASP 634 Ca 0.03 -3.64 0.39 0.00 -0.52 0.00 0.00 52.55 48.81 1w36 s ASP 634 Cb 0.13 -2.07 2.16 0.00 -1.46 0.00 0.00 42.92 41.68 1w36 s ASP 634 CO 0.78 -0.24 2.24 -0.08 0.52 0.00 0.00 175.17 178.38 1w36 h GLU 635 N 6.38 0.00 0.12 4.34 4.81 -1.83 -1.28 114.58 127.12 1w36 h GLU 635 Ca 0.17 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 59.11 1w36 h GLU 635 Cb 0.85 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.25 1w36 h GLU 635 CO 0.94 0.00 -1.23 1.12 -0.73 0.00 0.00 179.01 179.11 1w36 h HIS 636 N 0.00 0.89 -0.52 0.92 2.07 -1.94 -3.08 115.15 113.48 1w36 h HIS 636 Ca 0.00 -0.57 -0.06 0.00 -2.85 0.00 0.00 60.37 56.89 1w36 h HIS 636 Cb 0.21 -0.07 -0.02 0.00 2.57 0.00 0.00 27.41 30.10 1w36 h HIS 636 CO 0.00 1.42 0.06 0.00 -3.07 0.00 0.00 177.93 176.34 1w36 h ALA 637 N 0.38 1.13 0.30 6.11 0.00 -1.62 -2.99 119.26 122.58 1w36 h ALA 637 Ca -0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 1w36 h ALA 637 Cb 1.90 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1w36 h ALA 637 CO 0.23 0.57 -0.15 2.35 0.00 0.00 0.00 179.25 182.25 1w36 h TRP 638 N 0.79 -0.38 0.00 0.00 2.91 -1.50 -1.74 115.95 116.04 1w36 h TRP 638 Ca 0.16 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.17 1w36 h TRP 638 Cb 0.38 0.12 0.00 0.00 -0.51 0.00 0.00 29.16 29.16 1w36 h TRP 638 CO 0.02 -0.15 0.00 -0.25 -1.03 0.00 0.00 178.44 177.04 1w36 n ASP 639 N -5.21 0.49 0.02 2.65 8.00 -1.17 0.47 116.55 121.81 1w36 n ASP 639 Ca -0.10 0.72 -0.18 0.00 0.71 0.00 0.00 54.79 55.94 1w36 n ASP 639 Cb 0.22 -0.79 -0.13 0.00 -0.02 0.00 0.00 41.12 40.40 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 1.48 -0.18 2.53 2.07 -1.23 -0.65 116.25 120.28 1w36 h VAL 640 Ca 0.00 -2.27 -0.11 0.00 0.82 0.00 0.00 66.70 65.14 1w36 h VAL 640 Cb 0.02 2.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 1w36 h VAL 640 CO 0.00 0.65 -0.37 0.58 0.02 0.00 0.00 177.57 178.45 1w36 h VAL 641 N -0.27 1.30 -0.76 2.57 2.07 0.20 -1.19 116.25 120.17 1w36 h VAL 641 Ca -0.10 -1.47 -0.05 0.00 0.82 0.00 0.00 66.70 65.90 1w36 h VAL 641 Cb 1.42 1.57 -0.03 0.00 -1.52 0.00 0.00 31.29 32.73 1w36 h VAL 641 CO 0.13 0.45 0.29 0.58 0.02 0.00 0.00 177.57 179.04 1w36 h VAL 642 N 0.33 1.26 -0.13 2.57 2.07 0.17 -0.54 116.25 121.98 1w36 h VAL 642 Ca 0.04 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 1w36 h VAL 642 Cb 0.81 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1w36 h VAL 642 CO 0.06 0.34 0.04 -0.33 0.02 0.00 0.00 177.57 177.70 1w36 h GLU 643 N 1.11 0.20 -0.81 1.57 3.07 -0.75 0.43 114.58 119.40 1w36 h GLU 643 Ca 0.25 -0.04 0.20 0.00 -0.50 0.00 0.00 59.36 59.27 1w36 h GLU 643 Cb 0.24 -0.03 -0.14 0.00 -0.84 0.00 0.00 28.75 27.98 1w36 h GLU 643 CO -0.02 0.33 0.10 1.49 -1.40 0.00 0.00 179.01 179.51 1w36 h GLU 644 N 0.02 0.14 0.00 2.33 4.81 -0.78 0.50 114.58 121.61 1w36 h GLU 644 Ca 0.04 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.17 1w36 h GLU 644 Cb 0.22 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1w36 h GLU 644 CO -0.00 0.09 -0.44 0.74 -0.73 0.00 0.00 179.01 178.67 1w36 h PHE 645 N 0.15 0.00 -0.06 0.92 -1.00 -0.58 -1.64 116.94 114.72 1w36 h PHE 645 Ca 0.47 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 61.12 1w36 h PHE 645 Cb 0.88 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.42 1w36 h PHE 645 CO -0.36 0.44 -0.55 0.22 -1.61 0.00 0.00 178.31 176.45 1w36 h ASP 646 N 0.00 0.21 -0.83 2.17 3.58 0.19 -2.57 116.42 119.17 1w36 h ASP 646 Ca -0.00 -0.11 -0.03 0.00 0.42 0.00 0.00 57.03 57.31 1w36 h ASP 646 Cb 1.00 -0.06 -0.04 0.00 1.72 0.00 0.00 39.33 41.96 1w36 h ASP 646 CO 0.06 0.71 0.40 1.23 -2.88 0.00 0.00 179.24 178.76 1w36 h GLY 647 N 1.46 1.28 0.84 -0.78 0.00 0.50 -2.50 103.07 103.87 1w36 h GLY 647 Ca 0.00 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.68 1w36 h GLY 647 CO 0.08 0.60 0.04 -0.97 0.00 0.00 0.00 176.54 176.29 1w36 h TYR 648 N 1.17 0.28 -0.84 5.60 0.05 -0.95 -2.82 116.97 119.47 1w36 h TYR 648 Ca 0.28 -0.03 0.19 0.00 0.05 0.00 0.00 58.73 59.22 1w36 h TYR 648 Cb 0.12 -0.08 -0.06 0.00 1.01 0.00 0.00 36.73 37.72 1w36 h TYR 648 CO 0.01 0.40 0.56 0.07 -1.05 0.00 0.00 178.16 178.16 1w36 h ARG 649 N 0.08 0.36 -0.37 4.88 0.11 -1.24 0.54 114.38 118.73 1w36 h ARG 649 Ca 0.05 -0.02 -0.05 0.00 0.10 0.00 0.00 59.98 60.06 1w36 h ARG 649 Cb 0.26 -0.08 -0.01 0.00 1.11 0.00 0.00 29.97 31.25 1w36 h ARG 649 CO 0.00 0.24 0.02 0.37 0.10 0.00 0.00 179.97 180.70 1w36 h GLN 650 N 0.37 0.64 -0.30 0.08 5.75 -1.20 0.17 115.11 120.61 1w36 h GLN 650 Ca 0.43 -0.19 -0.03 0.00 -0.15 0.00 0.00 58.65 58.70 1w36 h GLN 650 Cb 1.09 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.57 1w36 h GLN 650 CO -0.14 0.73 0.06 0.82 -2.65 0.00 0.00 178.83 177.65 1w36 h ILE 651 N 0.47 1.22 0.24 2.39 1.08 -0.95 -1.36 117.51 120.60 1w36 h ILE 651 Ca 0.11 -0.76 -0.00 0.00 -0.39 0.00 0.00 64.86 63.82 1w36 h ILE 651 Cb 0.42 1.15 -0.03 0.00 -3.07 0.00 0.00 36.82 35.30 1w36 h ILE 651 CO 0.01 0.25 -0.38 -0.25 -0.69 0.00 0.00 178.15 177.09 1w36 h TRP 652 N 0.32 -1.08 -1.04 1.37 2.91 -0.75 0.61 115.95 118.29 1w36 h TRP 652 Ca 0.09 0.02 0.27 0.00 1.13 0.00 0.00 58.89 60.40 1w36 h TRP 652 Cb 0.31 0.44 -0.09 0.00 -0.51 0.00 0.00 29.16 29.31 1w36 h TRP 652 CO 0.02 -0.47 0.67 0.00 -1.03 0.00 0.00 178.44 177.63 1w36 h ARG 653 N -0.65 0.38 0.00 2.65 3.08 -0.52 -1.76 114.38 117.56 1w36 h ARG 653 Ca -0.03 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 59.86 1w36 h ARG 653 Cb 0.60 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 1w36 h ARG 653 CO -0.12 0.25 -1.00 1.63 -1.07 0.00 0.00 179.97 179.66 1w36 n LYS 654 N -4.63 0.52 -0.00 0.04 5.02 -0.53 -4.75 118.16 113.83 1w36 n LYS 654 Ca 0.25 0.53 0.10 0.00 -2.02 0.00 0.00 58.31 57.17 1w36 n LYS 654 Cb 0.88 -1.70 -0.12 0.00 -0.02 0.00 0.00 35.03 34.06 1w36 n LYS 654 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1w36 n ARG 655 N -4.50 0.50 0.00 1.97 5.12 0.21 -5.09 116.66 114.86 1w36 n ARG 655 Ca -0.22 -0.04 0.00 0.00 -1.93 0.00 0.00 57.85 55.66 1w36 n ARG 655 Cb 0.51 -1.44 0.00 0.00 -1.16 0.00 0.00 32.46 30.36 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 2.84 0.21 -0.13 0.00 -0.66 -4.64 105.19 104.25 1w36 n GLY 656 Ca 0.02 -2.06 -0.16 0.00 0.00 0.00 0.00 46.02 43.82 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 0.10 1.31 0.63 1.61 2.07 -1.90 -2.07 116.25 118.00 1w36 h VAL 657 Ca 0.00 -1.82 -0.03 0.00 0.82 0.00 0.00 66.70 65.67 1w36 h VAL 657 Cb 0.00 1.93 0.01 0.00 -1.52 0.00 0.00 31.29 31.71 1w36 h VAL 657 CO 0.00 0.57 -0.30 -0.03 0.02 0.00 0.00 177.57 177.83 1w36 h MET 658 N 0.42 -0.82 -0.99 1.57 1.85 -1.89 0.14 114.93 115.21 1w36 h MET 658 Ca -0.02 0.06 0.17 0.00 -0.61 0.00 0.00 59.70 59.30 1w36 h MET 658 Cb 1.21 0.19 -0.10 0.00 0.43 0.00 0.00 31.60 33.33 1w36 h MET 658 CO 0.13 -0.52 0.62 -1.35 -0.40 0.00 0.00 176.91 175.38 1w36 h PRO 659 N -0.94 0.77 0.46 0.39 0.11 -1.82 0.72 132.00 131.70 1w36 h PRO 659 Ca -0.09 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.95 1w36 h PRO 659 Cb 0.68 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.62 1w36 h PRO 659 CO 0.14 0.51 -0.22 1.98 -0.21 0.00 0.00 178.00 180.20 1w36 h MET 660 N 0.79 -0.60 -0.68 1.05 1.85 -1.01 -2.50 114.93 113.83 1w36 h MET 660 Ca 0.55 0.04 0.18 0.00 -0.61 0.00 0.00 59.70 59.86 1w36 h MET 660 Cb 0.82 0.14 -0.03 0.00 0.43 0.00 0.00 31.60 32.95 1w36 h MET 660 CO -0.33 -0.30 0.48 -0.07 -0.40 0.00 0.00 176.91 176.29 1w36 h LEU 661 N -0.85 0.10 -0.32 3.39 3.38 0.59 0.27 115.31 121.87 1w36 h LEU 661 Ca -0.06 0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.72 1w36 h LEU 661 Cb 0.57 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1w36 h LEU 661 CO 0.10 0.05 -0.76 -0.09 0.09 0.00 0.00 178.44 177.83 1w36 h ARG 662 N 0.11 0.51 0.98 1.13 2.43 -0.81 -1.32 114.38 117.41 1w36 h ARG 662 Ca 0.33 -0.42 -0.05 0.00 -0.81 0.00 0.00 59.98 59.03 1w36 h ARG 662 Cb 1.15 0.09 0.01 0.00 -0.42 0.00 0.00 29.97 30.81 1w36 h ARG 662 CO -0.04 1.05 -0.47 0.00 -1.51 0.00 0.00 179.97 179.00 1w36 h ALA 663 N 0.82 -1.32 -0.56 2.80 0.00 -0.08 -0.99 119.26 119.93 1w36 h ALA 663 Ca -0.04 -0.29 0.09 0.00 0.00 0.00 0.00 54.91 54.67 1w36 h ALA 663 Cb 1.35 0.51 -0.11 0.00 0.00 0.00 0.00 17.79 19.55 1w36 h ALA 663 CO 0.14 -1.24 -0.42 1.25 0.00 0.00 0.00 179.25 178.97 1w36 h LEU 664 N -1.32 -1.45 -1.16 0.00 5.85 -1.13 -1.39 115.31 114.71 1w36 h LEU 664 Ca -0.13 0.24 0.10 0.00 0.84 0.00 0.00 57.88 58.93 1w36 h LEU 664 Cb 1.01 0.66 -0.07 0.00 0.37 0.00 0.00 40.66 42.64 1w36 h LEU 664 CO 0.22 -0.33 0.59 0.24 -0.34 0.00 0.00 178.44 178.82 1w36 h MET 665 N -0.23 0.89 -0.07 1.25 2.86 -1.07 -1.62 114.93 116.94 1w36 h MET 665 Ca 0.18 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.69 1w36 h MET 665 Cb 0.56 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1w36 h MET 665 CO -0.68 0.59 -0.32 0.77 1.06 0.00 0.00 176.91 178.33 1w36 h SER 666 N 0.92 0.13 0.00 1.22 0.02 -0.10 -0.10 113.55 115.65 1w36 h SER 666 Ca 0.43 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 1w36 h SER 666 Cb 0.41 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1w36 h SER 666 CO -0.19 0.45 0.00 0.00 -1.14 0.00 0.00 176.83 175.95 1w36 n ALA 667 N -2.48 -0.13 0.39 3.77 0.00 -0.70 -3.44 120.51 117.93 1w36 n ALA 667 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1w36 n ALA 667 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1w36 n ALA 667 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1w36 n ARG 668 N -1.67 0.25 -3.81 0.00 5.12 -0.70 -4.79 116.66 111.06 1w36 n ARG 668 Ca 0.00 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.67 1w36 n ARG 668 Cb 0.00 -1.05 -0.03 0.00 -1.16 0.00 0.00 32.46 30.22 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 -0.12 -0.83 0.29 0.55 3.02 -0.46 -4.89 115.26 112.82 1w36 n ASN 669 Ca 0.00 -0.85 -0.12 0.00 -0.03 0.00 0.00 54.58 53.59 1w36 n ASN 669 Cb 0.03 -1.03 -0.06 0.00 -0.61 0.00 0.00 39.78 38.11 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 -0.75 0.00 -0.29 2.41 1.08 -1.38 -2.99 117.51 115.58 1w36 h ILE 670 Ca -0.45 -0.22 0.07 0.00 -0.39 0.00 0.00 64.86 63.87 1w36 h ILE 670 Cb 0.91 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.59 1w36 h ILE 670 CO 0.41 0.00 -0.23 0.00 -0.69 0.00 0.00 178.15 177.64 1w36 h ALA 671 N -1.43 -0.07 -0.02 1.87 0.00 -1.90 0.52 119.26 118.24 1w36 h ALA 671 Ca -0.08 0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1w36 h ALA 671 Cb 0.58 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 1w36 h ALA 671 CO 0.13 -0.64 -0.45 0.93 0.00 0.00 0.00 179.25 179.21 1w36 h GLU 672 N -0.21 -0.57 0.03 0.00 5.08 -1.93 -1.88 114.58 115.10 1w36 h GLU 672 Ca 0.15 0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1w36 h GLU 672 Cb 0.45 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1w36 h GLU 672 CO -0.42 -0.38 -0.02 -0.91 -1.00 0.00 0.00 179.01 176.28 1w36 h ASN 673 N -0.59 -0.04 -0.35 1.42 2.35 -1.26 -3.11 115.58 114.00 1w36 h ASN 673 Ca 0.04 -0.09 0.07 0.00 -0.55 0.00 0.00 56.30 55.78 1w36 h ASN 673 Cb 0.67 0.01 -0.09 0.00 0.05 0.00 0.00 38.32 38.97 1w36 h ASN 673 CO -0.34 0.06 -0.32 -0.07 -1.65 0.00 0.00 177.43 175.11 1w36 h LEU 674 N -0.14 -1.06 -1.94 1.61 3.38 0.15 -0.70 115.31 116.61 1w36 h LEU 674 Ca -0.00 0.18 0.12 0.00 0.09 0.00 0.00 57.88 58.27 1w36 h LEU 674 Cb 0.13 0.49 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1w36 h LEU 674 CO 0.01 -0.33 0.47 -0.07 0.09 0.00 0.00 178.44 178.61 1w36 h LEU 675 N -0.28 0.00 0.00 1.67 3.38 -1.30 0.44 115.31 119.22 1w36 h LEU 675 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1w36 h LEU 675 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1w36 h LEU 675 CO -0.50 0.00 -0.01 0.00 0.09 0.00 0.00 178.44 178.02 1w36 h ALA 676 N 1.45 0.99 -0.69 1.53 0.00 -1.06 -3.41 119.26 118.08 1w36 h ALA 676 Ca 0.20 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.63 1w36 h ALA 676 Cb 1.13 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.72 1w36 h ALA 676 CO -0.00 0.00 0.61 2.41 0.00 0.00 0.00 179.25 182.26 1w36 n THR 677 N -2.96 3.15 -2.32 0.00 -1.04 0.16 -5.00 114.28 106.25 1w36 n THR 677 Ca 0.04 -2.28 -0.00 0.00 -2.04 0.00 0.00 64.05 59.77 1w36 n THR 677 Cb 0.51 -1.28 -0.00 0.00 -1.82 0.00 0.00 70.33 67.74 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 -0.12 -1.90 -0.60 2.41 0.00 -1.26 -3.76 120.51 115.28 1w36 n ALA 678 Ca 0.44 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.39 1w36 n ALA 678 Cb 0.60 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 1.89 0.71 0.06 0.00 0.00 -1.26 -4.80 105.19 101.79 1w36 n GLY 679 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.00 -0.86 0.13 -0.02 0.00 -1.25 -2.30 105.19 98.90 1w36 n GLY 680 Ca 0.00 0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 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 0.41 -0.08 1.61 4.81 -1.84 -2.10 114.58 117.39 1w36 h GLU 681 Ca 0.00 -0.69 0.02 0.00 -0.13 0.00 0.00 59.36 58.55 1w36 h GLU 681 Cb 0.14 0.26 -0.03 0.00 0.63 0.00 0.00 28.75 29.75 1w36 h GLU 681 CO 0.00 1.33 -0.25 -0.09 -0.73 0.00 0.00 179.01 179.27 1w36 h ARG 682 N -0.10 -0.25 -0.68 1.92 1.12 -1.86 -0.06 114.38 114.47 1w36 h ARG 682 Ca -0.23 0.02 0.15 0.00 -1.11 0.00 0.00 59.98 58.80 1w36 h ARG 682 Cb 1.93 0.06 -0.11 0.00 -0.01 0.00 0.00 29.97 31.83 1w36 h ARG 682 CO 0.20 -0.16 0.02 0.00 -3.11 0.00 0.00 179.97 176.91 1w36 h ARG 683 N -0.26 0.13 -0.50 0.20 3.08 -1.64 -0.51 114.38 114.88 1w36 h ARG 683 Ca 0.02 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 59.97 1w36 h ARG 683 Cb 0.31 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 1w36 h ARG 683 CO -0.21 0.08 -0.05 1.25 -1.07 0.00 0.00 179.97 179.97 1w36 h LEU 684 N 0.13 0.87 -0.36 3.04 5.85 -0.87 -1.26 115.31 122.71 1w36 h LEU 684 Ca 0.36 -0.24 -0.16 0.00 0.84 0.00 0.00 57.88 58.68 1w36 h LEU 684 Cb 0.61 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 1w36 h LEU 684 CO -0.57 0.95 -0.78 0.71 -0.34 0.00 0.00 178.44 178.41 1w36 h THR 685 N 0.81 1.50 -0.62 1.05 1.35 0.18 -2.62 112.91 114.57 1w36 h THR 685 Ca 0.14 -2.72 -0.03 0.00 -0.55 0.00 0.00 66.41 63.25 1w36 h THR 685 Cb 0.55 2.49 -0.03 0.00 -1.73 0.00 0.00 68.15 69.43 1w36 h THR 685 CO 0.03 0.76 0.25 0.44 -0.25 0.00 0.00 175.52 176.75 1w36 h ASP 686 N 0.00 0.85 -0.71 5.36 3.45 -0.81 -1.60 116.42 122.95 1w36 h ASP 686 Ca -0.01 -0.17 0.05 0.00 0.43 0.00 0.00 57.03 57.34 1w36 h ASP 686 Cb 1.43 -0.22 -0.05 0.00 -0.56 0.00 0.00 39.33 39.92 1w36 h ASP 686 CO 0.10 0.78 0.41 0.40 -1.57 0.00 0.00 179.24 179.37 1w36 h ILE 687 N 0.86 1.01 -0.53 0.35 2.04 -1.09 0.92 117.51 121.07 1w36 h ILE 687 Ca 0.21 -0.26 -0.09 0.00 1.00 0.00 0.00 64.86 65.71 1w36 h ILE 687 Cb 0.20 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1w36 h ILE 687 CO -0.02 0.14 -0.03 -0.07 0.00 0.00 0.00 178.15 178.17 1w36 h LEU 688 N 0.77 0.90 -0.47 1.44 4.07 -1.23 -2.22 115.31 118.57 1w36 h LEU 688 Ca 0.31 -0.25 -0.03 0.00 0.08 0.00 0.00 57.88 57.99 1w36 h LEU 688 Cb 0.15 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.63 1w36 h LEU 688 CO -0.17 0.98 0.17 -0.74 -1.08 0.00 0.00 178.44 177.60 1w36 h HIS 689 N 0.84 0.74 -0.56 1.13 2.76 -0.32 -1.02 115.15 118.73 1w36 h HIS 689 Ca 0.15 -0.07 0.02 0.00 -2.20 0.00 0.00 60.37 58.28 1w36 h HIS 689 Cb 0.54 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 29.25 1w36 h HIS 689 CO 0.03 0.64 0.34 0.82 -1.30 0.00 0.00 177.93 178.47 1w36 h ILE 690 N 0.62 1.07 -0.55 6.26 2.04 -0.61 -1.93 117.51 124.42 1w36 h ILE 690 Ca 0.15 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 1w36 h ILE 690 Cb 0.24 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.62 1w36 h ILE 690 CO -0.01 0.12 0.33 0.28 0.00 0.00 0.00 178.15 178.87 1w36 h SER 691 N 0.68 0.65 -0.59 1.72 0.02 -0.96 0.61 113.55 115.68 1w36 h SER 691 Ca 0.22 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 61.07 1w36 h SER 691 Cb 0.01 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 1w36 h SER 691 CO -0.09 0.50 0.09 -0.33 -1.14 0.00 0.00 176.83 175.86 1w36 h GLU 692 N 0.75 0.99 -0.12 3.45 5.08 -0.58 -0.27 114.58 123.87 1w36 h GLU 692 Ca 0.20 -0.27 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1w36 h GLU 692 Cb -0.03 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 1w36 h GLU 692 CO -0.04 0.93 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.77 1w36 h LEU 693 N 0.89 0.28 -1.40 1.33 3.38 -0.48 -2.92 115.31 116.38 1w36 h LEU 693 Ca 0.18 -0.42 0.17 0.00 0.09 0.00 0.00 57.88 57.89 1w36 h LEU 693 Cb 0.43 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.03 1w36 h LEU 693 CO 0.01 0.64 0.57 0.25 0.09 0.00 0.00 178.44 180.01 1w36 h LEU 694 N -0.09 0.53 -0.77 1.67 5.85 0.31 -1.77 115.31 121.04 1w36 h LEU 694 Ca 0.03 0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 1w36 h LEU 694 Cb 0.54 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1w36 h LEU 694 CO 0.02 0.25 -0.52 1.56 -0.34 0.00 0.00 178.44 179.41 1w36 h GLN 695 N 0.55 0.24 0.07 1.25 1.08 -0.85 -2.29 115.11 115.16 1w36 h GLN 695 Ca 0.45 -0.14 -0.00 0.00 -1.45 0.00 0.00 58.65 57.50 1w36 h GLN 695 Cb 0.91 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.35 1w36 h GLN 695 CO -0.19 0.71 -0.03 0.93 -0.95 0.00 0.00 178.83 179.29 1w36 h GLU 696 N 0.19 -0.09 -0.93 1.46 5.08 -1.33 -3.20 114.58 115.76 1w36 h GLU 696 Ca 0.00 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.57 1w36 h GLU 696 Cb 0.98 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.18 1w36 h GLU 696 CO 0.08 0.49 0.60 0.00 -1.00 0.00 0.00 179.01 179.18 1w36 h ALA 697 N 0.01 2.04 -0.18 3.43 0.00 -1.36 -0.63 119.26 122.58 1w36 h ALA 697 Ca -0.01 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1w36 h ALA 697 Cb 0.61 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1w36 h ALA 697 CO 0.02 -0.34 -0.01 0.78 0.00 0.00 0.00 179.25 179.69 1w36 h GLY 698 N 0.53 0.27 -1.14 0.00 0.00 -1.41 -2.51 103.07 98.82 1w36 h GLY 698 Ca 0.50 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.69 1w36 h GLY 698 CO -0.23 0.13 0.00 -1.30 0.00 0.00 0.00 176.54 175.14 1w36 n THR 699 N -4.37 0.13 -2.21 4.70 -2.24 -0.24 -2.34 114.28 107.71 1w36 n THR 699 Ca -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1w36 n THR 699 Cb 0.18 -0.53 -0.00 0.00 -2.10 0.00 0.00 70.33 67.88 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 0.11 0.00 -3.69 -0.78 1.13 -0.94 -5.06 117.38 108.15 1w36 n GLN 700 Ca 0.00 -1.29 -0.13 0.00 -1.94 0.00 0.00 57.00 53.64 1w36 n GLN 700 Cb 0.26 -0.06 -0.09 0.00 0.11 0.00 0.00 30.24 30.46 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 -0.10 -0.29 1.08 1.43 -0.99 -5.05 118.68 114.76 1w36 s LEU 701 Ca 0.14 1.10 0.11 0.00 -1.03 0.00 0.00 54.13 54.45 1w36 s LEU 701 Cb 0.16 1.87 0.65 0.00 0.03 0.00 0.00 46.19 48.90 1w36 s LEU 701 CO -0.07 -0.19 1.66 1.21 0.23 0.00 0.00 176.35 179.19 1w36 n GLU 702 N 2.86 3.13 -3.94 1.70 4.07 -1.26 -4.90 120.64 122.30 1w36 n GLU 702 Ca -0.14 -3.05 -0.11 0.00 -0.06 0.00 0.00 57.16 53.80 1w36 n GLU 702 Cb 0.56 -2.05 -0.13 0.00 -0.06 0.00 0.00 31.44 29.76 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 -1.55 0.17 0.02 4.31 0.15 -1.26 -5.04 113.70 110.49 1w36 s SER 703 Ca 0.50 -0.25 -0.25 0.00 0.70 0.00 0.00 55.95 56.65 1w36 s SER 703 Cb 0.41 0.04 -0.17 0.00 -1.71 0.00 0.00 66.02 64.59 1w36 s SER 703 CO 0.10 -0.14 1.37 1.05 1.20 0.00 0.00 173.24 176.82 1w36 h GLU 704 N 5.40 -0.25 -0.96 5.44 9.09 -1.98 -3.12 114.58 128.21 1w36 h GLU 704 Ca -0.28 0.02 0.25 0.00 0.05 0.00 0.00 59.36 59.40 1w36 h GLU 704 Cb 1.21 0.06 -0.13 0.00 -1.65 0.00 0.00 28.75 28.23 1w36 h GLU 704 CO 0.46 0.04 0.50 0.45 0.05 0.00 0.00 179.01 180.51 1w36 h HIS 705 N -0.55 0.83 -0.45 2.06 3.86 -1.98 0.36 115.15 119.28 1w36 h HIS 705 Ca -0.03 0.04 0.07 0.00 -1.16 0.00 0.00 60.37 59.30 1w36 h HIS 705 Cb 0.41 -0.21 -0.06 0.00 1.06 0.00 0.00 27.41 28.60 1w36 h HIS 705 CO 0.02 -0.05 0.09 0.00 0.86 0.00 0.00 177.93 178.85 1w36 h ALA 706 N 1.75 0.50 -0.22 2.45 0.00 -1.96 0.18 119.26 121.97 1w36 h ALA 706 Ca 0.63 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.67 1w36 h ALA 706 Cb 1.26 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 1w36 h ALA 706 CO -0.54 -0.31 -0.02 1.25 0.00 0.00 0.00 179.25 179.64 1w36 h LEU 707 N 0.23 -0.12 -0.24 0.00 6.46 -0.30 0.56 115.31 121.89 1w36 h LEU 707 Ca 0.22 0.05 0.06 0.00 -0.12 0.00 0.00 57.88 58.10 1w36 h LEU 707 Cb 0.28 0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 40.25 1w36 h LEU 707 CO -0.29 -0.03 -0.26 0.58 -0.62 0.00 0.00 178.44 177.81 1w36 h VAL 708 N 0.05 0.36 -0.87 1.05 2.07 -0.86 0.40 116.25 118.44 1w36 h VAL 708 Ca 0.10 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.73 1w36 h VAL 708 Cb 0.14 0.36 -0.08 0.00 -1.52 0.00 0.00 31.29 30.19 1w36 h VAL 708 CO -0.19 0.00 0.51 -0.09 0.02 0.00 0.00 177.57 177.82 1w36 h ARG 709 N -0.27 0.81 -0.58 1.57 9.65 0.06 0.12 114.38 125.74 1w36 h ARG 709 Ca 0.14 -0.05 0.06 0.00 -1.10 0.00 0.00 59.98 59.03 1w36 h ARG 709 Cb 0.48 -0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 28.84 1w36 h ARG 709 CO -0.40 0.53 0.39 2.35 2.80 0.00 0.00 179.97 185.64 1w36 h TRP 710 N 0.83 0.57 0.49 2.20 7.01 0.42 -2.18 115.95 125.29 1w36 h TRP 710 Ca 0.43 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.42 1w36 h TRP 710 Cb 0.42 -0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.30 1w36 h TRP 710 CO -0.05 0.31 -0.24 1.25 -2.79 0.00 0.00 178.44 176.92 1w36 h LEU 711 N 0.57 -0.56 -0.96 0.65 6.46 0.18 -3.02 115.31 118.62 1w36 h LEU 711 Ca 0.25 -0.01 0.19 0.00 -0.12 0.00 0.00 57.88 58.19 1w36 h LEU 711 Cb 0.27 0.15 -0.18 0.00 -0.73 0.00 0.00 40.66 40.16 1w36 h LEU 711 CO -0.07 -0.14 -0.25 0.28 -0.62 0.00 0.00 178.44 177.63 1w36 h SER 712 N -1.15 -0.94 -0.44 1.25 0.02 -0.97 0.15 113.55 111.48 1w36 h SER 712 Ca -0.07 0.29 0.07 0.00 -0.84 0.00 0.00 61.79 61.25 1w36 h SER 712 Cb 0.53 0.61 -0.06 0.00 0.14 0.00 0.00 62.40 63.62 1w36 h SER 712 CO 0.11 -0.32 0.06 1.56 -1.14 0.00 0.00 176.83 177.10 1w36 h GLN 713 N -0.00 0.17 0.00 3.45 7.50 -1.45 0.61 115.11 125.39 1w36 h GLN 713 Ca 0.45 -0.01 -0.01 0.00 0.50 0.00 0.00 58.65 59.59 1w36 h GLN 713 Cb 0.69 -0.04 -0.00 0.00 0.05 0.00 0.00 27.48 28.18 1w36 h GLN 713 CO -0.99 0.11 -0.02 0.45 -1.50 0.00 0.00 178.83 176.88 1w36 h HIS 714 N 0.18 0.00 0.00 2.96 3.86 -0.64 -0.30 115.15 121.20 1w36 h HIS 714 Ca 0.22 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.19 1w36 h HIS 714 Cb 0.29 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.72 1w36 h HIS 714 CO -0.24 0.02 -1.29 0.82 0.86 0.00 0.00 177.93 178.11 1w36 h ILE 715 N 0.00 1.22 0.00 2.45 2.04 -0.02 -3.29 117.51 119.91 1w36 h ILE 715 Ca -0.00 -2.95 -0.18 0.00 1.00 0.00 0.00 64.86 62.73 1w36 h ILE 715 Cb 0.53 2.59 -0.03 0.00 -0.74 0.00 0.00 36.82 39.16 1w36 h ILE 715 CO 0.00 0.69 -1.24 -0.07 0.00 0.00 0.00 178.15 177.53 1w36 h LEU 716 N 0.00 0.00 -6.01 1.44 3.38 -0.28 -3.43 115.31 110.41 1w36 h LEU 716 Ca -0.13 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.34 1w36 h LEU 716 Cb 1.83 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 42.25 1w36 h LEU 716 CO 0.10 0.69 -0.90 1.21 0.09 0.00 0.00 178.44 179.63 1w36 n GLU 717 N -3.03 0.36 0.00 1.13 4.07 -0.18 -5.10 120.64 117.88 1w36 n GLU 717 Ca -0.08 -2.92 0.00 0.00 -0.06 0.00 0.00 57.16 54.10 1w36 n GLU 717 Cb 0.87 -1.55 0.00 0.00 -0.06 0.00 0.00 31.44 30.70 1w36 n GLU 717 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1w36 n PRO 718 N 2.56 3.52 -0.99 5.31 -0.04 -1.24 -4.71 135.00 139.40 1w36 n PRO 718 Ca 0.26 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.65 1w36 n PRO 718 Cb 0.51 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.94 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 -2.86 0.00 3.54 2.03 -1.26 -4.96 116.55 113.05 1w36 n ASP 719 Ca 0.00 0.16 0.00 0.00 0.52 0.00 0.00 54.79 55.47 1w36 n ASP 719 Cb 0.00 -2.42 0.00 0.00 -0.72 0.00 0.00 41.12 37.98 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 0.27 0.00 -4.32 1.67 3.41 -1.26 -4.90 113.62 108.48 1w36 n SER 720 Ca -0.06 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.25 1w36 n SER 720 Cb 0.31 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.46 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 -2.54 1.86 0.27 4.04 0.02 -1.26 -4.93 114.94 112.39 1w36 s ASN 721 Ca 0.00 0.93 0.25 0.00 -1.02 0.00 0.00 52.86 53.02 1w36 s ASN 721 Cb 0.00 -1.42 0.57 0.00 0.02 0.00 0.00 41.25 40.43 1w36 s ASN 721 CO 0.00 -3.57 1.63 0.00 0.02 0.00 0.00 177.10 175.18 1w36 h ALA 722 N -2.20 0.92 0.00 0.60 0.00 -1.98 -3.18 119.26 113.42 1w36 h ALA 722 Ca -0.51 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.32 1w36 h ALA 722 Cb 1.32 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1w36 h ALA 722 CO 0.48 0.00 -0.41 0.66 0.00 0.00 0.00 179.25 179.98 1w36 h SER 723 N 0.00 0.00 -0.57 0.00 4.64 -2.00 -2.58 113.55 113.04 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 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1w36 h SER 723 CO 0.00 0.41 0.00 -1.54 -0.87 0.00 0.00 176.83 174.83 1w36 n SER 724 N -3.56 3.89 -4.82 4.97 3.41 -1.20 -4.94 113.62 111.37 1w36 n SER 724 Ca -0.00 -2.27 -0.31 0.00 -0.26 0.00 0.00 58.87 56.02 1w36 n SER 724 Cb 0.52 -0.50 0.04 0.00 -0.26 0.00 0.00 64.21 64.02 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 -1.63 3.01 0.18 4.33 -0.21 -0.98 -0.25 119.66 124.12 1w36 s GLN 725 Ca 0.43 1.01 -0.30 0.00 0.02 0.00 0.00 55.36 56.51 1w36 s GLN 725 Cb 0.26 -2.00 -0.08 0.00 1.00 0.00 0.00 33.01 32.20 1w36 s GLN 725 CO 0.23 -1.04 1.07 -0.65 -2.12 0.00 0.00 175.29 172.78 1w36 s GLN 726 N -4.85 4.63 0.27 2.91 -0.21 -1.15 -4.59 119.66 116.68 1w36 s GLN 726 Ca 0.59 1.68 -0.24 0.00 0.02 0.00 0.00 55.36 57.41 1w36 s GLN 726 Cb -0.14 -3.28 -0.09 0.00 1.00 0.00 0.00 33.01 30.49 1w36 s GLN 726 CO 0.51 0.13 0.85 -1.64 -2.12 0.00 0.00 175.29 173.03 1w36 s MET 727 N -0.46 4.47 0.07 2.91 -1.94 -1.26 -5.05 119.30 118.04 1w36 s MET 727 Ca 0.48 1.15 -0.14 0.00 -1.71 0.00 0.00 55.69 55.48 1w36 s MET 727 Cb -0.29 -2.87 -0.06 0.00 2.01 0.00 0.00 34.83 33.62 1w36 s MET 727 CO 0.35 0.35 0.47 -0.98 -0.01 0.00 0.00 175.02 175.19 1w36 s ARG 728 N -1.95 3.93 0.42 2.03 1.04 -1.26 -5.01 118.95 118.14 1w36 s ARG 728 Ca 0.46 0.41 -0.24 0.00 -1.04 0.00 0.00 55.73 55.33 1w36 s ARG 728 Cb -0.18 -3.08 -0.08 0.00 -2.04 0.00 0.00 34.95 29.56 1w36 s ARG 728 CO 0.23 0.59 1.12 -0.51 -0.04 0.00 0.00 175.30 176.69 1w36 s LEU 729 N -1.56 4.11 -0.31 -1.89 2.01 -1.26 -4.97 118.68 114.81 1w36 s LEU 729 Ca 0.31 2.20 -0.29 0.00 0.01 0.00 0.00 54.13 56.36 1w36 s LEU 729 Cb -0.16 -4.16 0.01 0.00 0.01 0.00 0.00 46.19 41.89 1w36 s LEU 729 CO 0.17 -0.67 1.18 -0.70 1.01 0.00 0.00 176.35 177.34 1w36 s GLU 730 N -2.50 3.99 0.00 1.70 2.56 -1.26 -1.66 118.70 121.53 1w36 s GLU 730 Ca 0.59 1.14 0.00 0.00 0.00 0.00 0.00 54.97 56.70 1w36 s GLU 730 Cb -0.26 -3.81 0.00 0.00 2.00 0.00 0.00 34.13 32.06 1w36 s GLU 730 CO 0.33 -1.01 0.00 -1.13 -0.56 0.00 0.00 175.26 172.88 1w36 n SER 731 N 7.23 0.00 0.20 -1.70 3.41 -1.26 -4.89 113.62 116.61 1w36 n SER 731 Ca 0.13 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.85 1w36 n SER 731 Cb 0.47 0.00 0.56 0.00 -0.26 0.00 0.00 64.21 64.98 1w36 n SER 731 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1w36 h ASP 732 N 1.44 0.00 0.44 4.04 3.32 -1.70 0.85 116.42 124.81 1w36 h ASP 732 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1w36 h ASP 732 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1w36 h ASP 732 CO 0.00 0.00 -0.10 0.11 -1.72 0.00 0.00 179.24 177.53 1w36 h LYS 733 N 0.00 0.00 -0.64 3.56 1.57 -1.90 -2.37 116.57 116.78 1w36 h LYS 733 Ca 0.00 0.00 -0.38 0.00 -1.87 0.00 0.00 60.65 58.40 1w36 h LYS 733 Cb 0.35 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 32.44 1w36 h LYS 733 CO 0.00 0.10 0.09 0.72 -0.57 0.00 0.00 179.45 179.79 1w36 n HIS 734 N -3.50 2.06 -4.56 -1.35 8.25 0.30 -4.31 115.22 112.11 1w36 n HIS 734 Ca -0.02 -1.99 -0.29 0.00 -0.26 0.00 0.00 57.72 55.16 1w36 n HIS 734 Cb 0.24 -0.71 -0.14 0.00 1.12 0.00 0.00 29.99 30.50 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 -3.42 2.27 0.42 2.41 1.43 -0.89 -4.56 118.68 116.34 1w36 s LEU 735 Ca 0.51 -0.70 -0.26 0.00 -1.03 0.00 0.00 54.13 52.65 1w36 s LEU 735 Cb 0.44 -1.24 -0.09 0.00 0.03 0.00 0.00 46.19 45.33 1w36 s LEU 735 CO 0.02 0.20 1.40 0.68 0.23 0.00 0.00 176.35 178.89 1w36 s VAL 736 N -0.98 2.22 -0.22 -1.59 -7.23 -1.18 -4.33 120.40 107.09 1w36 s VAL 736 Ca 0.13 0.20 -0.06 0.00 -1.81 0.00 0.00 61.98 60.44 1w36 s VAL 736 Cb -0.10 -3.12 -0.03 0.00 0.56 0.00 0.00 36.38 33.69 1w36 s VAL 736 CO 0.05 0.03 0.04 -1.10 -0.31 0.00 0.00 175.10 173.81 1w36 s GLN 737 N -2.31 3.67 -0.29 4.82 -0.21 -1.18 -2.21 119.66 121.96 1w36 s GLN 737 Ca 0.58 -0.48 -0.07 0.00 0.02 0.00 0.00 55.36 55.41 1w36 s GLN 737 Cb -0.43 -3.21 0.01 0.00 1.00 0.00 0.00 33.01 30.38 1w36 s GLN 737 CO 0.56 -0.05 0.08 -1.50 -2.12 0.00 0.00 175.29 172.25 1w36 s ILE 738 N 1.22 3.98 0.28 1.08 2.07 0.23 -0.85 121.20 129.21 1w36 s ILE 738 Ca 0.04 -0.65 0.07 0.00 -1.41 0.00 0.00 60.65 58.69 1w36 s ILE 738 Cb -0.14 -3.03 -0.06 0.00 0.13 0.00 0.00 42.46 39.35 1w36 s ILE 738 CO 0.02 0.10 -0.05 0.54 -1.91 0.00 0.00 174.94 173.65 1w36 s VAL 739 N 1.51 1.63 0.35 4.00 0.11 -0.15 -1.69 120.40 126.17 1w36 s VAL 739 Ca 0.03 -2.12 -0.07 0.00 -2.93 0.00 0.00 61.98 56.89 1w36 s VAL 739 Cb -0.17 -2.47 -0.06 0.00 -1.53 0.00 0.00 36.38 32.15 1w36 s VAL 739 CO 0.02 -0.28 0.66 0.42 -3.33 0.00 0.00 175.10 172.60 1w36 s THR 740 N -3.02 4.91 0.34 5.04 -4.23 -1.25 0.41 115.64 117.84 1w36 s THR 740 Ca 0.30 0.32 0.09 0.00 -1.18 0.00 0.00 61.69 61.21 1w36 s THR 740 Cb 0.04 -3.74 0.32 0.00 1.34 0.00 0.00 72.50 70.46 1w36 s THR 740 CO 0.12 -0.44 1.82 0.40 -0.54 0.00 0.00 174.62 175.98 1w36 h ILE 741 N 1.17 0.74 0.20 2.99 1.08 -1.70 -1.43 117.51 120.56 1w36 h ILE 741 Ca -0.47 -0.24 -0.01 0.00 -0.39 0.00 0.00 64.86 63.75 1w36 h ILE 741 Cb 1.19 -0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 1w36 h ILE 741 CO 0.65 0.13 -0.10 0.45 -0.69 0.00 0.00 178.15 178.59 1w36 h HIS 742 N 0.69 -0.25 0.00 1.37 3.86 -1.93 -2.81 115.15 116.07 1w36 h HIS 742 Ca 0.53 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.73 1w36 h HIS 742 Cb 0.91 0.08 0.00 0.00 1.06 0.00 0.00 27.41 29.46 1w36 h HIS 742 CO -0.00 0.12 0.00 1.63 0.86 0.00 0.00 177.93 180.54 1w36 n LYS 743 N -5.03 0.05 0.05 2.45 5.02 -0.79 -1.88 118.16 118.04 1w36 n LYS 743 Ca -0.09 0.46 0.13 0.00 -2.02 0.00 0.00 58.31 56.79 1w36 n LYS 743 Cb 0.25 -1.64 0.32 0.00 -0.02 0.00 0.00 35.03 33.95 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 -1.74 0.59 -4.74 4.39 3.41 -0.61 -4.64 113.62 110.28 1w36 n SER 744 Ca 0.01 0.25 -0.42 0.00 -0.26 0.00 0.00 58.87 58.44 1w36 n SER 744 Cb 0.07 -0.20 -0.01 0.00 -0.26 0.00 0.00 64.21 63.81 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 -1.95 2.56 0.00 4.33 4.81 -0.79 -1.32 118.16 125.80 1w36 n LYS 745 Ca 0.05 0.91 0.00 0.00 -0.87 0.00 0.00 58.31 58.39 1w36 n LYS 745 Cb 0.40 -2.65 0.00 0.00 0.02 0.00 0.00 35.03 32.81 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 1.73 2.28 3.74 3.14 0.00 -1.26 -5.01 105.19 109.81 1w36 n GLY 746 Ca 0.07 -0.42 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 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 3.57 0.04 0.99 1.02 -0.44 -5.06 118.68 118.80 1w36 s LEU 747 Ca 0.00 2.45 0.08 0.00 0.02 0.00 0.00 54.13 56.68 1w36 s LEU 747 Cb 0.00 -4.60 -0.03 0.00 0.02 0.00 0.00 46.19 41.58 1w36 s LEU 747 CO 0.00 -1.83 -0.23 -0.70 0.02 0.00 0.00 176.35 173.61 1w36 s GLU 748 N -3.46 1.57 -0.08 1.70 2.12 -1.26 -4.76 118.70 114.53 1w36 s GLU 748 Ca 0.78 -0.98 -0.12 0.00 0.36 0.00 0.00 54.97 55.01 1w36 s GLU 748 Cb -0.32 -1.69 0.03 0.00 0.26 0.00 0.00 34.13 32.41 1w36 s GLU 748 CO 0.37 0.44 0.32 0.71 -0.54 0.00 0.00 175.26 176.56 1w36 s TYR 749 N -0.77 -0.29 0.06 5.30 1.51 -0.38 -5.02 117.35 117.77 1w36 s TYR 749 Ca 0.09 0.64 -0.22 0.00 -1.01 0.00 0.00 57.07 56.57 1w36 s TYR 749 Cb -0.09 0.11 -0.13 0.00 -0.11 0.00 0.00 41.96 41.74 1w36 s TYR 749 CO 0.02 -0.25 1.54 -1.35 -1.11 0.00 0.00 175.55 174.39 1w36 h PRO 750 N 4.97 0.19 -4.68 -1.71 0.11 -1.87 -1.82 132.00 127.19 1w36 h PRO 750 Ca -0.28 -0.05 -0.47 0.00 0.11 0.00 0.00 66.00 65.31 1w36 h PRO 750 Cb 1.18 -0.02 -0.32 0.00 0.11 0.00 0.00 31.00 31.95 1w36 h PRO 750 CO 0.34 0.37 -0.80 -0.51 -0.21 0.00 0.00 178.00 177.19 1w36 s LEU 751 N -9.68 1.75 0.06 2.35 1.43 -0.66 -2.12 118.68 111.81 1w36 s LEU 751 Ca -0.14 -0.24 0.05 0.00 -1.03 0.00 0.00 54.13 52.77 1w36 s LEU 751 Cb 0.06 -0.69 -0.03 0.00 0.03 0.00 0.00 46.19 45.56 1w36 s LEU 751 CO 0.70 0.07 -0.14 0.54 0.23 0.00 0.00 176.35 177.75 1w36 s VAL 752 N 0.32 1.09 -0.07 -1.59 0.11 -0.57 -2.12 120.40 117.57 1w36 s VAL 752 Ca -0.06 -1.22 0.03 0.00 -2.93 0.00 0.00 61.98 57.79 1w36 s VAL 752 Cb -0.11 -1.04 -0.02 0.00 -1.53 0.00 0.00 36.38 33.68 1w36 s VAL 752 CO 0.01 -0.18 -0.14 0.26 -3.33 0.00 0.00 175.10 171.73 1w36 s TRP 753 N -1.18 2.72 -0.61 1.54 0.52 0.52 -2.35 118.94 120.11 1w36 s TRP 753 Ca -0.01 -0.28 0.06 0.00 0.02 0.00 0.00 56.10 55.88 1w36 s TRP 753 Cb -0.09 -1.68 0.24 0.00 -1.15 0.00 0.00 33.47 30.78 1w36 s TRP 753 CO 0.02 0.09 0.68 1.28 0.02 0.00 0.00 176.95 179.04 1w36 n LEU 754 N 2.61 3.14 -0.07 2.99 4.32 -0.72 -1.02 117.00 128.24 1w36 n LEU 754 Ca -0.17 -5.30 0.05 0.00 -0.02 0.00 0.00 56.01 50.56 1w36 n LEU 754 Cb 0.52 -0.48 0.40 0.00 -1.62 0.00 0.00 43.42 42.24 1w36 n LEU 754 CO 0.27 2.03 1.18 1.55 -1.22 0.00 0.00 177.39 181.20 1w36 h PRO 755 N 4.30 0.62 -0.38 3.23 0.13 -1.82 -0.38 132.00 137.71 1w36 h PRO 755 Ca 0.18 -0.04 -0.28 0.00 -0.87 0.00 0.00 66.00 64.99 1w36 h PRO 755 Cb 0.70 -0.14 -0.23 0.00 0.13 0.00 0.00 31.00 31.46 1w36 h PRO 755 CO 0.77 0.41 -0.69 1.19 -0.23 0.00 0.00 178.00 179.44 1w36 n PHE 756 N -4.47 1.36 0.60 1.56 0.99 -1.26 -3.98 117.46 112.27 1w36 n PHE 756 Ca 0.06 -1.83 0.05 0.00 -0.00 0.00 0.00 57.45 55.72 1w36 n PHE 756 Cb 0.11 -0.29 0.29 0.00 -1.00 0.00 0.00 39.48 38.60 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 -0.85 0.21 1.00 4.37 0.13 -1.23 -2.89 119.36 120.09 1w36 n ILE 757 Ca 0.30 0.05 0.10 0.00 -1.10 0.00 0.00 62.75 62.11 1w36 n ILE 757 Cb 0.84 -0.89 -0.07 0.00 -0.84 0.00 0.00 39.64 38.69 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 -1.08 0.00 -1.81 9.51 -1.04 -1.26 -4.56 114.28 114.04 1w36 n THR 758 Ca 0.07 -0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.72 1w36 n THR 758 Cb 0.05 0.90 0.06 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 -3.00 4.81 0.00 8.00 0.01 -1.14 -4.74 114.94 118.88 1w36 s ASN 759 Ca 0.08 2.45 0.00 0.00 -0.71 0.00 0.00 52.86 54.68 1w36 s ASN 759 Cb 0.16 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.22 1w36 s ASN 759 CO 0.85 -1.85 0.00 2.22 -1.51 0.00 0.00 177.10 176.80 1w36 n PHE 760 N -1.93 0.00 -0.09 2.20 -1.74 -1.26 -4.84 117.46 109.80 1w36 n PHE 760 Ca 0.14 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.03 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 -0.05 0.00 -2.14 3.97 1.74 -1.26 -5.04 116.66 113.87 1w36 n ARG 761 Ca 0.00 0.03 -0.41 0.00 -0.77 0.00 0.00 57.85 56.69 1w36 n ARG 761 Cb 0.00 -0.06 -0.03 0.00 -1.02 0.00 0.00 32.46 31.35 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 3.05 0.04 1.55 1.01 -1.26 -4.95 120.40 119.84 1w36 s VAL 762 Ca 0.00 0.85 -0.30 0.00 0.00 0.00 0.00 61.98 62.52 1w36 s VAL 762 Cb 0.00 -3.54 -0.06 0.00 0.00 0.00 0.00 36.38 32.78 1w36 s VAL 762 CO 0.00 0.12 1.35 -1.58 0.00 0.00 0.00 175.10 174.99 1w36 s GLN 763 N 0.05 4.32 -0.00 2.72 -0.44 -1.26 -4.89 119.66 120.16 1w36 s GLN 763 Ca 0.59 1.95 0.03 0.00 -2.50 0.00 0.00 55.36 55.43 1w36 s GLN 763 Cb -0.38 -3.45 -0.04 0.00 -1.64 0.00 0.00 33.01 27.49 1w36 s GLN 763 CO 0.38 -0.48 0.13 0.39 0.50 0.00 0.00 175.29 176.20 1w36 n GLU 764 N 4.77 4.11 -2.93 1.67 -0.58 -1.26 -4.61 120.64 121.82 1w36 n GLU 764 Ca 0.12 -0.01 -0.41 0.00 -0.42 0.00 0.00 57.16 56.44 1w36 n GLU 764 Cb 0.44 -0.79 -0.04 0.00 -0.57 0.00 0.00 31.44 30.48 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 -1.61 4.45 -1.46 3.49 -0.21 -1.26 -4.97 119.66 118.09 1w36 s GLN 765 Ca 0.01 1.05 -0.13 0.00 0.02 0.00 0.00 55.36 56.31 1w36 s GLN 765 Cb 0.03 -3.47 0.04 0.00 1.00 0.00 0.00 33.01 30.60 1w36 s GLN 765 CO 0.14 -0.03 2.28 0.00 -2.12 0.00 0.00 175.29 175.56 1w36 n ALA 766 N 4.05 5.74 -3.99 6.09 0.00 -1.26 -4.81 120.51 126.32 1w36 n ALA 766 Ca 0.02 -3.88 -0.33 0.00 0.00 0.00 0.00 53.44 49.25 1w36 n ALA 766 Cb 0.51 -3.48 -0.15 0.00 0.00 0.00 0.00 19.45 16.33 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 2.88 3.26 0.18 0.00 5.36 -1.26 -1.60 117.98 126.80 1w36 s PHE 767 Ca 0.49 -2.24 0.00 0.00 -0.96 0.00 0.00 56.93 54.23 1w36 s PHE 767 Cb 0.14 -1.96 -0.04 0.00 -0.34 0.00 0.00 43.02 40.81 1w36 s PHE 767 CO -0.08 -0.86 0.05 1.52 -1.46 0.00 0.00 175.22 174.39 1w36 s TYR 768 N 1.13 1.16 -0.15 10.12 -0.85 -0.92 -4.66 117.35 123.18 1w36 s TYR 768 Ca -0.08 -1.16 -0.08 0.00 -0.52 0.00 0.00 57.07 55.23 1w36 s TYR 768 Cb -0.20 -0.65 -0.04 0.00 0.38 0.00 0.00 41.96 41.45 1w36 s TYR 768 CO -0.04 -0.38 0.12 -1.01 -1.52 0.00 0.00 175.55 172.71 1w36 s HIS 769 N -3.86 3.47 0.08 -3.49 3.76 -1.26 -0.91 115.29 113.08 1w36 s HIS 769 Ca 0.29 0.39 -0.31 0.00 -0.15 0.00 0.00 55.06 55.28 1w36 s HIS 769 Cb 0.07 -2.01 -0.08 0.00 1.11 0.00 0.00 32.58 31.66 1w36 s HIS 769 CO 0.06 0.51 1.60 0.34 -0.85 0.00 0.00 174.74 176.41 1w36 s ASP 770 N -0.43 6.64 0.25 1.40 -1.08 -0.18 -4.88 116.67 118.38 1w36 s ASP 770 Ca 0.11 2.46 0.19 0.00 -0.52 0.00 0.00 52.55 54.79 1w36 s ASP 770 Cb -0.12 -2.57 0.95 0.00 -1.46 0.00 0.00 42.92 39.73 1w36 s ASP 770 CO 0.02 -0.85 1.57 0.54 0.52 0.00 0.00 175.17 176.97 1w36 n ARG 771 N 5.22 0.12 -0.05 4.34 3.00 -1.26 -0.57 116.66 127.47 1w36 n ARG 771 Ca 0.15 0.57 -0.09 0.00 -0.01 0.00 0.00 57.85 58.47 1w36 n ARG 771 Cb 0.41 -1.86 -0.04 0.00 0.00 0.00 0.00 32.46 30.97 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 -2.12 0.00 1.00 -1.55 8.25 -1.26 -4.67 115.22 114.88 1w36 n HIS 772 Ca -0.00 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.59 1w36 n HIS 772 Cb 0.07 -0.34 0.42 0.00 1.12 0.00 0.00 29.99 31.26 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 -3.22 0.27 -1.37 0.41 3.41 -1.22 -4.94 113.62 106.97 1w36 n SER 773 Ca -0.18 0.09 -0.16 0.00 -0.26 0.00 0.00 58.87 58.36 1w36 n SER 773 Cb 0.64 -0.09 -0.07 0.00 -0.26 0.00 0.00 64.21 64.43 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 -1.50 -0.12 -3.46 7.33 0.99 0.27 -4.97 117.46 116.00 1w36 n PHE 774 Ca 0.06 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.30 1w36 n PHE 774 Cb 0.34 -3.03 -0.01 0.00 -1.00 0.00 0.00 39.48 35.78 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 -3.36 3.29 -0.10 -1.08 2.02 -1.26 -4.66 118.70 113.55 1w36 s GLU 775 Ca 0.00 -0.65 -0.19 0.00 0.02 0.00 0.00 54.97 54.15 1w36 s GLU 775 Cb 0.00 -2.74 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 1w36 s GLU 775 CO 0.00 0.10 0.52 0.00 0.02 0.00 0.00 175.26 175.90 1w36 s ALA 776 N -2.25 3.46 -0.11 5.21 0.00 -1.26 -1.01 121.76 125.79 1w36 s ALA 776 Ca 0.42 -0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.29 1w36 s ALA 776 Cb -0.10 -2.69 0.00 0.00 0.00 0.00 0.00 23.12 20.34 1w36 s ALA 776 CO 0.33 0.02 -0.23 0.08 0.00 0.00 0.00 175.76 175.96 1w36 s VAL 777 N 0.52 2.02 -0.29 0.00 1.01 -0.09 -0.58 120.40 122.99 1w36 s VAL 777 Ca 0.28 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 61.19 1w36 s VAL 777 Cb -0.16 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 1w36 s VAL 777 CO 0.12 0.55 0.12 -0.22 0.00 0.00 0.00 175.10 175.67 1w36 s LEU 778 N 0.54 3.91 -0.49 3.92 2.96 0.88 -2.17 118.68 128.23 1w36 s LEU 778 Ca -0.14 -0.45 -0.20 0.00 -0.22 0.00 0.00 54.13 53.12 1w36 s LEU 778 Cb -0.17 -1.97 0.04 0.00 0.50 0.00 0.00 46.19 44.59 1w36 s LEU 778 CO 0.05 -0.15 0.65 -0.62 -1.32 0.00 0.00 176.35 174.95 1w36 s ASP 779 N 1.60 6.26 0.00 3.68 2.15 -0.63 -2.01 116.67 127.73 1w36 s ASP 779 Ca 0.05 -0.68 0.05 0.00 0.43 0.00 0.00 52.55 52.39 1w36 s ASP 779 Cb -0.17 -2.31 0.28 0.00 -0.30 0.00 0.00 42.92 40.42 1w36 s ASP 779 CO 0.05 -0.87 1.00 0.18 -0.17 0.00 0.00 175.17 175.37 1w36 n LEU 780 N 6.28 0.00 -3.84 -1.34 4.77 -1.26 -4.07 117.00 117.53 1w36 n LEU 780 Ca -0.04 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.64 1w36 n LEU 780 Cb 0.46 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.39 1w36 n LEU 780 CO 0.54 0.00 -0.39 0.20 -1.33 0.00 0.00 177.39 176.41 1w36 s ASN 781 N -1.33 3.44 0.00 -1.43 0.01 -1.26 -4.63 114.94 109.73 1w36 s ASN 781 Ca 0.07 -1.04 0.00 0.00 -0.71 0.00 0.00 52.86 51.18 1w36 s ASN 781 Cb 0.03 -0.91 0.00 0.00 0.41 0.00 0.00 41.25 40.78 1w36 s ASN 781 CO 0.05 -0.27 0.66 0.00 -1.51 0.00 0.00 177.10 176.03 1w36 n ALA 782 N 4.84 0.75 -1.66 0.60 0.00 -1.26 -4.80 120.51 118.99 1w36 n ALA 782 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.91 1w36 n ALA 782 Cb 0.45 -1.83 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 1w36 n ALA 782 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1w36 s ALA 783 N 3.57 3.17 0.34 0.00 0.00 -1.26 -4.81 121.76 122.78 1w36 s ALA 783 Ca 0.00 1.04 0.20 0.00 0.00 0.00 0.00 51.96 53.20 1w36 s ALA 783 Cb 0.00 -3.95 1.25 0.00 0.00 0.00 0.00 23.12 20.41 1w36 s ALA 783 CO 0.00 -2.15 1.45 -2.30 0.00 0.00 0.00 175.76 172.76 1w36 n PRO 784 N 8.11 -0.05 -0.36 0.00 -0.02 -1.26 0.16 135.00 141.57 1w36 n PRO 784 Ca 0.24 1.26 -0.01 0.00 -2.02 0.00 0.00 63.50 62.98 1w36 n PRO 784 Cb 0.43 -2.28 0.12 0.00 -0.02 0.00 0.00 33.50 31.75 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 1.23 0.03 -0.52 4.57 -1.98 0.28 114.58 118.19 1w36 h GLU 785 Ca 0.78 -0.07 -0.26 0.00 -1.18 0.00 0.00 59.36 58.63 1w36 h GLU 785 Cb 2.09 -0.28 0.02 0.00 -0.16 0.00 0.00 28.75 30.41 1w36 h GLU 785 CO -0.70 0.81 -1.06 0.66 -1.18 0.00 0.00 179.01 177.55 1w36 h SER 786 N 1.27 0.78 0.11 1.04 4.64 -0.65 -1.95 113.55 118.78 1w36 h SER 786 Ca 0.37 -0.65 -0.05 0.00 -0.47 0.00 0.00 61.79 60.99 1w36 h SER 786 Cb -0.07 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 61.77 1w36 h SER 786 CO -0.10 1.45 -0.19 0.58 -0.87 0.00 0.00 176.83 177.70 1w36 h VAL 787 N 0.31 1.18 -0.52 0.95 2.07 -1.25 0.53 116.25 119.54 1w36 h VAL 787 Ca -0.13 -0.84 -0.11 0.00 0.82 0.00 0.00 66.70 66.44 1w36 h VAL 787 Cb 1.71 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 1w36 h VAL 787 CO 0.20 0.25 -0.12 0.44 0.02 0.00 0.00 177.57 178.37 1w36 h ASP 788 N 0.15 1.00 0.34 0.57 5.19 -0.89 0.86 116.42 123.63 1w36 h ASP 788 Ca 0.03 -0.36 -0.11 0.00 -0.62 0.00 0.00 57.03 55.97 1w36 h ASP 788 Cb 0.42 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.64 1w36 h ASP 788 CO 0.03 1.12 -0.47 -0.07 -3.12 0.00 0.00 179.24 176.73 1w36 h LEU 789 N 0.86 0.18 -0.26 1.55 3.38 -0.20 -2.61 115.31 118.21 1w36 h LEU 789 Ca 0.13 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1w36 h LEU 789 Cb 0.68 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1w36 h LEU 789 CO 0.05 0.63 -0.18 0.00 0.09 0.00 0.00 178.44 179.03 1w36 h ALA 790 N 1.38 0.37 -0.85 1.53 0.00 0.43 -2.95 119.26 119.17 1w36 h ALA 790 Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1w36 h ALA 790 Cb 0.89 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1w36 h ALA 790 CO 0.07 0.28 0.54 0.93 0.00 0.00 0.00 179.25 181.07 1w36 h GLU 791 N 0.29 1.12 -0.02 0.00 4.39 -0.73 -0.74 114.58 118.91 1w36 h GLU 791 Ca 0.05 -0.08 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 1w36 h GLU 791 Cb 0.71 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1w36 h GLU 791 CO 0.05 0.76 0.01 0.00 -1.16 0.00 0.00 179.01 178.67 1w36 h ALA 792 N 1.44 0.02 -0.08 3.43 0.00 -1.48 0.12 119.26 122.73 1w36 h ALA 792 Ca 0.31 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1w36 h ALA 792 Cb -0.10 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1w36 h ALA 792 CO -0.06 -0.43 0.19 0.93 0.00 0.00 0.00 179.25 179.88 1w36 h GLU 793 N -0.07 0.00 0.08 0.00 5.08 -1.15 0.40 114.58 118.92 1w36 h GLU 793 Ca 0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1w36 h GLU 793 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1w36 h GLU 793 CO -0.00 0.00 -0.04 -0.09 -1.00 0.00 0.00 179.01 177.88 1w36 h ARG 794 N 0.00 -0.10 0.00 2.33 2.43 0.46 -2.89 114.38 116.61 1w36 h ARG 794 Ca 0.04 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1w36 h ARG 794 Cb 0.41 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1w36 h ARG 794 CO -0.00 0.43 -0.21 1.37 -1.51 0.00 0.00 179.97 180.04 1w36 h LEU 795 N -0.73 0.00 -1.91 3.80 8.10 -1.14 -1.61 115.31 121.83 1w36 h LEU 795 Ca -0.01 0.00 0.29 0.00 0.11 0.00 0.00 57.88 58.27 1w36 h LEU 795 Cb 0.58 0.00 -0.04 0.00 -0.44 0.00 0.00 40.66 40.76 1w36 h LEU 795 CO 0.02 0.21 0.81 0.00 -4.11 0.00 0.00 178.44 175.37 1w36 h ALA 796 N 1.79 2.91 0.13 0.17 0.00 -0.95 0.15 119.26 123.46 1w36 h ALA 796 Ca -0.00 -0.04 -0.36 0.00 0.00 0.00 0.00 54.91 54.51 1w36 h ALA 796 Cb 1.00 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1w36 h ALA 796 CO 0.03 -1.33 -1.99 -1.91 0.00 0.00 0.00 179.25 174.05 1w36 n GLU 797 N -4.00 0.76 0.07 0.00 2.13 -0.80 -3.79 120.64 115.01 1w36 n GLU 797 Ca 0.22 0.26 -0.02 0.00 0.66 0.00 0.00 57.16 58.28 1w36 n GLU 797 Cb 1.15 -1.71 0.24 0.00 0.27 0.00 0.00 31.44 31.39 1w36 n GLU 797 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1w36 h ASP 798 N 0.07 0.33 -0.66 4.31 3.32 -0.09 0.81 116.42 124.52 1w36 h ASP 798 Ca -0.42 -0.12 0.03 0.00 0.02 0.00 0.00 57.03 56.54 1w36 h ASP 798 Cb 2.04 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 41.46 1w36 h ASP 798 CO 0.09 0.63 0.41 -0.07 -1.72 0.00 0.00 179.24 178.59 1w36 h LEU 799 N 0.29 0.68 -0.27 1.55 3.38 -0.95 0.93 115.31 120.91 1w36 h LEU 799 Ca 0.04 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1w36 h LEU 799 Cb 0.69 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1w36 h LEU 799 CO 0.05 0.47 0.17 0.03 0.09 0.00 0.00 178.44 179.25 1w36 h ARG 800 N 0.81 0.36 -0.61 1.13 3.08 -1.45 0.20 114.38 117.91 1w36 h ARG 800 Ca 0.26 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.31 1w36 h ARG 800 Cb 0.01 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 29.94 1w36 h ARG 800 CO -0.10 0.27 0.37 -0.07 -1.07 0.00 0.00 179.97 179.37 1w36 h LEU 801 N 0.35 0.59 -0.49 3.04 3.38 0.46 0.26 115.31 122.90 1w36 h LEU 801 Ca 0.10 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.10 1w36 h LEU 801 Cb -0.00 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1w36 h LEU 801 CO -0.02 0.41 0.28 0.25 0.09 0.00 0.00 178.44 179.45 1w36 h LEU 802 N 0.72 0.44 -1.56 1.67 6.46 0.17 0.08 115.31 123.30 1w36 h LEU 802 Ca 0.25 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 58.01 1w36 h LEU 802 Cb 0.04 -0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 39.87 1w36 h LEU 802 CO -0.11 0.31 0.13 0.22 -0.62 0.00 0.00 178.44 178.38 1w36 h TYR 803 N 0.56 0.42 -0.05 1.25 3.20 0.17 0.53 116.97 123.05 1w36 h TYR 803 Ca 0.20 -0.01 -0.19 0.00 3.14 0.00 0.00 58.73 61.87 1w36 h TYR 803 Cb 0.05 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 1w36 h TYR 803 CO -0.08 0.33 -0.79 0.28 -1.64 0.00 0.00 178.16 176.26 1w36 h VAL 804 N 0.43 1.39 -0.22 1.81 2.07 0.13 -3.21 116.25 118.65 1w36 h VAL 804 Ca 0.11 -2.24 -0.02 0.00 0.82 0.00 0.00 66.70 65.36 1w36 h VAL 804 Cb 0.07 2.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 1w36 h VAL 804 CO -0.01 0.67 0.04 0.00 0.02 0.00 0.00 177.57 178.29 1w36 h ALA 805 N 0.89 0.29 -0.12 1.67 0.00 0.19 -3.10 119.26 119.08 1w36 h ALA 805 Ca -0.04 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 1w36 h ALA 805 Cb 1.38 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1w36 h ALA 805 CO 0.13 -0.04 -0.36 -0.07 0.00 0.00 0.00 179.25 178.91 1w36 h LEU 806 N 0.17 0.26 0.00 0.00 4.07 -1.04 -3.31 115.31 115.47 1w36 h LEU 806 Ca 0.07 -0.10 0.00 0.00 0.08 0.00 0.00 57.88 57.93 1w36 h LEU 806 Cb 0.30 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.97 1w36 h LEU 806 CO 0.00 0.61 0.00 0.41 -1.08 0.00 0.00 178.44 178.38 1w36 n THR 807 N -4.07 0.30 0.10 0.22 -1.04 -1.17 -3.98 114.28 104.64 1w36 n THR 807 Ca -0.01 0.07 0.02 0.00 -2.04 0.00 0.00 64.05 62.10 1w36 n THR 807 Cb 0.45 -0.76 -0.01 0.00 -1.82 0.00 0.00 70.33 68.19 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 -7.28 -2.82 2.47 -1.65 -3.47 114.38 101.63 1w36 h ARG 808 Ca 0.00 0.00 -0.51 0.00 -1.26 0.00 0.00 59.98 58.21 1w36 h ARG 808 Cb 0.13 0.00 0.12 0.00 -1.65 0.00 0.00 29.97 28.57 1w36 h ARG 808 CO 0.00 0.38 0.34 -1.54 0.56 0.00 0.00 179.97 179.71 1w36 s SER 809 N -6.14 4.84 -0.01 7.04 1.04 -1.26 -1.25 113.70 117.96 1w36 s SER 809 Ca 0.01 1.85 -0.06 0.00 0.48 0.00 0.00 55.95 58.23 1w36 s SER 809 Cb 0.08 -2.53 -0.02 0.00 0.10 0.00 0.00 66.02 63.65 1w36 s SER 809 CO 0.77 -1.81 -0.13 0.52 0.98 0.00 0.00 173.24 173.57 1w36 n VAL 810 N -3.09 1.26 -0.10 5.02 0.31 -0.68 -4.81 118.33 116.25 1w36 n VAL 810 Ca 0.09 0.26 -0.23 0.00 -0.01 0.00 0.00 64.34 64.45 1w36 n VAL 810 Cb 0.53 -1.85 -0.12 0.00 -0.91 0.00 0.00 33.84 31.49 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 -3.81 0.60 -3.84 3.52 7.02 -0.90 -2.47 117.44 117.56 1w36 n TRP 811 Ca -0.07 0.20 -0.09 0.00 -1.02 0.00 0.00 57.50 56.52 1w36 n TRP 811 Cb 0.24 -1.07 -0.07 0.00 -2.42 0.00 0.00 31.31 27.99 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 -2.47 0.13 -0.22 -5.99 5.65 -1.16 -4.50 115.29 106.72 1w36 s HIS 812 Ca -0.31 -0.55 -0.19 0.00 0.25 0.00 0.00 55.06 54.26 1w36 s HIS 812 Cb 0.09 -0.03 0.06 0.00 -1.18 0.00 0.00 32.58 31.52 1w36 s HIS 812 CO 0.60 -0.57 0.59 0.00 -0.65 0.00 0.00 174.74 174.71 1w36 s SER 814 N 0.58 0.51 0.17 0.00 1.04 -0.99 -1.12 113.70 113.89 1w36 s SER 814 Ca -0.02 -0.06 0.11 0.00 0.48 0.00 0.00 55.95 56.46 1w36 s SER 814 Cb -0.05 -0.20 -0.04 0.00 0.10 0.00 0.00 66.02 65.83 1w36 s SER 814 CO -0.03 -0.04 -0.22 -1.48 0.98 0.00 0.00 173.24 172.45 1w36 s LEU 815 N 0.60 2.52 -0.12 2.42 -0.00 -0.78 -1.76 118.68 121.57 1w36 s LEU 815 Ca -0.06 -0.77 -0.16 0.00 -0.00 0.00 0.00 54.13 53.13 1w36 s LEU 815 Cb -0.10 -1.28 -0.05 0.00 -0.00 0.00 0.00 46.19 44.76 1w36 s LEU 815 CO -0.01 0.13 0.40 -0.83 -0.00 0.00 0.00 176.35 176.05 1w36 s GLY 816 N -2.53 2.34 0.03 -3.48 0.00 -0.15 -1.33 107.32 102.20 1w36 s GLY 816 Ca 0.20 -0.29 0.07 0.00 0.00 0.00 0.00 44.72 44.70 1w36 s GLY 816 CO 0.10 0.55 -0.20 0.14 0.00 0.00 0.00 173.10 173.69 1w36 s VAL 817 N 0.31 1.59 0.01 1.40 1.01 0.58 -4.18 120.40 121.11 1w36 s VAL 817 Ca 0.22 -1.11 -0.12 0.00 0.00 0.00 0.00 61.98 60.97 1w36 s VAL 817 Cb -0.15 -1.37 0.01 0.00 0.00 0.00 0.00 36.38 34.88 1w36 s VAL 817 CO 0.08 0.23 0.25 0.00 0.00 0.00 0.00 175.10 175.66 1w36 s ALA 818 N -0.74 -0.60 -0.40 5.51 0.00 -1.26 -1.87 121.76 122.39 1w36 s ALA 818 Ca 0.07 0.08 -0.05 0.00 0.00 0.00 0.00 51.96 52.06 1w36 s ALA 818 Cb -0.08 0.15 -0.13 0.00 0.00 0.00 0.00 23.12 23.06 1w36 s ALA 818 CO 0.01 -0.28 2.42 -0.35 0.00 0.00 0.00 175.76 177.56 1w36 n PRO 819 N 1.12 1.71 -1.64 0.00 -0.04 -1.26 -4.91 135.00 129.99 1w36 n PRO 819 Ca -0.21 -1.01 -0.46 0.00 -0.04 0.00 0.00 63.50 61.78 1w36 n PRO 819 Cb 0.57 -2.09 -0.03 0.00 -0.04 0.00 0.00 33.50 31.91 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 3.22 2.66 -3.90 1.53 4.77 -1.26 -3.72 117.00 120.30 1w36 n LEU 820 Ca 0.37 1.14 -0.11 0.00 -0.03 0.00 0.00 56.01 57.38 1w36 n LEU 820 Cb 0.42 -1.37 -0.13 0.00 -2.33 0.00 0.00 43.42 40.02 1w36 n LEU 820 CO 0.38 -0.73 -0.34 -0.69 -1.33 0.00 0.00 177.39 174.68 1w36 s VAL 821 N -0.12 0.04 0.00 4.08 1.01 -0.51 -2.57 120.40 122.32 1w36 s VAL 821 Ca 0.69 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1w36 s VAL 821 Cb -0.70 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 35.56 1w36 s VAL 821 CO 0.51 -0.16 0.00 0.54 0.00 0.00 0.00 175.10 175.98 1w36 n ARG 822 N 2.58 1.44 -1.66 2.72 1.74 -1.26 -4.55 116.66 117.66 1w36 n ARG 822 Ca -0.16 0.00 -0.46 0.00 -0.77 0.00 0.00 57.85 56.46 1w36 n ARG 822 Cb 0.58 -0.80 -0.04 0.00 -1.02 0.00 0.00 32.46 31.19 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 -1.67 1.99 -0.02 5.56 0.63 -1.26 -4.79 116.66 117.10 1w36 n ARG 823 Ca 0.00 0.72 -0.00 0.00 -0.92 0.00 0.00 57.85 57.64 1w36 n ARG 823 Cb 0.30 -2.43 0.01 0.00 0.45 0.00 0.00 32.46 30.79 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 2.82 1.05 -2.76 -0.14 3.00 -1.26 -4.74 116.66 114.63 1w36 n ARG 824 Ca 0.15 -0.07 -0.42 0.00 -0.01 0.00 0.00 57.85 57.50 1w36 n ARG 824 Cb 0.29 -1.27 -0.03 0.00 0.00 0.00 0.00 32.46 31.45 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 0.47 1.98 -0.70 -0.13 0.00 -1.26 -4.93 107.32 102.76 1w36 s GLY 825 Ca 0.01 0.15 -0.25 0.00 0.00 0.00 0.00 44.72 44.63 1w36 s GLY 825 CO 0.00 1.92 2.42 1.34 0.00 0.00 0.00 173.10 178.79 1w36 n ASP 826 N 5.65 1.68 -2.66 1.64 -0.08 -1.26 -4.13 116.55 117.38 1w36 n ASP 826 Ca 0.08 -0.93 0.00 0.00 -1.51 0.00 0.00 54.79 52.43 1w36 n ASP 826 Cb 0.48 -1.50 0.00 0.00 2.34 0.00 0.00 41.12 42.43 1w36 n ASP 826 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 1w36 n LYS 827 N 8.63 -0.35 -1.24 -0.67 3.00 -1.26 -4.73 118.16 121.54 1w36 n LYS 827 Ca 0.46 -0.17 -0.23 0.00 -0.00 0.00 0.00 58.31 58.37 1w36 n LYS 827 Cb 0.43 0.31 -0.01 0.00 0.00 0.00 0.00 35.03 35.76 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 -0.59 2.16 -2.02 1.64 5.02 -1.26 -4.53 118.16 118.58 1w36 n LYS 828 Ca 0.00 -2.05 -0.10 0.00 -2.02 0.00 0.00 58.31 54.14 1w36 n LYS 828 Cb 0.00 -1.93 -0.01 0.00 -0.02 0.00 0.00 35.03 33.07 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 0.61 0.18 0.00 0.72 0.00 -1.26 -4.98 105.19 100.46 1w36 n GLY 829 Ca 0.42 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 0.11 0.00 -3.15 1.61 8.00 -1.26 -4.36 116.55 117.50 1w36 n ASP 830 Ca -0.12 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.33 1w36 n ASP 830 Cb 0.54 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.66 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 -9.55 -0.74 -3.53 -2.24 -1.26 -4.25 114.28 92.71 1w36 n THR 831 Ca 0.00 -0.52 -0.17 0.00 -2.27 0.00 0.00 64.05 61.09 1w36 n THR 831 Cb 0.00 -6.60 -0.06 0.00 -2.10 0.00 0.00 70.33 61.57 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 -2.18 4.57 0.21 3.42 5.68 -1.06 -3.90 116.55 123.29 1w36 n ASP 832 Ca -0.03 -2.25 0.13 0.00 -0.50 0.00 0.00 54.79 52.13 1w36 n ASP 832 Cb 0.54 -1.05 0.25 0.00 -1.14 0.00 0.00 41.12 39.72 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 2.92 0.00 0.00 2.12 2.07 -1.85 -3.11 116.25 118.41 1w36 h VAL 833 Ca 0.36 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 67.00 1w36 h VAL 833 Cb 0.53 1.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1w36 h VAL 833 CO 0.98 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.57 1w36 n HIS 834 N -3.01 0.00 -0.37 1.57 1.44 -1.25 -2.81 115.22 110.79 1w36 n HIS 834 Ca 0.04 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.81 1w36 n HIS 834 Cb 0.49 0.00 0.19 0.00 0.12 0.00 0.00 29.99 30.80 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 -0.67 2.93 -4.33 -1.40 6.02 -1.18 -4.37 117.38 114.38 1w36 n GLN 835 Ca 0.06 -2.28 -0.25 0.00 -0.01 0.00 0.00 57.00 54.52 1w36 n GLN 835 Cb 0.03 -1.43 -0.09 0.00 1.02 0.00 0.00 30.24 29.77 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 -1.18 4.19 0.07 1.08 1.04 -1.12 -4.87 113.70 112.91 1w36 s SER 836 Ca 0.30 -0.70 -0.31 0.00 0.48 0.00 0.00 55.95 55.72 1w36 s SER 836 Cb 0.18 -0.66 -0.18 0.00 0.10 0.00 0.00 66.02 65.46 1w36 s SER 836 CO 0.16 0.06 1.59 0.00 0.98 0.00 0.00 173.24 176.03 1w36 h ALA 837 N 2.45 -0.78 -0.65 5.32 0.00 -1.87 0.20 119.26 123.93 1w36 h ALA 837 Ca -0.45 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.30 1w36 h ALA 837 Cb 1.23 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 1w36 h ALA 837 CO 0.57 -0.92 0.43 1.25 0.00 0.00 0.00 179.25 180.58 1w36 h LEU 838 N -0.81 0.72 -0.62 0.00 7.12 -1.90 0.04 115.31 119.85 1w36 h LEU 838 Ca -0.08 -0.01 -0.06 0.00 0.13 0.00 0.00 57.88 57.85 1w36 h LEU 838 Cb 0.61 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 40.54 1w36 h LEU 838 CO 0.13 0.51 0.14 1.23 -0.13 0.00 0.00 178.44 180.32 1w36 h GLY 839 N 0.84 1.08 1.90 3.75 0.00 -1.54 -2.28 103.07 106.81 1w36 h GLY 839 Ca 0.25 -0.68 -0.08 0.00 0.00 0.00 0.00 47.33 46.82 1w36 h GLY 839 CO -0.06 0.64 -0.32 -0.09 0.00 0.00 0.00 176.54 176.71 1w36 h ARG 840 N 0.92 0.12 0.13 4.80 2.43 0.13 0.41 114.38 123.32 1w36 h ARG 840 Ca 0.19 -0.04 -0.28 0.00 -0.81 0.00 0.00 59.98 59.04 1w36 h ARG 840 Cb 0.37 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1w36 h ARG 840 CO 0.00 0.43 -1.27 -0.07 -1.51 0.00 0.00 179.97 177.56 1w36 h LEU 841 N 0.11 0.43 -0.21 3.80 3.38 -1.27 -1.97 115.31 119.58 1w36 h LEU 841 Ca 0.01 -0.47 -0.14 0.00 0.09 0.00 0.00 57.88 57.38 1w36 h LEU 841 Cb 0.62 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1w36 h LEU 841 CO 0.04 1.37 -0.40 -0.07 0.09 0.00 0.00 178.44 179.47 1w36 h LEU 842 N 0.07 0.72 -3.91 1.67 3.38 -1.08 -3.02 115.31 113.15 1w36 h LEU 842 Ca -0.14 -0.54 -0.51 0.00 0.09 0.00 0.00 57.88 56.77 1w36 h LEU 842 Cb 1.98 -0.21 -0.29 0.00 0.09 0.00 0.00 40.66 42.23 1w36 h LEU 842 CO 0.20 1.13 0.65 0.00 0.09 0.00 0.00 178.44 180.52 1w36 n GLN 843 N -4.23 2.24 -0.41 1.13 6.02 0.10 -4.77 117.38 117.47 1w36 n GLN 843 Ca -0.06 -2.90 0.00 0.00 -0.01 0.00 0.00 57.00 54.03 1w36 n GLN 843 Cb 0.54 -2.14 0.00 0.00 1.02 0.00 0.00 30.24 29.66 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 -1.04 -1.23 0.00 -1.09 5.02 -1.11 -1.30 118.16 117.41 1w36 n LYS 844 Ca 0.58 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.87 1w36 n LYS 844 Cb 1.51 -2.68 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 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 0.00 3.15 3.76 0.72 0.00 -0.76 -4.93 105.19 107.13 1w36 n GLY 845 Ca 0.00 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.72 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 4.47 0.72 1.61 -1.05 -0.42 -4.92 118.70 119.11 1w36 s GLU 846 Ca 0.00 2.03 -0.16 0.00 -0.15 0.00 0.00 54.97 56.69 1w36 s GLU 846 Cb 0.00 -3.14 0.03 0.00 -0.44 0.00 0.00 34.13 30.58 1w36 s GLU 846 CO 0.00 -0.06 1.24 -1.25 0.95 0.00 0.00 175.26 176.15 1w36 s PRO 847 N -1.28 2.15 0.26 -4.83 0.04 -1.26 -4.76 135.00 125.32 1w36 s PRO 847 Ca 0.49 1.88 0.02 0.00 0.04 0.00 0.00 61.00 63.43 1w36 s PRO 847 Cb -0.36 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1w36 s PRO 847 CO 0.45 -1.86 0.14 -0.65 0.04 0.00 0.00 177.00 175.12 1w36 s GLN 848 N -3.76 1.43 0.93 4.56 -1.52 -1.26 -5.08 119.66 114.96 1w36 s GLN 848 Ca 0.77 -1.79 -0.12 0.00 -1.95 0.00 0.00 55.36 52.28 1w36 s GLN 848 Cb -0.32 -0.03 0.15 0.00 -0.22 0.00 0.00 33.01 32.58 1w36 s GLN 848 CO 0.44 -0.39 1.09 0.34 -0.25 0.00 0.00 175.29 176.53 1w36 s ASP 849 N -3.29 3.19 0.51 5.90 -1.08 -1.26 -4.32 116.67 116.32 1w36 s ASP 849 Ca 0.38 1.33 0.29 0.00 -0.52 0.00 0.00 52.55 54.03 1w36 s ASP 849 Cb 0.06 -2.00 1.31 0.00 -1.46 0.00 0.00 42.92 40.83 1w36 s ASP 849 CO 0.15 -2.79 1.98 0.00 0.52 0.00 0.00 175.17 175.03 1w36 h ALA 850 N -1.66 1.09 0.00 3.66 0.00 -1.86 -2.22 119.26 118.27 1w36 h ALA 850 Ca -0.51 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1w36 h ALA 850 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1w36 h ALA 850 CO 0.56 0.15 -1.33 0.00 0.00 0.00 0.00 179.25 178.63 1w36 n ALA 851 N -2.19 3.00 0.37 0.00 0.00 -1.26 -3.71 120.51 116.72 1w36 n ALA 851 Ca -0.01 -0.40 0.14 0.00 0.00 0.00 0.00 53.44 53.18 1w36 n ALA 851 Cb 0.31 -0.93 0.54 0.00 0.00 0.00 0.00 19.45 19.37 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 4.23 0.00 0.21 0.00 0.00 -1.73 -2.68 103.07 103.10 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 -0.10 -2.00 0.00 0.00 0.00 176.54 174.44 1w36 h LEU 853 N 0.00 -0.24 -1.00 3.11 6.46 -1.62 -3.05 115.31 118.97 1w36 h LEU 853 Ca 0.00 0.01 0.35 0.00 -0.12 0.00 0.00 57.88 58.12 1w36 h LEU 853 Cb 0.46 0.06 -0.18 0.00 -0.73 0.00 0.00 40.66 40.27 1w36 h LEU 853 CO 0.00 0.06 0.28 -1.14 -0.62 0.00 0.00 178.44 177.02 1w36 n ARG 854 N -4.04 -0.07 0.23 1.25 0.63 -1.15 0.13 116.66 113.64 1w36 n ARG 854 Ca -0.04 1.44 0.15 0.00 -0.92 0.00 0.00 57.85 58.48 1w36 n ARG 854 Cb 0.11 -2.43 0.47 0.00 0.45 0.00 0.00 32.46 31.06 1w36 n ARG 854 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1w36 h THR 855 N 0.00 0.00 0.11 5.15 1.35 -1.53 -2.46 112.91 115.53 1w36 h THR 855 Ca 0.73 -0.65 -0.29 0.00 -0.55 0.00 0.00 66.41 65.65 1w36 h THR 855 Cb 1.76 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 69.79 1w36 h THR 855 CO -0.85 0.00 -1.40 0.00 -0.25 0.00 0.00 175.52 173.02 1w36 h ILE 857 N 0.06 0.76 -0.90 0.00 2.04 -1.33 -2.59 117.51 115.55 1w36 h ILE 857 Ca -0.19 -0.48 0.14 0.00 1.00 0.00 0.00 64.86 65.33 1w36 h ILE 857 Cb 1.98 1.02 -0.07 0.00 -0.74 0.00 0.00 36.82 39.01 1w36 h ILE 857 CO 0.17 0.10 0.58 -0.33 0.00 0.00 0.00 178.15 178.67 1w36 h GLU 858 N -0.64 0.70 -0.55 2.37 5.08 -1.56 -2.22 114.58 117.76 1w36 h GLU 858 Ca -0.04 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.37 1w36 h GLU 858 Cb 0.45 -0.16 -0.07 0.00 0.50 0.00 0.00 28.75 29.47 1w36 h GLU 858 CO 0.06 0.46 0.13 0.00 -1.00 0.00 0.00 179.01 178.67 1w36 h ALA 859 N 1.59 0.65 -2.79 3.43 0.00 -1.23 -3.29 119.26 117.62 1w36 h ALA 859 Ca 0.45 0.11 -0.71 0.00 0.00 0.00 0.00 54.91 54.76 1w36 h ALA 859 Cb 0.70 0.13 -0.26 0.00 0.00 0.00 0.00 17.79 18.37 1w36 h ALA 859 CO -0.21 -0.28 -0.49 -0.48 0.00 0.00 0.00 179.25 177.78 1w36 s LEU 860 N -10.47 4.88 -0.01 0.00 2.34 -0.83 -4.94 118.68 109.65 1w36 s LEU 860 Ca -0.13 -1.16 0.00 0.00 0.06 0.00 0.00 54.13 52.90 1w36 s LEU 860 Cb 0.16 -2.02 0.01 0.00 -0.56 0.00 0.00 46.19 43.79 1w36 s LEU 860 CO 0.73 -0.44 0.76 0.00 -1.06 0.00 0.00 176.35 176.34 1w36 s ASP 862 N -0.74 4.24 0.00 0.00 1.01 -1.17 -4.44 116.67 115.57 1w36 s ASP 862 Ca 0.00 -0.56 0.00 0.00 0.71 0.00 0.00 52.55 52.70 1w36 s ASP 862 Cb 0.01 -0.72 0.00 0.00 1.01 0.00 0.00 42.92 43.22 1w36 s ASP 862 CO -0.00 0.11 0.00 -0.67 0.21 0.00 0.00 175.17 174.82 1w36 n ASP 863 N 0.14 0.00 0.00 0.27 -0.08 -1.26 -2.53 116.55 113.09 1w36 n ASP 863 Ca -0.11 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.17 1w36 n ASP 863 Cb 0.55 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.01 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 0.00 0.00 -4.31 1.67 8.00 -1.26 -4.95 116.55 115.70 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 -0.15 0.00 -0.02 0.00 0.00 41.12 40.95 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 2.62 0.14 0.53 1.01 -1.05 -0.43 121.20 124.01 1w36 s ILE 865 Ca 0.00 -0.82 -0.15 0.00 0.00 0.00 0.00 60.65 59.67 1w36 s ILE 865 Cb 0.00 -2.06 0.03 0.00 0.01 0.00 0.00 42.46 40.44 1w36 s ILE 865 CO 0.00 0.54 0.40 0.00 0.00 0.00 0.00 174.94 175.88 1w36 s ALA 866 N 0.27 -0.83 0.09 9.38 0.00 -0.48 -3.05 121.76 127.13 1w36 s ALA 866 Ca -0.13 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1w36 s ALA 866 Cb -0.16 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.63 1w36 s ALA 866 CO 0.07 -0.66 -0.04 1.67 0.00 0.00 0.00 175.76 176.80 1w36 s TRP 867 N -3.83 0.76 0.19 0.00 1.48 -1.26 -0.14 118.94 116.14 1w36 s TRP 867 Ca 0.05 -1.01 -0.06 0.00 -1.06 0.00 0.00 56.10 54.02 1w36 s TRP 867 Cb 0.02 -0.47 -0.02 0.00 -1.16 0.00 0.00 33.47 31.83 1w36 s TRP 867 CO -0.10 -0.27 0.25 -0.65 -4.06 0.00 0.00 176.95 172.12 1w36 s GLN 868 N -3.89 1.23 0.19 3.25 -0.21 -0.37 -4.91 119.66 114.96 1w36 s GLN 868 Ca 0.11 -1.37 -0.03 0.00 0.02 0.00 0.00 55.36 54.09 1w36 s GLN 868 Cb 0.07 0.35 -0.05 0.00 1.00 0.00 0.00 33.01 34.37 1w36 s GLN 868 CO -0.06 -0.44 0.42 0.95 -2.12 0.00 0.00 175.29 174.04 1w36 s THR 869 N -4.05 5.15 -0.64 -0.19 -4.23 -1.26 -0.71 115.64 109.71 1w36 s THR 869 Ca 0.26 -0.11 -0.14 0.00 -1.18 0.00 0.00 61.69 60.53 1w36 s THR 869 Cb 0.04 -3.68 -0.16 0.00 1.34 0.00 0.00 72.50 70.04 1w36 s THR 869 CO 0.06 -0.11 1.77 0.00 -0.54 0.00 0.00 174.62 175.80 1w36 n ALA 870 N -0.39 0.49 -2.71 3.99 0.00 -1.00 -4.58 120.51 116.30 1w36 n ALA 870 Ca -0.03 -1.41 -0.42 0.00 0.00 0.00 0.00 53.44 51.58 1w36 n ALA 870 Cb 0.53 -2.15 -0.03 0.00 0.00 0.00 0.00 19.45 17.80 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 7.07 3.32 1.24 0.00 -1.52 -1.26 -4.92 119.66 123.59 1w36 s GLN 871 Ca 0.63 -0.88 -0.18 0.00 -1.95 0.00 0.00 55.36 52.98 1w36 s GLN 871 Cb -0.18 -4.58 0.27 0.00 -0.22 0.00 0.00 33.01 28.29 1w36 s GLN 871 CO 0.17 -1.99 0.63 0.25 -0.25 0.00 0.00 175.29 174.10 1w36 n THR 872 N 6.20 0.00 -3.64 -0.19 -2.24 -1.26 -4.86 114.28 108.28 1w36 n THR 872 Ca 0.11 -0.21 -0.04 0.00 -2.27 0.00 0.00 64.05 61.64 1w36 n THR 872 Cb 0.48 -0.82 -0.01 0.00 -2.10 0.00 0.00 70.33 67.88 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 -2.42 -0.34 -0.01 3.38 0.00 -1.26 -5.03 107.32 101.64 1w36 s GLY 873 Ca 0.59 0.62 -0.23 0.00 0.00 0.00 0.00 44.72 45.71 1w36 s GLY 873 CO 0.56 0.17 0.51 -0.35 0.00 0.00 0.00 173.10 174.00 1w36 s ASP 874 N -2.73 -0.44 0.00 1.64 2.15 -1.26 -4.95 116.67 111.08 1w36 s ASP 874 Ca 0.10 0.34 0.00 0.00 0.43 0.00 0.00 52.55 53.42 1w36 s ASP 874 Cb -0.00 0.45 0.00 0.00 -0.30 0.00 0.00 42.92 43.07 1w36 s ASP 874 CO -0.03 -0.60 0.00 -3.20 -0.17 0.00 0.00 175.17 171.18 1w36 n ASN 875 N 0.85 0.00 0.18 -0.34 5.15 -1.26 -5.02 115.26 114.82 1w36 n ASN 875 Ca -0.20 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.78 1w36 n ASN 875 Cb 0.58 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.83 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 0.02 -2.11 1.20 7.27 -1.26 -4.66 117.38 117.83 1w36 n GLN 876 Ca 0.00 0.51 -0.29 0.00 0.07 0.00 0.00 57.00 57.29 1w36 n GLN 876 Cb 0.00 -1.90 0.03 0.00 2.41 0.00 0.00 30.24 30.78 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 -2.79 3.04 -0.33 3.69 0.04 -1.26 -4.12 135.00 133.26 1w36 s PRO 877 Ca 0.00 0.33 0.17 0.00 0.04 0.00 0.00 61.00 61.53 1w36 s PRO 877 Cb 0.00 -2.14 0.45 0.00 0.04 0.00 0.00 34.50 32.85 1w36 s PRO 877 CO 0.00 -0.79 1.11 1.87 0.04 0.00 0.00 177.00 179.23 1w36 n TRP 878 N -2.77 0.20 -0.67 0.56 -0.00 -1.25 -4.90 117.44 108.61 1w36 n TRP 878 Ca 0.05 -2.40 0.00 0.00 -0.00 0.00 0.00 57.50 55.15 1w36 n TRP 878 Cb 0.57 0.20 0.00 0.00 -0.00 0.00 0.00 31.31 32.08 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 -0.39 0.00 -5.00 5.87 6.02 -1.26 -4.83 117.38 117.79 1w36 n GLN 879 Ca 0.04 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.76 1w36 n GLN 879 Cb 0.83 -0.67 -0.16 0.00 1.02 0.00 0.00 30.24 31.26 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 2.00 1.61 0.04 5.09 0.11 -1.26 -5.07 120.40 122.92 1w36 s VAL 880 Ca 0.00 -0.87 0.01 0.00 -2.93 0.00 0.00 61.98 58.19 1w36 s VAL 880 Cb 0.00 -1.34 0.01 0.00 -1.53 0.00 0.00 36.38 33.51 1w36 s VAL 880 CO 0.00 0.46 0.04 0.59 -3.33 0.00 0.00 175.10 172.86 1w36 n ASN 881 N 2.62 0.66 -2.10 3.54 3.02 -1.26 -5.16 115.26 116.58 1w36 n ASN 881 Ca -0.15 -1.12 -0.10 0.00 -0.03 0.00 0.00 54.58 53.18 1w36 n ASN 881 Cb 0.53 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.65 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 -2.45 -0.37 -3.60 6.41 5.68 -1.26 -5.17 116.55 115.79 1w36 n ASP 882 Ca 0.00 -2.08 -0.07 0.00 -0.50 0.00 0.00 54.79 52.15 1w36 n ASP 882 Cb 0.04 0.85 -0.04 0.00 -1.14 0.00 0.00 41.12 40.83 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 -2.67 0.00 -0.28 2.12 1.01 -1.26 -5.20 120.40 114.12 1w36 s VAL 883 Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 61.98 61.97 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 0.14 0.00 0.93 -0.55 0.00 0.00 0.00 175.10 175.62 1w36 s SER 884 N -1.16 -0.57 -0.42 3.32 0.15 -1.26 -5.11 113.70 108.65 1w36 s SER 884 Ca 0.03 0.99 0.02 0.00 0.70 0.00 0.00 55.95 57.69 1w36 s SER 884 Cb -0.01 1.13 0.14 0.00 -1.71 0.00 0.00 66.02 65.58 1w36 s SER 884 CO -0.03 -0.16 0.26 0.42 1.20 0.00 0.00 173.24 174.93 1w36 s THR 885 N 0.89 0.92 -1.16 6.45 -4.23 -1.26 -5.05 115.64 112.21 1w36 s THR 885 Ca -0.04 -2.39 -0.20 0.00 -1.18 0.00 0.00 61.69 57.88 1w36 s THR 885 Cb -0.04 -1.64 -0.04 0.00 1.34 0.00 0.00 72.50 72.11 1w36 s THR 885 CO -0.11 -0.98 1.94 0.00 -0.54 0.00 0.00 174.62 174.92 1w36 n ALA 886 N 3.51 3.31 -2.81 3.99 0.00 -1.26 -4.86 120.51 122.39 1w36 n ALA 886 Ca 0.14 -3.46 -0.44 0.00 0.00 0.00 0.00 53.44 49.68 1w36 n ALA 886 Cb 0.37 -3.56 0.00 0.00 0.00 0.00 0.00 19.45 16.26 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 7.59 3.58 -4.48 0.00 -0.58 -1.26 -4.98 120.64 120.51 1w36 n GLU 887 Ca 0.48 -3.89 -0.23 0.00 -0.42 0.00 0.00 57.16 53.10 1w36 n GLU 887 Cb 0.43 -2.89 -0.10 0.00 -0.57 0.00 0.00 31.44 28.31 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 0.23 2.55 -0.02 -4.62 1.43 -1.26 -5.15 118.68 111.83 1w36 s LEU 888 Ca 0.39 -1.23 -0.30 0.00 -1.03 0.00 0.00 54.13 51.96 1w36 s LEU 888 Cb 0.01 -0.72 0.11 0.00 0.03 0.00 0.00 46.19 45.61 1w36 s LEU 888 CO 0.00 -0.35 1.09 0.54 0.23 0.00 0.00 176.35 177.87 1w36 s ASN 889 N -3.51 -0.18 -0.03 2.29 6.03 -1.26 -5.18 114.94 113.10 1w36 s ASN 889 Ca 0.31 -0.13 0.07 0.00 -1.03 0.00 0.00 52.86 52.08 1w36 s ASN 889 Cb 0.05 0.29 -0.01 0.00 -3.03 0.00 0.00 41.25 38.54 1w36 s ASN 889 CO 0.14 -0.50 -0.23 0.00 -2.03 0.00 0.00 177.10 174.47 1w36 s ALA 890 N -2.80 1.94 0.03 3.54 0.00 -1.26 -5.09 121.76 118.12 1w36 s ALA 890 Ca 0.10 -0.98 -0.34 0.00 0.00 0.00 0.00 51.96 50.74 1w36 s ALA 890 Cb 0.00 -0.53 -0.13 0.00 0.00 0.00 0.00 23.12 22.46 1w36 s ALA 890 CO -0.04 0.44 1.72 1.63 0.00 0.00 0.00 175.76 179.51 1w36 n LYS 891 N 2.66 2.10 -4.63 0.00 5.02 -1.26 -4.98 118.16 117.07 1w36 n LYS 891 Ca -0.16 0.76 -0.33 0.00 -2.02 0.00 0.00 58.31 56.56 1w36 n LYS 891 Cb 0.52 -2.56 -0.11 0.00 -0.02 0.00 0.00 35.03 32.86 1w36 n LYS 891 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1w36 s THR 892 N 2.45 3.54 0.08 -0.18 -4.23 -1.26 -5.09 115.64 110.95 1w36 s THR 892 Ca 0.86 -0.62 -0.13 0.00 -1.18 0.00 0.00 61.69 60.62 1w36 s THR 892 Cb -0.71 -2.46 -0.06 0.00 1.34 0.00 0.00 72.50 70.61 1w36 s THR 892 CO 0.45 0.54 0.46 -1.48 -0.54 0.00 0.00 174.62 174.05 1w36 s LEU 893 N -0.97 4.39 -0.06 4.79 -0.00 -1.26 -4.98 118.68 120.60 1w36 s LEU 893 Ca 0.13 0.95 0.16 0.00 -0.00 0.00 0.00 54.13 55.38 1w36 s LEU 893 Cb -0.11 -2.96 0.54 0.00 -0.00 0.00 0.00 46.19 43.66 1w36 s LEU 893 CO 0.03 0.20 1.45 0.00 -0.00 0.00 0.00 176.35 178.03 1w36 n GLN 894 N 1.17 3.13 -2.32 1.48 1.13 -1.26 -4.95 117.38 115.77 1w36 n GLN 894 Ca -0.09 -2.55 -0.26 0.00 -1.94 0.00 0.00 57.00 52.16 1w36 n GLN 894 Cb 0.52 -1.61 0.11 0.00 0.11 0.00 0.00 30.24 29.37 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 -1.52 1.64 0.05 -1.09 3.52 -1.26 -5.11 118.95 115.18 1w36 s ARG 895 Ca 0.40 -0.66 -0.01 0.00 -0.13 0.00 0.00 55.73 55.32 1w36 s ARG 895 Cb 0.24 -2.18 -0.04 0.00 -1.56 0.00 0.00 34.95 31.42 1w36 s ARG 895 CO 0.21 -1.57 -0.02 -0.48 -0.81 0.00 0.00 175.30 172.63 1w36 s LEU 896 N -5.33 2.42 0.08 -0.88 0.05 -1.26 -5.09 118.68 108.67 1w36 s LEU 896 Ca 0.66 -0.97 -0.27 0.00 0.05 0.00 0.00 54.13 53.59 1w36 s LEU 896 Cb -0.07 0.25 -0.12 0.00 -2.05 0.00 0.00 46.19 44.20 1w36 s LEU 896 CO 0.46 -0.60 1.43 -0.65 -0.55 0.00 0.00 176.35 176.44 1w36 h PRO 897 N 3.14 -0.63 0.00 1.48 0.11 -2.02 -3.46 132.00 130.62 1w36 h PRO 897 Ca -0.34 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1w36 h PRO 897 Cb 1.14 0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1w36 h PRO 897 CO 0.65 -0.42 0.00 0.41 -0.21 0.00 0.00 178.00 178.43 1w36 n GLY 898 N -1.40 0.81 3.51 -0.55 0.00 -1.26 -4.77 105.19 101.54 1w36 n GLY 898 Ca -0.08 0.46 -0.27 0.00 0.00 0.00 0.00 46.02 46.13 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 3.94 -0.07 1.61 1.01 -1.26 -5.14 116.67 112.75 1w36 s ASP 899 Ca 0.00 -0.71 0.02 0.00 0.71 0.00 0.00 52.55 52.57 1w36 s ASP 899 Cb 0.00 -0.54 0.01 0.00 1.01 0.00 0.00 42.92 43.41 1w36 s ASP 899 CO 0.00 0.10 -0.13 0.54 0.21 0.00 0.00 175.17 175.90 1w36 s ASN 900 N -2.83 1.93 -0.17 0.27 4.22 -1.26 -5.12 114.94 111.98 1w36 s ASN 900 Ca 0.24 -0.32 -0.09 0.00 -2.14 0.00 0.00 52.86 50.55 1w36 s ASN 900 Cb -0.08 -0.88 -0.05 0.00 1.28 0.00 0.00 41.25 41.52 1w36 s ASN 900 CO 0.13 0.03 0.13 0.86 -2.04 0.00 0.00 177.10 176.21 1w36 s TRP 901 N 0.76 3.47 0.28 1.54 -0.11 -1.26 -3.38 118.94 120.24 1w36 s TRP 901 Ca -0.13 0.39 -0.04 0.00 1.22 0.00 0.00 56.10 57.54 1w36 s TRP 901 Cb -0.16 -2.08 -0.01 0.00 -1.50 0.00 0.00 33.47 29.72 1w36 s TRP 901 CO 0.03 0.44 0.38 1.03 -4.62 0.00 0.00 176.95 174.20 1w36 s ARG 902 N -0.11 1.62 -0.24 5.86 0.52 -0.85 -4.95 118.95 120.81 1w36 s ARG 902 Ca 0.10 -1.60 0.02 0.00 -0.52 0.00 0.00 55.73 53.73 1w36 s ARG 902 Cb -0.11 0.40 0.05 0.00 0.52 0.00 0.00 34.95 35.81 1w36 s ARG 902 CO 0.00 -0.64 -0.12 0.08 0.02 0.00 0.00 175.30 174.64 1w36 s VAL 903 N -3.63 2.02 0.45 3.52 1.01 -1.26 -0.04 120.40 122.47 1w36 s VAL 903 Ca 0.31 -1.41 0.01 0.00 0.00 0.00 0.00 61.98 60.89 1w36 s VAL 903 Cb 0.02 -2.09 0.01 0.00 0.00 0.00 0.00 36.38 34.31 1w36 s VAL 903 CO 0.16 0.07 0.07 0.35 0.00 0.00 0.00 175.10 175.75 1w36 n THR 904 N 4.52 0.00 -2.59 3.92 -2.24 -0.61 -4.92 114.28 112.35 1w36 n THR 904 Ca -0.15 -2.04 -0.01 0.00 -2.27 0.00 0.00 64.05 59.58 1w36 n THR 904 Cb 0.44 0.31 0.06 0.00 -2.10 0.00 0.00 70.33 69.05 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 -1.38 -0.76 -2.06 3.42 3.41 -1.26 -0.49 113.62 114.49 1w36 n SER 905 Ca -0.15 -1.62 -0.04 0.00 -0.26 0.00 0.00 58.87 56.80 1w36 n SER 905 Cb 0.55 0.37 0.02 0.00 -0.26 0.00 0.00 64.21 64.90 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 -0.76 -0.84 -0.58 7.33 -0.00 -1.26 -4.85 117.16 116.20 1w36 n TYR 906 Ca -0.09 0.30 0.00 0.00 -0.00 0.00 0.00 57.90 58.10 1w36 n TYR 906 Cb 0.69 -2.90 0.00 0.00 -0.00 0.00 0.00 39.34 37.13 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 -1.90 0.00 0.10 2.98 3.41 -1.26 -4.56 113.62 112.38 1w36 n SER 907 Ca -0.02 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.62 1w36 n SER 907 Cb 0.53 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.89 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 0.32 0.00 5.00 0.00 -1.96 -3.36 103.07 103.06 1w36 h GLY 908 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1w36 h GLY 908 CO 0.00 0.16 0.00 -0.10 0.00 0.00 0.00 176.54 176.60 1w36 n LEU 909 N -4.33 0.00 -2.84 3.11 -0.00 -1.26 -4.22 117.00 107.47 1w36 n LEU 909 Ca -0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 55.83 1w36 n LEU 909 Cb 0.22 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.51 1w36 n LEU 909 CO 0.37 0.00 1.35 0.00 -0.00 0.00 0.00 177.39 179.11 1w36 n GLN 910 N 0.00 0.00 -0.98 1.96 6.02 -1.26 -4.86 117.38 118.26 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 -0.74 0.08 0.00 1.02 0.00 0.00 30.24 30.60 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 4.12 -0.06 -0.16 -1.09 1.13 -1.26 -4.79 117.38 115.27 1w36 n GLN 911 Ca 0.42 0.01 -0.08 0.00 -1.94 0.00 0.00 57.00 55.42 1w36 n GLN 911 Cb 0.06 -1.58 0.08 0.00 0.11 0.00 0.00 30.24 28.90 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 -0.22 -1.29 0.00 -1.09 5.12 -1.26 -4.38 116.66 113.54 1w36 n ARG 912 Ca 0.05 -0.37 0.00 0.00 -1.93 0.00 0.00 57.85 55.60 1w36 n ARG 912 Cb 0.53 -0.63 0.00 0.00 -1.16 0.00 0.00 32.46 31.20 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 -1.05 1.59 0.00 -0.13 0.00 -1.26 -4.80 105.19 99.54 1w36 n GLY 913 Ca 0.04 -0.37 0.02 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.87 1.61 8.25 -1.26 -4.65 115.22 117.30 1w36 n HIS 914 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 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 0.20 0.64 0.00 0.00 176.34 177.18 1w36 s GLY 915 N -1.22 1.50 0.00 -1.41 0.00 -1.26 -0.50 107.32 104.42 1w36 s GLY 915 Ca 0.05 1.27 0.00 0.00 0.00 0.00 0.00 44.72 46.03 1w36 s GLY 915 CO 0.03 2.96 0.00 1.39 0.00 0.00 0.00 173.10 177.48 1w36 n ILE 916 N 4.74 0.00 -0.02 0.90 5.41 -1.26 -4.79 119.36 124.34 1w36 n ILE 916 Ca 0.16 0.00 -0.11 0.00 1.00 0.00 0.00 62.75 63.81 1w36 n ILE 916 Cb 0.40 -0.12 -0.09 0.00 -0.71 0.00 0.00 39.64 39.12 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 -0.08 0.00 -1.39 0.00 -1.06 -1.83 119.26 114.90 1w36 h ALA 917 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1w36 h ALA 917 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1w36 h ALA 917 CO 0.00 -0.13 0.00 0.94 0.00 0.00 0.00 179.25 180.06 1w36 n GLN 918 N -4.77 0.15 -0.07 0.00 -0.06 -1.13 -2.77 117.38 108.73 1w36 n GLN 918 Ca -0.07 0.44 -0.18 0.00 -2.00 0.00 0.00 57.00 55.19 1w36 n GLN 918 Cb 0.31 -1.82 -0.13 0.00 -4.06 0.00 0.00 30.24 24.54 1w36 n GLN 918 CO 0.00 0.00 0.00 -0.44 -0.20 0.00 0.00 177.06 176.42 1w36 h ASP 919 N 0.00 0.05 0.26 1.69 3.32 -1.81 -3.31 116.42 116.62 1w36 h ASP 919 Ca 0.00 -0.81 -0.19 0.00 0.02 0.00 0.00 57.03 56.04 1w36 h ASP 919 Cb 0.27 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1w36 h ASP 919 CO 0.00 1.24 -0.77 -0.07 -1.72 0.00 0.00 179.24 177.92 1w36 h LEU 920 N -0.91 0.51 -7.11 1.55 3.38 -1.28 -3.40 115.31 108.04 1w36 h LEU 920 Ca -0.15 -0.35 -0.56 0.00 0.09 0.00 0.00 57.88 56.91 1w36 h LEU 920 Cb 1.20 -0.15 -0.40 0.00 0.09 0.00 0.00 40.66 41.40 1w36 h LEU 920 CO -0.06 1.10 -0.76 -0.04 0.09 0.00 0.00 178.44 178.77 1w36 s MET 921 N -3.55 0.61 0.54 1.13 -1.94 -1.11 -5.00 119.30 109.98 1w36 s MET 921 Ca -0.06 -0.84 0.26 0.00 -1.71 0.00 0.00 55.69 53.34 1w36 s MET 921 Cb 0.10 -1.86 1.56 0.00 2.01 0.00 0.00 34.83 36.63 1w36 s MET 921 CO 0.85 -0.92 2.15 -1.35 -0.01 0.00 0.00 175.02 175.73 1w36 h PRO 922 N 8.18 0.00 -0.11 2.03 0.11 -1.79 -3.14 132.00 137.28 1w36 h PRO 922 Ca -0.15 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.89 1w36 h PRO 922 Cb 1.03 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 1w36 h PRO 922 CO 0.44 0.07 -0.42 0.54 -0.21 0.00 0.00 178.00 178.42 1w36 n ARG 923 N -3.85 1.72 -2.00 1.05 1.74 -1.26 -4.98 116.66 109.08 1w36 n ARG 923 Ca -0.02 -3.32 -0.38 0.00 -0.77 0.00 0.00 57.85 53.36 1w36 n ARG 923 Cb 0.16 -1.69 0.02 0.00 -1.02 0.00 0.00 32.46 29.93 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 -3.26 3.95 -0.55 0.55 0.20 -1.19 -4.81 118.68 113.58 1w36 s LEU 924 Ca 0.40 2.57 -0.04 0.00 0.69 0.00 0.00 54.13 57.75 1w36 s LEU 924 Cb 0.38 -4.22 -0.05 0.00 -0.43 0.00 0.00 46.19 41.87 1w36 s LEU 924 CO -0.05 -1.23 1.82 -0.67 -0.29 0.00 0.00 176.35 175.93 1w36 n ASP 925 N -0.69 3.39 -0.07 3.68 4.64 -1.26 -4.65 116.55 121.59 1w36 n ASP 925 Ca 0.08 -2.17 0.19 0.00 -1.38 0.00 0.00 54.79 51.50 1w36 n ASP 925 Cb 0.46 -0.88 0.29 0.00 -1.04 0.00 0.00 41.12 39.95 1w36 n ASP 925 CO 0.00 0.00 0.00 0.52 -0.82 0.00 0.00 177.20 176.90 1w36 n VAL 926 N 4.09 0.00 0.57 5.18 0.31 -1.26 -0.77 118.33 126.46 1w36 n VAL 926 Ca 0.30 1.04 0.12 0.00 -0.01 0.00 0.00 64.34 65.79 1w36 n VAL 926 Cb 0.15 -1.92 0.45 0.00 -0.91 0.00 0.00 33.84 31.62 1w36 n VAL 926 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1w36 n ASP 927 N -2.81 0.50 -5.01 4.52 8.00 -1.26 -4.82 116.55 115.67 1w36 n ASP 927 Ca 0.15 0.59 -0.18 0.00 0.71 0.00 0.00 54.79 56.06 1w36 n ASP 927 Cb 1.23 -0.71 0.03 0.00 -0.02 0.00 0.00 41.12 41.65 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 -3.15 4.57 0.00 2.24 0.00 0.05 -4.96 121.76 120.51 1w36 s ALA 928 Ca 0.08 -1.85 0.00 0.00 0.00 0.00 0.00 51.96 50.19 1w36 s ALA 928 Cb 0.12 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.73 1w36 s ALA 928 CO 0.45 -0.50 0.00 0.00 0.00 0.00 0.00 175.76 175.71 1w36 n ALA 929 N -1.98 0.00 0.00 0.00 0.00 -1.26 -4.58 120.51 112.69 1w36 n ALA 929 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 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 -0.56 0.60 2.72 0.00 0.00 -1.26 -4.75 105.19 101.95 1w36 n GLY 930 Ca 0.00 -2.13 -0.23 0.00 0.00 0.00 0.00 46.02 43.66 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 3.95 0.00 -3.78 1.61 0.31 -1.26 -4.68 118.33 114.49 1w36 n VAL 931 Ca 0.00 -1.75 -0.13 0.00 -0.01 0.00 0.00 64.34 62.45 1w36 n VAL 931 Cb 0.00 0.27 -0.10 0.00 -0.91 0.00 0.00 33.84 33.10 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 -2.64 -0.73 0.00 3.52 0.00 -1.26 -4.87 121.76 115.78 1w36 s ALA 932 Ca 0.04 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.57 1w36 s ALA 932 Cb -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 23.12 22.88 1w36 s ALA 932 CO 0.02 -0.19 0.00 -1.13 0.00 0.00 0.00 175.76 174.46 1w36 n SER 933 N 2.18 0.00 -2.70 0.00 3.41 -1.26 -5.00 113.62 110.24 1w36 n SER 933 Ca -0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 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 -1.00 -3.33 0.31 -1.26 -3.81 118.33 109.25 1w36 n VAL 934 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.42 1w36 n VAL 934 Cb 0.00 -1.44 0.13 0.00 -0.91 0.00 0.00 33.84 31.62 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 3.67 1.78 0.25 2.52 0.31 -1.26 -4.85 118.33 120.75 1w36 n VAL 935 Ca 0.00 -2.13 0.15 0.00 -0.01 0.00 0.00 64.34 62.36 1w36 n VAL 935 Cb 0.00 -0.17 0.82 0.00 -0.91 0.00 0.00 33.84 33.58 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 0.00 0.00 0.00 5.55 4.81 -1.98 -3.47 114.58 119.49 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 0.96 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.34 1w36 h GLU 936 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 178.67 1w36 n GLU 937 N -2.60 0.00 0.00 1.92 1.02 -1.26 -4.44 120.64 115.27 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 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.54 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 0.02 0.00 -3.43 3.49 -0.04 -1.26 -4.27 135.00 129.51 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 -0.11 0.00 -0.04 0.00 0.00 33.50 32.94 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 -0.30 0.52 -4.23 -1.26 -5.12 115.64 104.98 1w36 s THR 939 Ca 0.00 -0.75 -0.41 0.00 -1.18 0.00 0.00 61.69 59.36 1w36 s THR 939 Cb 0.00 -0.95 -0.16 0.00 1.34 0.00 0.00 72.50 72.73 1w36 s THR 939 CO 0.00 -0.60 1.76 0.18 -0.54 0.00 0.00 174.62 175.42 1w36 n LEU 940 N 5.01 2.29 -4.27 4.79 4.77 -1.26 -4.99 117.00 123.34 1w36 n LEU 940 Ca 0.00 1.06 -0.21 0.00 -0.03 0.00 0.00 56.01 56.83 1w36 n LEU 940 Cb 0.44 -1.12 -0.12 0.00 -2.33 0.00 0.00 43.42 40.29 1w36 n LEU 940 CO 0.04 -0.46 -0.48 0.42 -1.33 0.00 0.00 177.39 175.57 1w36 s THR 941 N 3.68 1.55 -0.90 -5.08 -4.23 -1.26 -4.90 115.64 104.50 1w36 s THR 941 Ca 1.00 -1.65 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 1w36 s THR 941 Cb -1.10 -1.55 0.00 0.00 1.34 0.00 0.00 72.50 71.19 1w36 s THR 941 CO 0.67 -0.24 0.84 -2.65 -0.54 0.00 0.00 174.62 172.70 1w36 n PRO 942 N 0.77 0.00 0.15 3.99 -0.02 -1.26 -0.84 135.00 137.78 1w36 n PRO 942 Ca -0.17 0.35 0.12 0.00 -2.02 0.00 0.00 63.50 61.79 1w36 n PRO 942 Cb 0.55 -1.59 0.22 0.00 -0.02 0.00 0.00 33.50 32.67 1w36 n PRO 942 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1w36 h HIS 943 N 0.00 0.00 -0.57 6.00 3.86 -1.95 -3.21 115.15 119.29 1w36 h HIS 943 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1w36 h HIS 943 Cb 0.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.64 1w36 h HIS 943 CO 0.00 0.00 0.00 1.04 0.86 0.00 0.00 177.93 179.83 1w36 n GLN 944 N -2.65 4.09 -2.68 2.45 6.02 -0.02 -4.87 117.38 119.72 1w36 n GLN 944 Ca 0.04 -2.78 -0.42 0.00 -0.01 0.00 0.00 57.00 53.83 1w36 n GLN 944 Cb 0.49 -2.04 -0.03 0.00 1.02 0.00 0.00 30.24 29.68 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 -2.24 3.58 -0.05 1.08 5.36 -1.21 -4.90 117.98 119.60 1w36 s PHE 945 Ca 0.49 1.63 -0.09 0.00 -0.96 0.00 0.00 56.93 58.00 1w36 s PHE 945 Cb 0.35 -3.17 -0.04 0.00 -0.34 0.00 0.00 43.02 39.82 1w36 s PHE 945 CO 0.19 -0.19 0.27 -0.35 -1.46 0.00 0.00 175.22 173.67 1w36 n PRO 946 N 4.37 0.00 -2.92 10.12 -0.04 -1.26 -4.88 135.00 140.38 1w36 n PRO 946 Ca 0.07 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.26 1w36 n PRO 946 Cb 0.50 -0.30 -0.01 0.00 -0.04 0.00 0.00 33.50 33.64 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 0.30 3.60 0.00 0.54 3.52 -1.26 -4.69 118.95 120.96 1w36 s ARG 947 Ca 0.20 0.15 0.00 0.00 -0.13 0.00 0.00 55.73 55.94 1w36 s ARG 947 Cb -0.28 -2.47 0.00 0.00 -1.56 0.00 0.00 34.95 30.64 1w36 s ARG 947 CO 0.14 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 175.00 1w36 n GLY 948 N -1.73 -1.24 0.17 8.12 0.00 -1.26 -4.73 105.19 104.51 1w36 n GLY 948 Ca -0.00 -2.18 -0.21 0.00 0.00 0.00 0.00 46.02 43.62 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 -0.00 -0.25 4.61 0.00 -1.83 0.75 119.26 122.54 1w36 h ALA 949 Ca 0.00 -0.73 0.04 0.00 0.00 0.00 0.00 54.91 54.21 1w36 h ALA 949 Cb 0.00 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1w36 h ALA 949 CO 0.00 0.61 0.02 1.03 0.00 0.00 0.00 179.25 180.91 1w36 h SER 950 N 0.17 -0.06 -0.21 0.00 0.87 -1.94 0.55 113.55 112.94 1w36 h SER 950 Ca -0.17 0.05 -0.16 0.00 -1.23 0.00 0.00 61.79 60.28 1w36 h SER 950 Cb 1.80 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.84 1w36 h SER 950 CO 0.21 0.00 -0.49 1.55 -0.53 0.00 0.00 176.83 177.58 1w36 h PRO 951 N 0.10 0.69 -0.24 2.24 0.13 -1.85 -2.66 132.00 130.42 1w36 h PRO 951 Ca 0.12 -0.47 0.06 0.00 -0.87 0.00 0.00 66.00 64.84 1w36 h PRO 951 Cb 0.14 0.07 -0.07 0.00 0.13 0.00 0.00 31.00 31.27 1w36 h PRO 951 CO -0.18 1.09 -0.20 0.78 -0.23 0.00 0.00 178.00 179.26 1w36 h GLY 952 N 0.40 -0.08 2.00 1.56 0.00 -0.35 0.39 103.07 106.98 1w36 h GLY 952 Ca -0.00 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1w36 h GLY 952 CO 0.11 -0.18 0.00 -1.30 0.00 0.00 0.00 176.54 175.16 1w36 n THR 953 N -5.35 0.82 -0.06 4.70 -2.24 0.19 -1.63 114.28 110.70 1w36 n THR 953 Ca -0.01 0.19 -0.11 0.00 -2.27 0.00 0.00 64.05 61.84 1w36 n THR 953 Cb 0.27 -0.98 -0.05 0.00 -2.10 0.00 0.00 70.33 67.47 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 0.36 0.37 4.78 3.57 0.12 -2.37 116.94 123.76 1w36 h PHE 954 Ca 0.00 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 1w36 h PHE 954 Cb 0.34 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1w36 h PHE 954 CO 0.00 0.50 -0.35 -0.07 -2.23 0.00 0.00 178.31 176.16 1w36 h LEU 955 N 0.12 -0.94 -1.00 0.59 3.38 -0.51 -1.68 115.31 115.27 1w36 h LEU 955 Ca 0.06 0.07 0.34 0.00 0.09 0.00 0.00 57.88 58.44 1w36 h LEU 955 Cb 0.34 0.31 -0.18 0.00 0.09 0.00 0.00 40.66 41.21 1w36 h LEU 955 CO 0.01 -0.46 0.25 0.45 0.09 0.00 0.00 178.44 178.78 1w36 h HIS 956 N -0.71 0.34 -0.53 1.13 3.86 -1.53 2.09 115.15 119.80 1w36 h HIS 956 Ca -0.05 0.06 0.10 0.00 -1.16 0.00 0.00 60.37 59.32 1w36 h HIS 956 Cb 0.61 0.02 -0.08 0.00 1.06 0.00 0.00 27.41 29.01 1w36 h HIS 956 CO -0.18 -0.46 0.04 1.03 0.86 0.00 0.00 177.93 179.22 1w36 h SER 957 N 0.00 -0.15 -0.27 2.45 0.87 -0.78 -2.10 113.55 113.58 1w36 h SER 957 Ca 0.71 0.12 0.04 0.00 -1.23 0.00 0.00 61.79 61.43 1w36 h SER 957 Cb 1.69 0.19 -0.07 0.00 -0.44 0.00 0.00 62.40 63.77 1w36 h SER 957 CO -0.86 -0.05 -0.53 -0.07 -0.53 0.00 0.00 176.83 174.79 1w36 h LEU 958 N 0.16 -1.74 -0.09 2.23 4.07 0.42 -0.51 115.31 119.85 1w36 h LEU 958 Ca 0.27 0.22 0.00 0.00 0.08 0.00 0.00 57.88 58.45 1w36 h LEU 958 Cb 0.40 0.70 0.00 0.00 1.08 0.00 0.00 40.66 42.84 1w36 h LEU 958 CO -0.41 -0.43 0.00 0.49 -1.08 0.00 0.00 178.44 177.01 1w36 n PHE 959 N -5.29 0.00 -0.05 1.13 3.72 -0.91 -3.77 117.46 112.29 1w36 n PHE 959 Ca -0.05 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.22 1w36 n PHE 959 Cb 0.35 -0.01 -0.12 0.00 -0.94 0.00 0.00 39.48 38.76 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 0.01 0.00 -3.43 -1.08 5.08 -0.43 -3.41 114.58 111.33 1w36 h GLU 960 Ca 0.00 -0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.76 1w36 h GLU 960 Cb 0.04 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 28.89 1w36 h GLU 960 CO 0.00 0.80 -0.75 0.16 -1.00 0.00 0.00 179.01 178.22 1w36 s ASP 961 N -6.01 3.94 0.47 1.42 3.84 -1.25 -4.93 116.67 114.15 1w36 s ASP 961 Ca -0.18 -2.06 0.02 0.00 -0.00 0.00 0.00 52.55 50.33 1w36 s ASP 961 Cb -0.01 -0.99 -0.01 0.00 -1.38 0.00 0.00 42.92 40.53 1w36 s ASP 961 CO 0.68 -0.36 0.06 -0.76 -0.00 0.00 0.00 175.17 174.80 1w36 s LEU 962 N 1.07 2.14 -0.54 2.11 1.43 -1.26 -5.03 118.68 118.60 1w36 s LEU 962 Ca 0.13 -1.68 0.06 0.00 -1.03 0.00 0.00 54.13 51.61 1w36 s LEU 962 Cb -0.20 -0.44 0.34 0.00 0.03 0.00 0.00 46.19 45.92 1w36 s LEU 962 CO -0.14 -0.91 0.90 0.47 0.23 0.00 0.00 176.35 176.90 1w36 n ASP 963 N -1.32 3.77 -0.15 2.29 9.92 -1.26 -4.91 116.55 124.88 1w36 n ASP 963 Ca -0.14 -3.55 0.14 0.00 -0.53 0.00 0.00 54.79 50.71 1w36 n ASP 963 Cb 0.66 -0.57 0.25 0.00 -0.64 0.00 0.00 41.12 40.82 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 -0.11 0.50 0.00 1.24 0.99 -1.26 -0.76 117.46 118.07 1w36 n PHE 964 Ca 0.30 0.55 -0.01 0.00 -0.00 0.00 0.00 57.45 58.29 1w36 n PHE 964 Cb 0.44 -0.98 -0.00 0.00 -1.00 0.00 0.00 39.48 37.94 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 -3.91 4.37 1.35 -1.78 -3.39 112.91 109.55 1w36 h THR 965 Ca 0.38 0.00 -0.44 0.00 -0.55 0.00 0.00 66.41 65.80 1w36 h THR 965 Cb 0.97 0.00 0.17 0.00 -1.73 0.00 0.00 68.15 67.56 1w36 h THR 965 CO -0.37 0.00 0.34 -1.10 -0.25 0.00 0.00 175.52 174.14 1w36 s GLN 966 N -3.11 0.19 0.58 4.72 -0.21 0.06 -4.94 119.66 116.96 1w36 s GLN 966 Ca -0.01 -0.27 -0.11 0.00 0.02 0.00 0.00 55.36 54.99 1w36 s GLN 966 Cb 0.00 -1.78 -0.05 0.00 1.00 0.00 0.00 33.01 32.19 1w36 s GLN 966 CO 0.02 -2.74 0.99 -1.25 -2.12 0.00 0.00 175.29 170.19 1w36 s PRO 967 N -5.73 3.65 -0.48 2.91 0.04 -1.26 -4.89 135.00 129.24 1w36 s PRO 967 Ca 0.72 0.71 -0.28 0.00 0.04 0.00 0.00 61.00 62.20 1w36 s PRO 967 Cb -0.06 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1w36 s PRO 967 CO 0.54 -0.47 1.51 0.08 0.04 0.00 0.00 177.00 178.70 1w36 s VAL 968 N -3.03 3.74 0.33 -0.36 1.01 -1.26 -5.00 120.40 115.83 1w36 s VAL 968 Ca 0.55 0.68 -0.29 0.00 0.00 0.00 0.00 61.98 62.92 1w36 s VAL 968 Cb -0.11 -4.20 -0.11 0.00 0.00 0.00 0.00 36.38 31.96 1w36 s VAL 968 CO 0.49 -0.90 1.52 -0.62 0.00 0.00 0.00 175.10 175.59 1w36 s ASP 969 N 4.86 6.41 0.11 3.32 -1.08 -1.26 -4.88 116.67 124.15 1w36 s ASP 969 Ca 0.61 2.95 0.14 0.00 -0.52 0.00 0.00 52.55 55.73 1w36 s ASP 969 Cb -0.13 -2.65 -0.11 0.00 -1.46 0.00 0.00 42.92 38.57 1w36 s ASP 969 CO 0.28 -0.86 1.04 -0.65 0.52 0.00 0.00 175.17 175.50 1w36 h PRO 970 N 4.03 0.00 -0.01 4.34 0.11 -1.98 -3.27 132.00 135.22 1w36 h PRO 970 Ca -0.49 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.65 1w36 h PRO 970 Cb 1.23 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.30 1w36 h PRO 970 CO 0.72 0.49 -0.21 -0.91 -0.21 0.00 0.00 178.00 177.88 1w36 h ASN 971 N 0.00 -0.62 -0.67 -2.05 2.35 -1.99 0.98 115.58 113.57 1w36 h ASN 971 Ca -0.12 0.09 0.10 0.00 -0.55 0.00 0.00 56.30 55.82 1w36 h ASN 971 Cb 1.63 0.26 -0.11 0.00 0.05 0.00 0.00 38.32 40.15 1w36 h ASN 971 CO 0.07 -0.28 -0.45 -0.25 -1.65 0.00 0.00 177.43 174.87 1w36 h TRP 972 N -0.33 -1.33 -0.86 1.19 7.01 -1.96 -0.35 115.95 119.31 1w36 h TRP 972 Ca 0.06 0.09 0.07 0.00 2.11 0.00 0.00 58.89 61.22 1w36 h TRP 972 Cb 0.41 0.68 -0.06 0.00 -2.10 0.00 0.00 29.16 28.09 1w36 h TRP 972 CO -0.26 -0.42 0.53 0.28 -2.79 0.00 0.00 178.44 175.79 1w36 h VAL 973 N -0.18 1.03 -0.34 2.65 2.07 -1.41 -0.61 116.25 119.45 1w36 h VAL 973 Ca 0.20 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.34 1w36 h VAL 973 Cb 0.55 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1w36 h VAL 973 CO -0.75 0.18 0.03 0.08 0.02 0.00 0.00 177.57 177.12 1w36 h ARG 974 N 0.96 0.52 -0.32 1.57 0.11 0.35 -0.54 114.38 117.02 1w36 h ARG 974 Ca 0.38 -0.10 -0.07 0.00 0.10 0.00 0.00 59.98 60.29 1w36 h ARG 974 Cb 0.20 -0.08 -0.01 0.00 1.11 0.00 0.00 29.97 31.19 1w36 h ARG 974 CO -0.18 0.52 -0.09 1.49 0.10 0.00 0.00 179.97 181.81 1w36 h GLU 975 N 0.50 0.63 0.28 0.08 4.81 0.32 0.17 114.58 121.39 1w36 h GLU 975 Ca 0.11 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 1w36 h GLU 975 Cb 0.28 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 1w36 h GLU 975 CO 0.01 0.82 -0.19 0.87 -0.73 0.00 0.00 179.01 179.78 1w36 h LYS 976 N 0.41 -0.45 -0.78 1.92 6.56 -0.58 0.26 116.57 123.91 1w36 h LYS 976 Ca 0.08 0.03 0.00 0.00 -1.06 0.00 0.00 60.65 59.70 1w36 h LYS 976 Cb 0.59 0.10 -0.04 0.00 -0.57 0.00 0.00 32.23 32.31 1w36 h LYS 976 CO 0.03 -0.30 0.49 -0.07 -2.06 0.00 0.00 179.45 177.54 1w36 h LEU 977 N -0.47 0.91 -0.46 2.94 3.38 -1.04 -0.22 115.31 120.35 1w36 h LEU 977 Ca -0.02 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 1w36 h LEU 977 Cb 0.40 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1w36 h LEU 977 CO 0.01 0.68 -0.27 -0.08 0.09 0.00 0.00 178.44 178.88 1w36 h GLU 978 N 1.06 0.99 -0.12 1.13 4.81 -0.18 0.41 114.58 122.69 1w36 h GLU 978 Ca 0.28 -0.45 -0.23 0.00 -0.13 0.00 0.00 59.36 58.83 1w36 h GLU 978 Cb -0.08 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.29 1w36 h GLU 978 CO -0.06 1.13 -0.81 -0.07 -0.73 0.00 0.00 179.01 178.46 1w36 h LEU 979 N 0.84 0.92 0.00 1.64 3.38 -0.20 -2.89 115.31 119.01 1w36 h LEU 979 Ca 0.10 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1w36 h LEU 979 Cb 0.85 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1w36 h LEU 979 CO 0.08 1.43 0.00 0.61 0.09 0.00 0.00 178.44 180.65 1w36 n GLY 980 N 0.79 -0.88 2.22 0.83 0.00 -0.12 -4.88 105.19 103.15 1w36 n GLY 980 Ca -0.08 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 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 0.47 0.08 3.74 -0.02 0.00 -1.07 -5.04 105.19 103.35 1w36 n GLY 981 Ca 0.05 -0.46 -0.25 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.62 2.98 0.25 1.61 0.40 0.14 -5.02 117.98 115.73 1w36 s PHE 982 Ca 0.06 -0.10 -0.30 0.00 -0.60 0.00 0.00 56.93 56.00 1w36 s PHE 982 Cb -0.03 -1.41 -0.09 0.00 0.51 0.00 0.00 43.02 42.00 1w36 s PHE 982 CO 0.08 0.53 1.29 -1.21 0.70 0.00 0.00 175.22 176.61 1w36 s GLU 983 N -3.23 4.40 0.29 0.44 8.01 -1.26 -4.02 118.70 123.33 1w36 s GLU 983 Ca 0.30 2.08 0.04 0.00 0.01 0.00 0.00 54.97 57.40 1w36 s GLU 983 Cb -0.09 -3.15 0.67 0.00 -4.31 0.00 0.00 34.13 27.24 1w36 s GLU 983 CO 0.21 -0.18 1.78 0.77 0.01 0.00 0.00 175.26 177.85 1w36 h SER 984 N 4.57 0.75 0.00 -0.19 0.02 -1.90 -2.53 113.55 114.27 1w36 h SER 984 Ca -0.46 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1w36 h SER 984 Cb 1.22 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.71 1w36 h SER 984 CO 0.72 0.30 0.00 0.00 -1.14 0.00 0.00 176.83 176.71 1w36 n GLN 985 N -4.77 0.00 -0.01 3.45 3.00 -1.26 0.07 117.38 117.87 1w36 n GLN 985 Ca 0.21 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.30 1w36 n GLN 985 Cb 0.51 -0.98 -0.13 0.00 0.00 0.00 0.00 30.24 29.64 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 -0.23 0.00 -0.26 1.08 7.02 -0.95 -4.54 117.44 119.55 1w36 n TRP 986 Ca 0.00 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.55 1w36 n TRP 986 Cb 0.00 -0.26 0.21 0.00 -2.42 0.00 0.00 31.31 28.84 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 0.37 0.07 -0.99 -0.00 -0.60 -0.05 114.58 113.38 1w36 h GLU 987 Ca 0.00 -0.02 0.01 0.00 -0.00 0.00 0.00 59.36 59.35 1w36 h GLU 987 Cb 0.69 -0.08 -0.02 0.00 -0.00 0.00 0.00 28.75 29.34 1w36 h GLU 987 CO 0.00 0.25 -0.13 -1.35 -0.00 0.00 0.00 179.01 177.77 1w36 h PRO 988 N 0.38 -0.25 -0.66 1.06 0.11 -1.82 -0.83 132.00 130.00 1w36 h PRO 988 Ca 0.44 0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.50 1w36 h PRO 988 Cb 0.73 0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.87 1w36 h PRO 988 CO -0.46 -0.17 0.16 0.28 -0.21 0.00 0.00 178.00 177.61 1w36 h VAL 989 N -0.26 1.26 0.10 3.15 2.07 -1.70 -3.05 116.25 117.82 1w36 h VAL 989 Ca 0.02 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.60 1w36 h VAL 989 Cb 0.28 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1w36 h VAL 989 CO -0.08 0.36 -0.05 0.25 0.02 0.00 0.00 177.57 178.07 1w36 h LEU 990 N 0.98 -0.12 -1.31 2.57 5.85 -0.89 -1.71 115.31 120.67 1w36 h LEU 990 Ca 0.21 -0.43 0.09 0.00 0.84 0.00 0.00 57.88 58.58 1w36 h LEU 990 Cb 0.36 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.37 1w36 h LEU 990 CO 0.00 0.42 0.53 0.00 -0.34 0.00 0.00 178.44 179.05 1w36 h THR 991 N -0.71 0.98 0.00 1.05 1.03 -1.26 0.66 112.91 114.66 1w36 h THR 991 Ca -0.01 -0.27 -0.05 0.00 -0.01 0.00 0.00 66.41 66.06 1w36 h THR 991 Cb 0.54 0.12 -0.01 0.00 -1.07 0.00 0.00 68.15 67.74 1w36 h THR 991 CO 0.02 0.14 -0.26 -0.08 -0.01 0.00 0.00 175.52 175.34 1w36 h GLU 992 N 0.79 0.00 0.11 0.00 4.81 -1.57 -2.84 114.58 115.88 1w36 h GLU 992 Ca 0.36 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.43 1w36 h GLU 992 Cb 0.38 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.77 1w36 h GLU 992 CO -0.14 0.26 -0.76 2.35 -0.73 0.00 0.00 179.01 179.99 1w36 h TRP 993 N 0.00 0.42 0.25 0.92 7.01 0.78 -3.21 115.95 122.12 1w36 h TRP 993 Ca -0.00 -0.30 0.01 0.00 2.11 0.00 0.00 58.89 60.70 1w36 h TRP 993 Cb 0.75 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.77 1w36 h TRP 993 CO 0.00 1.29 -0.30 0.82 -2.79 0.00 0.00 178.44 177.46 1w36 h ILE 994 N -0.50 0.36 -0.07 2.65 2.04 0.16 -2.07 117.51 120.08 1w36 h ILE 994 Ca -0.14 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.75 1w36 h ILE 994 Cb 1.53 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.93 1w36 h ILE 994 CO 0.10 0.00 -0.16 0.71 0.00 0.00 0.00 178.15 178.81 1w36 h THR 995 N -0.61 0.60 -0.66 -0.27 1.35 -1.68 0.16 112.91 111.80 1w36 h THR 995 Ca -0.00 0.00 0.11 0.00 -0.55 0.00 0.00 66.41 65.97 1w36 h THR 995 Cb 0.58 0.60 -0.12 0.00 -1.73 0.00 0.00 68.15 67.48 1w36 h THR 995 CO -0.09 0.00 -0.36 0.00 -0.25 0.00 0.00 175.52 174.81 1w36 h ALA 996 N 0.77 -0.06 0.00 6.62 0.00 -1.52 1.06 119.26 126.14 1w36 h ALA 996 Ca 0.07 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1w36 h ALA 996 Cb 0.33 0.86 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1w36 h ALA 996 CO -0.20 -0.69 0.00 -0.24 0.00 0.00 0.00 179.25 178.12 1w36 h VAL 997 N -0.14 0.00 0.09 0.00 3.04 -0.64 -2.40 116.25 116.20 1w36 h VAL 997 Ca 0.24 -0.31 -0.17 0.00 -1.01 0.00 0.00 66.70 65.45 1w36 h VAL 997 Cb 0.56 1.20 0.01 0.00 -2.01 0.00 0.00 31.29 31.05 1w36 h VAL 997 CO -0.74 0.00 -0.80 -0.07 -1.01 0.00 0.00 177.57 174.95 1w36 h LEU 998 N 0.00 0.30 -2.80 3.16 3.38 0.37 -3.36 115.31 116.36 1w36 h LEU 998 Ca 0.00 -0.91 -0.16 0.00 0.09 0.00 0.00 57.88 56.90 1w36 h LEU 998 Cb 0.34 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 40.91 1w36 h LEU 998 CO 0.00 1.36 0.21 0.00 0.09 0.00 0.00 178.44 180.10 1w36 n GLN 999 N -4.21 1.40 -3.98 1.13 6.02 0.24 -2.53 117.38 115.44 1w36 n GLN 999 Ca -0.17 -0.88 -0.25 0.00 -0.01 0.00 0.00 57.00 55.69 1w36 n GLN 999 Cb 0.75 -1.35 -0.03 0.00 1.02 0.00 0.00 30.24 30.63 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 -0.99 3.87 -0.86 -1.58 0.00 -1.07 -4.98 121.76 116.16 1w36 s ALA 1000Ca 0.17 -1.11 -0.19 0.00 0.00 0.00 0.00 51.96 50.83 1w36 s ALA 1000Cb 0.14 -1.67 0.13 0.00 0.00 0.00 0.00 23.12 21.72 1w36 s ALA 1000CO 0.02 0.48 1.03 -1.25 0.00 0.00 0.00 175.76 176.04 1w36 s PRO 1001N -3.33 3.49 0.05 0.00 0.04 -1.26 -2.99 135.00 131.00 1w36 s PRO 1001Ca 0.34 -1.70 -0.31 0.00 0.04 0.00 0.00 61.00 59.37 1w36 s PRO 1001Cb -0.10 -4.72 -0.17 0.00 0.04 0.00 0.00 34.50 29.54 1w36 s PRO 1001CO 0.27 -1.70 1.47 -0.07 0.04 0.00 0.00 177.00 177.02 1w36 h LEU 1002N 10.17 -1.00 -3.78 -3.56 4.07 -1.91 -3.33 115.31 115.98 1w36 h LEU 1002Ca 0.06 0.04 -0.56 0.00 0.08 0.00 0.00 57.88 57.50 1w36 h LEU 1002Cb 1.04 0.27 -0.39 0.00 1.08 0.00 0.00 40.66 42.66 1w36 h LEU 1002CO 1.07 -0.67 -0.48 0.59 -1.08 0.00 0.00 178.44 177.87 1w36 n ASN 1003N -5.06 5.36 0.00 -0.43 3.02 -1.26 -4.94 115.26 111.95 1w36 n ASN 1003Ca -0.14 -3.76 0.00 0.00 -0.03 0.00 0.00 54.58 50.65 1w36 n ASN 1003Cb 0.44 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 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 -0.76 0.00 -2.51 3.52 1.02 -1.25 -4.73 120.64 115.93 1w36 n GLU 1004Ca 0.47 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 57.20 1w36 n GLU 1004Cb 0.91 -0.11 -0.01 0.00 -0.02 0.00 0.00 31.44 32.21 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 4.01 0.00 2.62 -4.23 -1.26 -4.68 115.64 112.10 1w36 s THR 1005Ca 0.00 -1.55 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1w36 s THR 1005Cb 0.00 -5.08 0.00 0.00 1.34 0.00 0.00 72.50 68.76 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 5.78 1.74 7.00 3.99 0.00 -1.26 -4.98 105.19 117.45 1w36 n GLY 1006Ca 0.45 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.31 1.61 0.31 -1.26 -4.82 118.33 111.86 1w36 n VAL 1007Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1w36 n VAL 1007Cb 0.00 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 1.75 -7.30 -0.33 4.52 2.88 -1.16 -4.37 113.62 109.61 1w36 n SER 1008Ca 0.00 1.68 0.28 0.00 -1.33 0.00 0.00 58.87 59.50 1w36 n SER 1008Cb 0.00 -4.48 0.53 0.00 -0.75 0.00 0.00 64.21 59.51 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 4.26 0.34 -1.58 2.46 3.38 -1.65 0.14 115.31 122.67 1w36 h LEU 1009Ca -0.03 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1w36 h LEU 1009Cb 0.06 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1w36 h LEU 1009CO 0.00 -0.33 0.36 0.77 0.09 0.00 0.00 178.44 179.33 1w36 h SER 1010N 0.11 0.00 -0.39 -0.43 4.64 -1.74 0.10 113.55 115.84 1w36 h SER 1010Ca 0.79 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.11 1w36 h SER 1010Cb 1.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.08 1w36 h SER 1010CO -0.72 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.24 1w36 n GLN 1011N -2.64 2.09 -3.50 4.77 6.02 0.04 -3.81 117.38 120.35 1w36 n GLN 1011Ca -0.02 -1.67 -0.42 0.00 -0.01 0.00 0.00 57.00 54.88 1w36 n GLN 1011Cb 0.40 -1.40 -0.09 0.00 1.02 0.00 0.00 30.24 30.17 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 5.33 0.82 1.08 1.43 0.36 -5.06 118.68 121.43 1w36 s LEU 1012Ca 0.33 -1.35 -0.12 0.00 -1.03 0.00 0.00 54.13 51.96 1w36 s LEU 1012Cb 0.18 -2.09 0.09 0.00 0.03 0.00 0.00 46.19 44.40 1w36 s LEU 1012CO 0.25 -0.57 1.15 -0.94 0.23 0.00 0.00 176.35 176.46 1w36 s SER 1013N 2.27 4.36 0.10 2.29 1.04 -1.26 -4.45 113.70 118.06 1w36 s SER 1013Ca 0.03 0.93 -0.28 0.00 0.48 0.00 0.00 55.95 57.12 1w36 s SER 1013Cb -0.23 -1.51 -0.10 0.00 0.10 0.00 0.00 66.02 64.28 1w36 s SER 1013CO 0.05 -2.01 1.45 0.00 0.98 0.00 0.00 173.24 173.71 1w36 h ALA 1014N -1.13 -0.77 0.00 5.32 0.00 -1.96 -1.16 119.26 119.55 1w36 h ALA 1014Ca -0.47 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1w36 h ALA 1014Cb 1.31 0.98 0.00 0.00 0.00 0.00 0.00 17.79 20.09 1w36 h ALA 1014CO 0.64 -0.96 0.68 0.00 0.00 0.00 0.00 179.25 179.62 1w36 h ARG 1015N -0.42 0.00 -0.29 0.00 -0.00 -2.04 0.31 114.38 111.94 1w36 h ARG 1015Ca 0.04 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.52 1w36 h ARG 1015Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.51 1w36 h ARG 1015CO -0.41 0.00 0.00 0.09 0.00 0.00 0.00 179.97 179.65 1w36 n ASN 1016N -2.32 2.88 -4.42 7.04 3.02 -0.44 -4.99 115.26 116.02 1w36 n ASN 1016Ca -0.01 -1.85 -0.24 0.00 -0.03 0.00 0.00 54.58 52.45 1w36 n ASN 1016Cb 0.70 -0.18 -0.11 0.00 -0.61 0.00 0.00 39.78 39.58 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 -1.14 1.53 -0.14 3.52 1.02 0.11 -0.88 119.74 123.75 1w36 s LYS 1017Ca 0.27 -1.61 -0.04 0.00 0.02 0.00 0.00 55.97 54.60 1w36 s LYS 1017Cb 0.15 -1.66 0.07 0.00 -0.52 0.00 0.00 37.83 35.87 1w36 s LYS 1017CO 0.21 0.33 0.23 -1.14 -0.92 0.00 0.00 175.35 174.07 1w36 s GLN 1018N -3.13 0.14 0.23 1.68 2.00 0.05 -4.96 119.66 115.67 1w36 s GLN 1018Ca 0.24 0.57 -0.04 0.00 -2.00 0.00 0.00 55.36 54.12 1w36 s GLN 1018Cb -0.06 -0.39 -0.05 0.00 0.80 0.00 0.00 33.01 33.31 1w36 s GLN 1018CO 0.11 -0.40 0.48 0.08 -0.50 0.00 0.00 175.29 175.06 1w36 s VAL 1019N 2.37 5.09 -0.43 1.34 1.01 -1.26 -1.99 120.40 126.53 1w36 s VAL 1019Ca 0.03 -0.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.85 1w36 s VAL 1019Cb -0.13 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.57 1w36 s VAL 1019CO -0.09 -0.19 0.44 -0.62 0.00 0.00 0.00 175.10 174.65 1w36 n GLU 1020N -0.59 -1.22 -3.16 2.72 1.02 -1.03 -4.92 120.64 113.47 1w36 n GLU 1020Ca -0.02 0.77 -0.31 0.00 -0.02 0.00 0.00 57.16 57.58 1w36 n GLU 1020Cb 0.53 -1.46 -0.05 0.00 -0.02 0.00 0.00 31.44 30.45 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 -2.80 3.82 -0.11 3.49 1.75 -1.10 -4.85 119.30 119.51 1w36 s MET 1021Ca 0.15 0.40 0.01 0.00 -1.25 0.00 0.00 55.69 55.00 1w36 s MET 1021Cb -0.02 -2.51 0.02 0.00 2.84 0.00 0.00 34.83 35.16 1w36 s MET 1021CO 0.62 0.15 -0.13 -2.00 -0.65 0.00 0.00 175.02 173.01 1w36 s GLU 1022N -3.29 2.06 0.23 4.11 2.12 -1.26 -1.64 118.70 121.03 1w36 s GLU 1022Ca 0.50 -0.49 0.10 0.00 0.36 0.00 0.00 54.97 55.44 1w36 s GLU 1022Cb -0.11 -1.82 -0.04 0.00 0.26 0.00 0.00 34.13 32.42 1w36 s GLU 1022CO 0.25 -0.12 -0.13 -0.59 -0.54 0.00 0.00 175.26 174.12 1w36 s PHE 1023N 1.17 2.49 -0.13 5.30 -0.71 -0.55 -4.98 117.98 120.58 1w36 s PHE 1023Ca -0.03 -0.28 -0.01 0.00 -1.04 0.00 0.00 56.93 55.57 1w36 s PHE 1023Cb -0.14 -1.16 0.04 0.00 -1.21 0.00 0.00 43.02 40.55 1w36 s PHE 1023CO -0.04 0.59 -0.02 0.71 -1.34 0.00 0.00 175.22 175.12 1w36 s TYR 1024N -2.06 1.21 -0.22 3.49 2.02 -1.26 -2.38 117.35 118.14 1w36 s TYR 1024Ca 0.27 -0.68 -0.04 0.00 -0.37 0.00 0.00 57.07 56.25 1w36 s TYR 1024Cb -0.07 -1.08 -0.01 0.00 -0.40 0.00 0.00 41.96 40.40 1w36 s TYR 1024CO 0.15 -0.50 -0.03 -0.51 -1.57 0.00 0.00 175.55 173.09 1w36 s LEU 1025N 1.80 2.97 0.42 -1.29 1.02 -0.85 -4.90 118.68 117.85 1w36 s LEU 1025Ca 0.03 -0.36 -0.24 0.00 0.02 0.00 0.00 54.13 53.58 1w36 s LEU 1025Cb -0.14 -1.76 -0.08 0.00 0.02 0.00 0.00 46.19 44.23 1w36 s LEU 1025CO -0.07 -0.01 1.14 -2.16 0.02 0.00 0.00 176.35 175.27 1w36 s PRO 1026N 1.44 3.98 -0.38 1.29 0.04 -1.26 -0.71 135.00 139.40 1w36 s PRO 1026Ca 0.05 1.75 0.01 0.00 0.04 0.00 0.00 61.00 62.85 1w36 s PRO 1026Cb -0.14 -2.56 0.12 0.00 0.04 0.00 0.00 34.50 31.95 1w36 s PRO 1026CO -0.02 -0.35 0.18 0.96 0.04 0.00 0.00 177.00 177.80 1w36 s ILE 1027N -1.50 1.03 0.83 0.56 -4.36 -0.98 -4.87 121.20 111.89 1w36 s ILE 1027Ca 0.59 -1.98 -0.09 0.00 -0.26 0.00 0.00 60.65 58.92 1w36 s ILE 1027Cb -0.28 -1.74 0.15 0.00 1.25 0.00 0.00 42.46 41.83 1w36 s ILE 1027CO 0.35 -0.82 1.15 -0.55 0.24 0.00 0.00 174.94 175.31 1w36 s SER 1028N 0.96 3.85 -0.13 4.36 0.15 -1.26 -1.63 113.70 120.00 1w36 s SER 1028Ca 0.14 0.06 -0.08 0.00 0.70 0.00 0.00 55.95 56.77 1w36 s SER 1028Cb -0.21 -0.32 0.03 0.00 -1.71 0.00 0.00 66.02 63.80 1w36 s SER 1028CO -0.10 -2.23 0.17 -0.62 1.20 0.00 0.00 173.24 171.66 1w36 n GLU 1029N -3.28 -3.52 -0.63 5.44 1.02 -1.26 -4.65 120.64 113.76 1w36 n GLU 1029Ca 0.14 2.74 -0.21 0.00 -0.02 0.00 0.00 57.16 59.81 1w36 n GLU 1029Cb 0.60 -3.70 -0.01 0.00 -0.02 0.00 0.00 31.44 28.31 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 1.96 0.00 -3.36 3.49 -0.04 -1.26 -4.83 135.00 130.96 1w36 n PRO 1030Ca -0.28 0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 62.72 1w36 n PRO 1030Cb 0.44 -0.47 -0.04 0.00 -0.04 0.00 0.00 33.50 33.39 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 1.82 6.31 -0.25 1.53 2.96 -0.98 -4.88 118.68 125.20 1w36 s LEU 1031Ca 0.29 -2.18 -0.28 0.00 -0.22 0.00 0.00 54.13 51.74 1w36 s LEU 1031Cb -0.35 -2.18 0.01 0.00 0.50 0.00 0.00 46.19 44.18 1w36 s LEU 1031CO 0.28 -0.72 1.02 -0.63 -1.32 0.00 0.00 176.35 174.99 1w36 s ILE 1032N 0.98 4.67 0.50 6.68 1.09 -1.26 -3.96 121.20 129.91 1w36 s ILE 1032Ca 0.09 1.93 0.42 0.00 -1.10 0.00 0.00 60.65 61.99 1w36 s ILE 1032Cb -0.22 -4.30 0.62 0.00 -1.06 0.00 0.00 42.46 37.50 1w36 s ILE 1032CO -0.02 -0.22 1.56 0.00 -0.10 0.00 0.00 174.94 176.17 1w36 n ALA 1033N 6.37 1.64 0.11 9.38 0.00 -1.26 -0.87 120.51 135.88 1w36 n ALA 1033Ca 0.11 0.76 -0.05 0.00 0.00 0.00 0.00 53.44 54.27 1w36 n ALA 1033Cb 0.46 -1.10 -0.02 0.00 0.00 0.00 0.00 19.45 18.79 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 -0.27 -0.05 0.00 4.64 -1.90 -2.87 113.55 113.10 1w36 h SER 1034Ca 0.91 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 62.26 1w36 h SER 1034Cb 3.32 0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 65.48 1w36 h SER 1034CO -0.24 -0.02 0.50 1.56 -0.87 0.00 0.00 176.83 177.76 1w36 h GLN 1035N -0.67 0.00 0.00 4.77 4.20 -1.41 0.90 115.11 122.91 1w36 h GLN 1035Ca -0.03 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.41 1w36 h GLN 1035Cb 0.25 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.98 1w36 h GLN 1035CO 0.05 0.00 -1.59 1.25 -0.67 0.00 0.00 178.83 177.87 1w36 h LEU 1036N 0.00 0.00 0.10 1.46 5.85 -1.49 -3.37 115.31 117.86 1w36 h LEU 1036Ca 0.02 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1w36 h LEU 1036Cb 1.02 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.05 1w36 h LEU 1036CO -0.00 0.95 -0.05 -0.78 -0.34 0.00 0.00 178.44 178.22 1w36 h ASP 1037N 0.00 -0.11 -0.38 1.25 1.82 0.11 -2.16 116.42 116.94 1w36 h ASP 1037Ca -0.24 -0.00 0.05 0.00 -0.39 0.00 0.00 57.03 56.44 1w36 h ASP 1037Cb 1.94 0.03 -0.08 0.00 0.68 0.00 0.00 39.33 41.90 1w36 h ASP 1037CO 0.08 -0.08 -0.55 0.71 -1.61 0.00 0.00 179.24 177.79 1w36 h THR 1038N -0.14 0.00 0.00 2.25 1.35 -1.65 -0.70 112.91 114.03 1w36 h THR 1038Ca -0.01 0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 65.73 1w36 h THR 1038Cb 0.11 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 66.51 1w36 h THR 1038CO 0.02 0.00 -0.53 0.17 -0.25 0.00 0.00 175.52 174.93 1w36 h LEU 1039N -0.42 0.00 -0.83 3.87 -0.00 -1.75 -2.01 115.31 114.18 1w36 h LEU 1039Ca 0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.94 1w36 h LEU 1039Cb 0.61 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.23 1w36 h LEU 1039CO -0.58 0.53 0.49 0.40 -0.00 0.00 0.00 178.44 179.28 1w36 h ILE 1040N 0.00 1.23 0.73 0.15 1.08 -0.83 -2.64 117.51 117.23 1w36 h ILE 1040Ca -0.01 -0.52 -0.04 0.00 -0.39 0.00 0.00 64.86 63.91 1w36 h ILE 1040Cb 1.00 0.08 0.01 0.00 -3.07 0.00 0.00 36.82 34.84 1w36 h ILE 1040CO 0.07 0.25 -0.35 0.03 -0.69 0.00 0.00 178.15 177.45 1w36 h ARG 1041N 1.14 -0.95 -0.92 2.37 3.08 -0.72 -1.60 114.38 116.79 1w36 h ARG 1041Ca 0.30 0.06 0.14 0.00 0.07 0.00 0.00 59.98 60.55 1w36 h ARG 1041Cb -0.03 0.22 -0.15 0.00 0.08 0.00 0.00 29.97 30.09 1w36 h ARG 1041CO -0.05 -0.63 -0.40 1.96 -1.07 0.00 0.00 179.97 179.77 1w36 h GLN 1042N -1.00 -0.03 0.00 0.04 4.20 -1.28 -2.50 115.11 114.53 1w36 h GLN 1042Ca -0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1w36 h GLN 1042Cb 0.75 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.54 1w36 h GLN 1042CO 0.17 -0.02 -0.53 0.74 -0.67 0.00 0.00 178.83 178.51 1w36 h PHE 1043N -0.04 0.00 -3.22 2.96 -1.00 -1.54 -3.45 116.94 110.65 1w36 h PHE 1043Ca 0.31 0.00 -0.67 0.00 2.81 0.00 0.00 57.97 60.42 1w36 h PHE 1043Cb 0.58 0.00 -0.32 0.00 3.61 0.00 0.00 35.95 39.82 1w36 h PHE 1043CO -0.85 0.00 -0.81 0.34 -1.61 0.00 0.00 178.31 175.38 1w36 s ASP 1044N -4.71 3.55 0.44 2.17 2.15 -0.60 -4.73 116.67 114.94 1w36 s ASP 1044Ca 0.06 -0.53 0.22 0.00 0.43 0.00 0.00 52.55 52.73 1w36 s ASP 1044Cb 0.12 -1.56 1.03 0.00 -0.30 0.00 0.00 42.92 42.21 1w36 s ASP 1044CO 0.71 0.04 1.90 1.55 -0.17 0.00 0.00 175.17 179.20 1w36 h PRO 1045N 7.66 0.00 0.17 4.34 0.13 -1.87 -3.05 132.00 139.37 1w36 h PRO 1045Ca -0.39 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 1w36 h PRO 1045Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1w36 h PRO 1045CO 0.60 0.24 -0.08 1.25 -0.23 0.00 0.00 178.00 179.78 1w36 h LEU 1046N 0.00 -0.19 -0.19 1.56 6.46 -1.93 -3.18 115.31 117.84 1w36 h LEU 1046Ca -0.00 -0.27 0.00 0.00 -0.12 0.00 0.00 57.88 57.48 1w36 h LEU 1046Cb 0.60 0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.58 1w36 h LEU 1046CO 0.03 0.37 0.00 -1.54 -0.62 0.00 0.00 178.44 176.68 1w36 n SER 1047N -4.91 0.09 0.18 1.25 3.41 -1.21 -0.90 113.62 111.53 1w36 n SER 1047Ca -0.06 -0.92 0.13 0.00 -0.26 0.00 0.00 58.87 57.76 1w36 n SER 1047Cb 0.23 -0.04 0.39 0.00 -0.26 0.00 0.00 64.21 64.52 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 1.83 1.00 -0.85 7.33 0.00 -1.51 -3.31 119.26 123.75 1w36 h ALA 1048Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.23 1w36 h ALA 1048Cb 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 1w36 h ALA 1048CO 0.00 0.00 2.21 0.41 0.00 0.00 0.00 179.25 181.87 1w36 n GLY 1049N 0.78 2.60 1.43 0.00 0.00 -0.08 -4.87 105.19 105.06 1w36 n GLY 1049Ca 0.03 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.59 1w36 n GLY 1049CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w36 h PRO 1051N 2.07 0.00 0.00 0.00 0.11 -1.89 -3.47 132.00 128.82 1w36 h PRO 1051Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1w36 h PRO 1051Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1w36 h PRO 1051CO 0.00 0.00 0.00 -0.35 -0.21 0.00 0.00 178.00 177.44 1w36 n PRO 1052N -2.59 0.00 -4.31 1.05 -0.04 -1.26 -4.69 135.00 123.15 1w36 n PRO 1052Ca 0.05 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.13 1w36 n PRO 1052Cb 0.46 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.87 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 -1.44 -0.35 1.53 -0.00 -1.26 -4.81 117.00 110.66 1w36 n LEU 1053Ca 0.00 -1.09 0.11 0.00 -0.00 0.00 0.00 56.01 55.03 1w36 n LEU 1053Cb 0.00 -1.93 0.48 0.00 -0.00 0.00 0.00 43.42 41.97 1w36 n LEU 1053CO 0.00 0.25 0.83 -1.84 -0.00 0.00 0.00 177.39 176.63 1w36 n GLU 1054N -4.30 1.47 -3.73 1.47 0.28 -1.26 -4.85 120.64 109.72 1w36 n GLU 1054Ca 0.05 -0.70 -0.23 0.00 -0.16 0.00 0.00 57.16 56.12 1w36 n GLU 1054Cb 0.50 -1.38 -0.03 0.00 1.43 0.00 0.00 31.44 31.96 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 -0.09 0.10 -4.43 -1.84 -1.74 -1.26 -4.94 117.46 103.27 1w36 n PHE 1055Ca 0.16 -1.90 -0.20 0.00 -0.56 0.00 0.00 57.45 54.95 1w36 n PHE 1055Cb 0.24 -0.31 -0.14 0.00 1.52 0.00 0.00 39.48 40.80 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 -3.60 0.96 0.00 3.97 0.23 -1.26 -4.60 119.30 115.00 1w36 s MET 1056Ca 0.12 -0.64 0.00 0.00 -1.03 0.00 0.00 55.69 54.14 1w36 s MET 1056Cb -0.01 -0.95 0.00 0.00 -1.53 0.00 0.00 34.83 32.34 1w36 s MET 1056CO 0.07 0.24 0.00 1.04 -2.03 0.00 0.00 175.02 174.35 1w36 n GLN 1057N 2.22 0.00 -3.66 3.16 6.02 -1.26 -4.97 117.38 118.89 1w36 n GLN 1057Ca -0.17 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.72 1w36 n GLN 1057Cb 0.55 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.70 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 -0.52 0.43 5.09 1.01 -1.25 -4.92 120.40 120.23 1w36 s VAL 1058Ca 0.00 0.21 0.08 0.00 0.00 0.00 0.00 61.98 62.27 1w36 s VAL 1058Cb 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 36.38 35.82 1w36 s VAL 1058CO 0.00 0.09 0.54 -0.13 0.00 0.00 0.00 175.10 175.60 1w36 s ARG 1059N 2.46 2.72 0.00 2.72 0.52 -1.22 -2.31 118.95 123.85 1w36 s ARG 1059Ca -0.01 -1.34 0.00 0.00 -0.52 0.00 0.00 55.73 53.86 1w36 s ARG 1059Cb -0.12 -2.66 0.00 0.00 0.52 0.00 0.00 34.95 32.69 1w36 s ARG 1059CO -0.11 -0.30 0.00 0.41 0.02 0.00 0.00 175.30 175.32 1w36 n GLY 1060N -1.81 0.52 3.17 -3.53 0.00 -0.64 -2.00 105.19 100.89 1w36 n GLY 1060Ca 0.07 -0.94 -0.11 0.00 0.00 0.00 0.00 46.02 45.05 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 1.01 -0.29 1.61 -1.94 0.95 -2.33 119.30 118.30 1w36 s MET 1061Ca 0.00 -1.49 -0.02 0.00 -1.71 0.00 0.00 55.69 52.46 1w36 s MET 1061Cb 0.00 0.22 0.10 0.00 2.01 0.00 0.00 34.83 37.15 1w36 s MET 1061CO 0.00 -0.29 0.11 -1.17 -0.01 0.00 0.00 175.02 173.66 1w36 s LEU 1062N -3.08 1.35 0.80 -0.03 2.96 0.11 -1.57 118.68 119.22 1w36 s LEU 1062Ca 0.28 -1.41 -0.11 0.00 -0.22 0.00 0.00 54.13 52.67 1w36 s LEU 1062Cb 0.07 -0.60 0.07 0.00 0.50 0.00 0.00 46.19 46.24 1w36 s LEU 1062CO 0.04 -0.42 1.09 -0.54 -1.32 0.00 0.00 176.35 175.21 1w36 s LYS 1063N 1.87 2.03 0.00 1.98 1.02 0.35 -2.00 119.74 124.99 1w36 s LYS 1063Ca 0.09 0.69 0.00 0.00 0.02 0.00 0.00 55.97 56.77 1w36 s LYS 1063Cb -0.17 -1.91 0.00 0.00 -0.52 0.00 0.00 37.83 35.24 1w36 s LYS 1063CO -0.29 -1.67 0.00 0.41 -0.92 0.00 0.00 175.35 172.88 1w36 n GLY 1064N -1.96 1.85 3.43 -3.33 0.00 -1.00 -4.46 105.19 99.72 1w36 n GLY 1064Ca 0.07 -0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.36 2.69 -0.31 1.61 0.40 -1.26 -1.48 117.98 118.28 1w36 s PHE 1065Ca 0.00 -0.32 -0.07 0.00 -0.60 0.00 0.00 56.93 55.94 1w36 s PHE 1065Cb 0.00 -1.67 0.02 0.00 0.51 0.00 0.00 43.02 41.88 1w36 s PHE 1065CO 0.00 0.05 0.09 0.42 0.70 0.00 0.00 175.22 176.48 1w36 s ILE 1066N -0.43 3.87 0.28 0.64 -1.09 -0.65 -4.94 121.20 118.87 1w36 s ILE 1066Ca 0.05 -0.86 -0.01 0.00 -2.23 0.00 0.00 60.65 57.60 1w36 s ILE 1066Cb -0.12 -3.07 0.31 0.00 -1.58 0.00 0.00 42.46 38.00 1w36 s ILE 1066CO 0.02 -0.01 1.64 0.44 -1.23 0.00 0.00 174.94 175.79 1w36 h ASP 1067N 8.22 -0.15 -3.99 3.58 3.32 -1.89 -2.70 116.42 122.81 1w36 h ASP 1067Ca -0.28 0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 1w36 h ASP 1067Cb 1.11 0.31 -0.22 0.00 0.22 0.00 0.00 39.33 40.75 1w36 h ASP 1067CO 0.60 -0.18 0.22 -0.22 -1.72 0.00 0.00 179.24 177.94 1w36 s LEU 1068N -10.73 -0.66 -0.07 1.55 2.96 -1.10 -2.45 118.68 108.18 1w36 s LEU 1068Ca -0.13 1.19 -0.00 0.00 -0.22 0.00 0.00 54.13 54.97 1w36 s LEU 1068Cb 0.25 2.34 0.03 0.00 0.50 0.00 0.00 46.19 49.31 1w36 s LEU 1068CO 0.77 -0.29 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.79 1w36 s VAL 1069N 0.07 0.52 0.16 1.68 1.01 -0.84 0.50 120.40 123.50 1w36 s VAL 1069Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.95 1w36 s VAL 1069Cb -0.04 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1w36 s VAL 1069CO 0.01 0.26 0.05 0.72 0.00 0.00 0.00 175.10 176.14 1w36 s PHE 1070N 1.54 1.06 0.07 5.22 -0.71 -1.20 -0.77 117.98 123.19 1w36 s PHE 1070Ca -0.01 -1.17 0.09 0.00 -1.04 0.00 0.00 56.93 54.79 1w36 s PHE 1070Cb -0.13 -0.60 -0.03 0.00 -1.21 0.00 0.00 43.02 41.05 1w36 s PHE 1070CO -0.04 -0.41 -0.23 -0.98 -1.34 0.00 0.00 175.22 172.22 1w36 s ARG 1071N -4.01 1.44 -0.56 1.99 1.70 -0.06 0.19 118.95 119.63 1w36 s ARG 1071Ca 0.27 -1.10 0.07 0.00 -0.47 0.00 0.00 55.73 54.49 1w36 s ARG 1071Cb 0.07 -1.67 0.28 0.00 -0.57 0.00 0.00 34.95 33.06 1w36 s ARG 1071CO 0.04 0.41 0.75 1.58 -1.08 0.00 0.00 175.30 177.01 1w36 n HIS 1072N 1.51 2.76 -2.96 5.89 -0.00 0.26 -4.92 115.22 117.75 1w36 n HIS 1072Ca -0.18 -3.99 -0.00 0.00 0.46 0.00 0.00 57.72 54.01 1w36 n HIS 1072Cb 0.53 -0.50 -0.00 0.00 -0.12 0.00 0.00 29.99 29.90 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 0.68 -1.89 -1.38 1.57 -0.58 -1.26 -4.57 120.64 113.21 1w36 n GLU 1073Ca 0.28 1.78 0.00 0.00 -0.42 0.00 0.00 57.16 58.81 1w36 n GLU 1073Cb 0.45 -3.14 0.00 0.00 -0.57 0.00 0.00 31.44 28.17 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 1.04 -4.64 0.00 0.62 0.00 -1.26 -5.05 105.19 95.89 1w36 n GLY 1074Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 0.91 0.00 -3.98 1.61 5.12 -1.16 -5.02 116.66 114.14 1w36 n ARG 1075Ca 0.00 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.58 1w36 n ARG 1075Cb 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.24 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 3.45 0.27 -1.55 4.12 0.29 -0.58 117.35 123.36 1w36 s TYR 1076Ca 0.00 0.32 0.08 0.00 0.02 0.00 0.00 57.07 57.49 1w36 s TYR 1076Cb 0.00 -1.81 -0.06 0.00 -1.52 0.00 0.00 41.96 38.58 1w36 s TYR 1076CO 0.00 0.62 -0.09 0.71 0.02 0.00 0.00 175.55 176.81 1w36 s TYR 1077N -1.23 2.00 -0.23 2.71 1.51 0.13 -3.69 117.35 118.54 1w36 s TYR 1077Ca 0.24 -0.61 0.02 0.00 -1.01 0.00 0.00 57.07 55.71 1w36 s TYR 1077Cb -0.12 -1.08 0.04 0.00 -0.11 0.00 0.00 41.96 40.69 1w36 s TYR 1077CO 0.15 0.38 -0.14 -0.51 -1.11 0.00 0.00 175.55 174.31 1w36 s LEU 1078N -3.45 2.96 0.01 -1.29 1.02 -1.26 -3.25 118.68 113.42 1w36 s LEU 1078Ca 0.29 -1.12 0.03 0.00 0.02 0.00 0.00 54.13 53.35 1w36 s LEU 1078Cb 0.02 -1.52 -0.03 0.00 0.02 0.00 0.00 46.19 44.67 1w36 s LEU 1078CO 0.12 -0.12 -0.05 -0.22 0.02 0.00 0.00 176.35 176.10 1w36 s LEU 1079N 1.17 3.28 -0.19 1.79 2.96 0.18 0.32 118.68 128.19 1w36 s LEU 1079Ca -0.04 -0.12 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 1w36 s LEU 1079Cb -0.17 -1.89 0.07 0.00 0.50 0.00 0.00 46.19 44.69 1w36 s LEU 1079CO -0.08 0.27 0.09 -0.62 -1.32 0.00 0.00 176.35 174.69 1w36 s ASP 1080N -1.52 2.59 0.05 3.68 -1.08 -0.93 -2.71 116.67 116.76 1w36 s ASP 1080Ca 0.18 -0.74 -0.30 0.00 -0.52 0.00 0.00 52.55 51.17 1w36 s ASP 1080Cb -0.11 -0.31 -0.05 0.00 -1.46 0.00 0.00 42.92 40.99 1w36 s ASP 1080CO 0.09 -0.36 1.03 -0.31 0.52 0.00 0.00 175.17 176.14 1w36 s TYR 1081N 2.09 3.64 -0.35 -5.34 1.51 -1.26 -2.25 117.35 115.40 1w36 s TYR 1081Ca 0.03 1.63 0.01 0.00 -1.01 0.00 0.00 57.07 57.73 1w36 s TYR 1081Cb -0.16 -3.18 0.11 0.00 -0.11 0.00 0.00 41.96 38.61 1w36 s TYR 1081CO -0.13 -0.28 0.12 0.15 -1.11 0.00 0.00 175.55 174.30 1w36 s LYS 1082N 0.68 1.00 0.35 -0.62 1.02 -0.07 -4.97 119.74 117.14 1w36 s LYS 1082Ca 0.52 -1.45 -0.26 0.00 0.02 0.00 0.00 55.97 54.80 1w36 s LYS 1082Cb -0.24 -2.33 -0.09 0.00 -0.52 0.00 0.00 37.83 34.65 1w36 s LYS 1082CO 0.29 -1.01 1.08 -1.54 -0.92 0.00 0.00 175.35 173.25 1w36 s SER 1083N 1.19 6.93 -0.27 2.83 1.04 -1.26 -2.45 113.70 121.71 1w36 s SER 1083Ca 0.12 2.16 -0.26 0.00 0.48 0.00 0.00 55.95 58.45 1w36 s SER 1083Cb -0.19 -2.60 0.12 0.00 0.10 0.00 0.00 66.02 63.45 1w36 s SER 1083CO -0.16 -0.38 1.03 0.20 0.98 0.00 0.00 173.24 174.91 1w36 s ASN 1084N -1.25 -0.44 0.00 7.02 -0.87 -1.26 -4.76 114.94 113.37 1w36 s ASN 1084Ca 0.53 0.81 0.00 0.00 -1.57 0.00 0.00 52.86 52.63 1w36 s ASN 1084Cb -0.27 0.81 0.00 0.00 -0.02 0.00 0.00 41.25 41.77 1w36 s ASN 1084CO 0.34 -0.18 0.00 -2.67 -2.57 0.00 0.00 177.10 172.02 1w36 n TRP 1085N 2.03 0.00 -3.57 2.20 2.14 -1.26 -4.80 117.44 114.19 1w36 n TRP 1085Ca -0.12 0.00 -0.38 0.00 2.07 0.00 0.00 57.50 59.07 1w36 n TRP 1085Cb 0.56 0.00 -0.05 0.00 -0.81 0.00 0.00 31.31 31.01 1w36 n TRP 1085CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1w36 n LEU 1086N -1.55 4.52 -4.15 5.67 4.77 -1.26 -4.94 117.00 120.06 1w36 n LEU 1086Ca 0.00 -5.12 -0.44 0.00 -0.03 0.00 0.00 56.01 50.43 1w36 n LEU 1086Cb 0.00 -1.18 0.01 0.00 -2.33 0.00 0.00 43.42 39.91 1w36 n LEU 1086CO 0.00 1.52 1.04 0.61 -1.33 0.00 0.00 177.39 179.23 1w36 n GLY 1087N 2.36 4.70 6.21 -0.72 0.00 -1.26 -4.98 105.19 111.49 1w36 n GLY 1087Ca 0.22 -2.59 0.00 0.00 0.00 0.00 0.00 46.02 43.66 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 2.15 0.00 -4.08 1.61 -0.58 -1.26 -4.55 120.64 113.93 1w36 n GLU 1088Ca 0.26 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.89 1w36 n GLU 1088Cb 0.36 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 -3.89 0.25 0.00 1.62 1.01 -1.26 -4.82 116.67 109.59 1w36 s ASP 1089Ca 0.00 -1.21 0.00 0.00 0.71 0.00 0.00 52.55 52.05 1w36 s ASP 1089Cb 0.00 0.55 0.00 0.00 1.01 0.00 0.00 42.92 44.48 1w36 s ASP 1089CO 0.00 -1.09 0.00 -1.54 0.21 0.00 0.00 175.17 172.75 1w36 n SER 1090N -0.62 0.00 0.27 0.27 3.41 -1.26 -1.02 113.62 114.66 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 0.00 0.00 -0.26 0.00 0.00 64.21 64.58 1w36 n SER 1090CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1w36 n SER 1091N 0.00 0.00 -0.83 4.04 3.41 -1.26 0.31 113.62 119.29 1w36 n SER 1091Ca 0.00 0.41 0.11 0.00 -0.26 0.00 0.00 58.87 59.12 1w36 n SER 1091Cb 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.03 1w36 n SER 1091CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w36 n ALA 1092N -1.38 2.54 -1.96 7.33 0.00 -0.19 -4.55 120.51 122.29 1w36 n ALA 1092Ca 0.00 -0.67 -0.20 0.00 0.00 0.00 0.00 53.44 52.57 1w36 n ALA 1092Cb 0.88 -0.73 0.05 0.00 0.00 0.00 0.00 19.45 19.65 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 1.12 2.37 -4.01 0.00 4.02 0.15 -4.38 117.16 116.44 1w36 n TYR 1093Ca 0.12 -2.12 -0.32 0.00 -0.01 0.00 0.00 57.90 55.57 1w36 n TYR 1093Cb 0.53 -0.33 -0.06 0.00 -0.02 0.00 0.00 39.34 39.46 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 -4.41 4.95 0.28 -0.72 -4.23 -1.26 -0.87 115.64 109.37 1w36 s THR 1094Ca 0.49 -0.45 0.11 0.00 -1.18 0.00 0.00 61.69 60.66 1w36 s THR 1094Cb 0.40 -3.34 0.16 0.00 1.34 0.00 0.00 72.50 71.06 1w36 s THR 1094CO 0.02 0.24 0.57 0.00 -0.54 0.00 0.00 174.62 174.92 1w36 n GLN 1095N 0.76 0.01 -0.02 3.99 1.13 -1.26 -1.15 117.38 120.84 1w36 n GLN 1095Ca -0.10 0.46 -0.01 0.00 -1.94 0.00 0.00 57.00 55.41 1w36 n GLN 1095Cb 0.52 -1.15 -0.00 0.00 0.11 0.00 0.00 30.24 29.72 1w36 n GLN 1095CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1w36 n GLN 1096N -2.09 0.10 -0.28 -1.09 6.02 -1.26 -3.19 117.38 115.59 1w36 n GLN 1096Ca 0.10 0.27 0.13 0.00 -0.01 0.00 0.00 57.00 57.48 1w36 n GLN 1096Cb 0.67 -0.91 0.25 0.00 1.02 0.00 0.00 30.24 31.26 1w36 n GLN 1096CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1w36 n ALA 1097N -2.60 0.43 0.40 -1.58 0.00 -0.30 0.26 120.51 117.11 1w36 n ALA 1097Ca -0.02 0.86 -0.16 0.00 0.00 0.00 0.00 53.44 54.13 1w36 n ALA 1097Cb 0.06 -0.64 -0.08 0.00 0.00 0.00 0.00 19.45 18.80 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 -0.99 -1.12 0.00 2.86 -1.55 0.27 114.93 114.39 1w36 h MET 1098Ca 0.50 0.07 0.33 0.00 -2.06 0.00 0.00 59.70 58.53 1w36 h MET 1098Cb 1.04 0.23 -0.04 0.00 0.06 0.00 0.00 31.60 32.88 1w36 h MET 1098CO -0.75 -0.66 0.88 0.00 1.06 0.00 0.00 176.91 177.44 1w36 h ALA 1099N -1.38 3.02 0.10 6.32 0.00 0.12 0.42 119.26 127.86 1w36 h ALA 1099Ca -0.11 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1w36 h ALA 1099Cb 0.79 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1w36 h ALA 1099CO 0.17 -1.46 -0.05 0.00 0.00 0.00 0.00 179.25 177.92 1w36 h ALA 1100N 1.30 -0.64 -1.06 0.00 0.00 0.46 -3.10 119.26 116.22 1w36 h ALA 1100Ca 0.53 -0.03 0.31 0.00 0.00 0.00 0.00 54.91 55.72 1w36 h ALA 1100Cb 2.28 0.05 -0.13 0.00 0.00 0.00 0.00 17.79 19.99 1w36 h ALA 1100CO -0.01 -0.63 0.64 0.00 0.00 0.00 0.00 179.25 179.26 1w36 h ALA 1101N -1.88 2.10 -0.87 0.00 0.00 0.13 0.43 119.26 119.18 1w36 h ALA 1101Ca -0.01 0.13 0.21 0.00 0.00 0.00 0.00 54.91 55.24 1w36 h ALA 1101Cb 0.10 0.10 -0.13 0.00 0.00 0.00 0.00 17.79 17.87 1w36 h ALA 1101CO 0.02 -0.64 0.33 0.52 0.00 0.00 0.00 179.25 179.48 1w36 h MET 1102N 0.36 0.33 0.01 0.00 2.86 -0.23 -0.46 114.93 117.81 1w36 h MET 1102Ca 0.70 -0.02 -0.23 0.00 -2.06 0.00 0.00 59.70 58.09 1w36 h MET 1102Cb 1.68 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 33.23 1w36 h MET 1102CO -0.48 0.22 -1.15 1.96 1.06 0.00 0.00 176.91 178.52 1w36 h GLN 1103N 0.34 0.02 -0.52 1.72 4.20 -0.07 0.55 115.11 121.36 1w36 h GLN 1103Ca 0.53 -0.04 0.04 0.00 0.06 0.00 0.00 58.65 59.25 1w36 h GLN 1103Cb 1.01 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.76 1w36 h GLN 1103CO -0.55 0.93 0.27 0.00 -0.67 0.00 0.00 178.83 178.81 1w36 h ALA 1104N 0.96 0.66 -0.68 3.87 0.00 -0.65 -1.56 119.26 121.87 1w36 h ALA 1104Ca -0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1w36 h ALA 1104Cb 1.83 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.54 1w36 h ALA 1104CO 0.13 -0.08 0.00 0.72 0.00 0.00 0.00 179.25 180.02 1w36 n HIS 1105N -4.87 1.37 -4.29 0.00 8.25 -0.71 -4.95 115.22 110.02 1w36 n HIS 1105Ca 0.05 -0.57 -0.39 0.00 -0.26 0.00 0.00 57.72 56.55 1w36 n HIS 1105Cb 0.13 -0.18 -0.07 0.00 1.12 0.00 0.00 29.99 30.99 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 1.30 -0.85 0.28 -0.41 5.12 -0.59 -4.75 116.66 116.76 1w36 n ARG 1106Ca 0.26 0.13 0.12 0.00 -1.93 0.00 0.00 57.85 56.42 1w36 n ARG 1106Cb 0.83 -4.49 0.79 0.00 -1.16 0.00 0.00 32.46 28.43 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 -0.78 0.00 -1.10 -1.55 0.99 -1.19 -1.54 116.97 111.80 1w36 h TYR 1107Ca -0.54 0.00 0.30 0.00 2.00 0.00 0.00 58.73 60.49 1w36 h TYR 1107Cb 1.30 0.00 -0.08 0.00 1.00 0.00 0.00 36.73 38.95 1w36 h TYR 1107CO 0.69 0.01 0.73 0.38 -0.00 0.00 0.00 178.16 179.97 1w36 h ASP 1108N 0.00 0.31 -0.68 3.88 2.03 -1.86 1.03 116.42 121.14 1w36 h ASP 1108Ca -0.00 0.07 -0.00 0.00 -0.73 0.00 0.00 57.03 56.37 1w36 h ASP 1108Cb 0.03 0.02 -0.03 0.00 -0.83 0.00 0.00 39.33 38.52 1w36 h ASP 1108CO 0.00 0.04 0.42 0.25 -1.03 0.00 0.00 179.24 178.92 1w36 h LEU 1109N 0.26 0.80 -0.49 0.15 6.46 -1.63 -2.97 115.31 117.89 1w36 h LEU 1109Ca 0.60 -0.05 0.07 0.00 -0.12 0.00 0.00 57.88 58.39 1w36 h LEU 1109Cb 1.78 -0.20 -0.06 0.00 -0.73 0.00 0.00 40.66 41.45 1w36 h LEU 1109CO -0.23 0.61 0.15 -0.61 -0.62 0.00 0.00 178.44 177.74 1w36 h GLN 1110N 0.92 0.30 0.00 1.25 4.15 0.97 -1.24 115.11 121.46 1w36 h GLN 1110Ca 0.24 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.65 1w36 h GLN 1110Cb -0.05 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.57 1w36 h GLN 1110CO -0.05 0.20 0.00 0.66 -1.93 0.00 0.00 178.83 177.71 1w36 n TYR 1111N -5.04 0.00 -0.26 3.99 4.02 -1.09 0.41 117.16 119.19 1w36 n TYR 1111Ca 0.05 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.93 1w36 n TYR 1111Cb 0.21 -0.43 0.05 0.00 -0.02 0.00 0.00 39.34 39.15 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 0.37 -0.72 4.20 -1.54 0.69 115.11 118.05 1w36 h GLN 1112Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1w36 h GLN 1112Cb 0.00 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1w36 h GLN 1112CO 0.00 -0.04 -0.20 -0.07 -0.67 0.00 0.00 178.83 177.85 1w36 h LEU 1113N -0.07 -0.48 -0.66 1.46 3.38 -1.01 -0.63 115.31 117.30 1w36 h LEU 1113Ca 0.31 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.40 1w36 h LEU 1113Cb 0.57 0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.38 1w36 h LEU 1113CO -0.78 -0.33 0.29 1.88 0.09 0.00 0.00 178.44 179.60 1w36 h TYR 1114N -0.53 0.52 0.00 1.13 0.99 0.18 -1.05 116.97 118.20 1w36 h TYR 1114Ca -0.05 0.03 -0.11 0.00 2.00 0.00 0.00 58.73 60.60 1w36 h TYR 1114Cb 0.42 -0.13 -0.02 0.00 1.00 0.00 0.00 36.73 38.00 1w36 h TYR 1114CO -0.07 0.16 -0.53 1.79 -0.00 0.00 0.00 178.16 179.51 1w36 h THR 1115N 0.50 1.18 -0.04 -2.88 1.35 0.44 0.63 112.91 114.09 1w36 h THR 1115Ca 0.33 -1.97 -0.04 0.00 -0.55 0.00 0.00 66.41 64.18 1w36 h THR 1115Cb 0.38 2.12 -0.01 0.00 -1.73 0.00 0.00 68.15 68.92 1w36 h THR 1115CO -0.29 0.52 -0.18 0.25 -0.25 0.00 0.00 175.52 175.57 1w36 h LEU 1116N 0.00 0.06 0.28 3.87 6.46 -0.03 0.51 115.31 126.47 1w36 h LEU 1116Ca -0.01 -0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.73 1w36 h LEU 1116Cb 1.08 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.99 1w36 h LEU 1116CO 0.07 0.25 -0.13 0.00 -0.62 0.00 0.00 178.44 178.01 1w36 h ALA 1117N 1.75 -0.38 -0.92 1.25 0.00 0.01 -1.80 119.26 119.18 1w36 h ALA 1117Ca 0.01 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1w36 h ALA 1117Cb 0.36 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 1w36 h ALA 1117CO 0.03 -0.45 0.60 1.25 0.00 0.00 0.00 179.25 180.67 1w36 h LEU 1118N -0.90 0.92 0.00 0.00 6.46 -0.49 0.35 115.31 121.65 1w36 h LEU 1118Ca -0.04 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 1w36 h LEU 1118Cb 0.51 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1w36 h LEU 1118CO 0.06 0.59 0.00 1.57 -0.62 0.00 0.00 178.44 180.04 1w36 n HIS 1119N -4.49 0.00 -0.29 1.25 -0.00 0.18 -0.19 115.22 111.67 1w36 n HIS 1119Ca 0.14 0.00 -0.01 0.00 0.46 0.00 0.00 57.72 58.31 1w36 n HIS 1119Cb 0.20 -0.31 0.05 0.00 -0.12 0.00 0.00 29.99 29.81 1w36 n HIS 1119CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1w36 h ARG 1120N 0.00 -0.05 -0.16 1.57 2.47 -0.79 0.68 114.38 118.10 1w36 h ARG 1120Ca 0.00 0.00 0.04 0.00 -1.26 0.00 0.00 59.98 58.77 1w36 h ARG 1120Cb 0.00 0.01 -0.05 0.00 -1.65 0.00 0.00 29.97 28.29 1w36 h ARG 1120CO 0.00 -0.04 -0.13 -0.92 0.56 0.00 0.00 179.97 179.44 1w36 h TYR 1121N -0.06 -0.33 0.01 3.04 3.20 -0.18 0.14 116.97 122.80 1w36 h TYR 1121Ca 0.33 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.23 1w36 h TYR 1121Cb 0.59 0.17 -0.02 0.00 1.54 0.00 0.00 36.73 39.01 1w36 h TYR 1121CO -0.71 -0.20 -0.08 -0.07 -1.64 0.00 0.00 178.16 175.47 1w36 h LEU 1122N -0.15 -0.22 -1.12 2.82 3.38 0.84 0.95 115.31 121.81 1w36 h LEU 1122Ca 0.10 0.03 0.18 0.00 0.09 0.00 0.00 57.88 58.29 1w36 h LEU 1122Cb 0.29 0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.04 1w36 h LEU 1122CO -0.25 -0.12 0.61 -0.09 0.09 0.00 0.00 178.44 178.69 1w36 h ARG 1123N -0.14 0.70 -0.04 1.13 2.43 -0.43 0.50 114.38 118.53 1w36 h ARG 1123Ca 0.03 -0.04 -0.19 0.00 -0.81 0.00 0.00 59.98 58.97 1w36 h ARG 1123Cb 0.17 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1w36 h ARG 1123CO -0.07 0.46 -0.78 1.25 -1.51 0.00 0.00 179.97 179.32 1w36 h HIS 1124N 0.72 0.44 0.00 2.20 2.76 0.16 -3.38 115.15 118.05 1w36 h HIS 1124Ca 0.55 -0.21 -0.07 0.00 -2.20 0.00 0.00 60.37 58.44 1w36 h HIS 1124Cb 0.91 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.80 1w36 h HIS 1124CO -0.00 0.98 -0.48 0.00 -1.30 0.00 0.00 177.93 177.13 1w36 h ARG 1125N 0.20 0.00 -6.22 5.26 2.47 0.16 -3.43 114.38 112.83 1w36 h ARG 1125Ca -0.04 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.16 1w36 h ARG 1125Cb 1.37 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 29.63 1w36 h ARG 1125CO 0.13 0.61 1.19 0.42 0.56 0.00 0.00 179.97 182.87 1w36 s ILE 1126N -2.13 3.59 -0.03 2.04 1.09 0.15 -4.95 121.20 120.96 1w36 s ILE 1126Ca -0.17 0.39 -0.30 0.00 -1.10 0.00 0.00 60.65 59.47 1w36 s ILE 1126Cb 0.01 -4.40 -0.07 0.00 -1.06 0.00 0.00 42.46 36.95 1w36 s ILE 1126CO 0.43 -1.30 1.83 0.00 -0.10 0.00 0.00 174.94 175.80 1w36 s ALA 1127N 7.14 3.53 -0.44 9.38 0.00 -1.26 -2.85 121.76 137.25 1w36 s ALA 1127Ca 0.52 1.07 -0.05 0.00 0.00 0.00 0.00 51.96 53.51 1w36 s ALA 1127Cb -0.11 -3.82 0.01 0.00 0.00 0.00 0.00 23.12 19.20 1w36 s ALA 1127CO 0.20 -1.59 0.47 -3.47 0.00 0.00 0.00 175.76 171.37 1w36 n ASP 1128N 7.67 -6.20 -4.51 0.00 2.03 -1.26 -5.07 116.55 109.20 1w36 n ASP 1128Ca 0.19 0.13 -0.28 0.00 0.52 0.00 0.00 54.79 55.35 1w36 n ASP 1128Cb 0.42 -4.12 -0.11 0.00 -0.72 0.00 0.00 41.12 36.60 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 -2.65 2.56 -0.06 -0.67 6.14 -1.13 -5.14 117.35 116.39 1w36 s TYR 1129Ca 0.07 -0.25 0.02 0.00 0.64 0.00 0.00 57.07 57.55 1w36 s TYR 1129Cb -0.02 -1.31 0.01 0.00 0.42 0.00 0.00 41.96 41.06 1w36 s TYR 1129CO 0.54 0.44 -0.10 0.34 0.64 0.00 0.00 175.55 177.41 1w36 s ASP 1130N -2.42 1.56 0.33 4.32 -1.08 -1.26 -4.98 116.67 113.13 1w36 s ASP 1130Ca 0.21 -0.25 0.11 0.00 -0.52 0.00 0.00 52.55 52.10 1w36 s ASP 1130Cb -0.10 -0.69 0.99 0.00 -1.46 0.00 0.00 42.92 41.66 1w36 s ASP 1130CO 0.12 0.02 1.67 0.22 0.52 0.00 0.00 175.17 177.72 1w36 h TYR 1131N 6.93 0.82 -0.57 -5.34 3.20 -1.98 -1.69 116.97 118.34 1w36 h TYR 1131Ca -0.33 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.55 1w36 h TYR 1131Cb 1.18 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.23 1w36 h TYR 1131CO 0.48 -0.16 0.04 0.39 -1.64 0.00 0.00 178.16 177.27 1w36 n GLU 1132N -5.07 4.55 0.00 1.82 1.02 -1.26 -2.05 120.64 119.65 1w36 n GLU 1132Ca 0.29 -2.97 0.00 0.00 -0.02 0.00 0.00 57.16 54.46 1w36 n GLU 1132Cb 0.89 -2.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 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 -0.66 -4.81 115.22 118.18 1w36 n HIS 1133Ca 0.28 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 1w36 n HIS 1133Cb 1.18 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.29 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 -0.61 0.00 0.00 4.41 8.25 -1.07 -4.42 115.22 121.78 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 0.01 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.12 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 -0.87 0.00 -3.12 4.41 -0.00 -0.87 0.11 117.46 117.11 1w36 n PHE 1135Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.45 57.40 1w36 n PHE 1135Cb 0.10 0.00 0.03 0.00 -0.00 0.00 0.00 39.48 39.61 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 5.00 -1.21 0.00 7.13 0.00 -1.26 -2.86 105.19 111.99 1w36 n GLY 1136Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.53 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 -1.57 5.38 2.15 -0.02 0.00 -1.24 -4.73 105.19 105.15 1w36 n GLY 1137Ca -0.03 -1.36 -0.01 0.00 0.00 0.00 0.00 46.02 44.63 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 -7.97 -4.82 1.61 0.31 -1.15 -4.37 118.33 101.95 1w36 n VAL 1138Ca 0.00 1.24 -0.28 0.00 -0.01 0.00 0.00 64.34 65.29 1w36 n VAL 1138Cb 0.00 -5.48 -0.15 0.00 -0.91 0.00 0.00 33.84 27.31 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 -0.70 1.83 -0.35 2.52 -1.09 0.15 -2.35 121.20 121.21 1w36 s ILE 1139Ca -0.06 -1.21 -0.00 0.00 -2.23 0.00 0.00 60.65 57.15 1w36 s ILE 1139Cb 0.00 -1.57 0.12 0.00 -1.58 0.00 0.00 42.46 39.43 1w36 s ILE 1139CO 0.44 0.31 0.16 -0.31 -1.23 0.00 0.00 174.94 174.32 1w36 s TYR 1140N -0.74 1.42 -0.61 3.97 4.12 0.11 -2.18 117.35 123.43 1w36 s TYR 1140Ca 0.09 -1.81 -0.25 0.00 0.02 0.00 0.00 57.07 55.13 1w36 s TYR 1140Cb -0.09 -1.51 0.04 0.00 -1.52 0.00 0.00 41.96 38.89 1w36 s TYR 1140CO 0.01 -0.84 1.04 -0.51 0.02 0.00 0.00 175.55 175.27 1w36 s LEU 1141N 1.21 3.92 -0.77 -1.29 1.43 -0.95 -2.50 118.68 119.73 1w36 s LEU 1141Ca 0.14 -0.45 -0.26 0.00 -1.03 0.00 0.00 54.13 52.53 1w36 s LEU 1141Cb -0.20 -2.74 0.03 0.00 0.03 0.00 0.00 46.19 43.31 1w36 s LEU 1141CO -0.14 -1.41 1.29 -0.36 0.23 0.00 0.00 176.35 175.96 1w36 s PHE 1142N 4.40 2.32 0.33 0.29 0.40 -0.27 -0.89 117.98 124.57 1w36 s PHE 1142Ca 0.31 -0.16 0.17 0.00 -0.60 0.00 0.00 56.93 56.65 1w36 s PHE 1142Cb -0.12 -4.62 1.18 0.00 0.51 0.00 0.00 43.02 39.97 1w36 s PHE 1142CO 0.17 -2.05 1.45 1.28 0.70 0.00 0.00 175.22 176.78 1w36 n LEU 1143N 9.25 0.27 -4.90 -0.37 4.77 -1.03 -4.33 117.00 120.67 1w36 n LEU 1143Ca 0.06 1.53 -0.29 0.00 -0.03 0.00 0.00 56.01 57.28 1w36 n LEU 1143Cb 0.49 -0.72 0.09 0.00 -2.33 0.00 0.00 43.42 40.95 1w36 n LEU 1143CO 0.70 -1.69 0.77 -0.13 -1.33 0.00 0.00 177.39 175.71 1w36 s ARG 1144N -5.45 1.95 -1.13 3.23 0.52 -1.26 -3.97 118.95 112.84 1w36 s ARG 1144Ca -0.09 0.05 0.00 0.00 -0.52 0.00 0.00 55.73 55.18 1w36 s ARG 1144Cb 0.31 -1.97 0.00 0.00 0.52 0.00 0.00 34.95 33.80 1w36 s ARG 1144CO 0.72 -1.58 0.00 0.41 0.02 0.00 0.00 175.30 174.87 1w36 n GLY 1145N -3.29 0.10 2.98 -3.53 0.00 -1.26 -4.74 105.19 95.46 1w36 n GLY 1145Ca 0.08 -0.37 -0.31 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 -2.61 1.82 0.20 1.61 1.01 -1.25 -2.62 120.40 118.57 1w36 s VAL 1146Ca 0.00 -1.61 0.08 0.00 0.00 0.00 0.00 61.98 60.45 1w36 s VAL 1146Cb 0.00 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1w36 s VAL 1146CO 0.00 -0.24 0.03 -1.81 0.00 0.00 0.00 175.10 173.08 1w36 s ASP 1147N 1.22 4.87 0.48 3.32 1.01 -1.26 -4.74 116.67 121.56 1w36 s ASP 1147Ca -0.02 -0.41 0.14 0.00 0.71 0.00 0.00 52.55 52.97 1w36 s ASP 1147Cb -0.19 -1.06 1.12 0.00 1.01 0.00 0.00 42.92 43.80 1w36 s ASP 1147CO -0.08 0.05 2.09 0.11 0.21 0.00 0.00 175.17 177.55 1w36 h LYS 1148N 2.35 0.10 -2.03 8.23 6.56 -1.94 -3.34 116.57 126.50 1w36 h LYS 1148Ca -0.47 -0.01 -0.55 0.00 -1.06 0.00 0.00 60.65 58.56 1w36 h LYS 1148Cb 1.22 -0.02 -0.40 0.00 -0.57 0.00 0.00 32.23 32.46 1w36 h LYS 1148CO 0.59 0.12 -1.05 0.39 -2.06 0.00 0.00 179.45 177.44 1w36 n GLU 1149N -4.47 1.07 -2.70 3.15 -0.58 -1.26 -4.85 120.64 111.00 1w36 n GLU 1149Ca -0.02 -3.48 -0.06 0.00 -0.42 0.00 0.00 57.16 53.18 1w36 n GLU 1149Cb 0.13 -1.47 0.09 0.00 -0.57 0.00 0.00 31.44 29.62 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 1.07 -1.86 -0.68 -0.32 8.25 -1.25 -5.16 115.22 115.26 1w36 n HIS 1150Ca 0.23 -1.56 -0.32 0.00 -0.26 0.00 0.00 57.72 55.81 1w36 n HIS 1150Cb 0.54 1.46 0.17 0.00 1.12 0.00 0.00 29.99 33.27 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 0.16 -1.49 -1.03 -0.41 -0.04 -1.26 -2.74 135.00 128.20 1w36 n PRO 1151Ca -0.02 -0.41 -0.01 0.00 -0.04 0.00 0.00 63.50 63.02 1w36 n PRO 1151Cb 0.73 -1.74 -0.00 0.00 -0.04 0.00 0.00 33.50 32.45 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 -2.18 -1.69 -4.06 0.54 6.02 -1.26 -4.93 117.38 109.82 1w36 n GLN 1152Ca 0.01 0.47 -0.33 0.00 -0.01 0.00 0.00 57.00 57.14 1w36 n GLN 1152Cb 0.61 -4.76 -0.15 0.00 1.02 0.00 0.00 30.24 26.96 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 -1.82 2.70 0.00 -1.09 0.74 -1.11 -4.08 119.66 115.01 1w36 s GLN 1153Ca 0.00 -1.04 0.00 0.00 0.05 0.00 0.00 55.36 54.37 1w36 s GLN 1153Cb 0.00 -2.79 0.00 0.00 1.10 0.00 0.00 33.01 31.32 1w36 s GLN 1153CO 0.00 -0.38 0.00 0.41 -0.55 0.00 0.00 175.29 174.77 1w36 n GLY 1154N 4.57 2.48 3.84 2.59 0.00 -0.05 -4.32 105.19 114.29 1w36 n GLY 1154Ca -0.17 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.15 4.96 -0.01 -0.61 -4.36 -1.26 -1.11 121.20 116.66 1w36 s ILE 1155Ca 0.00 -0.52 0.00 0.00 -0.26 0.00 0.00 60.65 59.87 1w36 s ILE 1155Cb 0.00 -3.38 0.01 0.00 1.25 0.00 0.00 42.46 40.34 1w36 s ILE 1155CO 0.00 0.18 -0.01 -0.47 0.24 0.00 0.00 174.94 174.88 1w36 s TYR 1156N -1.40 0.17 0.04 1.37 5.04 -1.04 -4.84 117.35 116.69 1w36 s TYR 1156Ca 0.30 -0.01 0.03 0.00 -2.44 0.00 0.00 57.07 54.95 1w36 s TYR 1156Cb -0.12 -0.16 -0.02 0.00 0.35 0.00 0.00 41.96 42.00 1w36 s TYR 1156CO 0.23 -0.03 -0.10 0.99 -1.34 0.00 0.00 175.55 175.30 1w36 s THR 1157N 0.22 0.73 0.12 4.34 2.01 -1.26 0.05 115.64 121.84 1w36 s THR 1157Ca -0.02 -0.92 -0.11 0.00 0.31 0.00 0.00 61.69 60.95 1w36 s THR 1157Cb -0.04 -0.71 0.01 0.00 0.01 0.00 0.00 72.50 71.77 1w36 s THR 1157CO -0.01 -0.17 0.28 -0.89 -0.69 0.00 0.00 174.62 173.14 1w36 s THR 1158N -0.99 0.10 -0.42 -0.82 2.01 -0.99 -5.04 115.64 109.49 1w36 s THR 1158Ca -0.04 -1.06 0.08 0.00 0.31 0.00 0.00 61.69 60.98 1w36 s THR 1158Cb -0.08 -1.41 0.25 0.00 0.01 0.00 0.00 72.50 71.27 1w36 s THR 1158CO 0.01 -0.47 0.62 -1.14 -0.69 0.00 0.00 174.62 172.94 1w36 n ARG 1159N -0.15 0.73 0.00 4.92 3.00 -1.26 -4.18 116.66 119.73 1w36 n ARG 1159Ca -0.13 -2.84 0.00 0.00 -0.00 0.00 0.00 57.85 54.88 1w36 n ARG 1159Cb 0.63 -1.28 0.00 0.00 0.00 0.00 0.00 32.46 31.81 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 1.46 0.00 0.08 -0.14 -0.02 -1.26 -4.65 135.00 130.48 1w36 n PRO 1160Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 1w36 n PRO 1160Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.04 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 -4.71 115.26 115.97 1w36 n ASN 1161Ca 0.00 0.12 0.00 0.00 1.68 0.00 0.00 54.58 56.38 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 -0.82 0.00 0.09 5.41 0.00 -1.26 -4.12 120.51 119.80 1w36 n ALA 1162Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 1w36 n ALA 1162Cb 0.43 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.72 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 -0.95 -0.98 0.06 0.00 0.00 -1.26 -3.65 105.19 98.41 1w36 n GLY 1163Ca 0.00 -0.52 -0.06 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.72 0.99 6.46 -1.90 -3.10 115.31 117.05 1w36 h LEU 1164Ca 0.00 -0.40 0.16 0.00 -0.12 0.00 0.00 57.88 57.52 1w36 h LEU 1164Cb 0.93 0.00 -0.12 0.00 -0.73 0.00 0.00 40.66 40.74 1w36 h LEU 1164CO 0.00 0.71 0.08 0.40 -0.62 0.00 0.00 178.44 179.01 1w36 h ILE 1165N -1.00 0.44 0.00 4.05 1.08 -1.90 0.44 117.51 120.63 1w36 h ILE 1165Ca -0.00 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 64.41 1w36 h ILE 1165Cb 0.41 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 34.41 1w36 h ILE 1165CO -0.00 0.03 0.00 0.00 -0.69 0.00 0.00 178.15 177.49 1w36 n ALA 1166N -2.79 -0.13 -0.22 1.87 0.00 -1.24 0.12 120.51 118.11 1w36 n ALA 1166Ca 0.13 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.59 1w36 n ALA 1166Cb 0.45 0.29 0.14 0.00 0.00 0.00 0.00 19.45 20.33 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 0.12 -0.10 0.00 3.38 -1.28 -2.10 115.31 115.34 1w36 h LEU 1167Ca 0.00 0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.11 1w36 h LEU 1167Cb 0.00 0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1w36 h LEU 1167CO 0.00 0.05 -0.11 -0.03 0.09 0.00 0.00 178.44 178.44 1w36 h MET 1168N 0.34 -0.13 -0.47 1.13 4.05 0.34 0.78 114.93 120.97 1w36 h MET 1168Ca 0.35 0.01 0.07 0.00 -0.28 0.00 0.00 59.70 59.85 1w36 h MET 1168Cb 0.53 0.03 -0.06 0.00 -0.80 0.00 0.00 31.60 31.30 1w36 h MET 1168CO -0.40 -0.09 0.13 0.22 0.23 0.00 0.00 176.91 177.01 1w36 h ASP 1169N -0.14 0.09 0.11 1.39 -0.00 0.16 0.31 116.42 118.34 1w36 h ASP 1169Ca 0.07 0.07 0.00 0.00 -0.00 0.00 0.00 57.03 57.17 1w36 h ASP 1169Cb 0.25 0.08 0.00 0.00 -0.00 0.00 0.00 39.33 39.65 1w36 h ASP 1169CO -0.18 0.08 -0.04 -1.84 -0.00 0.00 0.00 179.24 177.26 1w36 n GLU 1170N -5.06 1.14 0.23 0.28 0.28 -0.97 -2.66 120.64 113.87 1w36 n GLU 1170Ca 0.05 -0.43 0.12 0.00 -0.16 0.00 0.00 57.16 56.73 1w36 n GLU 1170Cb 0.21 -1.49 0.33 0.00 1.43 0.00 0.00 31.44 31.92 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 1.05 0.00 0.00 3.44 4.05 0.28 0.22 114.93 123.97 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 0.30 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.10 1w36 h MET 1171CO 0.00 0.10 0.00 0.34 0.23 0.00 0.00 176.91 177.58 1w36 n PHE 1172N -3.16 0.00 0.59 1.39 7.35 -1.09 -4.37 117.46 118.17 1w36 n PHE 1172Ca 0.02 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 56.84 1w36 n PHE 1172Cb 0.48 -0.44 0.45 0.00 0.35 0.00 0.00 39.48 40.33 1w36 n PHE 1172CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1w36 n ALA 1173N -1.81 2.05 -0.66 3.13 0.00 -1.24 -4.03 120.51 117.94 1w36 n ALA 1173Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1w36 n ALA 1173Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.02 1w36 n ALA 1173CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91