#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h1n n ALA 0 N 0.00 0.00 -2.75 5.41 0.00 -1.26 -5.21 120.51 116.70 2h1n n ALA 0 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2h1n n ALA 0 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 2h1n n ALA 0 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2h1n s LYS 2 N 0.35 0.64 0.17 0.00 1.02 -1.26 -5.03 119.74 115.64 2h1n s LYS 2 Ca 0.00 -0.73 -0.14 0.00 0.02 0.00 0.00 55.97 55.12 2h1n s LYS 2 Cb 0.00 0.26 0.07 0.00 -0.52 0.00 0.00 37.83 37.64 2h1n s LYS 2 CO 0.00 -0.17 1.82 0.35 -0.92 0.00 0.00 175.35 176.43 2h1n h PHE 3 N 3.52 0.71 0.00 3.18 3.57 -1.48 -1.45 116.94 125.00 2h1n h PHE 3 Ca -0.32 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.18 2h1n h PHE 3 Cb 1.19 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.69 2h1n h PHE 3 CO 0.52 0.47 0.10 -1.13 -2.23 0.00 0.00 178.31 176.04 2h1n n SER 4 N -4.68 0.31 -0.65 0.41 3.41 -1.26 -0.90 113.62 110.27 2h1n n SER 4 Ca 0.03 0.59 0.11 0.00 -0.26 0.00 0.00 58.87 59.34 2h1n n SER 4 Cb 0.04 -0.60 0.03 0.00 -0.26 0.00 0.00 64.21 63.42 2h1n n SER 4 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2h1n n GLU 5 N -1.91 1.60 -1.91 4.33 1.02 -0.55 -4.95 120.64 118.28 2h1n n GLU 5 Ca -0.01 -1.31 -0.42 0.00 -0.02 0.00 0.00 57.16 55.40 2h1n n GLU 5 Cb 0.12 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 30.05 2h1n n GLU 5 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2h1n s PHE 6 N -2.27 2.60 -0.25 -0.32 2.99 -0.07 -4.92 117.98 115.74 2h1n s PHE 6 Ca 0.21 0.38 -0.29 0.00 0.00 0.00 0.00 56.93 57.23 2h1n s PHE 6 Cb 0.18 -3.98 -0.00 0.00 0.00 0.00 0.00 43.02 39.22 2h1n s PHE 6 CO 0.47 -3.83 1.29 1.03 -0.00 0.00 0.00 175.22 174.18 2h1n s ARG 7 N 2.17 4.03 -0.17 0.44 0.52 -1.26 -5.02 118.95 119.67 2h1n s ARG 7 Ca 0.73 1.41 -0.16 0.00 -0.52 0.00 0.00 55.73 57.20 2h1n s ARG 7 Cb -0.42 -3.84 -0.04 0.00 0.52 0.00 0.00 34.95 31.17 2h1n s ARG 7 CO 0.32 -0.97 0.39 -0.47 0.02 0.00 0.00 175.30 174.59 2h1n s TYR 8 N 4.06 3.43 -0.03 -0.53 5.04 -1.26 -5.08 117.35 122.99 2h1n s TYR 8 Ca 0.56 0.67 0.01 0.00 -2.44 0.00 0.00 57.07 55.87 2h1n s TYR 8 Cb -0.19 -2.48 0.01 0.00 0.35 0.00 0.00 41.96 39.65 2h1n s TYR 8 CO 0.20 0.10 -0.05 -1.21 -1.34 0.00 0.00 175.55 173.25 2h1n s GLU 9 N 0.92 0.66 0.14 4.97 2.02 -1.26 -5.12 118.70 121.03 2h1n s GLU 9 Ca 0.20 -0.14 -0.31 0.00 0.02 0.00 0.00 54.97 54.73 2h1n s GLU 9 Cb -0.14 -0.67 -0.10 0.00 0.10 0.00 0.00 34.13 33.32 2h1n s GLU 9 CO 0.07 0.01 1.64 0.50 0.02 0.00 0.00 175.26 177.50 2h1n s ARG 10 N 0.47 4.19 0.61 1.61 3.52 -1.26 -4.96 118.95 123.14 2h1n s ARG 10 Ca -0.06 2.40 -0.19 0.00 -0.13 0.00 0.00 55.73 57.75 2h1n s ARG 10 Cb -0.10 -3.33 -0.03 0.00 -1.56 0.00 0.00 34.95 29.94 2h1n s ARG 10 CO -0.00 -0.68 1.32 -2.30 -0.81 0.00 0.00 175.30 172.83 2h1n n PRO 11 N 4.64 1.35 -3.08 5.12 -0.02 -1.26 -4.97 135.00 136.78 2h1n n PRO 11 Ca 0.15 0.51 -0.44 0.00 -2.02 0.00 0.00 63.50 61.70 2h1n n PRO 11 Cb 0.39 -2.55 -0.05 0.00 -0.02 0.00 0.00 33.50 31.26 2h1n n PRO 11 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2h1n s ASP 12 N -1.19 6.22 0.15 2.55 -1.08 -1.26 -4.97 116.67 117.08 2h1n s ASP 12 Ca 0.78 -1.01 -0.16 0.00 -0.52 0.00 0.00 52.55 51.64 2h1n s ASP 12 Cb -0.39 -2.32 0.01 0.00 -1.46 0.00 0.00 42.92 38.76 2h1n s ASP 12 CO 0.44 -1.05 1.76 0.40 0.52 0.00 0.00 175.17 177.24 2h1n h ILE 13 N 5.91 1.15 -0.27 4.11 1.08 -1.99 -0.83 117.51 126.67 2h1n h ILE 13 Ca -0.28 -0.36 -0.08 0.00 -0.39 0.00 0.00 64.86 63.75 2h1n h ILE 13 Cb 1.09 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 35.45 2h1n h ILE 13 CO 1.04 0.15 -0.18 0.00 -0.69 0.00 0.00 178.15 178.47 2h1n h ALA 14 N 1.10 1.19 -0.44 1.87 0.00 -1.99 -0.34 119.26 120.65 2h1n h ALA 14 Ca 0.15 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 2h1n h ALA 14 Cb 0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2h1n h ALA 14 CO -0.03 0.52 -0.25 0.37 0.00 0.00 0.00 179.25 179.87 2h1n h GLN 15 N 0.43 0.92 -0.67 0.00 5.75 -1.90 -1.20 115.11 118.44 2h1n h GLN 15 Ca 0.07 -0.40 -0.01 0.00 -0.15 0.00 0.00 58.65 58.16 2h1n h GLN 15 Cb 0.57 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.06 2h1n h GLN 15 CO 0.04 1.06 0.38 1.25 -2.65 0.00 0.00 178.83 178.91 2h1n h LEU 16 N 0.79 0.83 -0.44 -2.39 5.85 -0.58 -1.18 115.31 118.20 2h1n h LEU 16 Ca 0.10 -0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 2h1n h LEU 16 Cb 0.81 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 2h1n h LEU 16 CO 0.07 0.68 0.12 1.56 -0.34 0.00 0.00 178.44 180.53 2h1n h GLN 17 N 0.92 0.69 -0.25 1.25 4.20 -0.95 0.43 115.11 121.41 2h1n h GLN 17 Ca 0.24 -0.16 0.03 0.00 0.06 0.00 0.00 58.65 58.82 2h1n h GLN 17 Cb 0.02 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2h1n h GLN 17 CO -0.04 0.69 0.05 0.00 -0.67 0.00 0.00 178.83 178.86 2h1n h ALA 18 N 0.97 0.26 -0.02 3.87 0.00 -1.00 -0.50 119.26 122.83 2h1n h ALA 18 Ca 0.14 0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 2h1n h ALA 18 Cb 0.30 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2h1n h ALA 18 CO -0.00 -0.36 -0.74 0.77 0.00 0.00 0.00 179.25 178.91 2h1n h SER 19 N 0.15 0.19 -0.16 0.00 0.02 -1.12 -2.43 113.55 110.19 2h1n h SER 19 Ca 0.11 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 2h1n h SER 19 Cb 0.11 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 2h1n h SER 19 CO -0.14 0.86 -0.01 0.15 -1.14 0.00 0.00 176.83 176.55 2h1n h PHE 20 N 0.10 0.32 -0.87 3.45 3.57 -0.72 -2.56 116.94 120.24 2h1n h PHE 20 Ca -0.02 -0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.43 2h1n h PHE 20 Cb 1.31 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.92 2h1n h PHE 20 CO 0.02 0.53 0.58 1.96 -2.23 0.00 0.00 178.31 179.16 2h1n h GLN 21 N 0.03 1.15 -0.82 1.11 1.08 -1.06 -1.24 115.11 115.35 2h1n h GLN 21 Ca 0.05 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 2h1n h GLN 21 Cb 0.40 -0.26 -0.04 0.00 -0.05 0.00 0.00 27.48 27.54 2h1n h GLN 21 CO 0.01 0.76 0.42 1.49 -0.95 0.00 0.00 178.83 180.56 2h1n h GLU 22 N 1.18 1.17 -0.12 1.46 4.81 -1.41 0.60 114.58 122.28 2h1n h GLU 22 Ca 0.32 -0.16 -0.19 0.00 -0.13 0.00 0.00 59.36 59.20 2h1n h GLU 22 Cb -0.14 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.02 2h1n h GLU 22 CO -0.07 0.89 -0.71 0.00 -0.73 0.00 0.00 179.01 178.38 2h1n h ALA 23 N 1.22 0.52 -0.28 2.92 0.00 -1.13 -2.50 119.26 120.02 2h1n h ALA 23 Ca 0.29 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 2h1n h ALA 23 Cb 0.08 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2h1n h ALA 23 CO -0.04 0.73 -0.16 1.25 0.00 0.00 0.00 179.25 181.03 2h1n h LEU 24 N 0.39 0.47 -0.51 0.00 5.85 -1.03 -0.20 115.31 120.28 2h1n h LEU 24 Ca -0.03 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.51 2h1n h LEU 24 Cb 1.30 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 2h1n h LEU 24 CO 0.13 0.66 0.14 -0.78 -0.34 0.00 0.00 178.44 178.25 2h1n h ASP 25 N 0.44 0.76 -0.48 1.25 3.58 -0.77 -0.84 116.42 120.36 2h1n h ASP 25 Ca 0.08 -0.22 -0.01 0.00 0.42 0.00 0.00 57.03 57.30 2h1n h ASP 25 Cb 0.54 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.36 2h1n h ASP 25 CO 0.03 0.79 0.27 0.28 -2.88 0.00 0.00 179.24 177.73 2h1n h SER 26 N 0.71 0.60 -0.21 2.28 0.02 -0.99 -1.30 113.55 114.66 2h1n h SER 26 Ca 0.16 -0.08 0.03 0.00 -0.84 0.00 0.00 61.79 61.06 2h1n h SER 26 Cb 0.31 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 2h1n h SER 26 CO -0.00 0.51 0.04 0.15 -1.14 0.00 0.00 176.83 176.39 2h1n h PHE 27 N 0.64 0.07 0.00 3.45 3.57 -0.82 -0.45 116.94 123.40 2h1n h PHE 27 Ca 0.17 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2h1n h PHE 27 Cb 0.04 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.78 2h1n h PHE 27 CO -0.02 0.02 0.00 0.54 -2.23 0.00 0.00 178.31 176.62 2h1n n ARG 28 N -5.08 0.19 -0.01 1.11 1.74 -0.34 -3.36 116.66 110.90 2h1n n ARG 28 Ca -0.02 0.34 0.03 0.00 -0.77 0.00 0.00 57.85 57.42 2h1n n ARG 28 Cb 0.09 -1.81 0.03 0.00 -1.02 0.00 0.00 32.46 29.76 2h1n n ARG 28 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2h1n n ARG 29 N -2.15 0.08 -1.81 5.56 5.12 -0.51 -5.02 116.66 117.92 2h1n n ARG 29 Ca 0.03 -0.94 -0.41 0.00 -1.93 0.00 0.00 57.85 54.60 2h1n n ARG 29 Cb 0.28 -1.12 -0.01 0.00 -1.16 0.00 0.00 32.46 30.45 2h1n n ARG 29 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2h1n s ALA 30 N -0.56 3.70 -2.32 7.54 0.00 -0.21 -4.92 121.76 124.98 2h1n s ALA 30 Ca 0.08 1.54 0.26 0.00 0.00 0.00 0.00 51.96 53.84 2h1n s ALA 30 Cb 0.05 -3.63 1.10 0.00 0.00 0.00 0.00 23.12 20.65 2h1n s ALA 30 CO 0.08 -0.97 1.76 0.41 0.00 0.00 0.00 175.76 177.04 2h1n n GLY 31 N 1.82 -0.15 3.35 0.00 0.00 -1.26 -4.94 105.19 104.01 2h1n n GLY 31 Ca 0.06 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 2h1n n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2h1n s SER 32 N -1.85 0.02 0.25 1.61 1.04 -1.26 -5.04 113.70 108.47 2h1n s SER 32 Ca 0.37 -0.84 -0.00 0.00 0.48 0.00 0.00 55.95 55.96 2h1n s SER 32 Cb 0.20 0.45 0.32 0.00 0.10 0.00 0.00 66.02 67.08 2h1n s SER 32 CO 0.31 -0.91 1.69 0.00 0.98 0.00 0.00 173.24 175.31 2h1n h ALA 33 N 2.51 1.01 -0.80 5.32 0.00 -1.95 -2.79 119.26 122.57 2h1n h ALA 33 Ca -0.31 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 2h1n h ALA 33 Cb 1.23 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 2h1n h ALA 33 CO 0.47 0.59 0.50 0.00 0.00 0.00 0.00 179.25 180.81 2h1n h ALA 34 N 1.21 1.02 -0.06 0.00 0.00 -1.99 0.35 119.26 119.78 2h1n h ALA 34 Ca 0.08 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2h1n h ALA 34 Cb 0.68 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2h1n h ALA 34 CO 0.05 0.46 -0.37 -0.07 0.00 0.00 0.00 179.25 179.33 2h1n h LEU 35 N 1.09 0.13 -0.22 0.00 3.38 -1.95 -2.27 115.31 115.47 2h1n h LEU 35 Ca 0.29 -0.05 -0.12 0.00 0.09 0.00 0.00 57.88 58.09 2h1n h LEU 35 Cb -0.07 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 2h1n h LEU 35 CO -0.06 0.49 -0.32 1.56 0.09 0.00 0.00 178.44 180.20 2h1n h GLN 36 N 0.11 0.61 -0.66 1.13 4.20 -1.00 -2.41 115.11 117.09 2h1n h GLN 36 Ca 0.01 -0.36 0.14 0.00 0.06 0.00 0.00 58.65 58.50 2h1n h GLN 36 Cb 0.71 0.03 -0.11 0.00 0.30 0.00 0.00 27.48 28.41 2h1n h GLN 36 CO 0.05 0.97 0.02 0.45 -0.67 0.00 0.00 178.83 179.65 2h1n h HIS 37 N 0.31 -0.01 -0.03 2.96 3.86 -0.03 -2.01 115.15 120.20 2h1n h HIS 37 Ca 0.02 0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 2h1n h HIS 37 Cb 0.91 0.11 -0.00 0.00 1.06 0.00 0.00 27.41 29.48 2h1n h HIS 37 CO 0.08 -0.17 0.02 0.93 0.86 0.00 0.00 177.93 179.65 2h1n h GLU 38 N 0.13 0.05 -1.13 2.45 4.39 -1.37 -1.30 114.58 117.79 2h1n h GLU 38 Ca 0.35 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.05 2h1n h GLU 38 Cb 0.59 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2h1n h GLU 38 CO -0.56 0.11 0.00 0.00 -1.16 0.00 0.00 179.01 177.40 2h1n n ALA 39 N -2.14 1.09 0.00 3.43 0.00 -0.76 -2.22 120.51 119.91 2h1n n ALA 39 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2h1n n ALA 39 Cb 0.07 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.68 2h1n n ALA 39 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2h1n n LYS 41 N 0.72 0.00 0.10 0.00 5.02 -0.49 -2.11 118.16 121.40 2h1n n LYS 41 Ca 0.00 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.16 2h1n n LYS 41 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 2h1n n LYS 41 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2h1n h ARG 42 N 0.00 -0.20 -0.70 1.97 1.12 -1.73 -0.90 114.38 113.94 2h1n h ARG 42 Ca 0.00 0.01 0.04 0.00 -1.11 0.00 0.00 59.98 58.92 2h1n h ARG 42 Cb 0.00 0.05 -0.05 0.00 -0.01 0.00 0.00 29.97 29.96 2h1n h ARG 42 CO 0.00 -0.00 0.43 0.82 -3.11 0.00 0.00 179.97 178.11 2h1n h ILE 43 N -0.37 1.06 -0.07 1.20 2.04 -1.71 -0.83 117.51 118.82 2h1n h ILE 43 Ca -0.02 -0.28 -0.11 0.00 1.00 0.00 0.00 64.86 65.44 2h1n h ILE 43 Cb 0.29 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2h1n h ILE 43 CO 0.04 0.15 -0.46 0.78 0.00 0.00 0.00 178.15 178.65 2h1n h ASN 44 N 0.82 0.18 -0.17 1.72 2.35 -1.83 -0.74 115.58 117.91 2h1n h ASN 44 Ca 0.29 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2h1n h ASN 44 Cb 0.07 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2h1n h ASN 44 CO -0.13 0.62 0.09 -0.08 -1.65 0.00 0.00 177.43 176.28 2h1n h GLU 45 N 0.14 0.24 -0.65 0.81 4.81 -0.39 -1.28 114.58 118.25 2h1n h GLU 45 Ca 0.01 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2h1n h GLU 45 Cb 0.87 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.17 2h1n h GLU 45 CO 0.07 0.24 0.41 -0.07 -0.73 0.00 0.00 179.01 178.93 2h1n h LEU 46 N 0.17 0.69 -0.56 1.64 3.38 -0.78 -2.25 115.31 117.60 2h1n h LEU 46 Ca 0.06 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2h1n h LEU 46 Cb 0.07 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2h1n h LEU 46 CO -0.01 0.49 0.26 0.03 0.09 0.00 0.00 178.44 179.29 2h1n h ARG 47 N 0.82 0.82 -0.58 1.13 3.08 -1.01 -2.84 114.38 115.80 2h1n h ARG 47 Ca 0.26 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 2h1n h ARG 47 Cb -0.02 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 2h1n h ARG 47 CO -0.09 0.69 0.23 0.00 -1.07 0.00 0.00 179.97 179.73 2h1n h ARG 48 N 0.77 0.87 -0.40 0.04 3.08 -0.90 -0.82 114.38 117.02 2h1n h ARG 48 Ca 0.19 -0.16 0.07 0.00 0.07 0.00 0.00 59.98 60.16 2h1n h ARG 48 Cb 0.15 -0.14 -0.06 0.00 0.08 0.00 0.00 29.97 29.99 2h1n h ARG 48 CO -0.02 0.74 -0.01 0.00 -1.07 0.00 0.00 179.97 179.62 2h1n h ARG 49 N 0.80 0.10 0.20 0.04 -0.00 -1.31 0.19 114.38 114.40 2h1n h ARG 49 Ca 0.19 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.66 2h1n h ARG 49 Cb 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 29.97 30.15 2h1n h ARG 49 CO -0.02 0.06 -0.09 -0.92 0.00 0.00 0.00 179.97 179.00 2h1n h TYR 50 N 0.10 -0.24 0.00 3.04 3.20 -1.23 -2.94 116.97 118.90 2h1n h TYR 50 Ca 0.20 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.06 2h1n h TYR 50 Cb 0.28 0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.63 2h1n h TYR 50 CO -0.27 0.07 0.00 0.66 -1.64 0.00 0.00 178.16 176.98 2h1n h SER 51 N -0.57 0.00 0.00 -2.11 4.64 -0.96 -1.03 113.55 113.52 2h1n h SER 51 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2h1n h SER 51 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2h1n h SER 51 CO 0.04 0.00 0.00 0.41 -0.87 0.00 0.00 176.83 176.41 2h1n n THR 52 N -2.69 0.00 0.00 2.95 -1.04 0.67 -1.99 114.28 112.18 2h1n n THR 52 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 2h1n n THR 52 Cb 0.28 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 2h1n n THR 52 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2h1n n ALA 54 N -0.03 0.00 -0.05 2.41 0.00 -0.39 -1.06 120.51 121.39 2h1n n ALA 54 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2h1n n ALA 54 Cb 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.40 2h1n n ALA 54 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2h1n h ASN 55 N 0.00 0.96 -0.83 0.00 2.35 -1.67 0.56 115.58 116.96 2h1n h ASN 55 Ca 0.00 -0.58 0.09 0.00 -0.55 0.00 0.00 56.30 55.26 2h1n h ASN 55 Cb 0.00 -0.28 -0.07 0.00 0.05 0.00 0.00 38.32 38.02 2h1n h ASN 55 CO 0.00 1.38 0.48 0.25 -1.65 0.00 0.00 177.43 177.90 2h1n h LEU 56 N 0.60 0.71 -0.03 1.61 6.46 -1.34 0.18 115.31 123.50 2h1n h LEU 56 Ca -0.02 0.04 -0.02 0.00 -0.12 0.00 0.00 57.88 57.76 2h1n h LEU 56 Cb 1.30 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 41.14 2h1n h LEU 56 CO 0.14 0.41 -0.04 0.00 -0.62 0.00 0.00 178.44 178.33 2h1n h HIS 58 N -0.43 -0.03 0.20 0.00 -0.00 -0.19 0.16 115.15 114.86 2h1n h HIS 58 Ca 0.00 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.41 2h1n h HIS 58 Cb 0.59 0.07 -0.03 0.00 -0.00 0.00 0.00 27.41 28.04 2h1n h HIS 58 CO 0.11 -0.08 -0.33 0.82 -0.00 0.00 0.00 177.93 178.46 2h1n h ILE 59 N 0.10 0.31 -0.24 6.26 2.04 -1.04 -0.55 117.51 124.39 2h1n h ILE 59 Ca 0.18 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.01 2h1n h ILE 59 Cb 0.26 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 2h1n h ILE 59 CO -0.31 0.00 0.00 0.03 0.00 0.00 0.00 178.15 177.87 2h1n h ARG 60 N -0.60 0.36 0.34 2.37 3.08 -1.03 0.08 114.38 118.98 2h1n h ARG 60 Ca 0.01 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2h1n h ARG 60 Cb 0.60 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.59 2h1n h ARG 60 CO -0.14 0.38 -0.17 1.25 -1.07 0.00 0.00 179.97 180.22 2h1n h HIS 61 N 0.35 -0.43 -0.02 3.04 2.76 -0.50 -3.14 115.15 117.22 2h1n h HIS 61 Ca 0.08 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 2h1n h HIS 61 Cb 0.23 0.14 -0.00 0.00 1.55 0.00 0.00 27.41 29.33 2h1n h HIS 61 CO 0.01 -0.09 -0.01 1.79 -1.30 0.00 0.00 177.93 178.32 2h1n h THR 62 N -0.87 1.02 -0.02 6.26 1.35 -0.68 -1.99 112.91 117.99 2h1n h THR 62 Ca -0.05 -0.10 0.01 0.00 -0.55 0.00 0.00 66.41 65.72 2h1n h THR 62 Cb 0.53 1.03 -0.01 0.00 -1.73 0.00 0.00 68.15 67.97 2h1n h THR 62 CO 0.08 0.03 -0.02 0.40 -0.25 0.00 0.00 175.52 175.75 2h1n h ILE 63 N 0.02 0.93 -3.01 6.82 2.04 -1.03 0.09 117.51 123.37 2h1n h ILE 63 Ca 0.01 0.00 -0.56 0.00 1.00 0.00 0.00 64.86 65.30 2h1n h ILE 63 Cb 0.04 0.93 -0.40 0.00 -0.74 0.00 0.00 36.82 36.65 2h1n h ILE 63 CO 0.00 0.00 -0.77 -0.62 0.00 0.00 0.00 178.15 176.77 2h1n s ASP 64 N -5.16 3.84 0.00 1.72 2.15 -0.78 -3.90 116.67 114.54 2h1n s ASP 64 Ca -0.13 -1.50 0.27 0.00 0.43 0.00 0.00 52.55 51.62 2h1n s ASP 64 Cb 0.07 -0.66 1.36 0.00 -0.30 0.00 0.00 42.92 43.39 2h1n s ASP 64 CO 0.66 -0.43 1.93 0.35 -0.17 0.00 0.00 175.17 177.52 2h1n n THR 65 N 5.01 0.12 1.00 1.71 -2.24 -0.45 -2.37 114.28 117.04 2h1n n THR 65 Ca -0.04 0.03 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 2h1n n THR 65 Cb 0.42 -0.58 0.30 0.00 -2.10 0.00 0.00 70.33 68.37 2h1n n THR 65 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2h1n n ASN 66 N -1.30 0.43 -4.52 3.42 3.02 -1.26 -4.79 115.26 110.26 2h1n n ASN 66 Ca 0.12 -0.14 -0.45 0.00 -0.03 0.00 0.00 54.58 54.08 2h1n n ASN 66 Cb 0.22 0.15 -0.05 0.00 -0.61 0.00 0.00 39.78 39.49 2h1n n ASN 66 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2h1n n ASP 67 N -1.51 2.48 -0.27 6.41 -0.08 -1.00 -4.84 116.55 117.74 2h1n n ASP 67 Ca 0.06 0.16 -0.06 0.00 -1.51 0.00 0.00 54.79 53.44 2h1n n ASP 67 Cb 0.34 -1.41 0.05 0.00 2.34 0.00 0.00 41.12 42.44 2h1n n ASP 67 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 2h1n h GLU 68 N 14.61 1.10 -0.13 -0.67 4.57 -1.90 -1.21 114.58 130.95 2h1n h GLU 68 Ca -0.31 -0.20 0.04 0.00 -1.18 0.00 0.00 59.36 57.72 2h1n h GLU 68 Cb 1.28 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 29.65 2h1n h GLU 68 CO 1.04 0.90 -0.13 0.35 -1.18 0.00 0.00 179.01 179.99 2h1n h PHE 69 N 1.06 -0.33 0.00 0.92 3.57 -1.99 -2.10 116.94 118.07 2h1n h PHE 69 Ca 0.25 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.66 2h1n h PHE 69 Cb 0.20 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 2h1n h PHE 69 CO 0.02 -0.19 -0.78 1.88 -2.23 0.00 0.00 178.31 177.00 2h1n h TYR 70 N -0.16 0.00 -0.29 0.41 -1.99 -1.92 -2.19 116.97 110.83 2h1n h TYR 70 Ca 0.09 0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.88 2h1n h TYR 70 Cb 0.29 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.97 2h1n h TYR 70 CO -0.25 0.46 -0.03 -0.22 -0.00 0.00 0.00 178.16 178.12 2h1n h LYS 71 N 0.00 0.05 -0.48 4.88 3.64 -1.04 0.10 116.57 123.72 2h1n h LYS 71 Ca -0.05 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.23 2h1n h LYS 71 Cb 1.40 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 2h1n h LYS 71 CO 0.05 0.03 -0.08 0.87 -2.27 0.00 0.00 179.45 178.06 2h1n h LYS 72 N 0.05 0.90 -0.67 1.90 1.79 -1.28 -2.67 116.57 116.59 2h1n h LYS 72 Ca 0.14 -0.33 -0.06 0.00 -2.18 0.00 0.00 60.65 58.22 2h1n h LYS 72 Cb 0.20 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.76 2h1n h LYS 72 CO -0.26 0.97 0.18 0.93 -1.08 0.00 0.00 179.45 180.20 2h1n h GLU 73 N 0.75 1.04 -0.61 3.15 4.39 -1.21 -2.19 114.58 119.90 2h1n h GLU 73 Ca 0.13 -0.23 0.03 0.00 0.34 0.00 0.00 59.36 59.63 2h1n h GLU 73 Cb 0.62 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.09 2h1n h GLU 73 CO 0.04 0.90 0.40 0.37 -1.16 0.00 0.00 179.01 179.57 2h1n h GLN 74 N 0.99 0.72 -0.47 2.33 5.75 -0.64 -1.40 115.11 122.39 2h1n h GLN 74 Ca 0.21 -0.04 -0.12 0.00 -0.15 0.00 0.00 58.65 58.55 2h1n h GLN 74 Cb 0.32 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.69 2h1n h GLN 74 CO -0.00 0.48 -0.17 -0.44 -2.65 0.00 0.00 178.83 176.04 2h1n h ASP 75 N 0.74 0.93 -0.83 -0.69 3.45 -1.06 -1.17 116.42 117.78 2h1n h ASP 75 Ca 0.24 -0.33 0.09 0.00 0.43 0.00 0.00 57.03 57.47 2h1n h ASP 75 Cb 0.04 -0.25 -0.07 0.00 -0.56 0.00 0.00 39.33 38.48 2h1n h ASP 75 CO -0.06 1.08 0.48 0.15 -1.57 0.00 0.00 179.24 179.32 2h1n h PHE 76 N 0.81 0.87 -0.03 4.55 3.57 -0.73 -0.76 116.94 125.22 2h1n h PHE 76 Ca 0.12 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.45 2h1n h PHE 76 Cb 0.72 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 2h1n h PHE 76 CO 0.04 0.36 -0.82 0.74 -2.23 0.00 0.00 178.31 176.40 2h1n h PHE 77 N 0.80 0.45 -0.37 0.41 0.04 -1.13 0.15 116.94 117.29 2h1n h PHE 77 Ca 0.40 -0.23 -0.00 0.00 2.80 0.00 0.00 57.97 60.94 2h1n h PHE 77 Cb 0.36 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 2h1n h PHE 77 CO -0.06 1.01 0.21 -0.44 -0.60 0.00 0.00 178.31 178.43 2h1n h ASP 78 N 0.20 0.44 0.33 2.17 3.32 -0.77 -1.20 116.42 120.90 2h1n h ASP 78 Ca -0.05 -0.02 -0.33 0.00 0.02 0.00 0.00 57.03 56.65 2h1n h ASP 78 Cb 1.42 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.86 2h1n h ASP 78 CO 0.13 0.35 -1.67 -0.08 -1.72 0.00 0.00 179.24 176.25 2h1n h GLU 79 N 0.50 0.29 0.00 3.56 4.81 -0.80 -3.40 114.58 119.54 2h1n h GLU 79 Ca 0.13 -0.49 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 2h1n h GLU 79 Cb 0.00 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2h1n h GLU 79 CO -0.02 1.16 -1.63 0.25 -0.73 0.00 0.00 179.01 178.04 2h1n n THR 80 N -3.48 0.05 -0.21 0.32 -2.24 0.48 -4.32 114.28 104.89 2h1n n THR 80 Ca -0.21 -0.36 -0.00 0.00 -2.27 0.00 0.00 64.05 61.20 2h1n n THR 80 Cb 1.06 0.23 0.11 0.00 -2.10 0.00 0.00 70.33 69.62 2h1n n THR 80 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2h1n h GLU 81 N 0.00 0.46 -0.40 -0.78 4.22 -1.42 -0.57 114.58 116.09 2h1n h GLU 81 Ca 0.00 -0.03 0.11 0.00 0.08 0.00 0.00 59.36 59.53 2h1n h GLU 81 Cb 0.86 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 2h1n h GLU 81 CO 0.00 0.30 0.30 -1.35 -2.18 0.00 0.00 179.01 176.08 2h1n h PRO 82 N 0.47 0.00 0.01 0.92 0.11 -1.81 0.18 132.00 131.88 2h1n h PRO 82 Ca 0.31 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.19 2h1n h PRO 82 Cb 0.34 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.42 2h1n h PRO 82 CO -0.28 0.00 -1.08 -0.39 -0.21 0.00 0.00 178.00 176.05 2h1n h VAL 83 N 0.00 1.63 -0.51 3.15 -1.51 -1.35 -2.67 116.25 114.99 2h1n h VAL 83 Ca 0.19 -3.34 -0.10 0.00 -1.23 0.00 0.00 66.70 62.22 2h1n h VAL 83 Cb 0.79 2.83 -0.02 0.00 -2.13 0.00 0.00 31.29 32.76 2h1n h VAL 83 CO -0.00 0.94 -0.07 0.58 -1.23 0.00 0.00 177.57 177.78 2h1n h VAL 84 N 0.01 1.27 -0.95 7.19 2.07 -0.85 -2.02 116.25 122.96 2h1n h VAL 84 Ca -0.04 -1.20 0.11 0.00 0.82 0.00 0.00 66.70 66.39 2h1n h VAL 84 Cb 1.81 1.01 -0.08 0.00 -1.52 0.00 0.00 31.29 32.50 2h1n h VAL 84 CO 0.13 0.42 0.59 0.11 0.02 0.00 0.00 177.57 178.84 2h1n h LYS 85 N 0.81 0.92 -0.58 1.57 1.79 -0.95 0.58 116.57 120.70 2h1n h LYS 85 Ca 0.14 -0.06 0.04 0.00 -2.18 0.00 0.00 60.65 58.59 2h1n h LYS 85 Cb 0.62 -0.21 -0.05 0.00 -1.58 0.00 0.00 32.23 31.02 2h1n h LYS 85 CO 0.04 0.61 0.32 0.78 -1.08 0.00 0.00 179.45 180.12 2h1n h GLY 86 N 0.94 0.83 0.93 3.86 0.00 -1.10 0.37 103.07 108.90 2h1n h GLY 86 Ca 0.47 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.55 2h1n h GLY 86 CO -0.26 0.16 0.13 1.41 0.00 0.00 0.00 176.54 177.98 2h1n h LEU 87 N 0.62 0.46 -0.68 3.11 3.38 -0.31 -0.78 115.31 121.12 2h1n h LEU 87 Ca 0.25 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2h1n h LEU 87 Cb 0.12 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2h1n h LEU 87 CO -0.15 0.51 0.37 0.58 0.09 0.00 0.00 178.44 179.84 2h1n h VAL 88 N 0.39 1.21 -0.59 1.22 2.07 -0.75 -1.12 116.25 118.68 2h1n h VAL 88 Ca 0.11 -0.53 0.05 0.00 0.82 0.00 0.00 66.70 67.14 2h1n h VAL 88 Cb 0.19 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 2h1n h VAL 88 CO -0.01 0.23 0.33 -1.13 0.02 0.00 0.00 177.57 177.01 2h1n h ASN 89 N 0.93 0.50 -0.82 0.57 -0.73 -0.06 0.25 115.58 116.21 2h1n h ASN 89 Ca 0.24 0.02 0.03 0.00 1.87 0.00 0.00 56.30 58.46 2h1n h ASN 89 Cb 0.04 -0.08 -0.05 0.00 0.27 0.00 0.00 38.32 38.50 2h1n h ASN 89 CO -0.04 0.34 0.53 0.44 -0.37 0.00 0.00 177.43 178.33 2h1n h ASP 90 N 0.63 0.87 0.45 1.15 3.45 -0.51 -1.83 116.42 120.63 2h1n h ASP 90 Ca 0.26 -0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.70 2h1n h ASP 90 Cb 0.12 -0.19 -0.00 0.00 -0.56 0.00 0.00 39.33 38.70 2h1n h ASP 90 CO -0.15 0.60 -0.26 0.22 -1.57 0.00 0.00 179.24 178.08 2h1n h TYR 91 N 1.02 -0.68 -0.39 4.55 3.20 -0.53 -2.62 116.97 121.53 2h1n h TYR 91 Ca 0.33 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.19 2h1n h TYR 91 Cb 0.01 0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 2h1n h TYR 91 CO -0.03 -0.40 0.25 1.88 -1.64 0.00 0.00 178.16 178.22 2h1n h TYR 92 N -0.67 0.49 -0.48 -3.82 0.05 -0.81 -0.31 116.97 111.42 2h1n h TYR 92 Ca -0.05 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.70 2h1n h TYR 92 Cb 0.54 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 2h1n h TYR 92 CO -0.08 0.32 0.14 -0.09 -1.05 0.00 0.00 178.16 177.40 2h1n h ARG 93 N 0.53 0.74 -0.52 4.88 2.43 -1.15 -0.46 114.38 120.83 2h1n h ARG 93 Ca 0.14 -0.16 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 2h1n h ARG 93 Cb -0.05 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 2h1n h ARG 93 CO -0.03 0.71 -0.02 0.00 -1.51 0.00 0.00 179.97 179.12 2h1n h ALA 94 N 1.00 0.71 -0.23 2.80 0.00 -1.04 -3.09 119.26 119.40 2h1n h ALA 94 Ca 0.15 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2h1n h ALA 94 Cb 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2h1n h ALA 94 CO -0.00 0.54 0.07 1.25 0.00 0.00 0.00 179.25 181.11 2h1n h LEU 95 N 0.81 0.34 -1.16 0.00 5.85 -0.89 -2.32 115.31 117.93 2h1n h LEU 95 Ca 0.15 -0.20 -0.08 0.00 0.84 0.00 0.00 57.88 58.58 2h1n h LEU 95 Cb 0.55 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 2h1n h LEU 95 CO 0.03 0.45 -0.37 1.62 -0.34 0.00 0.00 178.44 179.83 2h1n h VAL 96 N 0.20 1.05 -0.21 1.05 3.04 -1.11 -3.01 116.25 117.26 2h1n h VAL 96 Ca 0.07 -1.38 -0.09 0.00 -1.01 0.00 0.00 66.70 64.30 2h1n h VAL 96 Cb 0.24 1.79 -0.05 0.00 -2.01 0.00 0.00 31.29 31.26 2h1n h VAL 96 CO -0.00 0.36 -0.15 -1.54 -1.01 0.00 0.00 177.57 175.23 2h1n n SER 97 N -3.78 2.51 -4.75 3.17 3.41 -1.17 -5.00 113.62 108.02 2h1n n SER 97 Ca -0.01 -3.59 -0.41 0.00 -0.26 0.00 0.00 58.87 54.60 2h1n n SER 97 Cb 0.45 -0.57 -0.04 0.00 -0.26 0.00 0.00 64.21 63.79 2h1n n SER 97 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2h1n s SER 98 N -2.65 7.14 0.64 4.04 0.15 -0.88 -4.92 113.70 117.22 2h1n s SER 98 Ca 0.41 2.27 0.37 0.00 0.70 0.00 0.00 55.95 59.69 2h1n s SER 98 Cb 0.37 -2.62 2.05 0.00 -1.71 0.00 0.00 66.02 64.11 2h1n s SER 98 CO 0.00 -0.29 2.23 1.55 1.20 0.00 0.00 173.24 177.92 2h1n h PRO 99 N 4.61 0.00 -0.64 5.44 0.13 -1.92 -0.62 132.00 138.99 2h1n h PRO 99 Ca -0.46 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.52 2h1n h PRO 99 Cb 1.21 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.25 2h1n h PRO 99 CO 0.71 0.00 0.18 1.19 -0.23 0.00 0.00 178.00 179.85 2h1n n PHE 100 N -3.33 2.19 -0.35 1.56 3.01 -1.26 -4.66 117.46 114.61 2h1n n PHE 100 Ca -0.02 -1.10 0.11 0.00 1.01 0.00 0.00 57.45 57.45 2h1n n PHE 100 Cb 0.17 -0.61 0.29 0.00 -0.01 0.00 0.00 39.48 39.32 2h1n n PHE 100 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2h1n h ARG 101 N 2.79 0.83 0.05 -1.08 2.43 -1.43 -1.25 114.38 116.73 2h1n h ARG 101 Ca 0.18 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.33 2h1n h ARG 101 Cb 2.16 -0.19 -0.05 0.00 -0.42 0.00 0.00 29.97 31.47 2h1n h ARG 101 CO 0.63 0.55 -0.41 0.00 -1.51 0.00 0.00 179.97 179.23 2h1n h ALA 102 N 1.60 -0.67 -0.80 2.80 0.00 -1.85 0.12 119.26 120.46 2h1n h ALA 102 Ca 0.54 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.37 2h1n h ALA 102 Cb 0.74 0.70 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 2h1n h ALA 102 CO -0.33 -0.95 0.40 0.93 0.00 0.00 0.00 179.25 179.29 2h1n h GLU 103 N -0.59 1.15 -0.24 0.00 5.08 -1.80 -2.20 114.58 115.98 2h1n h GLU 103 Ca 0.04 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2h1n h GLU 103 Cb 0.65 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2h1n h GLU 103 CO -0.28 0.88 0.09 -0.07 -1.00 0.00 0.00 179.01 178.63 2h1n h LEU 104 N 1.14 0.33 -0.99 1.33 4.07 -0.80 -1.47 115.31 118.92 2h1n h LEU 104 Ca 0.28 -0.17 0.02 0.00 0.08 0.00 0.00 57.88 58.10 2h1n h LEU 104 Cb 0.10 -0.08 -0.05 0.00 1.08 0.00 0.00 40.66 41.70 2h1n h LEU 104 CO -0.04 0.41 0.65 -0.33 -1.08 0.00 0.00 178.44 178.05 2h1n h GLU 105 N 0.23 1.25 -0.10 1.13 5.08 -0.60 -1.63 114.58 119.94 2h1n h GLU 105 Ca 0.08 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2h1n h GLU 105 Cb 0.18 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2h1n h GLU 105 CO -0.01 0.83 -0.34 0.37 -1.00 0.00 0.00 179.01 178.86 2h1n h GLN 106 N 1.29 0.20 -0.21 2.33 5.75 -1.07 0.39 115.11 123.79 2h1n h GLN 106 Ca 0.38 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.80 2h1n h GLN 106 Cb -0.07 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.47 2h1n h GLN 106 CO -0.10 0.53 0.00 0.28 -2.65 0.00 0.00 178.83 176.89 2h1n n VAL 107 N -4.09 0.26 -0.20 2.39 0.31 -0.58 -4.56 118.33 111.86 2h1n n VAL 107 Ca -0.01 -0.49 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 2h1n n VAL 107 Cb 0.42 0.70 0.00 0.00 -0.91 0.00 0.00 33.84 34.05 2h1n n VAL 107 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 2h1n n TRP 108 N 0.80 0.00 0.00 3.52 8.01 -0.67 -5.06 117.44 124.05 2h1n n TRP 108 Ca 0.17 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.36 2h1n n TRP 108 Cb 0.45 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.75 2h1n n TRP 108 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2h1n n GLY 109 N 0.00 1.16 0.40 6.99 0.00 0.13 -4.50 105.19 109.37 2h1n n GLY 109 Ca 0.00 -1.43 0.21 0.00 0.00 0.00 0.00 46.02 44.80 2h1n n GLY 109 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h1n h LYS 110 N 0.00 0.00 -0.70 1.61 1.57 -1.92 -2.96 116.57 114.18 2h1n h LYS 110 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2h1n h LYS 110 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 2h1n h LYS 110 CO 0.00 0.00 0.36 0.37 -0.57 0.00 0.00 179.45 179.61 2h1n h GLN 111 N 0.00 0.98 -0.77 3.15 5.75 -1.85 0.21 115.11 122.58 2h1n h GLN 111 Ca 0.24 -0.13 0.06 0.00 -0.15 0.00 0.00 58.65 58.67 2h1n h GLN 111 Cb 1.15 -0.19 -0.05 0.00 1.07 0.00 0.00 27.48 29.47 2h1n h GLN 111 CO -0.00 0.76 0.51 1.25 -2.65 0.00 0.00 178.83 178.69 2h1n h LEU 112 N 0.96 0.73 0.07 -2.39 7.12 -1.75 -0.79 115.31 119.26 2h1n h LEU 112 Ca 0.24 0.00 -0.24 0.00 0.13 0.00 0.00 57.88 58.01 2h1n h LEU 112 Cb 0.08 -0.15 -0.01 0.00 -0.53 0.00 0.00 40.66 40.04 2h1n h LEU 112 CO -0.04 0.47 -1.13 -0.26 -0.13 0.00 0.00 178.44 177.36 2h1n h PHE 113 N 0.83 0.26 0.19 1.25 -1.00 -1.44 -2.12 116.94 114.92 2h1n h PHE 113 Ca 0.33 -0.19 -0.01 0.00 2.81 0.00 0.00 57.97 60.92 2h1n h PHE 113 Cb 0.24 -0.01 -0.00 0.00 3.61 0.00 0.00 35.95 39.78 2h1n h PHE 113 CO -0.00 1.15 -0.12 0.00 -1.61 0.00 0.00 178.31 177.73 2h1n h ALA 114 N 0.78 -0.29 -0.78 2.45 0.00 -0.47 -1.27 119.26 119.67 2h1n h ALA 114 Ca -0.08 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.85 2h1n h ALA 114 Cb 1.88 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 19.75 2h1n h ALA 114 CO 0.17 -0.67 0.46 -0.07 0.00 0.00 0.00 179.25 179.14 2h1n h LEU 115 N -0.30 0.70 -0.06 0.00 3.38 -1.18 -2.51 115.31 115.33 2h1n h LEU 115 Ca -0.02 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2h1n h LEU 115 Cb 0.25 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2h1n h LEU 115 CO 0.02 0.44 -0.02 0.00 0.09 0.00 0.00 178.44 178.97 2h1n h ALA 116 N 1.39 0.08 -0.94 1.53 0.00 -1.16 -0.77 119.26 119.39 2h1n h ALA 116 Ca 0.35 -0.21 0.21 0.00 0.00 0.00 0.00 54.91 55.26 2h1n h ALA 116 Cb 0.22 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.91 2h1n h ALA 116 CO -0.19 -0.19 0.62 0.93 0.00 0.00 0.00 179.25 180.41 2h1n h GLU 117 N -0.24 0.44 0.01 0.00 5.08 -1.10 -0.87 114.58 117.90 2h1n h GLU 117 Ca 0.01 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 2h1n h GLU 117 Cb 0.42 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2h1n h GLU 117 CO 0.01 0.29 -0.20 1.15 -1.00 0.00 0.00 179.01 179.26 2h1n h THR 118 N 0.45 1.59 0.00 1.13 2.02 -0.98 -3.21 112.91 113.91 2h1n h THR 118 Ca 0.51 -1.99 -0.00 0.00 0.77 0.00 0.00 66.41 65.69 2h1n h THR 118 Cb 1.20 2.88 -0.00 0.00 -1.74 0.00 0.00 68.15 70.48 2h1n h THR 118 CO -0.22 0.54 -0.01 1.56 0.37 0.00 0.00 175.52 177.76 2h1n h GLN 119 N -0.61 0.00 0.00 6.66 7.50 -0.67 -2.21 115.11 125.79 2h1n h GLN 119 Ca -0.03 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.10 2h1n h GLN 119 Cb 0.99 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.51 2h1n h GLN 119 CO 0.04 0.01 -0.13 -0.07 -1.50 0.00 0.00 178.83 177.17 2h1n h LEU 120 N 0.00 0.00 -2.12 1.46 4.07 -1.17 -1.95 115.31 115.59 2h1n h LEU 120 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2h1n h LEU 120 Cb 0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.77 2h1n h LEU 120 CO 0.00 0.13 0.00 2.29 -1.08 0.00 0.00 178.44 179.78 2h1n n LYS 121 N -3.99 2.68 0.00 1.13 2.85 -0.83 -4.14 118.16 115.87 2h1n n LYS 121 Ca -0.02 -1.86 0.07 0.00 -1.05 0.00 0.00 58.31 55.45 2h1n n LYS 121 Cb 0.22 -1.62 -0.03 0.00 -0.65 0.00 0.00 35.03 32.95 2h1n n LYS 121 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 2h1n n THR 122 N 0.71 0.00 -3.84 0.58 5.66 -0.73 -5.00 114.28 111.65 2h1n n THR 122 Ca 0.17 -0.28 -0.12 0.00 -3.05 0.00 0.00 64.05 60.77 2h1n n THR 122 Cb 0.59 1.12 -0.12 0.00 -1.55 0.00 0.00 70.33 70.37 2h1n n THR 122 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 2h1n s TYR 123 N -2.01 -0.09 -0.01 1.09 5.04 -1.26 -5.08 117.35 115.03 2h1n s TYR 123 Ca 0.10 0.23 -0.12 0.00 -2.44 0.00 0.00 57.07 54.84 2h1n s TYR 123 Cb 0.12 0.02 0.01 0.00 0.35 0.00 0.00 41.96 42.46 2h1n s TYR 123 CO 0.46 -0.11 0.24 0.00 -1.34 0.00 0.00 175.55 174.79 2h1n s ALA 124 N -0.24 -0.58 0.35 3.97 0.00 -1.26 -5.04 121.76 118.95 2h1n s ALA 124 Ca -0.03 0.12 0.13 0.00 0.00 0.00 0.00 51.96 52.17 2h1n s ALA 124 Cb -0.02 0.10 0.98 0.00 0.00 0.00 0.00 23.12 24.17 2h1n s ALA 124 CO 0.00 -0.24 1.73 -1.35 0.00 0.00 0.00 175.76 175.91 2h1n h PRO 125 N 4.02 0.49 0.00 0.00 0.11 -2.01 -1.13 132.00 133.48 2h1n h PRO 125 Ca -0.30 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2h1n h PRO 125 Cb 1.18 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2h1n h PRO 125 CO 0.40 0.32 0.00 -0.24 -0.21 0.00 0.00 178.00 178.28 2h1n h VAL 126 N 0.50 0.00 -0.38 3.15 3.04 -1.99 -2.79 116.25 117.78 2h1n h VAL 126 Ca 0.64 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 66.21 2h1n h VAL 126 Cb 1.37 1.11 0.00 0.00 -2.01 0.00 0.00 31.29 31.76 2h1n h VAL 126 CO -0.43 0.00 0.00 2.30 -1.01 0.00 0.00 177.57 178.43 2h1n n ILE 127 N -3.07 0.49 0.38 3.17 -5.35 -0.42 -4.57 119.36 109.98 2h1n n ILE 127 Ca -0.02 -0.65 -0.18 0.00 -0.27 0.00 0.00 62.75 61.63 2h1n n ILE 127 Cb 0.12 0.68 -0.09 0.00 -1.74 0.00 0.00 39.64 38.61 2h1n n ILE 127 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 2h1n h VAL 128 N 3.62 0.31 -0.85 7.28 2.07 -1.64 0.16 116.25 127.20 2h1n h VAL 128 Ca 0.00 -0.05 0.17 0.00 0.82 0.00 0.00 66.70 67.64 2h1n h VAL 128 Cb 0.81 0.32 -0.11 0.00 -1.52 0.00 0.00 31.29 30.79 2h1n h VAL 128 CO 0.00 0.01 0.39 -0.33 0.02 0.00 0.00 177.57 177.66 2h1n h GLU 129 N -0.96 0.49 -0.35 1.57 5.08 -1.84 -0.58 114.58 117.98 2h1n h GLU 129 Ca -0.09 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 2h1n h GLU 129 Cb 0.72 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 2h1n h GLU 129 CO 0.16 0.32 -0.01 -0.44 -1.00 0.00 0.00 179.01 178.04 2h1n h ASP 130 N 0.50 0.62 -0.70 1.42 3.45 -1.78 -2.10 116.42 117.82 2h1n h ASP 130 Ca 0.49 -0.31 0.11 0.00 0.43 0.00 0.00 57.03 57.74 2h1n h ASP 130 Cb 0.79 -0.17 -0.08 0.00 -0.56 0.00 0.00 39.33 39.32 2h1n h ASP 130 CO -0.43 0.78 0.32 -0.07 -1.57 0.00 0.00 179.24 178.27 2h1n h LEU 131 N 0.44 0.37 -0.51 1.55 4.07 0.68 0.06 115.31 121.97 2h1n h LEU 131 Ca 0.10 0.08 -0.09 0.00 0.08 0.00 0.00 57.88 58.05 2h1n h LEU 131 Cb 0.47 0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.22 2h1n h LEU 131 CO 0.02 0.20 -0.02 1.56 -1.08 0.00 0.00 178.44 179.12 2h1n h GLN 132 N 0.53 0.91 -0.59 1.13 4.20 -1.02 -1.29 115.11 118.98 2h1n h GLN 132 Ca 0.36 -0.30 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 2h1n h GLN 132 Cb 0.44 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 2h1n h GLN 132 CO -0.31 0.95 0.21 -0.22 -0.67 0.00 0.00 178.83 178.79 2h1n h LYS 133 N 0.77 0.87 -0.18 1.46 3.64 -0.93 -1.70 116.57 120.50 2h1n h LYS 133 Ca 0.14 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2h1n h LYS 133 Cb 0.55 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2h1n h LYS 133 CO 0.03 0.73 0.02 1.49 -2.27 0.00 0.00 179.45 179.45 2h1n h GLU 134 N 0.85 0.31 -0.76 1.90 4.81 -0.70 -1.88 114.58 119.12 2h1n h GLU 134 Ca 0.20 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.36 2h1n h GLU 134 Cb 0.20 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 2h1n h GLU 134 CO -0.01 0.48 0.49 -0.91 -0.73 0.00 0.00 179.01 178.33 2h1n h ASN 135 N 0.09 0.82 -0.26 1.04 2.35 -0.91 -1.35 115.58 117.36 2h1n h ASN 135 Ca 0.05 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.72 2h1n h ASN 135 Cb 0.33 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 2h1n h ASN 135 CO 0.01 0.58 -0.11 0.11 -1.65 0.00 0.00 177.43 176.36 2h1n h LYS 136 N 0.97 0.53 -0.35 0.81 1.57 -1.26 -2.33 116.57 116.51 2h1n h LYS 136 Ca 0.29 -0.23 0.06 0.00 -1.87 0.00 0.00 60.65 58.90 2h1n h LYS 136 Cb -0.04 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.20 2h1n h LYS 136 CO -0.09 0.78 0.03 -0.07 -0.57 0.00 0.00 179.45 179.53 2h1n h LEU 137 N 0.26 -0.08 -0.24 2.94 4.07 -1.04 0.76 115.31 121.99 2h1n h LEU 137 Ca 0.06 0.07 0.05 0.00 0.08 0.00 0.00 57.88 58.14 2h1n h LEU 137 Cb 0.62 0.12 -0.05 0.00 1.08 0.00 0.00 40.66 42.42 2h1n h LEU 137 CO 0.04 -0.00 -0.10 0.00 -1.08 0.00 0.00 178.44 177.29 2h1n h ALA 138 N 1.29 0.10 -0.81 1.53 0.00 -1.20 -2.15 119.26 118.01 2h1n h ALA 138 Ca 0.17 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.22 2h1n h ALA 138 Cb 0.22 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 2h1n h ALA 138 CO -0.26 -0.51 0.51 0.77 0.00 0.00 0.00 179.25 179.75 2h1n h SER 139 N -0.07 0.81 -1.00 0.00 0.02 -0.77 -1.62 113.55 110.92 2h1n h SER 139 Ca 0.12 0.01 0.15 0.00 -0.84 0.00 0.00 61.79 61.23 2h1n h SER 139 Cb 0.25 -0.16 -0.09 0.00 0.14 0.00 0.00 62.40 62.53 2h1n h SER 139 CO -0.28 0.54 0.62 -0.08 -1.14 0.00 0.00 176.83 176.49 2h1n h GLU 140 N 0.95 0.86 0.26 3.45 4.81 -0.24 -0.74 114.58 123.93 2h1n h GLU 140 Ca 0.34 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.51 2h1n h GLU 140 Cb 0.09 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.28 2h1n h GLU 140 CO -0.14 0.57 -0.12 -0.92 -0.73 0.00 0.00 179.01 177.66 2h1n h TYR 141 N 0.88 -0.32 -0.76 0.92 3.20 -0.89 -1.61 116.97 118.39 2h1n h TYR 141 Ca 0.53 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.47 2h1n h TYR 141 Cb 0.68 0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.99 2h1n h TYR 141 CO -0.00 -0.04 0.43 1.15 -1.64 0.00 0.00 178.16 178.06 2h1n h THR 142 N -0.60 0.94 -0.68 1.81 2.02 -1.19 -1.34 112.91 113.87 2h1n h THR 142 Ca -0.04 -0.26 -0.04 0.00 0.77 0.00 0.00 66.41 66.84 2h1n h THR 142 Cb 0.43 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 2h1n h THR 142 CO 0.06 0.14 0.25 0.50 0.37 0.00 0.00 175.52 176.84 2h1n h LYS 143 N 0.76 1.01 0.07 6.66 3.64 -1.13 -0.43 116.57 127.15 2h1n h LYS 143 Ca 0.35 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2h1n h LYS 143 Cb 0.27 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 2h1n h LYS 143 CO -0.22 0.84 -0.04 1.25 -2.27 0.00 0.00 179.45 179.02 2h1n h LEU 144 N 0.99 -0.08 -0.57 5.20 5.85 -0.24 -2.71 115.31 123.75 2h1n h LEU 144 Ca 0.23 -0.28 0.02 0.00 0.84 0.00 0.00 57.88 58.69 2h1n h LEU 144 Cb 0.22 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 2h1n h LEU 144 CO -0.02 0.24 0.36 0.40 -0.34 0.00 0.00 178.44 179.08 2h1n h ILE 145 N -0.42 1.09 0.00 4.05 5.03 -1.20 -2.18 117.51 123.88 2h1n h ILE 145 Ca -0.01 -0.24 0.00 0.00 -0.12 0.00 0.00 64.86 64.49 2h1n h ILE 145 Cb 0.36 0.31 0.00 0.00 -3.03 0.00 0.00 36.82 34.47 2h1n h ILE 145 CO 0.02 0.13 0.00 0.00 -0.68 0.00 0.00 178.15 177.62 2h1n h ALA 146 N 1.24 1.00 -0.00 1.87 0.00 -1.01 -2.54 119.26 119.81 2h1n h ALA 146 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2h1n h ALA 146 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2h1n h ALA 146 CO -0.08 0.00 -0.29 -1.13 0.00 0.00 0.00 179.25 177.75 2h1n n SER 147 N -2.95 0.44 -4.68 0.00 3.41 -0.82 -3.62 113.62 105.40 2h1n n SER 147 Ca -0.02 -0.21 -0.62 0.00 -0.26 0.00 0.00 58.87 57.76 2h1n n SER 147 Cb 0.09 0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 63.96 2h1n n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2h1n n ALA 148 N -1.30 -1.39 -3.51 7.33 0.00 -0.96 -4.91 120.51 115.77 2h1n n ALA 148 Ca 0.08 0.49 -0.27 0.00 0.00 0.00 0.00 53.44 53.74 2h1n n ALA 148 Cb 0.33 -1.99 -0.10 0.00 0.00 0.00 0.00 19.45 17.69 2h1n n ALA 148 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2h1n n LYS 149 N 3.82 1.32 0.00 0.00 5.02 -1.26 -4.21 118.16 122.84 2h1n n LYS 149 Ca 0.27 -3.92 0.00 0.00 -2.02 0.00 0.00 58.31 52.64 2h1n n LYS 149 Cb 0.04 -1.89 0.00 0.00 -0.02 0.00 0.00 35.03 33.16 2h1n n LYS 149 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2h1n n ILE 150 N 1.82 0.00 0.00 -0.18 5.41 -0.34 -4.68 119.36 121.40 2h1n n ILE 150 Ca 0.25 0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.00 2h1n n ILE 150 Cb 0.44 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.37 2h1n n ILE 150 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 2h1n n PHE 152 N 0.00 0.00 -3.73 1.39 7.35 -0.75 -0.13 117.46 121.59 2h1n n PHE 152 Ca 0.00 0.00 -0.28 0.00 -0.76 0.00 0.00 57.45 56.41 2h1n n PHE 152 Cb 0.00 0.00 0.04 0.00 0.35 0.00 0.00 39.48 39.87 2h1n n PHE 152 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2h1n n GLU 153 N 0.00 -5.92 0.00 -4.13 -0.58 -1.26 -3.01 120.64 105.74 2h1n n GLU 153 Ca 0.00 0.67 0.00 0.00 -0.42 0.00 0.00 57.16 57.41 2h1n n GLU 153 Cb 0.00 -5.59 0.00 0.00 -0.57 0.00 0.00 31.44 25.28 2h1n n GLU 153 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2h1n n GLY 154 N -1.72 2.77 3.46 0.62 0.00 -1.26 -5.07 105.19 103.99 2h1n n GLY 154 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 2h1n n GLY 154 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2h1n s GLU 155 N -0.42 1.47 0.18 1.61 -1.05 -1.16 -5.14 118.70 114.18 2h1n s GLU 155 Ca 0.00 -1.41 -0.30 0.00 -0.15 0.00 0.00 54.97 53.11 2h1n s GLU 155 Cb 0.00 0.41 -0.08 0.00 -0.44 0.00 0.00 34.13 34.02 2h1n s GLU 155 CO 0.00 -0.58 1.07 -1.21 0.95 0.00 0.00 175.26 175.49 2h1n s GLU 156 N -3.98 4.64 0.03 -4.83 2.02 -1.26 -1.81 118.70 113.50 2h1n s GLU 156 Ca 0.28 1.66 0.03 0.00 0.02 0.00 0.00 54.97 56.97 2h1n s GLU 156 Cb 0.02 -3.29 -0.02 0.00 0.10 0.00 0.00 34.13 30.94 2h1n s GLU 156 CO 0.11 0.14 -0.10 1.03 0.02 0.00 0.00 175.26 176.47 2h1n s ARG 157 N -0.47 0.67 0.79 1.61 0.52 0.82 -4.84 118.95 118.05 2h1n s ARG 157 Ca 0.48 -0.64 -0.11 0.00 -0.52 0.00 0.00 55.73 54.93 2h1n s ARG 157 Cb -0.28 -0.58 0.07 0.00 0.52 0.00 0.00 34.95 34.67 2h1n s ARG 157 CO 0.34 0.14 1.10 0.95 0.02 0.00 0.00 175.30 177.85 2h1n s THR 158 N -0.90 3.06 0.22 0.02 -4.23 -1.26 -1.20 115.64 111.35 2h1n s THR 158 Ca -0.03 0.35 -0.10 0.00 -1.18 0.00 0.00 61.69 60.73 2h1n s THR 158 Cb -0.07 -3.12 0.19 0.00 1.34 0.00 0.00 72.50 70.84 2h1n s THR 158 CO 0.01 -0.45 1.67 -0.07 -0.54 0.00 0.00 174.62 175.24 2h1n h LEU 159 N -1.05 -0.18 -0.93 4.79 -0.00 -1.87 -1.24 115.31 114.82 2h1n h LEU 159 Ca -0.47 0.14 0.03 0.00 -0.00 0.00 0.00 57.88 57.58 2h1n h LEU 159 Cb 1.27 0.24 -0.05 0.00 -0.00 0.00 0.00 40.66 42.11 2h1n h LEU 159 CO 0.60 -0.08 0.61 0.00 -0.00 0.00 0.00 178.44 179.57 2h1n h ALA 160 N 1.55 1.22 0.00 1.53 0.00 -1.97 -2.85 119.26 118.74 2h1n h ALA 160 Ca 0.33 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2h1n h ALA 160 Cb 0.53 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2h1n h ALA 160 CO -0.50 0.50 0.00 1.04 0.00 0.00 0.00 179.25 180.29 2h1n n GLN 161 N -4.48 0.16 0.15 0.00 6.02 -0.47 -1.69 117.38 117.07 2h1n n GLN 161 Ca 0.12 0.15 0.13 0.00 -0.01 0.00 0.00 57.00 57.39 2h1n n GLN 161 Cb 0.07 -1.50 0.34 0.00 1.02 0.00 0.00 30.24 30.17 2h1n n GLN 161 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2h1n h LEU 162 N 0.00 0.00 -0.59 1.08 3.38 -1.45 -3.39 115.31 114.33 2h1n h LEU 162 Ca 0.00 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.08 2h1n h LEU 162 Cb 0.21 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.84 2h1n h LEU 162 CO 0.00 0.00 -0.29 -0.61 0.09 0.00 0.00 178.44 177.63 2h1n h GLN 163 N 0.00 -0.12 -0.80 1.13 5.75 -1.49 0.82 115.11 120.40 2h1n h GLN 163 Ca 0.00 0.01 0.17 0.00 -0.15 0.00 0.00 58.65 58.67 2h1n h GLN 163 Cb 0.80 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 29.33 2h1n h GLN 163 CO 0.00 -0.08 0.53 -1.35 -2.65 0.00 0.00 178.83 175.28 2h1n h PRO 164 N -0.13 0.39 0.15 -2.39 0.11 -1.83 -1.01 132.00 127.28 2h1n h PRO 164 Ca 0.25 -0.02 -0.29 0.00 0.11 0.00 0.00 66.00 66.05 2h1n h PRO 164 Cb 0.53 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.57 2h1n h PRO 164 CO -0.67 0.26 -1.33 0.74 -0.21 0.00 0.00 178.00 176.78 2h1n h PHE 165 N 0.40 0.58 -0.63 0.65 -1.00 -1.22 -3.20 116.94 112.51 2h1n h PHE 165 Ca 0.40 -0.42 0.11 0.00 2.81 0.00 0.00 57.97 60.86 2h1n h PHE 165 Cb 0.96 -0.02 -0.04 0.00 3.61 0.00 0.00 35.95 40.46 2h1n h PHE 165 CO -0.00 1.35 0.42 0.28 -1.61 0.00 0.00 178.31 178.75 2h1n h VAL 166 N 0.09 0.88 -0.56 -0.55 2.07 0.20 -2.52 116.25 115.86 2h1n h VAL 166 Ca -0.17 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 2h1n h VAL 166 Cb 2.02 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 2h1n h VAL 166 CO 0.21 0.08 0.03 -0.62 0.02 0.00 0.00 177.57 177.29 2h1n n GLU 167 N -4.47 4.55 -2.45 1.57 1.02 -0.56 -4.71 120.64 115.60 2h1n n GLU 167 Ca 0.11 -2.95 -0.37 0.00 -0.02 0.00 0.00 57.16 53.92 2h1n n GLU 167 Cb 0.39 -2.22 -0.03 0.00 -0.02 0.00 0.00 31.44 29.56 2h1n n GLU 167 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2h1n s SER 168 N -0.75 6.68 0.38 1.62 0.15 -0.95 -4.64 113.70 116.19 2h1n s SER 168 Ca 0.51 2.16 0.07 0.00 0.70 0.00 0.00 55.95 59.39 2h1n s SER 168 Cb 0.39 -2.60 0.80 0.00 -1.71 0.00 0.00 66.02 62.90 2h1n s SER 168 CO 0.15 -0.56 1.98 -0.65 1.20 0.00 0.00 173.24 175.36 2h1n h PRO 169 N 2.59 0.66 -6.26 5.44 0.11 -1.92 -3.41 132.00 129.21 2h1n h PRO 169 Ca -0.48 -0.04 -0.56 0.00 0.11 0.00 0.00 66.00 65.03 2h1n h PRO 169 Cb 1.22 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2h1n h PRO 169 CO 0.62 0.43 1.14 0.34 -0.21 0.00 0.00 178.00 180.33 2h1n s ASP 170 N -6.31 6.46 0.23 -2.05 3.68 -1.26 -4.92 116.67 112.49 2h1n s ASP 170 Ca -0.09 2.01 -0.01 0.00 2.13 0.00 0.00 52.55 56.59 2h1n s ASP 170 Cb 0.19 -2.53 0.24 0.00 -1.45 0.00 0.00 42.92 39.36 2h1n s ASP 170 CO 0.76 -1.13 1.60 -0.09 0.13 0.00 0.00 175.17 176.44 2h1n h ARG 171 N 10.46 0.55 -1.74 4.34 2.43 -2.00 -2.33 114.38 126.09 2h1n h ARG 171 Ca -0.38 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.52 2h1n h ARG 171 Cb 1.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2h1n h ARG 171 CO 0.97 0.85 0.00 0.00 -1.51 0.00 0.00 179.97 180.28 2h1n n ALA 172 N -2.50 2.27 0.00 2.80 0.00 -1.26 -2.23 120.51 119.59 2h1n n ALA 172 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2h1n n ALA 172 Cb 0.51 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.73 2h1n n ALA 172 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2h1n n ARG 174 N 1.20 0.00 -0.02 0.00 1.74 -0.88 -2.36 116.66 116.34 2h1n n ARG 174 Ca 0.00 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.95 2h1n n ARG 174 Cb 0.23 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.59 2h1n n ARG 174 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 2h1n h GLN 175 N 0.00 0.11 -0.70 5.56 4.15 -1.73 -0.92 115.11 121.58 2h1n h GLN 175 Ca 0.00 -0.05 0.07 0.00 0.77 0.00 0.00 58.65 59.45 2h1n h GLN 175 Cb 0.00 -0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.62 2h1n h GLN 175 CO 0.00 0.48 0.38 0.00 -1.93 0.00 0.00 178.83 177.76 2h1n h ARG 176 N -0.26 0.65 -0.05 1.69 3.08 -1.76 0.13 114.38 117.86 2h1n h ARG 176 Ca 0.01 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2h1n h ARG 176 Cb 0.44 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 2h1n h ARG 176 CO 0.01 0.43 0.01 0.00 -1.07 0.00 0.00 179.97 179.35 2h1n h ALA 177 N 1.38 0.07 -0.45 0.04 0.00 -1.81 0.18 119.26 118.68 2h1n h ALA 177 Ca 0.33 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2h1n h ALA 177 Cb 0.26 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2h1n h ALA 177 CO -0.22 -0.31 0.26 0.77 0.00 0.00 0.00 179.25 179.75 2h1n h SER 178 N -0.14 0.55 -0.83 0.00 0.02 -0.93 -0.39 113.55 111.83 2h1n h SER 178 Ca 0.02 -0.07 0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2h1n h SER 178 Cb 0.24 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.59 2h1n h SER 178 CO 0.00 0.47 0.55 -0.33 -1.14 0.00 0.00 176.83 176.38 2h1n h GLU 179 N 0.59 0.99 -0.02 3.45 5.08 -0.87 -0.90 114.58 122.90 2h1n h GLU 179 Ca 0.16 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2h1n h GLU 179 Cb 0.03 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 2h1n h GLU 179 CO -0.03 0.65 0.01 0.00 -1.00 0.00 0.00 179.01 178.65 2h1n h ALA 180 N 1.52 0.02 -0.59 3.43 0.00 -0.34 0.35 119.26 123.66 2h1n h ALA 180 Ca 0.33 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.24 2h1n h ALA 180 Cb 0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 2h1n h ALA 180 CO -0.10 -0.42 0.32 -0.09 0.00 0.00 0.00 179.25 178.95 2h1n h ARG 181 N -0.07 0.59 0.00 0.00 2.43 -0.51 -2.43 114.38 114.39 2h1n h ARG 181 Ca 0.01 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2h1n h ARG 181 Cb 0.10 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2h1n h ARG 181 CO -0.00 0.39 -0.32 0.74 -1.51 0.00 0.00 179.97 179.27 2h1n h PHE 182 N 0.61 0.00 0.00 2.20 -1.00 -1.07 -3.03 116.94 114.65 2h1n h PHE 182 Ca 0.26 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.02 2h1n h PHE 182 Cb 0.14 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.70 2h1n h PHE 182 CO -0.09 0.00 -0.06 0.66 -1.61 0.00 0.00 178.31 177.21 2h1n h SER 183 N 0.00 0.00 -0.45 2.17 4.64 0.21 0.15 113.55 120.27 2h1n h SER 183 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 2h1n h SER 183 Cb 0.81 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.88 2h1n h SER 183 CO 0.00 0.06 0.09 0.15 -0.87 0.00 0.00 176.83 176.26 2h1n h PHE 184 N 0.00 0.77 0.06 4.77 3.57 -1.42 -1.06 116.94 123.62 2h1n h PHE 184 Ca -0.00 -0.10 -0.27 0.00 3.53 0.00 0.00 57.97 61.13 2h1n h PHE 184 Cb 0.12 -0.21 0.03 0.00 2.79 0.00 0.00 35.95 38.67 2h1n h PHE 184 CO 0.00 0.72 -1.11 0.74 -2.23 0.00 0.00 178.31 176.43 2h1n h PHE 185 N 0.60 1.00 -0.67 0.41 -1.00 -1.47 -2.20 116.94 113.60 2h1n h PHE 185 Ca 0.14 -0.59 0.08 0.00 2.81 0.00 0.00 57.97 60.41 2h1n h PHE 185 Cb 0.35 -0.10 -0.07 0.00 3.61 0.00 0.00 35.95 39.75 2h1n h PHE 185 CO 0.02 1.43 0.33 -0.22 -1.61 0.00 0.00 178.31 178.26 2h1n h LYS 186 N 0.29 0.56 -0.23 1.51 3.64 -0.75 -1.16 116.57 120.42 2h1n h LYS 186 Ca -0.16 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.11 2h1n h LYS 186 Cb 1.78 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.46 2h1n h LYS 186 CO 0.22 0.37 -0.19 -0.44 -2.27 0.00 0.00 179.45 177.13 2h1n h ASP 187 N 0.58 0.39 -0.64 4.20 3.32 -1.10 -2.79 116.42 120.37 2h1n h ASP 187 Ca 0.32 -0.11 -0.14 0.00 0.02 0.00 0.00 57.03 57.12 2h1n h ASP 187 Cb 0.31 -0.10 -0.09 0.00 0.22 0.00 0.00 39.33 39.67 2h1n h ASP 187 CO -0.25 0.60 0.17 -1.22 -1.72 0.00 0.00 179.24 176.82 2h1n n TYR 188 N -4.18 2.18 0.17 4.55 4.01 -0.84 -4.69 117.16 118.36 2h1n n TYR 188 Ca -0.00 -1.08 -0.14 0.00 -0.16 0.00 0.00 57.90 56.52 2h1n n TYR 188 Cb 0.35 -0.61 -0.07 0.00 -0.31 0.00 0.00 39.34 38.71 2h1n n TYR 188 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 2h1n h GLU 189 N 2.84 -0.46 -0.48 -0.72 4.81 -0.95 -0.27 114.58 119.35 2h1n h GLU 189 Ca 0.18 0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.53 2h1n h GLU 189 Cb 2.15 0.10 -0.08 0.00 0.63 0.00 0.00 28.75 31.55 2h1n h GLU 189 CO 0.62 -0.31 -0.04 0.87 -0.73 0.00 0.00 179.01 179.42 2h1n h LYS 190 N -0.48 0.07 -0.23 1.92 1.79 -1.85 0.13 116.57 117.92 2h1n h LYS 190 Ca -0.01 -0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2h1n h LYS 190 Cb 0.43 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.06 2h1n h LYS 190 CO -0.03 0.04 0.12 0.93 -1.08 0.00 0.00 179.45 179.44 2h1n h GLU 191 N 0.07 0.32 -0.47 3.15 3.07 -1.80 -0.64 114.58 118.28 2h1n h GLU 191 Ca 0.24 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 59.02 2h1n h GLU 191 Cb 0.36 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 2h1n h GLU 191 CO -0.44 0.30 0.16 -0.07 -1.40 0.00 0.00 179.01 177.56 2h1n h LEU 192 N 0.26 0.68 -0.08 1.33 3.38 -0.77 0.17 115.31 120.29 2h1n h LEU 192 Ca 0.08 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.87 2h1n h LEU 192 Cb 0.07 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2h1n h LEU 192 CO -0.01 0.70 -0.04 0.44 0.09 0.00 0.00 178.44 179.62 2h1n h ASP 193 N 0.63 -0.14 -0.41 -0.43 3.32 -0.48 -1.45 116.42 117.47 2h1n h ASP 193 Ca 0.15 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 57.09 2h1n h ASP 193 Cb 0.26 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 2h1n h ASP 193 CO -0.01 -0.06 -0.31 -0.33 -1.72 0.00 0.00 179.24 176.82 2h1n h GLU 194 N -0.04 0.93 -0.20 3.56 5.08 -0.98 -1.45 114.58 121.49 2h1n h GLU 194 Ca 0.05 -0.46 0.02 0.00 -1.00 0.00 0.00 59.36 57.97 2h1n h GLU 194 Cb 0.11 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2h1n h GLU 194 CO -0.10 1.11 0.06 1.25 -1.00 0.00 0.00 179.01 180.33 2h1n h LEU 195 N 0.76 0.05 -0.20 1.33 6.46 -0.50 -0.34 115.31 122.87 2h1n h LEU 195 Ca 0.08 0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.84 2h1n h LEU 195 Cb 0.90 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.84 2h1n h LEU 195 CO 0.08 0.06 0.05 0.22 -0.62 0.00 0.00 178.44 178.23 2h1n h TYR 196 N 0.15 0.33 -0.80 1.25 3.20 -1.19 -1.48 116.97 118.43 2h1n h TYR 196 Ca 0.09 -0.04 0.16 0.00 3.14 0.00 0.00 58.73 62.08 2h1n h TYR 196 Cb 0.06 -0.09 -0.10 0.00 1.54 0.00 0.00 36.73 38.14 2h1n h TYR 196 CO -0.13 0.43 0.34 0.22 -1.64 0.00 0.00 178.16 177.39 2h1n h ASP 197 N 0.13 0.32 0.06 -2.11 3.58 -0.98 0.21 116.42 117.63 2h1n h ASP 197 Ca 0.06 0.12 -0.19 0.00 0.42 0.00 0.00 57.03 57.43 2h1n h ASP 197 Cb 0.27 0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.41 2h1n h ASP 197 CO 0.00 0.10 -0.71 -0.08 -2.88 0.00 0.00 179.24 175.67 2h1n h GLU 198 N 0.46 0.59 -0.29 0.28 4.81 -0.81 -1.97 114.58 117.64 2h1n h GLU 198 Ca 0.45 -0.46 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 2h1n h GLU 198 Cb 0.73 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 2h1n h GLU 198 CO -0.43 1.08 0.15 -0.07 -0.73 0.00 0.00 179.01 179.01 2h1n h LEU 199 N 0.41 0.22 -0.25 1.64 4.07 -0.46 -1.68 115.31 119.27 2h1n h LEU 199 Ca -0.03 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 2h1n h LEU 199 Cb 1.30 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 43.00 2h1n h LEU 199 CO 0.13 0.17 0.13 0.58 -1.08 0.00 0.00 178.44 178.37 2h1n h VAL 200 N 0.31 1.13 -0.33 1.22 2.07 -0.52 -0.99 116.25 119.14 2h1n h VAL 200 Ca 0.12 -0.37 -0.13 0.00 0.82 0.00 0.00 66.70 67.14 2h1n h VAL 200 Cb 0.03 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2h1n h VAL 200 CO -0.08 0.13 -0.31 0.45 0.02 0.00 0.00 177.57 177.78 2h1n h HIS 201 N 0.27 0.82 -0.31 1.57 3.86 -1.25 -0.56 115.15 119.55 2h1n h HIS 201 Ca 0.09 -0.21 -0.16 0.00 -1.16 0.00 0.00 60.37 58.92 2h1n h HIS 201 Cb 0.10 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.38 2h1n h HIS 201 CO -0.03 0.93 -0.44 -0.24 0.86 0.00 0.00 177.93 179.02 2h1n h VAL 202 N 0.60 1.28 -0.96 2.45 3.04 -1.18 -0.95 116.25 120.54 2h1n h VAL 202 Ca 0.07 -1.62 -0.00 0.00 -1.01 0.00 0.00 66.70 64.14 2h1n h VAL 202 Cb 0.82 1.56 -0.05 0.00 -2.01 0.00 0.00 31.29 31.62 2h1n h VAL 202 CO 0.07 0.53 0.60 0.03 -1.01 0.00 0.00 177.57 177.79 2h1n h ARG 203 N 0.63 1.28 0.06 4.17 3.08 -0.97 -0.54 114.38 122.10 2h1n h ARG 203 Ca 0.03 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2h1n h ARG 203 Cb 1.04 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.81 2h1n h ARG 203 CO 0.10 0.88 -0.03 1.15 -1.07 0.00 0.00 179.97 181.01 2h1n h THR 204 N 1.31 1.15 -0.54 2.04 2.02 -0.91 -2.28 112.91 115.70 2h1n h THR 204 Ca 0.35 -0.71 0.10 0.00 0.77 0.00 0.00 66.41 66.91 2h1n h THR 204 Cb -0.09 1.61 -0.08 0.00 -1.74 0.00 0.00 68.15 67.86 2h1n h THR 204 CO -0.07 0.18 0.10 0.00 0.37 0.00 0.00 175.52 176.10 2h1n h ALA 205 N 0.52 0.61 0.12 6.16 0.00 -0.98 -0.66 119.26 125.03 2h1n h ALA 205 Ca -0.01 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2h1n h ALA 205 Cb 0.35 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2h1n h ALA 205 CO 0.01 -0.31 -0.17 0.82 0.00 0.00 0.00 179.25 179.61 2h1n h ILE 206 N 0.24 0.62 -0.33 0.00 2.04 -1.03 0.24 117.51 119.28 2h1n h ILE 206 Ca 0.27 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.17 2h1n h ILE 206 Cb 0.39 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 2h1n h ILE 206 CO -0.36 0.00 0.13 0.00 0.00 0.00 0.00 178.15 177.92 2h1n h ALA 207 N 0.50 0.39 -0.69 1.87 0.00 -0.93 -0.89 119.26 119.50 2h1n h ALA 207 Ca 0.02 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2h1n h ALA 207 Cb 0.34 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 2h1n h ALA 207 CO -0.08 -0.26 0.13 0.00 0.00 0.00 0.00 179.25 179.04 2h1n h ARG 208 N 0.28 1.12 -0.23 0.00 3.08 -0.93 0.65 114.38 118.36 2h1n h ARG 208 Ca 0.15 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 2h1n h ARG 208 Cb 0.10 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2h1n h ARG 208 CO -0.14 1.01 0.12 0.87 -1.07 0.00 0.00 179.97 180.77 2h1n h LYS 209 N 1.05 0.31 -0.01 0.04 1.57 -0.53 0.88 116.57 119.88 2h1n h LYS 209 Ca 0.21 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2h1n h LYS 209 Cb 0.42 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2h1n h LYS 209 CO 0.01 0.23 0.00 1.28 -0.57 0.00 0.00 179.45 180.40 2h1n n LEU 210 N -4.47 0.28 0.00 2.94 4.77 -0.38 -4.90 117.00 115.24 2h1n n LEU 210 Ca 0.00 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2h1n n LEU 210 Cb 0.10 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2h1n n LEU 210 CO 0.35 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 2h1n n GLY 211 N 0.96 0.75 3.81 -0.72 0.00 0.30 -5.06 105.19 105.24 2h1n n GLY 211 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 2h1n n GLY 211 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2h1n s PHE 212 N -2.67 3.05 0.28 1.61 0.40 0.14 -4.95 117.98 115.84 2h1n s PHE 212 Ca 0.00 1.48 0.07 0.00 -0.60 0.00 0.00 56.93 57.87 2h1n s PHE 212 Cb 0.00 -2.95 0.38 0.00 0.51 0.00 0.00 43.02 40.96 2h1n s PHE 212 CO 0.00 -1.15 1.64 1.96 0.70 0.00 0.00 175.22 178.38 2h1n h GLN 213 N -0.02 0.18 0.00 0.44 1.08 -1.94 -3.32 115.11 111.53 2h1n h GLN 213 Ca -0.46 -0.11 0.08 0.00 -1.45 0.00 0.00 58.65 56.72 2h1n h GLN 213 Cb 1.22 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.64 2h1n h GLN 213 CO 0.57 0.65 0.32 0.27 -0.95 0.00 0.00 178.83 179.70 2h1n n ASN 214 N -3.94 -0.98 0.22 1.46 0.23 -1.26 -4.84 115.26 106.15 2h1n n ASN 214 Ca -0.02 -1.52 0.09 0.00 -0.53 0.00 0.00 54.58 52.60 2h1n n ASN 214 Cb 0.54 1.59 0.49 0.00 -2.08 0.00 0.00 39.78 40.33 2h1n n ASN 214 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 2h1n h PHE 215 N 1.55 0.00 0.16 -2.53 3.57 -1.82 -3.36 116.94 114.51 2h1n h PHE 215 Ca -0.15 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.36 2h1n h PHE 215 Cb 0.67 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.36 2h1n h PHE 215 CO 0.00 0.25 -0.51 0.28 -2.23 0.00 0.00 178.31 176.11 2h1n h VAL 216 N 0.00 0.00 -0.91 1.41 2.07 -1.97 0.33 116.25 117.18 2h1n h VAL 216 Ca -0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 2h1n h VAL 216 Cb 0.66 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.35 2h1n h VAL 216 CO 0.03 0.00 0.55 -0.08 0.02 0.00 0.00 177.57 178.09 2h1n h GLU 217 N -0.76 0.85 -0.08 1.57 4.81 -2.01 -2.32 114.58 116.64 2h1n h GLU 217 Ca -0.01 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 2h1n h GLU 217 Cb 0.75 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 2h1n h GLU 217 CO -0.25 0.57 -0.01 1.25 -0.73 0.00 0.00 179.01 179.84 2h1n h LEU 218 N 0.88 0.15 -0.87 1.64 5.85 -1.43 -2.12 115.31 119.41 2h1n h LEU 218 Ca 0.45 -0.34 0.09 0.00 0.84 0.00 0.00 57.88 58.93 2h1n h LEU 218 Cb 0.44 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.36 2h1n h LEU 218 CO -0.26 0.45 0.52 1.23 -0.34 0.00 0.00 178.44 180.04 2h1n h GLY 219 N -0.15 1.36 0.92 3.75 0.00 0.09 0.14 103.07 109.18 2h1n h GLY 219 Ca 0.02 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 2h1n h GLY 219 CO 0.01 0.17 0.12 -0.97 0.00 0.00 0.00 176.54 175.86 2h1n h TYR 220 N 0.87 0.37 -0.99 5.60 -1.99 -1.40 -2.32 116.97 117.12 2h1n h TYR 220 Ca 0.41 -0.02 0.01 0.00 2.00 0.00 0.00 58.73 61.14 2h1n h TYR 220 Cb 0.35 -0.11 -0.05 0.00 2.00 0.00 0.00 36.73 38.91 2h1n h TYR 220 CO -0.04 0.36 0.65 0.00 -0.00 0.00 0.00 178.16 179.13 2h1n h ALA 221 N 0.98 1.26 -0.65 3.88 0.00 -0.56 -1.86 119.26 122.30 2h1n h ALA 221 Ca 0.09 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2h1n h ALA 221 Cb 0.13 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 2h1n h ALA 221 CO -0.01 0.63 0.43 0.00 0.00 0.00 0.00 179.25 180.30 2h1n h ARG 222 N 1.33 0.75 -0.01 0.00 3.08 -0.59 -2.22 114.38 116.71 2h1n h ARG 222 Ca 0.37 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.37 2h1n h ARG 222 Cb -0.13 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.75 2h1n h ARG 222 CO -0.08 0.49 0.00 1.28 -1.07 0.00 0.00 179.97 180.59 2h1n n LEU 223 N -4.46 0.30 -0.23 3.04 4.32 -0.72 -4.91 117.00 114.33 2h1n n LEU 223 Ca 0.08 -0.11 -0.03 0.00 -0.02 0.00 0.00 56.01 55.93 2h1n n LEU 223 Cb 0.13 -0.01 -0.01 0.00 -1.62 0.00 0.00 43.42 41.91 2h1n n LEU 223 CO 0.35 0.05 -0.03 0.61 -1.22 0.00 0.00 177.39 177.15 2h1n n GLY 224 N 0.96 0.62 3.55 -0.72 0.00 -0.84 -4.63 105.19 104.14 2h1n n GLY 224 Ca 0.19 -0.54 -0.38 0.00 0.00 0.00 0.00 46.02 45.30 2h1n n GLY 224 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h1n s ARG 225 N -1.69 2.96 0.00 1.61 0.52 -1.08 -4.74 118.95 116.52 2h1n s ARG 225 Ca 0.00 -0.13 0.23 0.00 -0.52 0.00 0.00 55.73 55.31 2h1n s ARG 225 Cb 0.00 -4.62 -0.00 0.00 0.52 0.00 0.00 34.95 30.85 2h1n s ARG 225 CO 0.00 -2.58 1.08 0.25 0.02 0.00 0.00 175.30 174.08 2h1n n THR 226 N 7.02 0.00 -0.05 0.02 -2.24 -1.26 -4.57 114.28 113.19 2h1n n THR 226 Ca 0.21 -0.19 -0.02 0.00 -2.27 0.00 0.00 64.05 61.78 2h1n n THR 226 Cb 0.50 1.14 -0.13 0.00 -2.10 0.00 0.00 70.33 69.73 2h1n n THR 226 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2h1n n ASP 227 N -0.39 0.90 -3.88 3.42 8.00 -1.26 -5.03 116.55 118.32 2h1n n ASP 227 Ca 0.08 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.48 2h1n n ASP 227 Cb 0.43 1.26 -0.09 0.00 -0.02 0.00 0.00 41.12 42.70 2h1n n ASP 227 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2h1n s TYR 228 N -2.73 0.10 0.39 1.24 -0.85 -1.26 -5.04 117.35 109.21 2h1n s TYR 228 Ca -0.08 -0.34 0.01 0.00 -0.52 0.00 0.00 57.07 56.15 2h1n s TYR 228 Cb 0.07 -0.07 -0.01 0.00 0.38 0.00 0.00 41.96 42.34 2h1n s TYR 228 CO 0.71 -0.39 0.05 0.27 -1.52 0.00 0.00 175.55 174.66 2h1n n ASN 229 N 0.79 2.36 0.17 -0.18 0.23 -1.26 -4.93 115.26 112.44 2h1n n ASN 229 Ca -0.19 -2.86 0.04 0.00 -0.53 0.00 0.00 54.58 51.03 2h1n n ASN 229 Cb 0.58 0.54 0.43 0.00 -2.08 0.00 0.00 39.78 39.25 2h1n n ASN 229 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2h1n h ALA 230 N 1.36 1.56 0.00 -2.53 0.00 -2.01 -2.19 119.26 115.45 2h1n h ALA 230 Ca -0.32 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2h1n h ALA 230 Cb 1.06 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2h1n h ALA 230 CO 0.52 0.32 0.00 -0.25 0.00 0.00 0.00 179.25 179.84 2h1n n ASP 231 N -4.26 0.20 0.00 0.00 8.00 -1.26 -1.34 116.55 117.88 2h1n n ASP 231 Ca -0.02 -0.33 0.00 0.00 0.71 0.00 0.00 54.79 55.16 2h1n n ASP 231 Cb 0.28 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 2h1n n ASP 231 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2h1n n VAL 233 N 0.47 0.00 -0.26 2.53 0.31 -0.83 -2.22 118.33 118.33 2h1n n VAL 233 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 2h1n n VAL 233 Cb 0.05 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.05 2h1n n VAL 233 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2h1n h ALA 234 N 0.00 0.94 -0.78 3.52 0.00 -1.48 -0.68 119.26 120.78 2h1n h ALA 234 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2h1n h ALA 234 Cb 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 2h1n h ALA 234 CO 0.00 0.31 0.36 0.78 0.00 0.00 0.00 179.25 180.69 2h1n h GLY 235 N 0.96 1.20 1.31 0.00 0.00 -1.72 -2.60 103.07 102.23 2h1n h GLY 235 Ca 0.28 -0.60 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 2h1n h GLY 235 CO -0.08 0.57 0.01 -1.82 0.00 0.00 0.00 176.54 175.23 2h1n h TYR 236 N 1.11 0.89 -0.69 5.60 3.20 -1.59 -2.22 116.97 123.26 2h1n h TYR 236 Ca 0.27 -0.12 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 2h1n h TYR 236 Cb 0.14 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 2h1n h TYR 236 CO 0.01 0.81 0.42 0.00 -1.64 0.00 0.00 178.16 177.76 2h1n h ARG 237 N 0.78 0.94 -0.68 1.82 3.08 -0.85 -1.55 114.38 117.92 2h1n h ARG 237 Ca 0.15 -0.09 0.05 0.00 0.07 0.00 0.00 59.98 60.17 2h1n h ARG 237 Cb 0.45 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 30.25 2h1n h ARG 237 CO 0.02 0.67 0.39 -0.09 -1.07 0.00 0.00 179.97 179.89 2h1n h ARG 238 N 0.94 0.71 -0.04 0.04 2.43 -1.09 0.14 114.38 117.51 2h1n h ARG 238 Ca 0.25 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.38 2h1n h ARG 238 Cb -0.03 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 2h1n h ARG 238 CO -0.05 0.47 -0.02 1.96 -1.51 0.00 0.00 179.97 180.83 2h1n h GLN 239 N 0.73 -0.01 -0.44 0.20 4.20 -0.88 -0.42 115.11 118.50 2h1n h GLN 239 Ca 0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.01 2h1n h GLN 239 Cb 0.14 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2h1n h GLN 239 CO -0.16 -0.01 0.28 0.28 -0.67 0.00 0.00 178.83 178.55 2h1n h VAL 240 N -0.01 1.13 -0.15 -0.54 2.07 -0.92 -1.38 116.25 116.44 2h1n h VAL 240 Ca 0.02 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 2h1n h VAL 240 Cb 0.04 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2h1n h VAL 240 CO -0.04 0.12 -0.11 0.50 0.02 0.00 0.00 177.57 178.06 2h1n h LYS 241 N 0.59 0.23 0.17 1.57 3.64 -0.45 0.02 116.57 122.33 2h1n h LYS 241 Ca 0.16 -0.05 -0.26 0.00 -1.27 0.00 0.00 60.65 59.23 2h1n h LYS 241 Cb -0.04 -0.03 0.02 0.00 -0.41 0.00 0.00 32.23 31.77 2h1n h LYS 241 CO -0.03 0.35 -1.21 1.15 -2.27 0.00 0.00 179.45 177.44 2h1n h THR 242 N 0.22 1.28 0.00 1.00 2.02 -0.72 -3.32 112.91 113.39 2h1n h THR 242 Ca 0.05 -2.54 -0.29 0.00 0.77 0.00 0.00 66.41 64.40 2h1n h THR 242 Cb 0.33 3.00 -0.05 0.00 -1.74 0.00 0.00 68.15 69.69 2h1n h THR 242 CO 0.02 0.75 -2.08 1.41 0.37 0.00 0.00 175.52 175.99 2h1n n HIS 243 N -3.93 0.34 -0.02 3.16 8.25 -0.55 -4.55 115.22 117.92 2h1n n HIS 243 Ca -0.19 0.12 -0.18 0.00 -0.26 0.00 0.00 57.72 57.21 2h1n n HIS 243 Cb 0.93 -1.00 -0.14 0.00 1.12 0.00 0.00 29.99 30.90 2h1n n HIS 243 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2h1n n ILE 244 N -2.78 1.69 -0.25 1.59 2.08 -0.02 -4.02 119.36 117.66 2h1n n ILE 244 Ca -0.23 -0.68 -0.05 0.00 0.56 0.00 0.00 62.75 62.34 2h1n n ILE 244 Cb 1.03 -1.51 0.05 0.00 -0.75 0.00 0.00 39.64 38.46 2h1n n ILE 244 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 2h1n h VAL 245 N 0.05 1.19 -0.29 1.39 2.07 -1.64 0.23 116.25 119.25 2h1n h VAL 245 Ca -0.43 -0.39 -0.06 0.00 0.82 0.00 0.00 66.70 66.64 2h1n h VAL 245 Cb 2.02 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 2h1n h VAL 245 CO 0.06 0.19 -0.09 -0.65 0.02 0.00 0.00 177.57 177.09 2h1n h PRO 246 N 0.94 0.47 -0.17 1.57 0.11 -1.80 -2.37 132.00 130.74 2h1n h PRO 246 Ca 0.25 -0.12 -0.06 0.00 0.11 0.00 0.00 66.00 66.18 2h1n h PRO 246 Cb -0.06 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 30.99 2h1n h PRO 246 CO -0.05 0.57 -0.13 1.25 -0.21 0.00 0.00 178.00 179.43 2h1n h LEU 247 N 0.44 0.41 -1.17 2.35 6.46 -1.41 -2.81 115.31 119.58 2h1n h LEU 247 Ca 0.09 -0.45 0.11 0.00 -0.12 0.00 0.00 57.88 57.50 2h1n h LEU 247 Cb 0.44 -0.11 -0.07 0.00 -0.73 0.00 0.00 40.66 40.18 2h1n h LEU 247 CO 0.02 0.78 0.59 0.00 -0.62 0.00 0.00 178.44 179.21 2h1n h ALA 248 N 0.65 1.63 -0.97 1.25 0.00 -0.43 -0.05 119.26 121.33 2h1n h ALA 248 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2h1n h ALA 248 Cb 0.64 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 2h1n h ALA 248 CO 0.03 0.16 0.61 0.00 0.00 0.00 0.00 179.25 180.06 2h1n h ALA 249 N 1.55 1.25 -0.43 0.00 0.00 -1.25 -0.72 119.26 119.67 2h1n h ALA 249 Ca 0.44 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.20 2h1n h ALA 249 Cb 0.46 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2h1n h ALA 249 CO -0.20 0.67 0.05 -0.22 0.00 0.00 0.00 179.25 179.55 2h1n h LYS 250 N 1.33 0.73 -0.30 0.00 3.64 -0.80 -1.46 116.57 119.72 2h1n h LYS 250 Ca 0.35 -0.21 -0.11 0.00 -1.27 0.00 0.00 60.65 59.42 2h1n h LYS 250 Cb -0.10 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 2h1n h LYS 250 CO -0.07 0.78 -0.23 -0.07 -2.27 0.00 0.00 179.45 177.59 2h1n h LEU 251 N 0.58 0.72 -1.14 5.20 3.38 -0.96 -1.36 115.31 121.73 2h1n h LEU 251 Ca 0.13 -0.45 -0.05 0.00 0.09 0.00 0.00 57.88 57.61 2h1n h LEU 251 Cb 0.41 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2h1n h LEU 251 CO 0.01 1.01 0.10 0.03 0.09 0.00 0.00 178.44 179.69 2h1n h ARG 252 N 0.43 0.71 -0.06 1.13 2.47 -1.13 0.55 114.38 118.48 2h1n h ARG 252 Ca 0.06 -0.14 -0.01 0.00 -1.26 0.00 0.00 59.98 58.63 2h1n h ARG 252 Cb 0.78 -0.11 -0.00 0.00 -1.65 0.00 0.00 29.97 28.99 2h1n h ARG 252 CO 0.06 0.65 0.01 1.49 0.56 0.00 0.00 179.97 182.75 2h1n h GLU 253 N 0.69 0.09 -0.79 0.04 4.57 -1.00 0.91 114.58 119.09 2h1n h GLU 253 Ca 0.15 -0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.44 2h1n h GLU 253 Cb 0.27 -0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 28.77 2h1n h GLU 253 CO -0.00 0.30 0.39 0.00 -1.18 0.00 0.00 179.01 178.52 2h1n h ARG 254 N -0.13 0.58 0.84 1.92 3.08 -0.90 -2.48 114.38 117.28 2h1n h ARG 254 Ca 0.02 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 2h1n h ARG 254 Cb 0.25 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 30.18 2h1n h ARG 254 CO 0.00 0.38 -0.41 0.37 -1.07 0.00 0.00 179.97 179.24 2h1n h GLN 255 N 0.60 -1.10 -1.17 0.04 4.15 -0.49 -2.22 115.11 114.93 2h1n h GLN 255 Ca 0.41 0.07 0.34 0.00 0.77 0.00 0.00 58.65 60.25 2h1n h GLN 255 Cb 0.53 0.25 -0.10 0.00 0.21 0.00 0.00 27.48 28.37 2h1n h GLN 255 CO -0.33 -0.73 0.77 -0.09 -1.93 0.00 0.00 178.83 176.51 2h1n h ARG 256 N -1.14 0.23 0.03 1.69 2.43 -0.48 -0.91 114.38 116.22 2h1n h ARG 256 Ca -0.11 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 58.94 2h1n h ARG 256 Cb 0.88 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 30.39 2h1n h ARG 256 CO 0.18 0.15 -0.40 1.96 -1.51 0.00 0.00 179.97 180.35 2h1n h GLN 257 N 0.23 0.22 -0.03 0.20 4.20 -1.17 -2.77 115.11 115.99 2h1n h GLN 257 Ca 0.68 -0.28 -0.21 0.00 0.06 0.00 0.00 58.65 58.90 2h1n h GLN 257 Cb 2.01 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 29.88 2h1n h GLN 257 CO -0.30 1.03 -0.86 0.07 -0.67 0.00 0.00 178.83 178.11 2h1n h ARG 258 N -0.46 0.40 0.00 1.46 0.11 -0.59 -1.34 114.38 113.95 2h1n h ARG 258 Ca -0.06 -0.39 0.00 0.00 0.10 0.00 0.00 59.98 59.64 2h1n h ARG 258 Cb 1.20 0.10 0.00 0.00 1.11 0.00 0.00 29.97 32.38 2h1n h ARG 258 CO 0.08 1.05 0.00 1.51 0.10 0.00 0.00 179.97 182.70 2h1n n ILE 259 N -3.77 0.89 -2.87 0.08 3.06 -0.62 -4.16 119.36 111.96 2h1n n ILE 259 Ca -0.06 0.22 -0.01 0.00 -2.50 0.00 0.00 62.75 60.40 2h1n n ILE 259 Cb 0.78 -0.95 0.00 0.00 0.54 0.00 0.00 39.64 40.01 2h1n n ILE 259 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2h1n n GLN 260 N -1.48 -1.36 -3.73 9.51 6.02 -0.51 -4.84 117.38 120.99 2h1n n GLN 260 Ca 0.04 1.50 -0.14 0.00 -0.01 0.00 0.00 57.00 58.40 2h1n n GLN 260 Cb 0.18 -5.33 -0.09 0.00 1.02 0.00 0.00 30.24 26.02 2h1n n GLN 260 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2h1n s VAL 261 N -2.90 0.02 -0.04 5.09 0.11 -1.06 -5.06 120.40 116.57 2h1n s VAL 261 Ca 0.04 -0.18 -0.17 0.00 -2.93 0.00 0.00 61.98 58.74 2h1n s VAL 261 Cb -0.01 -0.62 -0.10 0.00 -1.53 0.00 0.00 36.38 34.11 2h1n s VAL 261 CO 0.68 -0.10 0.72 -0.08 -3.33 0.00 0.00 175.10 172.98 2h1n h GLU 262 N 4.67 -0.47 -6.24 1.54 4.81 -1.97 -3.44 114.58 113.47 2h1n h GLU 262 Ca -0.28 0.03 -0.68 0.00 -0.13 0.00 0.00 59.36 58.30 2h1n h GLU 262 Cb 1.18 0.11 -0.19 0.00 0.63 0.00 0.00 28.75 30.47 2h1n h GLU 262 CO 0.32 -0.23 -0.71 0.15 -0.73 0.00 0.00 179.01 177.80 2h1n s LYS 263 N -3.44 2.61 -0.83 1.92 -0.14 -1.26 -5.07 119.74 113.53 2h1n s LYS 263 Ca -0.09 -0.65 -0.19 0.00 -1.36 0.00 0.00 55.97 53.67 2h1n s LYS 263 Cb 0.01 -2.51 0.12 0.00 -1.68 0.00 0.00 37.83 33.76 2h1n s LYS 263 CO 0.31 0.63 1.03 -1.17 -0.76 0.00 0.00 175.35 175.39 2h1n s LEU 264 N -1.07 5.02 0.84 3.17 2.96 -1.26 -5.02 118.68 123.31 2h1n s LEU 264 Ca 0.14 -1.78 -0.12 0.00 -0.22 0.00 0.00 54.13 52.15 2h1n s LEU 264 Cb -0.11 -2.38 0.09 0.00 0.50 0.00 0.00 46.19 44.29 2h1n s LEU 264 CO 0.04 -1.13 1.17 -0.31 -1.32 0.00 0.00 176.35 174.80 2h1n s TYR 265 N 2.87 2.84 0.48 5.38 1.51 -1.26 -4.59 117.35 124.59 2h1n s TYR 265 Ca 0.28 0.77 0.19 0.00 -1.01 0.00 0.00 57.07 57.30 2h1n s TYR 265 Cb -0.10 -3.48 1.21 0.00 -0.11 0.00 0.00 41.96 39.49 2h1n s TYR 265 CO -0.04 -1.93 1.99 0.10 -1.11 0.00 0.00 175.55 174.57 2h1n h TYR 266 N -1.17 0.22 -0.00 2.71 -0.00 -1.66 0.24 116.97 117.30 2h1n h TYR 266 Ca -0.47 0.01 0.00 0.00 -0.00 0.00 0.00 58.73 58.26 2h1n h TYR 266 Cb 1.33 -0.07 0.00 0.00 -0.00 0.00 0.00 36.73 37.99 2h1n h TYR 266 CO 0.30 0.10 -0.07 2.48 -0.00 0.00 0.00 178.16 180.96 2h1n n TYR 267 N -4.44 0.00 -0.06 0.10 0.18 -1.26 -3.28 117.16 108.40 2h1n n TYR 267 Ca 0.09 0.00 -0.08 0.00 1.88 0.00 0.00 57.90 59.80 2h1n n TYR 267 Cb 0.47 -0.14 -0.15 0.00 -0.38 0.00 0.00 39.34 39.15 2h1n n TYR 267 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 2h1n n ASP 268 N -0.86 0.38 -0.25 9.48 8.00 0.81 -4.61 116.55 129.49 2h1n n ASP 268 Ca 0.16 0.18 0.05 0.00 0.71 0.00 0.00 54.79 55.89 2h1n n ASP 268 Cb 0.26 0.60 0.18 0.00 -0.02 0.00 0.00 41.12 42.14 2h1n n ASP 268 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2h1n h GLU 269 N 0.00 0.38 0.00 -1.24 5.08 -1.41 0.24 114.58 117.62 2h1n h GLU 269 Ca -0.40 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2h1n h GLU 269 Cb 2.06 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 31.22 2h1n h GLU 269 CO 0.05 0.25 0.00 -0.35 -1.00 0.00 0.00 179.01 177.96 2h1n n PRO 270 N -5.05 0.51 -3.96 2.33 -0.04 -1.26 -5.11 135.00 122.42 2h1n n PRO 270 Ca 0.14 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.39 2h1n n PRO 270 Cb 0.43 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 2h1n n PRO 270 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2h1n s PHE 271 N -2.02 3.22 0.40 0.54 5.36 0.83 -4.85 117.98 121.46 2h1n s PHE 271 Ca 0.25 -0.11 -0.23 0.00 -0.96 0.00 0.00 56.93 55.88 2h1n s PHE 271 Cb 0.11 -1.57 -0.13 0.00 -0.34 0.00 0.00 43.02 41.09 2h1n s PHE 271 CO 0.19 0.40 0.49 1.19 -1.46 0.00 0.00 175.22 176.04 2h1n n PHE 273 N -1.33 -0.66 0.15 10.12 3.01 -1.26 -4.91 117.46 122.57 2h1n n PHE 273 Ca -0.07 0.63 0.01 0.00 1.01 0.00 0.00 57.45 59.04 2h1n n PHE 273 Cb 0.58 -1.97 0.33 0.00 -0.01 0.00 0.00 39.48 38.41 2h1n n PHE 273 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2h1n h PRO 274 N 0.78 0.09 0.00 -1.08 0.13 -1.89 -0.79 132.00 129.25 2h1n h PRO 274 Ca -0.39 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2h1n h PRO 274 Cb 1.41 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.53 2h1n h PRO 274 CO 0.51 0.43 0.00 0.25 -0.23 0.00 0.00 178.00 178.97 2h1n n THR 275 N -4.10 0.85 0.00 1.56 -2.24 -1.26 -4.99 114.28 104.10 2h1n n THR 275 Ca -0.02 0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 2h1n n THR 275 Cb 0.41 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.70 2h1n n THR 275 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h1n n GLY 276 N 0.19 3.17 3.75 3.38 0.00 -0.30 -5.06 105.19 110.33 2h1n n GLY 276 Ca 0.04 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 44.00 2h1n n GLY 276 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2h1n s ASN 277 N 0.00 5.43 0.33 1.61 0.01 -1.26 -4.57 114.94 116.49 2h1n s ASN 277 Ca 0.00 2.58 -0.29 0.00 -0.71 0.00 0.00 52.86 54.44 2h1n s ASN 277 Cb 0.00 -2.62 -0.11 0.00 0.41 0.00 0.00 41.25 38.93 2h1n s ASN 277 CO 0.00 -1.44 1.51 -2.16 -1.51 0.00 0.00 177.10 173.50 2h1n s PRO 278 N -2.96 4.15 0.07 -0.60 0.04 -1.26 -4.97 135.00 129.47 2h1n s PRO 278 Ca 0.71 2.52 0.06 0.00 0.04 0.00 0.00 61.00 64.33 2h1n s PRO 278 Cb -0.36 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.15 2h1n s PRO 278 CO 0.41 -0.53 -0.16 0.95 0.04 0.00 0.00 177.00 177.71 2h1n s THR 279 N -0.59 1.24 0.43 1.26 -4.23 -1.26 -3.34 115.64 109.15 2h1n s THR 279 Ca 0.57 -1.26 -0.26 0.00 -1.18 0.00 0.00 61.69 59.56 2h1n s THR 279 Cb -0.46 -1.15 -0.09 0.00 1.34 0.00 0.00 72.50 72.14 2h1n s THR 279 CO 0.55 -0.11 1.41 -2.84 -0.54 0.00 0.00 174.62 173.08 2h1n s PRO 280 N -1.58 3.83 -0.41 3.99 0.02 -1.26 -4.69 135.00 134.90 2h1n s PRO 280 Ca 0.01 2.39 -0.00 0.00 0.02 0.00 0.00 61.00 63.42 2h1n s PRO 280 Cb -0.09 -2.74 0.33 0.00 0.02 0.00 0.00 34.50 32.02 2h1n s PRO 280 CO 0.02 -0.70 1.93 1.63 -0.33 0.00 0.00 177.00 179.56 2h1n n LYS 281 N 0.00 2.05 0.00 5.54 4.76 -0.59 -4.93 118.16 124.99 2h1n n LYS 281 Ca 0.04 -2.12 0.00 0.00 -2.87 0.00 0.00 58.31 53.36 2h1n n LYS 281 Cb 0.42 -1.83 0.00 0.00 -1.84 0.00 0.00 35.03 31.77 2h1n n LYS 281 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2h1n n GLY 282 N -0.20 0.88 1.87 0.72 0.00 -1.26 -5.07 105.19 102.12 2h1n n GLY 282 Ca 0.41 -0.84 -0.15 0.00 0.00 0.00 0.00 46.02 45.44 2h1n n GLY 282 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2h1n n ASP 283 N 0.00 -0.56 -0.19 1.61 5.68 -1.26 -4.54 116.55 117.29 2h1n n ASP 283 Ca 0.00 -1.09 -0.01 0.00 -0.50 0.00 0.00 54.79 53.19 2h1n n ASP 283 Cb 0.00 -0.51 0.09 0.00 -1.14 0.00 0.00 41.12 39.56 2h1n n ASP 283 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2h1n h ALA 284 N -2.08 0.73 -0.55 2.12 0.00 -2.00 0.25 119.26 117.74 2h1n h ALA 284 Ca -0.21 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2h1n h ALA 284 Cb 0.61 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2h1n h ALA 284 CO 0.15 -0.19 0.14 -0.44 0.00 0.00 0.00 179.25 178.91 2h1n h ASP 285 N 0.41 0.83 -0.34 0.00 3.45 -1.99 -0.83 116.42 117.95 2h1n h ASP 285 Ca 0.28 -0.23 0.01 0.00 0.43 0.00 0.00 57.03 57.53 2h1n h ASP 285 Cb 0.33 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.86 2h1n h ASP 285 CO -0.28 0.84 0.20 -0.25 -1.57 0.00 0.00 179.24 178.19 2h1n h TRP 286 N 0.78 0.38 -0.24 4.55 7.01 -1.72 0.53 115.95 127.24 2h1n h TRP 286 Ca 0.17 0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.23 2h1n h TRP 286 Cb 0.33 -0.12 -0.05 0.00 -2.10 0.00 0.00 29.16 27.22 2h1n h TRP 286 CO 0.02 0.23 -0.07 0.82 -2.79 0.00 0.00 178.44 176.65 2h1n h ILE 287 N 0.42 0.75 -0.81 2.65 2.04 -0.73 -1.33 117.51 120.49 2h1n h ILE 287 Ca 0.14 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.95 2h1n h ILE 287 Cb -0.00 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 2h1n h ILE 287 CO -0.06 0.00 0.34 0.58 0.00 0.00 0.00 178.15 179.01 2h1n h VAL 288 N -0.01 1.26 -0.34 1.67 2.07 -0.83 0.15 116.25 120.22 2h1n h VAL 288 Ca 0.12 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.80 2h1n h VAL 288 Cb 0.19 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 2h1n h VAL 288 CO -0.25 0.33 0.07 -0.61 0.02 0.00 0.00 177.57 177.13 2h1n h GLN 289 N 1.18 0.55 -0.18 1.57 4.15 -0.56 0.15 115.11 121.97 2h1n h GLN 289 Ca 0.27 -0.14 -0.03 0.00 0.77 0.00 0.00 58.65 59.52 2h1n h GLN 289 Cb 0.19 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 2h1n h GLN 289 CO -0.03 0.62 -0.04 -0.91 -1.93 0.00 0.00 178.83 176.54 2h1n h ASN 290 N 0.40 0.25 -0.70 -0.69 2.35 -1.04 -1.96 115.58 114.18 2h1n h ASN 290 Ca 0.11 -0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.76 2h1n h ASN 290 Cb 0.32 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.59 2h1n h ASN 290 CO 0.00 0.33 0.20 1.23 -1.65 0.00 0.00 177.43 177.55 2h1n h GLY 291 N 0.62 1.19 1.01 2.83 0.00 0.05 -2.86 103.07 105.90 2h1n h GLY 291 Ca 0.06 -0.71 0.01 0.00 0.00 0.00 0.00 47.33 46.69 2h1n h GLY 291 CO 0.01 0.66 0.47 -0.09 0.00 0.00 0.00 176.54 177.60 2h1n h ARG 292 N 1.06 0.96 -1.19 4.80 2.43 -0.01 -2.29 114.38 120.14 2h1n h ARG 292 Ca 0.23 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2h1n h ARG 292 Cb 0.32 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 2h1n h ARG 292 CO -0.00 0.65 0.00 0.94 -1.51 0.00 0.00 179.97 180.04 2h1n n GLN 293 N -4.57 0.40 0.00 0.20 7.27 -0.89 -2.51 117.38 117.29 2h1n n GLN 293 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.14 2h1n n GLN 293 Cb 0.02 -1.27 0.00 0.00 2.41 0.00 0.00 30.24 31.41 2h1n n GLN 293 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2h1n n TYR 295 N 0.63 0.00 -0.08 3.69 0.53 -0.86 -1.11 117.16 119.95 2h1n n TYR 295 Ca 0.00 0.00 -0.13 0.00 -1.02 0.00 0.00 57.90 56.75 2h1n n TYR 295 Cb 0.17 0.00 -0.05 0.00 -1.03 0.00 0.00 39.34 38.43 2h1n n TYR 295 CO 0.00 0.00 0.00 0.93 -1.02 0.00 0.00 176.86 176.77 2h1n h GLU 296 N 0.00 0.58 -0.07 -0.72 5.08 -1.72 -1.55 114.58 116.18 2h1n h GLU 296 Ca 0.00 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 57.98 2h1n h GLU 296 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2h1n h GLU 296 CO 0.00 0.87 -0.39 0.93 -1.00 0.00 0.00 179.01 179.42 2h1n h GLU 297 N 0.29 0.14 0.37 2.33 5.08 -1.40 -3.33 114.58 118.06 2h1n h GLU 297 Ca 0.05 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2h1n h GLU 297 Cb 0.74 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2h1n h GLU 297 CO 0.05 0.51 -0.18 1.25 -1.00 0.00 0.00 179.01 179.65 2h1n h LEU 298 N 0.12 -0.42 -7.08 1.33 6.46 -1.81 -3.47 115.31 110.44 2h1n h LEU 298 Ca 0.01 -0.14 -0.05 0.00 -0.12 0.00 0.00 57.88 57.58 2h1n h LEU 298 Cb 0.75 0.11 -0.16 0.00 -0.73 0.00 0.00 40.66 40.63 2h1n h LEU 298 CO 0.06 -0.03 0.14 -0.94 -0.62 0.00 0.00 178.44 177.04 2h1n s SER 299 N -5.00 -0.55 0.42 1.25 1.04 -1.18 -5.03 113.70 104.65 2h1n s SER 299 Ca -0.14 0.30 0.10 0.00 0.48 0.00 0.00 55.95 56.69 2h1n s SER 299 Cb 0.02 0.54 0.93 0.00 0.10 0.00 0.00 66.02 67.60 2h1n s SER 299 CO 0.50 -0.76 2.03 1.55 0.98 0.00 0.00 173.24 177.54 2h1n h PRO 300 N 2.62 0.48 -0.13 4.02 0.13 -1.84 -1.67 132.00 135.62 2h1n h PRO 300 Ca -0.31 -0.03 -0.23 0.00 -0.87 0.00 0.00 66.00 64.57 2h1n h PRO 300 Cb 1.22 -0.11 0.01 0.00 0.13 0.00 0.00 31.00 32.25 2h1n h PRO 300 CO 0.40 0.32 -0.82 1.05 -0.23 0.00 0.00 178.00 178.72 2h1n h GLU 301 N 0.50 0.78 -0.02 0.86 9.09 -1.95 -1.93 114.58 121.89 2h1n h GLU 301 Ca 0.19 -0.66 -0.11 0.00 0.05 0.00 0.00 59.36 58.83 2h1n h GLU 301 Cb 0.15 0.15 -0.01 0.00 -1.65 0.00 0.00 28.75 27.39 2h1n h GLU 301 CO -0.05 1.26 -0.48 1.79 0.05 0.00 0.00 179.01 181.58 2h1n h THR 302 N 0.52 1.35 0.46 -1.06 1.35 -1.74 -1.59 112.91 112.20 2h1n h THR 302 Ca -0.06 -1.68 -0.02 0.00 -0.55 0.00 0.00 66.41 64.10 2h1n h THR 302 Cb 1.45 1.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 2h1n h THR 302 CO 0.17 0.48 -0.22 1.23 -0.25 0.00 0.00 175.52 176.93 2h1n h GLY 303 N 1.43 -0.64 0.09 5.82 0.00 -0.30 -0.57 103.07 108.90 2h1n h GLY 303 Ca -0.00 0.24 0.09 0.00 0.00 0.00 0.00 47.33 47.66 2h1n h GLY 303 CO 0.07 -0.23 -0.09 -2.09 0.00 0.00 0.00 176.54 174.19 2h1n h GLU 304 N -0.80 0.02 0.04 4.80 4.81 -1.32 -1.73 114.58 120.40 2h1n h GLU 304 Ca -0.06 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2h1n h GLU 304 Cb 0.55 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 2h1n h GLU 304 CO 0.10 0.01 -0.04 0.35 -0.73 0.00 0.00 179.01 178.70 2h1n h PHE 305 N 0.02 -0.11 -0.02 0.92 3.57 -1.24 -2.11 116.94 117.97 2h1n h PHE 305 Ca 0.23 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.58 2h1n h PHE 305 Cb 0.35 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.12 2h1n h PHE 305 CO -0.38 -0.07 -0.68 0.35 -2.23 0.00 0.00 178.31 175.30 2h1n h PHE 306 N -0.10 0.15 0.00 0.41 3.57 -0.91 -2.27 116.94 117.80 2h1n h PHE 306 Ca 0.00 -0.07 -0.08 0.00 3.53 0.00 0.00 57.97 61.36 2h1n h PHE 306 Cb 0.10 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2h1n h PHE 306 CO -0.10 0.76 -0.36 -0.09 -2.23 0.00 0.00 178.31 176.29 2h1n h ARG 307 N 0.08 0.00 -1.30 1.11 1.12 -1.31 -2.20 114.38 111.87 2h1n h ARG 307 Ca -0.01 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.86 2h1n h ARG 307 Cb 1.21 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.17 2h1n h ARG 307 CO 0.10 0.36 0.00 0.98 -3.11 0.00 0.00 179.97 178.30 2h1n n TYR 308 N -3.77 0.00 0.00 2.20 9.36 -0.80 -1.95 117.16 122.20 2h1n n TYR 308 Ca -0.01 -0.15 0.00 0.00 3.32 0.00 0.00 57.90 61.06 2h1n n TYR 308 Cb 0.44 -0.13 0.00 0.00 -0.63 0.00 0.00 39.34 39.02 2h1n n TYR 308 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2h1n n VAL 310 N 0.68 0.00 0.18 2.97 0.31 -0.83 -2.47 118.33 119.17 2h1n n VAL 310 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.36 2h1n n VAL 310 Cb 0.17 0.00 0.34 0.00 -0.91 0.00 0.00 33.84 33.45 2h1n n VAL 310 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2h1n h GLU 311 N 0.00 0.00 -0.46 5.55 5.08 -1.66 -2.32 114.58 120.77 2h1n h GLU 311 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2h1n h GLU 311 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2h1n h GLU 311 CO 0.00 0.40 0.00 0.72 -1.00 0.00 0.00 179.01 179.13 2h1n n HIS 312 N -3.96 0.60 -3.84 4.33 8.25 -1.03 -4.73 115.22 114.83 2h1n n HIS 312 Ca -0.02 -0.30 -0.28 0.00 -0.26 0.00 0.00 57.72 56.87 2h1n n HIS 312 Cb 0.44 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.56 2h1n n HIS 312 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2h1n n GLU 313 N 1.22 -2.61 -3.01 -0.41 1.02 -0.87 -1.60 120.64 114.38 2h1n n GLU 313 Ca 0.19 0.43 -0.44 0.00 -0.02 0.00 0.00 57.16 57.33 2h1n n GLU 313 Cb 0.52 -4.38 0.00 0.00 -0.02 0.00 0.00 31.44 27.57 2h1n n GLU 313 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2h1n n LEU 314 N -4.33 5.90 -3.41 -4.62 4.77 -1.26 -4.26 117.00 109.78 2h1n n LEU 314 Ca -0.23 -4.92 -0.16 0.00 -0.03 0.00 0.00 56.01 50.68 2h1n n LEU 314 Cb 0.65 -1.45 -0.10 0.00 -2.33 0.00 0.00 43.42 40.19 2h1n n LEU 314 CO 0.72 1.33 -0.16 -0.62 -1.33 0.00 0.00 177.39 177.33 2h1n s ASP 316 N 0.66 1.31 -0.14 -1.43 -1.08 -0.12 -1.36 116.67 114.51 2h1n s ASP 316 Ca 0.35 -0.45 0.18 0.00 -0.52 0.00 0.00 52.55 52.11 2h1n s ASP 316 Cb -0.01 0.61 -0.26 0.00 -1.46 0.00 0.00 42.92 41.79 2h1n s ASP 316 CO 0.00 -0.36 0.19 0.18 0.52 0.00 0.00 175.17 175.70 2h1n n LEU 317 N 5.32 0.00 -4.85 -1.34 4.77 -1.26 -1.87 117.00 117.77 2h1n n LEU 317 Ca -0.03 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.58 2h1n n LEU 317 Cb 0.48 0.33 -0.06 0.00 -2.33 0.00 0.00 43.42 41.84 2h1n n LEU 317 CO 0.03 0.33 0.03 -0.69 -1.33 0.00 0.00 177.39 175.76 2h1n s VAL 318 N -2.77 5.15 0.17 4.08 1.01 -1.25 -0.04 120.40 126.75 2h1n s VAL 318 Ca -0.09 0.59 -0.32 0.00 0.00 0.00 0.00 61.98 62.16 2h1n s VAL 318 Cb 0.08 -3.63 -0.10 0.00 0.00 0.00 0.00 36.38 32.73 2h1n s VAL 318 CO 0.81 0.51 1.59 0.00 0.00 0.00 0.00 175.10 178.01 2h1n s ALA 319 N -1.15 3.80 0.08 5.51 0.00 -0.80 -4.61 121.76 124.59 2h1n s ALA 319 Ca 0.24 1.41 0.02 0.00 0.00 0.00 0.00 51.96 53.63 2h1n s ALA 319 Cb -0.15 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.30 2h1n s ALA 319 CO 0.13 -0.80 -0.07 0.15 0.00 0.00 0.00 175.76 175.17 2h1n s LYS 320 N 1.11 0.73 0.16 0.00 1.02 -1.26 -4.93 119.74 116.57 2h1n s LYS 320 Ca 0.71 -1.13 -0.34 0.00 0.02 0.00 0.00 55.97 55.22 2h1n s LYS 320 Cb -0.45 -0.24 -0.14 0.00 -0.52 0.00 0.00 37.83 36.49 2h1n s LYS 320 CO 0.32 0.01 1.55 1.63 -0.92 0.00 0.00 175.35 177.93 2h1n n LYS 321 N 0.48 2.07 -0.97 1.68 4.01 -1.26 -1.50 118.16 122.66 2h1n n LYS 321 Ca -0.16 0.75 0.00 0.00 -0.51 0.00 0.00 58.31 58.39 2h1n n LYS 321 Cb 0.59 -2.50 0.00 0.00 -0.51 0.00 0.00 35.03 32.61 2h1n n LYS 321 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2h1n n GLY 322 N 3.29 0.72 3.80 0.72 0.00 -1.24 -4.90 105.19 107.58 2h1n n GLY 322 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 2h1n n GLY 322 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2h1n s LYS 323 N -0.13 4.38 0.79 1.61 2.20 -0.56 -1.34 119.74 126.69 2h1n s LYS 323 Ca 0.00 1.04 -0.13 0.00 -0.36 0.00 0.00 55.97 56.52 2h1n s LYS 323 Cb 0.00 -2.89 0.08 0.00 -1.51 0.00 0.00 37.83 33.51 2h1n s LYS 323 CO 0.00 0.37 1.19 0.00 -0.36 0.00 0.00 175.35 176.55 2h1n s ALA 324 N -1.52 1.90 0.65 3.13 0.00 0.02 -4.51 121.76 121.44 2h1n s ALA 324 Ca 0.45 0.78 -0.08 0.00 0.00 0.00 0.00 51.96 53.11 2h1n s ALA 324 Cb -0.18 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.50 2h1n s ALA 324 CO 0.22 -2.19 0.99 0.20 0.00 0.00 0.00 175.76 174.98 2h1n s GLY 325 N -2.27 1.62 0.00 0.00 0.00 -1.26 -4.94 107.32 100.48 2h1n s GLY 325 Ca 0.72 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.81 2h1n s GLY 325 CO 0.50 -0.29 0.00 0.61 0.00 0.00 0.00 173.10 173.92 2h1n n GLY 326 N -2.79 -1.76 3.09 0.20 0.00 -1.26 -4.97 105.19 97.70 2h1n n GLY 326 Ca 0.06 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.33 2h1n n GLY 326 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h1n s GLY 327 N -0.21 -0.10 0.25 -0.02 0.00 -1.26 -3.49 107.32 102.50 2h1n s GLY 327 Ca 0.00 0.38 -0.00 0.00 0.00 0.00 0.00 44.72 45.09 2h1n s GLY 327 CO 0.00 0.28 0.33 1.58 0.00 0.00 0.00 173.10 175.30 2h1n n TYR 328 N 2.54 -1.09 -3.43 1.90 0.18 -0.37 -4.98 117.16 111.91 2h1n n TYR 328 Ca -0.15 -1.77 -0.12 0.00 1.88 0.00 0.00 57.90 57.74 2h1n n TYR 328 Cb 0.58 0.38 -0.10 0.00 -0.38 0.00 0.00 39.34 39.81 2h1n n TYR 328 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2h1n n THR 330 N 5.35 0.00 -4.27 0.00 -2.24 -1.15 -4.89 114.28 107.08 2h1n n THR 330 Ca -0.05 -1.48 -0.26 0.00 -2.27 0.00 0.00 64.05 59.99 2h1n n THR 330 Cb 0.50 -0.29 -0.17 0.00 -2.10 0.00 0.00 70.33 68.27 2h1n n THR 330 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2h1n s TYR 331 N -1.81 1.58 -0.62 4.78 5.04 -1.26 -1.47 117.35 123.58 2h1n s TYR 331 Ca 0.27 -0.71 -0.18 0.00 -2.44 0.00 0.00 57.07 54.01 2h1n s TYR 331 Cb -0.02 -1.21 0.12 0.00 0.35 0.00 0.00 41.96 41.20 2h1n s TYR 331 CO 0.17 -0.42 0.69 0.42 -1.34 0.00 0.00 175.55 175.07 2h1n s ILE 332 N 1.16 4.98 0.10 3.14 1.01 -0.06 -4.85 121.20 126.68 2h1n s ILE 332 Ca -0.05 -1.29 -0.27 0.00 0.00 0.00 0.00 60.65 59.05 2h1n s ILE 332 Cb -0.14 -4.47 -0.13 0.00 0.01 0.00 0.00 42.46 37.73 2h1n s ILE 332 CO -0.03 -1.09 1.67 0.44 0.00 0.00 0.00 174.94 175.94 2h1n h ASP 333 N 8.96 -0.48 0.22 3.58 3.45 -1.85 -1.00 116.42 129.29 2h1n h ASP 333 Ca -0.23 0.04 -0.02 0.00 0.43 0.00 0.00 57.03 57.25 2h1n h ASP 333 Cb 1.08 0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 40.01 2h1n h ASP 333 CO 1.05 -0.28 -0.11 0.44 -1.57 0.00 0.00 179.24 178.77 2h1n h ASP 334 N -0.41 0.00 0.02 6.45 3.32 -1.94 0.10 116.42 123.97 2h1n h ASP 334 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2h1n h ASP 334 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2h1n h ASP 334 CO -0.03 0.11 -0.11 -1.22 -1.72 0.00 0.00 179.24 176.27 2h1n n TYR 335 N -3.96 0.00 -3.86 4.55 4.02 -1.03 -4.97 117.16 111.91 2h1n n TYR 335 Ca -0.02 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.63 2h1n n TYR 335 Cb 0.20 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 2h1n n TYR 335 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2h1n n LYS 336 N 0.40 -3.99 -3.73 -0.72 5.02 0.36 -4.97 118.16 110.54 2h1n n LYS 336 Ca 0.15 0.49 -0.24 0.00 -2.02 0.00 0.00 58.31 56.70 2h1n n LYS 336 Cb 0.45 -4.82 -0.17 0.00 -0.02 0.00 0.00 35.03 30.47 2h1n n LYS 336 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2h1n s ALA 337 N -3.82 0.63 0.68 7.82 0.00 -1.05 -5.00 121.76 121.03 2h1n s ALA 337 Ca 0.04 -0.19 -0.12 0.00 0.00 0.00 0.00 51.96 51.69 2h1n s ALA 337 Cb -0.02 -0.83 0.01 0.00 0.00 0.00 0.00 23.12 22.27 2h1n s ALA 337 CO 0.86 -0.68 1.06 -2.14 0.00 0.00 0.00 175.76 174.86 2h1n s PRO 338 N 2.01 2.92 -0.02 0.00 0.02 -1.26 -0.88 135.00 137.80 2h1n s PRO 338 Ca 0.04 1.04 0.02 0.00 0.02 0.00 0.00 61.00 62.12 2h1n s PRO 338 Cb -0.14 -1.99 -0.00 0.00 0.02 0.00 0.00 34.50 32.40 2h1n s PRO 338 CO -0.06 -1.11 -0.08 0.12 -0.33 0.00 0.00 177.00 175.54 2h1n s PHE 339 N -2.90 0.80 -0.22 6.54 5.36 -0.54 -4.83 117.98 122.18 2h1n s PHE 339 Ca 0.60 -0.17 -0.07 0.00 -0.96 0.00 0.00 56.93 56.33 2h1n s PHE 339 Cb -0.15 -0.55 -0.03 0.00 -0.34 0.00 0.00 43.02 41.95 2h1n s PHE 339 CO 0.51 -0.06 0.04 0.42 -1.46 0.00 0.00 175.22 174.68 2h1n s ILE 340 N 0.03 4.24 -0.10 3.12 1.01 -0.46 -2.94 121.20 126.10 2h1n s ILE 340 Ca -0.00 -0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.46 2h1n s ILE 340 Cb -0.06 -2.95 -0.01 0.00 0.01 0.00 0.00 42.46 39.45 2h1n s ILE 340 CO -0.00 0.38 -0.16 0.12 0.00 0.00 0.00 174.94 175.29 2h1n s PHE 341 N 1.25 2.72 0.24 3.97 5.36 -0.79 -0.95 117.98 129.79 2h1n s PHE 341 Ca 0.04 -0.62 -0.19 0.00 -0.96 0.00 0.00 56.93 55.21 2h1n s PHE 341 Cb -0.15 -1.76 0.02 0.00 -0.34 0.00 0.00 43.02 40.79 2h1n s PHE 341 CO 0.03 -0.17 0.61 -1.54 -1.46 0.00 0.00 175.22 172.69 2h1n s SER 342 N 0.10 -0.26 -0.70 6.13 1.04 -0.78 -1.24 113.70 118.00 2h1n s SER 342 Ca -0.07 -0.57 0.05 0.00 0.48 0.00 0.00 55.95 55.83 2h1n s SER 342 Cb -0.15 0.65 0.20 0.00 0.10 0.00 0.00 66.02 66.82 2h1n s SER 342 CO 0.05 -1.20 0.61 0.59 0.98 0.00 0.00 173.24 174.27 2h1n n ASN 343 N -0.41 3.38 -4.72 7.02 3.02 -1.21 -3.82 115.26 118.51 2h1n n ASN 343 Ca -0.06 -3.30 -0.42 0.00 -0.03 0.00 0.00 54.58 50.77 2h1n n ASN 343 Cb 0.61 -0.75 -0.03 0.00 -0.61 0.00 0.00 39.78 39.00 2h1n n ASN 343 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2h1n s PHE 344 N -1.84 2.95 0.00 3.10 0.40 0.94 -4.39 117.98 119.15 2h1n s PHE 344 Ca 0.30 0.48 0.00 0.00 -0.60 0.00 0.00 56.93 57.11 2h1n s PHE 344 Cb 0.02 -4.06 0.00 0.00 0.51 0.00 0.00 43.02 39.50 2h1n s PHE 344 CO -0.11 -3.94 0.15 0.25 0.70 0.00 0.00 175.22 172.27 2h1n n THR 345 N 3.84 0.00 -0.07 0.64 -2.24 -1.26 -1.91 114.28 113.29 2h1n n THR 345 Ca 0.15 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 2h1n n THR 345 Cb 0.36 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.63 2h1n n THR 345 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h1n n GLY 346 N 0.59 0.96 3.88 3.38 0.00 -1.26 -4.77 105.19 107.97 2h1n n GLY 346 Ca 0.00 -0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 2h1n n GLY 346 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2h1n s THR 347 N -2.00 1.89 0.49 2.61 -4.23 -1.26 -4.47 115.64 108.66 2h1n s THR 347 Ca 0.00 -1.50 0.39 0.00 -1.18 0.00 0.00 61.69 59.40 2h1n s THR 347 Cb 0.00 -2.38 0.41 0.00 1.34 0.00 0.00 72.50 71.87 2h1n s THR 347 CO 0.00 0.00 2.23 0.77 -0.54 0.00 0.00 174.62 177.08 2h1n h SER 348 N 0.88 0.00 -0.25 3.99 4.64 -1.92 -1.55 113.55 119.35 2h1n h SER 348 Ca -0.38 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.01 2h1n h SER 348 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 2h1n h SER 348 CO 0.59 0.01 0.21 1.23 -0.87 0.00 0.00 176.83 178.00 2h1n h GLY 349 N 0.63 0.00 0.14 -0.77 0.00 -1.95 -1.83 103.07 99.29 2h1n h GLY 349 Ca -0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 2h1n h GLY 349 CO 0.00 0.00 -0.06 -0.55 0.00 0.00 0.00 176.54 175.94 2h1n h ASP 350 N 0.00 -0.32 -0.07 0.19 5.19 -1.62 -1.67 116.42 118.12 2h1n h ASP 350 Ca 0.12 0.13 -0.18 0.00 -0.62 0.00 0.00 57.03 56.47 2h1n h ASP 350 Cb 0.54 0.24 0.01 0.00 0.18 0.00 0.00 39.33 40.30 2h1n h ASP 350 CO -0.00 -0.11 -0.66 0.40 -3.12 0.00 0.00 179.24 175.74 2h1n h ILE 351 N 0.06 1.35 -0.87 0.35 5.03 -1.55 -2.20 117.51 119.68 2h1n h ILE 351 Ca 0.23 -1.98 0.23 0.00 -0.12 0.00 0.00 64.86 63.22 2h1n h ILE 351 Cb 0.35 2.29 -0.15 0.00 -3.03 0.00 0.00 36.82 36.28 2h1n h ILE 351 CO -0.44 0.60 0.11 0.44 -0.68 0.00 0.00 178.15 178.18 2h1n h ASP 352 N 0.18 -0.24 0.20 1.72 3.45 -1.28 -1.65 116.42 118.81 2h1n h ASP 352 Ca -0.06 0.22 -0.30 0.00 0.43 0.00 0.00 57.03 57.32 2h1n h ASP 352 Cb 1.32 0.35 0.03 0.00 -0.56 0.00 0.00 39.33 40.48 2h1n h ASP 352 CO 0.13 -0.22 -1.30 0.58 -1.57 0.00 0.00 179.24 176.86 2h1n h VAL 353 N 0.12 1.32 0.26 -1.35 2.07 -1.25 -2.52 116.25 114.90 2h1n h VAL 353 Ca 0.52 -2.60 -0.01 0.00 0.82 0.00 0.00 66.70 65.43 2h1n h VAL 353 Cb 1.03 2.98 -0.00 0.00 -1.52 0.00 0.00 31.29 33.78 2h1n h VAL 353 CO -0.73 0.78 -0.15 0.25 0.02 0.00 0.00 177.57 177.73 2h1n h LEU 354 N 0.09 -0.38 -1.02 2.57 5.85 -0.98 0.12 115.31 121.57 2h1n h LEU 354 Ca -0.22 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.43 2h1n h LEU 354 Cb 2.01 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 43.14 2h1n h LEU 354 CO 0.25 -0.25 -0.31 0.71 -0.34 0.00 0.00 178.44 178.49 2h1n h THR 355 N -0.40 1.27 0.78 1.05 1.35 -1.43 0.29 112.91 115.82 2h1n h THR 355 Ca -0.03 -1.31 -0.04 0.00 -0.55 0.00 0.00 66.41 64.49 2h1n h THR 355 Cb 0.33 1.49 0.01 0.00 -1.73 0.00 0.00 68.15 68.25 2h1n h THR 355 CO 0.03 0.40 -0.37 -0.74 -0.25 0.00 0.00 175.52 174.59 2h1n h HIS 356 N 0.28 -0.97 -0.04 4.73 -0.00 -1.20 -2.84 115.15 115.11 2h1n h HIS 356 Ca 0.04 -0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.32 2h1n h HIS 356 Cb 0.69 0.32 -0.01 0.00 -0.00 0.00 0.00 27.41 28.41 2h1n h HIS 356 CO 0.02 -0.60 -0.29 0.93 -0.00 0.00 0.00 177.93 177.98 2h1n h GLU 357 N -1.15 0.08 -0.26 5.26 4.39 -0.62 -1.64 114.58 120.64 2h1n h GLU 357 Ca -0.11 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.53 2h1n h GLU 357 Cb 0.80 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.43 2h1n h GLU 357 CO 0.17 0.37 -0.01 0.00 -1.16 0.00 0.00 179.01 178.38 2h1n h ALA 358 N 1.64 1.49 -0.33 3.43 0.00 -0.48 -0.65 119.26 124.36 2h1n h ALA 358 Ca 0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 2h1n h ALA 358 Cb 0.56 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2h1n h ALA 358 CO 0.04 0.36 0.14 0.78 0.00 0.00 0.00 179.25 180.57 2h1n h GLY 359 N 0.72 0.53 0.68 0.00 0.00 -1.04 0.24 103.07 104.20 2h1n h GLY 359 Ca 0.09 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.14 2h1n h GLY 359 CO 0.01 0.26 -0.29 0.45 0.00 0.00 0.00 176.54 176.97 2h1n h HIS 360 N 0.39 -0.78 -0.45 5.60 -0.00 -1.34 -1.67 115.15 116.90 2h1n h HIS 360 Ca 0.11 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.48 2h1n h HIS 360 Cb 0.17 0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 27.86 2h1n h HIS 360 CO -0.01 -0.42 0.24 0.00 -0.00 0.00 0.00 177.93 177.74 2h1n h ALA 361 N -0.03 1.57 -0.53 2.45 0.00 -1.03 -0.53 119.26 121.16 2h1n h ALA 361 Ca -0.01 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2h1n h ALA 361 Cb 0.56 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2h1n h ALA 361 CO -0.06 0.36 -0.02 0.35 0.00 0.00 0.00 179.25 179.88 2h1n h PHE 362 N 0.63 1.03 0.13 0.00 3.57 -0.35 -1.01 116.94 120.93 2h1n h PHE 362 Ca 0.16 -0.18 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2h1n h PHE 362 Cb 0.03 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.51 2h1n h PHE 362 CO 0.00 0.95 -0.06 0.37 -2.23 0.00 0.00 178.31 177.34 2h1n h GLN 363 N 0.81 -0.16 -0.61 1.11 -0.00 -0.28 -1.78 115.11 114.20 2h1n h GLN 363 Ca 0.15 0.01 0.09 0.00 -0.00 0.00 0.00 58.65 58.90 2h1n h GLN 363 Cb 0.55 0.04 -0.07 0.00 0.00 0.00 0.00 27.48 28.00 2h1n h GLN 363 CO 0.03 0.10 0.23 0.28 0.00 0.00 0.00 178.83 179.46 2h1n h VAL 364 N -0.42 0.77 -0.38 2.39 2.07 -1.12 -0.65 116.25 118.92 2h1n h VAL 364 Ca -0.02 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.38 2h1n h VAL 364 Cb 0.34 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 2h1n h VAL 364 CO 0.03 0.07 0.22 0.22 0.02 0.00 0.00 177.57 178.13 2h1n h TYR 365 N 0.41 0.41 0.00 1.57 3.20 -1.11 -1.90 116.97 119.55 2h1n h TYR 365 Ca 0.31 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.19 2h1n h TYR 365 Cb 0.38 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.52 2h1n h TYR 365 CO -0.17 0.24 0.00 0.39 -1.64 0.00 0.00 178.16 176.98 2h1n n GLU 366 N -4.88 0.07 -0.14 1.82 -0.58 -0.62 -2.94 120.64 113.37 2h1n n GLU 366 Ca 0.01 0.27 0.04 0.00 -0.42 0.00 0.00 57.16 57.06 2h1n n GLU 366 Cb 0.06 -1.62 0.12 0.00 -0.57 0.00 0.00 31.44 29.43 2h1n n GLU 366 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2h1n n SER 367 N -1.74 2.72 0.07 1.62 7.64 -0.35 -4.65 113.62 118.93 2h1n n SER 367 Ca 0.04 -2.04 0.12 0.00 1.01 0.00 0.00 58.87 58.00 2h1n n SER 367 Cb 0.22 -0.19 0.47 0.00 -1.01 0.00 0.00 64.21 63.70 2h1n n SER 367 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2h1n n ARG 368 N 0.21 0.15 0.16 1.43 1.85 -0.89 -2.89 116.66 116.68 2h1n n ARG 368 Ca 0.09 0.21 0.12 0.00 -1.00 0.00 0.00 57.85 57.27 2h1n n ARG 368 Cb 0.40 -1.71 0.60 0.00 -1.05 0.00 0.00 32.46 30.70 2h1n n ARG 368 CO 0.00 0.00 0.00 -2.39 -0.01 0.00 0.00 177.63 175.23 2h1n n HIS 369 N -1.98 0.78 -2.11 2.89 1.44 -1.26 -4.80 115.22 110.18 2h1n n HIS 369 Ca 0.05 0.39 -0.42 0.00 -2.01 0.00 0.00 57.72 55.73 2h1n n HIS 369 Cb 0.33 -1.12 -0.03 0.00 0.12 0.00 0.00 29.99 29.29 2h1n n HIS 369 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 2h1n s TYR 370 N -3.54 2.64 -1.18 -1.40 1.51 -1.14 -4.90 117.35 109.34 2h1n s TYR 370 Ca -0.01 0.60 0.19 0.00 -1.01 0.00 0.00 57.07 56.84 2h1n s TYR 370 Cb 0.07 -3.78 0.88 0.00 -0.11 0.00 0.00 41.96 39.01 2h1n s TYR 370 CO 0.24 -3.02 1.60 -0.40 -1.11 0.00 0.00 175.55 172.86 2h1n n ASP 371 N 5.61 0.00 -4.53 2.29 5.75 -1.26 -4.65 116.55 119.77 2h1n n ASP 371 Ca 0.14 0.29 -0.34 0.00 -0.01 0.00 0.00 54.79 54.88 2h1n n ASP 371 Cb 0.43 -0.41 -0.12 0.00 -1.03 0.00 0.00 41.12 39.99 2h1n n ASP 371 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2h1n s ILE 372 N -2.82 4.14 0.29 2.12 -1.09 -1.26 -4.99 121.20 117.59 2h1n s ILE 372 Ca 0.13 -0.26 0.00 0.00 -2.23 0.00 0.00 60.65 58.29 2h1n s ILE 372 Cb 0.13 -2.84 0.14 0.00 -1.58 0.00 0.00 42.46 38.30 2h1n s ILE 372 CO 0.32 0.47 1.81 1.55 -1.23 0.00 0.00 174.94 177.87 2h1n h PRO 373 N 6.82 0.71 0.00 2.79 0.13 -1.93 -2.92 132.00 137.59 2h1n h PRO 373 Ca -0.33 -0.17 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 2h1n h PRO 373 Cb 1.18 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 2h1n h PRO 373 CO 0.64 0.71 -0.03 0.93 -0.23 0.00 0.00 178.00 180.02 2h1n h GLU 374 N 0.67 0.00 -0.00 0.86 3.07 -1.95 -2.17 114.58 115.06 2h1n h GLU 374 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 2h1n h GLU 374 Cb 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.29 2h1n h GLU 374 CO 0.01 0.03 -0.31 0.66 -1.40 0.00 0.00 179.01 178.01 2h1n n TYR 375 N -3.96 0.00 -0.16 4.33 4.02 -1.10 -4.12 117.16 116.16 2h1n n TYR 375 Ca -0.03 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.79 2h1n n TYR 375 Cb 0.12 -0.20 0.02 0.00 -0.02 0.00 0.00 39.34 39.26 2h1n n TYR 375 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2h1n h ASN 376 N 0.60 0.53 -4.16 7.72 2.35 -1.46 0.16 115.58 121.33 2h1n h ASN 376 Ca 0.00 -0.01 -0.69 0.00 -0.55 0.00 0.00 56.30 55.05 2h1n h ASN 376 Cb 0.48 -0.13 -0.25 0.00 0.05 0.00 0.00 38.32 38.48 2h1n h ASN 376 CO 0.00 0.38 -0.82 0.26 -1.65 0.00 0.00 177.43 175.61 2h1n s TRP 377 N -6.15 2.54 0.53 1.19 0.52 -1.26 -4.43 118.94 111.88 2h1n s TRP 377 Ca -0.13 -0.28 -0.09 0.00 0.02 0.00 0.00 56.10 55.62 2h1n s TRP 377 Cb 0.12 -1.52 0.13 0.00 -1.15 0.00 0.00 33.47 31.05 2h1n s TRP 377 CO 0.74 0.16 0.62 -0.35 0.02 0.00 0.00 176.95 178.13 2h1n n PRO 378 N 2.01 -1.19 -1.06 4.98 -0.04 -1.25 -3.85 135.00 134.61 2h1n n PRO 378 Ca -0.16 -0.97 -0.31 0.00 -0.04 0.00 0.00 63.50 62.02 2h1n n PRO 378 Cb 0.52 -0.73 0.13 0.00 -0.04 0.00 0.00 33.50 33.37 2h1n n PRO 378 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2h1n s THR 379 N -2.27 2.81 0.26 0.52 -4.23 -1.26 -4.69 115.64 106.77 2h1n s THR 379 Ca 0.37 0.26 -0.01 0.00 -1.18 0.00 0.00 61.69 61.13 2h1n s THR 379 Cb -0.02 -2.60 0.09 0.00 1.34 0.00 0.00 72.50 71.31 2h1n s THR 379 CO 0.27 -0.34 1.73 -0.07 -0.54 0.00 0.00 174.62 175.67 2h1n h LEU 380 N -1.47 0.68 -0.90 4.79 3.38 -1.97 -1.34 115.31 118.47 2h1n h LEU 380 Ca -0.45 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.34 2h1n h LEU 380 Cb 1.25 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.78 2h1n h LEU 380 CO 0.49 0.82 0.60 1.05 0.09 0.00 0.00 178.44 181.48 2h1n h GLU 381 N 0.63 1.17 -0.37 1.13 9.09 -1.92 -0.99 114.58 123.32 2h1n h GLU 381 Ca 0.11 -0.07 -0.03 0.00 0.05 0.00 0.00 59.36 59.42 2h1n h GLU 381 Cb 0.55 -0.26 -0.02 0.00 -1.65 0.00 0.00 28.75 27.37 2h1n h GLU 381 CO 0.03 0.77 0.12 0.00 0.05 0.00 0.00 179.01 179.99 2h1n h ALA 382 N 1.34 0.48 -0.85 1.06 0.00 -1.71 -2.93 119.26 116.65 2h1n h ALA 382 Ca 0.34 -0.16 0.15 0.00 0.00 0.00 0.00 54.91 55.24 2h1n h ALA 382 Cb -0.11 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 17.44 2h1n h ALA 382 CO -0.08 0.11 0.44 0.00 0.00 0.00 0.00 179.25 179.72 2h1n h GLU 384 N 0.62 0.00 -0.23 0.00 4.39 -1.03 -2.40 114.58 115.93 2h1n h GLU 384 Ca 0.47 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 60.14 2h1n h GLU 384 Cb 0.67 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 2h1n h GLU 384 CO -0.37 0.00 0.03 0.82 -1.16 0.00 0.00 179.01 178.34 2h1n h ILE 385 N 0.00 1.23 -0.63 3.13 2.04 -0.95 -3.20 117.51 119.13 2h1n h ILE 385 Ca 0.00 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.11 2h1n h ILE 385 Cb 0.40 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.74 2h1n h ILE 385 CO 0.00 0.24 0.39 0.45 0.00 0.00 0.00 178.15 179.23 2h1n h HIS 386 N 0.18 0.74 0.00 1.37 3.86 -1.45 -1.61 115.15 118.25 2h1n h HIS 386 Ca 0.07 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2h1n h HIS 386 Cb 0.33 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.56 2h1n h HIS 386 CO 0.02 0.43 0.00 -1.13 0.86 0.00 0.00 177.93 178.11 2h1n n SER 387 N -4.70 1.72 -1.63 2.45 3.41 -1.16 -4.58 113.62 109.14 2h1n n SER 387 Ca 0.06 -1.88 -0.05 0.00 -0.26 0.00 0.00 58.87 56.74 2h1n n SER 387 Cb 0.07 -0.47 -0.01 0.00 -0.26 0.00 0.00 64.21 63.54 2h1n n SER 387 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2h1n n SER 389 N 0.24 -0.27 0.00 4.04 7.64 -0.61 -4.33 113.62 120.33 2h1n n SER 389 Ca 0.00 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2h1n n SER 389 Cb 0.33 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2h1n n SER 389 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2h1n n GLU 391 N -0.89 0.00 0.10 1.43 1.02 -1.26 -1.84 120.64 119.20 2h1n n GLU 391 Ca 0.01 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.92 2h1n n GLU 391 Cb 0.08 -0.01 -0.15 0.00 -0.02 0.00 0.00 31.44 31.34 2h1n n GLU 391 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2h1n h PHE 392 N 0.00 0.80 -0.02 -0.32 0.05 -1.95 -3.24 116.94 112.26 2h1n h PHE 392 Ca 0.00 -0.58 0.01 0.00 3.82 0.00 0.00 57.97 61.21 2h1n h PHE 392 Cb 0.00 -0.03 -0.00 0.00 2.00 0.00 0.00 35.95 37.92 2h1n h PHE 392 CO 0.00 1.55 0.02 0.74 -0.18 0.00 0.00 178.31 180.44 2h1n h PHE 393 N 0.00 0.00 0.00 -0.55 -1.00 -1.77 -1.12 116.94 112.50 2h1n h PHE 393 Ca -0.27 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.51 2h1n h PHE 393 Cb 2.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.59 2h1n h PHE 393 CO 0.13 0.00 0.00 1.15 -1.61 0.00 0.00 178.31 177.98 2h1n h THR 394 N 0.00 0.00 -0.69 -1.55 2.02 -1.83 -3.39 112.91 107.47 2h1n h THR 394 Ca 0.01 -0.34 0.15 0.00 0.77 0.00 0.00 66.41 67.00 2h1n h THR 394 Cb 0.05 1.17 -0.11 0.00 -1.74 0.00 0.00 68.15 67.52 2h1n h THR 394 CO -0.00 0.00 0.05 -0.50 0.37 0.00 0.00 175.52 175.44 2h1n h TRP 395 N 0.00 0.05 -0.00 3.16 4.06 -1.27 -2.03 115.95 119.92 2h1n h TRP 395 Ca 0.00 0.05 0.00 0.00 2.06 0.00 0.00 58.89 61.00 2h1n h TRP 395 Cb 0.49 0.09 -0.00 0.00 -1.00 0.00 0.00 29.16 28.74 2h1n h TRP 395 CO 0.00 -0.17 0.00 -1.35 -3.56 0.00 0.00 178.44 173.37 2h1n h PRO 396 N 0.15 0.00 -4.87 0.49 0.11 -1.82 -3.43 132.00 122.63 2h1n h PRO 396 Ca 0.38 0.00 -0.70 0.00 0.11 0.00 0.00 66.00 65.78 2h1n h PRO 396 Cb 0.64 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 31.56 2h1n h PRO 396 CO -0.57 0.00 0.73 -1.58 -0.21 0.00 0.00 178.00 176.38 2h1n s TRP 397 N -5.03 3.21 0.00 0.65 0.51 -0.77 -4.88 118.94 112.63 2h1n s TRP 397 Ca -0.05 -1.47 0.00 0.00 -2.12 0.00 0.00 56.10 52.46 2h1n s TRP 397 Cb 0.17 -4.22 0.00 0.00 -0.81 0.00 0.00 33.47 28.61 2h1n s TRP 397 CO 0.66 -1.42 0.00 -0.85 -0.51 0.00 0.00 176.95 174.83 2h1n n GLU 399 N 6.20 0.00 0.10 4.98 0.00 -1.26 -4.14 120.64 126.52 2h1n n GLU 399 Ca 0.23 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.43 2h1n n GLU 399 Cb 0.49 0.00 0.47 0.00 0.00 0.00 0.00 31.44 32.40 2h1n n GLU 399 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 2h1n h LEU 400 N 0.00 0.29 0.00 -1.84 3.38 -1.90 -1.87 115.31 113.36 2h1n h LEU 400 Ca 0.00 -0.02 -0.31 0.00 0.09 0.00 0.00 57.88 57.64 2h1n h LEU 400 Cb 0.00 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 2h1n h LEU 400 CO 0.00 0.26 -2.16 0.49 0.09 0.00 0.00 178.44 177.12 2h1n n PHE 401 N -4.44 0.00 0.27 1.13 3.01 -1.26 -4.71 117.46 111.46 2h1n n PHE 401 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.49 2h1n n PHE 401 Cb 0.12 -0.83 -0.03 0.00 -0.01 0.00 0.00 39.48 38.73 2h1n n PHE 401 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2h1n n PHE 402 N -2.64 0.00 -2.75 1.38 3.72 -1.23 -1.54 117.46 114.40 2h1n n PHE 402 Ca -0.28 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.12 2h1n n PHE 402 Cb 1.04 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.58 2h1n n PHE 402 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2h1n n GLY 403 N 1.06 3.05 0.25 1.37 0.00 -0.71 -2.20 105.19 108.02 2h1n n GLY 403 Ca 0.01 -0.29 0.08 0.00 0.00 0.00 0.00 46.02 45.82 2h1n n GLY 403 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2h1n h GLU 404 N 0.00 0.00 0.00 1.61 4.11 -1.99 -2.23 114.58 116.08 2h1n h GLU 404 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2h1n h GLU 404 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2h1n h GLU 404 CO 0.00 0.06 0.00 -0.25 0.07 0.00 0.00 179.01 178.89 2h1n n ASP 405 N -4.41 0.01 -0.29 3.06 10.43 -0.93 -3.80 116.55 120.61 2h1n n ASP 405 Ca -0.03 0.50 0.08 0.00 2.57 0.00 0.00 54.79 57.91 2h1n n ASP 405 Cb 0.14 -0.50 0.19 0.00 1.84 0.00 0.00 41.12 42.78 2h1n n ASP 405 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2h1n h ALA 406 N 2.10 0.85 -0.15 2.24 0.00 -1.53 -0.34 119.26 122.44 2h1n h ALA 406 Ca 0.00 0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2h1n h ALA 406 Cb 0.05 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2h1n h ALA 406 CO 0.00 -0.46 0.06 -0.44 0.00 0.00 0.00 179.25 178.41 2h1n h ASP 407 N 0.06 0.21 -0.60 0.00 3.32 -1.86 -0.79 116.42 116.76 2h1n h ASP 407 Ca 0.47 -0.17 0.12 0.00 0.02 0.00 0.00 57.03 57.48 2h1n h ASP 407 Cb 0.85 -0.05 -0.10 0.00 0.22 0.00 0.00 39.33 40.25 2h1n h ASP 407 CO -0.78 0.32 0.02 0.11 -1.72 0.00 0.00 179.24 177.18 2h1n h LYS 408 N 0.09 0.13 0.12 3.56 1.57 -1.47 -1.89 116.57 118.68 2h1n h LYS 408 Ca 0.05 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2h1n h LYS 408 Cb 0.17 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2h1n h LYS 408 CO -0.00 0.09 -0.06 -0.92 -0.57 0.00 0.00 179.45 177.99 2h1n h TYR 409 N 0.14 -0.15 -0.63 -1.35 3.20 -0.52 -0.72 116.97 116.93 2h1n h TYR 409 Ca 0.31 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.19 2h1n h TYR 409 Cb 0.50 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.79 2h1n h TYR 409 CO -0.34 -0.03 0.42 0.00 -1.64 0.00 0.00 178.16 176.57 2h1n h ARG 410 N -0.23 0.83 -0.14 1.82 3.08 -0.88 0.25 114.38 119.11 2h1n h ARG 410 Ca -0.02 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 2h1n h ARG 410 Cb 0.19 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 2h1n h ARG 410 CO 0.03 0.55 -0.12 0.35 -1.07 0.00 0.00 179.97 179.71 2h1n h PHE 411 N 0.85 0.38 -0.87 3.04 3.57 -1.10 -1.94 116.94 120.87 2h1n h PHE 411 Ca 0.23 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 2h1n h PHE 411 Cb -0.10 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.52 2h1n h PHE 411 CO -0.00 0.70 0.49 0.00 -2.23 0.00 0.00 178.31 177.27 2h1n h ALA 412 N 0.61 1.22 -0.09 2.41 0.00 -0.74 -1.59 119.26 121.09 2h1n h ALA 412 Ca 0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2h1n h ALA 412 Cb 0.63 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2h1n h ALA 412 CO 0.03 0.64 0.03 1.25 0.00 0.00 0.00 179.25 181.20 2h1n h HIS 413 N 1.22 0.14 -0.08 0.00 -0.00 -0.41 -0.22 115.15 115.79 2h1n h HIS 413 Ca 0.31 -0.01 -0.12 0.00 -0.00 0.00 0.00 60.37 60.55 2h1n h HIS 413 Cb 0.00 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 27.36 2h1n h HIS 413 CO 0.01 0.26 -0.49 1.25 -0.00 0.00 0.00 177.93 178.96 2h1n h LEU 414 N -0.02 0.23 0.32 0.26 5.85 -1.26 -1.79 115.31 118.91 2h1n h LEU 414 Ca 0.03 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 2h1n h LEU 414 Cb 0.18 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2h1n h LEU 414 CO -0.00 0.69 -0.15 0.28 -0.34 0.00 0.00 178.44 178.91 2h1n h SER 415 N 0.17 -0.37 -0.52 1.25 0.02 -1.04 -3.00 113.55 110.06 2h1n h SER 415 Ca 0.01 -0.14 0.06 0.00 -0.84 0.00 0.00 61.79 60.88 2h1n h SER 415 Cb 0.93 0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.53 2h1n h SER 415 CO 0.07 -0.06 0.35 0.44 -1.14 0.00 0.00 176.83 176.50 2h1n h ASP 416 N -0.70 0.42 -0.83 3.07 3.32 -0.98 -0.46 116.42 120.27 2h1n h ASP 416 Ca -0.04 -0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.11 2h1n h ASP 416 Cb 0.48 -0.09 -0.08 0.00 0.22 0.00 0.00 39.33 39.86 2h1n h ASP 416 CO 0.07 0.28 0.47 0.00 -1.72 0.00 0.00 179.24 178.35 2h1n h ALA 417 N 1.71 1.20 0.09 3.45 0.00 -1.21 -0.77 119.26 123.74 2h1n h ALA 417 Ca 0.22 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2h1n h ALA 417 Cb 0.27 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2h1n h ALA 417 CO -0.06 0.08 -0.04 -0.07 0.00 0.00 0.00 179.25 179.15 2h1n h LEU 418 N 0.77 -0.10 -1.99 0.00 3.38 -1.01 -3.33 115.31 113.03 2h1n h LEU 418 Ca 0.41 -0.39 0.23 0.00 0.09 0.00 0.00 57.88 58.23 2h1n h LEU 418 Cb 0.41 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2h1n h LEU 418 CO -0.26 0.55 0.58 -0.07 0.09 0.00 0.00 178.44 179.33 2h1n h LEU 419 N -0.96 0.00 -0.75 1.67 3.38 -1.10 0.10 115.31 117.65 2h1n h LEU 419 Ca -0.01 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 2h1n h LEU 419 Cb 0.48 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2h1n h LEU 419 CO 0.02 0.00 0.04 0.15 0.09 0.00 0.00 178.44 178.74 2h1n h PHE 420 N 0.00 1.06 -0.42 1.13 3.57 -1.25 -3.35 116.94 117.69 2h1n h PHE 420 Ca 0.38 -0.16 0.09 0.00 3.53 0.00 0.00 57.97 61.81 2h1n h PHE 420 Cb 1.54 -0.29 -0.09 0.00 2.79 0.00 0.00 35.95 39.90 2h1n h PHE 420 CO 0.00 0.93 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.76 2h1n h LEU 421 N 0.92 -0.62 -1.31 0.59 3.38 -1.09 0.46 115.31 117.65 2h1n h LEU 421 Ca 0.18 0.15 0.05 0.00 0.09 0.00 0.00 57.88 58.34 2h1n h LEU 421 Cb 0.48 0.35 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 2h1n h LEU 421 CO 0.02 -0.21 0.50 -0.65 0.09 0.00 0.00 178.44 178.18 2h1n h PRO 422 N -0.09 0.85 0.31 1.13 0.11 -1.74 -1.70 132.00 130.86 2h1n h PRO 422 Ca 0.21 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 2h1n h PRO 422 Cb 0.41 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.33 2h1n h PRO 422 CO -0.48 0.56 -0.15 -0.92 -0.21 0.00 0.00 178.00 176.80 2h1n h TYR 423 N 0.88 -0.39 -0.53 0.65 5.03 -1.11 -2.11 116.97 119.39 2h1n h TYR 423 Ca 0.31 -0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.68 2h1n h TYR 423 Cb 0.12 0.13 -0.06 0.00 1.55 0.00 0.00 36.73 38.48 2h1n h TYR 423 CO -0.00 -0.08 0.23 0.78 -1.32 0.00 0.00 178.16 177.77 2h1n h GLY 424 N -0.70 0.74 1.50 1.82 0.00 -1.04 1.00 103.07 106.38 2h1n h GLY 424 Ca -0.04 -0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.16 2h1n h GLY 424 CO 0.07 0.05 0.33 -2.08 0.00 0.00 0.00 176.54 174.90 2h1n h VAL 425 N 0.43 1.12 -0.15 4.60 2.07 -1.38 -1.52 116.25 121.42 2h1n h VAL 425 Ca 0.25 -0.22 -0.17 0.00 0.82 0.00 0.00 66.70 67.38 2h1n h VAL 425 Cb 0.23 0.41 0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2h1n h VAL 425 CO -0.22 0.12 -0.58 0.00 0.02 0.00 0.00 177.57 176.91 2h1n h ALA 426 N 1.70 0.27 -0.60 1.67 0.00 -0.24 -1.39 119.26 120.67 2h1n h ALA 426 Ca 0.18 -0.53 0.06 0.00 0.00 0.00 0.00 54.91 54.62 2h1n h ALA 426 Cb -0.05 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2h1n h ALA 426 CO -0.04 0.50 0.30 0.28 0.00 0.00 0.00 179.25 180.30 2h1n h VAL 427 N 0.32 0.92 -0.15 0.00 2.07 -0.72 0.88 116.25 119.58 2h1n h VAL 427 Ca -0.03 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 2h1n h VAL 427 Cb 1.21 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 2h1n h VAL 427 CO 0.12 0.10 0.06 -0.78 0.02 0.00 0.00 177.57 177.09 2h1n h ASP 428 N 0.56 0.20 -0.77 0.57 1.82 -1.10 -2.41 116.42 115.30 2h1n h ASP 428 Ca 0.27 -0.17 0.04 0.00 -0.39 0.00 0.00 57.03 56.78 2h1n h ASP 428 Cb 0.21 -0.05 -0.05 0.00 0.68 0.00 0.00 39.33 40.12 2h1n h ASP 428 CO -0.20 0.32 0.48 -0.08 -1.61 0.00 0.00 179.24 178.15 2h1n h GLU 429 N 0.08 0.90 -0.46 0.28 4.81 -0.91 -2.23 114.58 117.05 2h1n h GLU 429 Ca 0.05 -0.05 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 2h1n h GLU 429 Cb 0.18 -0.20 -0.08 0.00 0.63 0.00 0.00 28.75 29.27 2h1n h GLU 429 CO -0.00 0.60 -0.07 0.35 -0.73 0.00 0.00 179.01 179.16 2h1n h PHE 430 N 0.93 -0.16 -0.72 0.92 3.57 -0.57 -1.14 116.94 119.78 2h1n h PHE 430 Ca 0.31 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.82 2h1n h PHE 430 Cb 0.04 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 2h1n h PHE 430 CO -0.04 -0.16 0.35 1.96 -2.23 0.00 0.00 178.31 178.19 2h1n h GLN 431 N 0.04 1.04 -0.45 1.11 4.20 -0.92 0.59 115.11 120.72 2h1n h GLN 431 Ca 0.23 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.79 2h1n h GLN 431 Cb 0.35 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 2h1n h GLN 431 CO -0.44 0.82 0.29 0.45 -0.67 0.00 0.00 178.83 179.27 2h1n h HIS 432 N 1.01 0.58 -0.82 2.96 3.86 -0.91 -1.06 115.15 120.78 2h1n h HIS 432 Ca 0.25 0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.52 2h1n h HIS 432 Cb 0.12 -0.19 -0.06 0.00 1.06 0.00 0.00 27.41 28.33 2h1n h HIS 432 CO 0.01 0.39 0.50 0.00 0.86 0.00 0.00 177.93 179.69 2h1n h ALA 433 N 1.14 1.12 0.21 2.45 0.00 -0.70 -1.77 119.26 121.71 2h1n h ALA 433 Ca 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2h1n h ALA 433 Cb -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2h1n h ALA 433 CO -0.03 0.25 -0.10 0.28 0.00 0.00 0.00 179.25 179.64 2h1n h VAL 434 N 0.93 0.87 0.00 0.00 2.07 -0.21 -2.57 116.25 117.34 2h1n h VAL 434 Ca 0.36 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2h1n h VAL 434 Cb 0.15 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2h1n h VAL 434 CO -0.17 0.12 0.00 1.88 0.02 0.00 0.00 177.57 179.43 2h1n h TYR 435 N -0.57 0.00 0.00 1.57 -1.99 -1.18 -2.84 116.97 111.96 2h1n h TYR 435 Ca -0.03 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.70 2h1n h TYR 435 Cb 0.42 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.15 2h1n h TYR 435 CO 0.02 0.00 0.00 0.93 -0.00 0.00 0.00 178.16 179.11 2h1n h GLU 436 N 0.00 0.00 -2.12 4.88 5.08 -1.35 -3.37 114.58 117.70 2h1n h GLU 436 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 2h1n h GLU 436 Cb 0.89 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.74 2h1n h GLU 436 CO 0.00 0.00 -0.84 0.09 -1.00 0.00 0.00 179.01 177.26 2h1n n ASN 437 N -3.03 2.31 0.20 1.42 3.02 -0.97 -4.95 115.26 113.26 2h1n n ASN 437 Ca 0.04 -3.17 0.15 0.00 -0.03 0.00 0.00 54.58 51.56 2h1n n ASN 437 Cb 0.51 -0.64 0.65 0.00 -0.61 0.00 0.00 39.78 39.70 2h1n n ASN 437 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2h1n h PRO 438 N 3.81 0.00 -5.33 3.52 0.13 -1.71 -3.46 132.00 128.97 2h1n h PRO 438 Ca 0.13 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.61 2h1n h PRO 438 Cb 0.75 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.72 2h1n h PRO 438 CO 0.67 0.00 0.33 -0.51 -0.23 0.00 0.00 178.00 178.26 2h1n s ASP 439 N -4.70 6.24 0.11 1.44 1.01 -1.26 -4.87 116.67 114.63 2h1n s ASP 439 Ca 0.01 -0.81 0.08 0.00 0.71 0.00 0.00 52.55 52.53 2h1n s ASP 439 Cb 0.09 -2.37 -0.04 0.00 1.01 0.00 0.00 42.92 41.61 2h1n s ASP 439 CO 0.40 -1.15 -0.13 0.42 0.21 0.00 0.00 175.17 174.92 2h1n s THR 441 N 3.38 3.17 0.44 -1.27 -4.23 -1.26 -5.15 115.64 110.72 2h1n s THR 441 Ca 0.21 -1.35 0.20 0.00 -1.18 0.00 0.00 61.69 59.56 2h1n s THR 441 Cb -0.17 -2.47 0.39 0.00 1.34 0.00 0.00 72.50 71.59 2h1n s THR 441 CO 0.13 0.11 1.89 -0.65 -0.54 0.00 0.00 174.62 175.56 2h1n h PRO 442 N 3.67 0.31 -0.80 3.99 0.11 -2.00 0.18 132.00 137.47 2h1n h PRO 442 Ca -0.49 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2h1n h PRO 442 Cb 1.17 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 2h1n h PRO 442 CO 0.50 0.21 0.42 0.00 -0.21 0.00 0.00 178.00 178.91 2h1n h ALA 443 N 1.62 1.23 -0.02 -0.75 0.00 -2.00 -2.56 119.26 116.79 2h1n h ALA 443 Ca 0.42 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 55.05 2h1n h ALA 443 Cb 1.15 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 2h1n h ALA 443 CO -0.13 0.61 -0.66 0.93 0.00 0.00 0.00 179.25 180.00 2h1n h GLU 444 N 1.12 0.10 -0.78 0.00 5.08 -1.11 -2.85 114.58 116.14 2h1n h GLU 444 Ca 0.28 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 2h1n h GLU 444 Cb 0.06 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 2h1n h GLU 444 CO -0.04 0.72 0.42 0.00 -1.00 0.00 0.00 179.01 179.11 2h1n h ARG 445 N 0.07 1.08 -0.48 2.33 3.08 -1.09 -1.07 114.38 118.30 2h1n h ARG 445 Ca -0.01 -0.12 -0.08 0.00 0.07 0.00 0.00 59.98 59.84 2h1n h ARG 445 Cb 1.18 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 2h1n h ARG 445 CO 0.09 0.80 -0.02 0.87 -1.07 0.00 0.00 179.97 180.64 2h1n h LYS 446 N 1.09 0.80 -0.24 0.04 1.57 -1.28 -0.57 116.57 117.98 2h1n h LYS 446 Ca 0.27 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 2h1n h LYS 446 Cb 0.04 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 2h1n h LYS 446 CO -0.04 0.82 -0.06 0.77 -0.57 0.00 0.00 179.45 180.36 2h1n h SER 447 N 0.74 0.47 -0.51 0.86 0.02 -1.23 -0.00 113.55 113.90 2h1n h SER 447 Ca 0.14 -0.37 0.08 0.00 -0.84 0.00 0.00 61.79 60.80 2h1n h SER 447 Cb 0.48 -0.13 -0.07 0.00 0.14 0.00 0.00 62.40 62.83 2h1n h SER 447 CO 0.02 0.73 0.14 0.58 -1.14 0.00 0.00 176.83 177.16 2h1n h VAL 448 N 0.20 0.75 0.60 2.27 2.07 -1.06 0.37 116.25 121.46 2h1n h VAL 448 Ca 0.06 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 2h1n h VAL 448 Cb 0.53 0.44 0.01 0.00 -1.52 0.00 0.00 31.29 30.75 2h1n h VAL 448 CO 0.02 0.05 -0.29 -0.25 0.02 0.00 0.00 177.57 177.13 2h1n h TRP 449 N 0.29 -0.74 -0.87 1.57 2.91 -0.99 -2.07 115.95 116.05 2h1n h TRP 449 Ca 0.26 -0.02 0.19 0.00 1.13 0.00 0.00 58.89 60.45 2h1n h TRP 449 Cb 0.32 0.25 -0.06 0.00 -0.51 0.00 0.00 29.16 29.16 2h1n h TRP 449 CO -0.20 -0.46 0.58 -0.09 -1.03 0.00 0.00 178.44 177.24 2h1n h ARG 450 N -0.82 0.40 -0.05 2.65 9.65 -0.33 0.14 114.38 126.02 2h1n h ARG 450 Ca -0.08 -0.02 -0.22 0.00 -1.10 0.00 0.00 59.98 58.55 2h1n h ARG 450 Cb 0.62 -0.09 0.02 0.00 -1.39 0.00 0.00 29.97 29.13 2h1n h ARG 450 CO 0.13 0.26 -0.84 -0.91 2.80 0.00 0.00 179.97 181.42 2h1n h ASN 451 N 0.41 0.82 -0.58 -3.80 -0.26 -0.79 -1.16 115.58 110.23 2h1n h ASN 451 Ca 0.45 -0.71 0.05 0.00 -0.56 0.00 0.00 56.30 55.53 2h1n h ASN 451 Cb 1.10 -0.25 -0.05 0.00 -1.06 0.00 0.00 38.32 38.07 2h1n h ASN 451 CO -0.16 1.41 0.32 0.40 -1.06 0.00 0.00 177.43 178.33 2h1n h ILE 452 N 0.31 0.98 -0.30 2.81 2.04 -0.53 -1.50 117.51 121.32 2h1n h ILE 452 Ca -0.09 -0.21 0.01 0.00 1.00 0.00 0.00 64.86 65.57 2h1n h ILE 452 Cb 1.50 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2h1n h ILE 452 CO 0.17 0.11 0.19 -0.08 0.00 0.00 0.00 178.15 178.53 2h1n h GLU 453 N 0.61 0.37 0.00 2.37 4.81 -0.73 -0.50 114.58 121.50 2h1n h GLU 453 Ca 0.25 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 2h1n h GLU 453 Cb 0.13 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 2h1n h GLU 453 CO -0.15 0.24 -0.04 0.87 -0.73 0.00 0.00 179.01 179.20 2h1n h LYS 454 N 0.38 0.00 0.15 1.92 1.57 -0.87 0.22 116.57 119.94 2h1n h LYS 454 Ca 0.11 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.66 2h1n h LYS 454 Cb -0.02 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.30 2h1n h LYS 454 CO -0.04 0.04 -1.09 0.00 -0.57 0.00 0.00 179.45 177.79 2h1n h ALA 455 N 1.96 -0.03 0.00 3.86 0.00 -0.14 -3.35 119.26 121.56 2h1n h ALA 455 Ca -0.00 -0.83 -0.14 0.00 0.00 0.00 0.00 54.91 53.93 2h1n h ALA 455 Cb 0.09 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2h1n h ALA 455 CO 0.00 0.55 -2.05 0.66 0.00 0.00 0.00 179.25 178.41 2h1n n TYR 456 N -4.00 0.00 -3.26 0.00 4.02 -0.33 -4.51 117.16 109.08 2h1n n TYR 456 Ca -0.17 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.45 2h1n n TYR 456 Cb 0.89 -0.65 -0.07 0.00 -0.02 0.00 0.00 39.34 39.50 2h1n n TYR 456 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2h1n n LEU 457 N -2.40 3.48 0.20 7.72 4.77 0.76 -4.78 117.00 126.75 2h1n n LEU 457 Ca -0.15 -5.42 0.08 0.00 -0.03 0.00 0.00 56.01 50.49 2h1n n LEU 457 Cb 0.77 -0.45 0.37 0.00 -2.33 0.00 0.00 43.42 41.77 2h1n n LEU 457 CO 0.40 2.15 0.73 1.55 -1.33 0.00 0.00 177.39 180.89 2h1n h PRO 458 N 3.80 0.00 -0.00 3.23 0.13 -1.69 -2.59 132.00 134.88 2h1n h PRO 458 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2h1n h PRO 458 Cb 0.65 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.78 2h1n h PRO 458 CO 0.78 0.29 -0.20 0.25 -0.23 0.00 0.00 178.00 178.90 2h1n n THR 459 N -3.40 0.00 -1.94 1.56 -2.24 -1.26 -4.87 114.28 102.12 2h1n n THR 459 Ca 0.00 -0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 2h1n n THR 459 Cb 0.49 -0.18 -0.01 0.00 -2.10 0.00 0.00 70.33 68.53 2h1n n THR 459 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2h1n s ARG 460 N -2.95 4.20 -0.17 -0.78 3.52 -0.98 -5.00 118.95 116.79 2h1n s ARG 460 Ca 0.14 2.40 -0.04 0.00 -0.13 0.00 0.00 55.73 58.11 2h1n s ARG 460 Cb 0.19 -2.99 0.08 0.00 -1.56 0.00 0.00 34.95 30.66 2h1n s ARG 460 CO 0.59 -0.39 0.20 0.34 -0.81 0.00 0.00 175.30 175.23 2h1n s ASP 461 N -0.32 1.25 0.00 -2.12 2.15 -1.26 -5.03 116.67 111.34 2h1n s ASP 461 Ca 0.51 -0.08 0.13 0.00 0.43 0.00 0.00 52.55 53.54 2h1n s ASP 461 Cb -0.43 0.34 0.38 0.00 -0.30 0.00 0.00 42.92 42.91 2h1n s ASP 461 CO 0.58 -0.31 1.31 -1.22 -0.17 0.00 0.00 175.17 175.37 2h1n n TYR 462 N 5.32 0.52 -3.85 -5.34 4.01 -1.26 -1.65 117.16 114.92 2h1n n TYR 462 Ca -0.05 -0.26 -0.24 0.00 -0.16 0.00 0.00 57.90 57.18 2h1n n TYR 462 Cb 0.50 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.53 2h1n n TYR 462 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2h1n n ALA 463 N 0.67 -1.91 -1.54 -0.72 0.00 -1.26 -0.72 120.51 115.03 2h1n n ALA 463 Ca 0.14 -0.17 -0.19 0.00 0.00 0.00 0.00 53.44 53.22 2h1n n ALA 463 Cb 0.34 -2.06 -0.08 0.00 0.00 0.00 0.00 19.45 17.65 2h1n n ALA 463 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2h1n n ASP 464 N -2.99 -5.33 -4.60 0.00 8.00 -1.26 -4.94 116.55 105.43 2h1n n ASP 464 Ca -0.26 0.46 -0.43 0.00 0.71 0.00 0.00 54.79 55.27 2h1n n ASP 464 Cb 0.66 -4.47 -0.02 0.00 -0.02 0.00 0.00 41.12 37.27 2h1n n ASP 464 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2h1n s HIS 465 N -2.66 2.10 0.07 1.24 2.46 0.10 -4.93 115.29 113.67 2h1n s HIS 465 Ca 0.00 0.64 -0.31 0.00 0.47 0.00 0.00 55.06 55.86 2h1n s HIS 465 Cb 0.00 -4.22 -0.15 0.00 -0.13 0.00 0.00 32.58 28.08 2h1n s HIS 465 CO 0.00 -2.48 1.48 0.22 -2.47 0.00 0.00 174.74 171.49 2h1n h ASP 466 N 11.80 -1.21 -0.37 9.88 3.58 -1.92 0.11 116.42 138.28 2h1n h ASP 466 Ca -0.31 0.10 0.07 0.00 0.42 0.00 0.00 57.03 57.31 2h1n h ASP 466 Cb 1.14 0.40 -0.07 0.00 1.72 0.00 0.00 39.33 42.52 2h1n h ASP 466 CO 1.06 -0.58 -0.05 0.22 -2.88 0.00 0.00 179.24 177.00 2h1n h TYR 467 N -0.88 -0.12 -0.59 0.28 3.20 -1.99 -0.87 116.97 116.01 2h1n h TYR 467 Ca -0.06 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.74 2h1n h TYR 467 Cb 0.76 0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.12 2h1n h TYR 467 CO -0.23 -0.12 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.07 2h1n h LEU 468 N 0.04 1.05 -1.42 2.82 3.38 -1.91 -2.29 115.31 116.98 2h1n h LEU 468 Ca 0.18 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 2h1n h LEU 468 Cb 0.27 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2h1n h LEU 468 CO -0.35 1.12 -0.20 -0.08 0.09 0.00 0.00 178.44 179.02 2h1n h GLU 469 N 0.96 0.13 0.00 1.13 4.57 0.11 -0.96 114.58 120.52 2h1n h GLU 469 Ca 0.16 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2h1n h GLU 469 Cb 0.60 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 2h1n h GLU 469 CO 0.04 0.33 0.00 0.54 -1.18 0.00 0.00 179.01 178.74 2h1n n ARG 470 N -4.25 0.63 -0.33 1.92 1.74 -0.42 -4.89 116.66 111.06 2h1n n ARG 470 Ca -0.01 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 2h1n n ARG 470 Cb 0.29 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 2h1n n ARG 470 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2h1n n GLY 471 N 0.67 1.63 0.03 -0.13 0.00 -0.37 -4.28 105.19 102.76 2h1n n GLY 471 Ca 0.16 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 46.17 2h1n n GLY 471 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h1n n GLY 472 N -0.87 -1.47 0.26 -0.02 0.00 -0.88 -4.47 105.19 97.74 2h1n n GLY 472 Ca 0.00 -0.17 0.04 0.00 0.00 0.00 0.00 46.02 45.89 2h1n n GLY 472 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2h1n h PHE 473 N 0.00 0.18 -0.07 1.61 3.57 -1.83 -2.17 116.94 118.24 2h1n h PHE 473 Ca 0.00 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.56 2h1n h PHE 473 Cb 0.60 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 2h1n h PHE 473 CO 0.00 -0.11 0.19 0.11 -2.23 0.00 0.00 178.31 176.27 2h1n h TRP 474 N 0.22 0.00 0.00 0.41 5.08 -1.99 -2.74 115.95 116.93 2h1n h TRP 474 Ca 0.38 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.33 2h1n h TRP 474 Cb 0.64 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.80 2h1n h TRP 474 CO -0.29 0.00 -0.11 1.96 -1.28 0.00 0.00 178.44 178.72 2h1n h GLN 475 N 0.00 0.00 0.00 0.12 4.20 -1.72 -0.82 115.11 116.88 2h1n h GLN 475 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2h1n h GLN 475 Cb 0.41 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.19 2h1n h GLN 475 CO -0.00 0.11 0.00 0.07 -0.67 0.00 0.00 178.83 178.34 2h1n h ARG 476 N 0.00 0.00 -6.13 1.46 0.11 -1.71 -3.42 114.38 104.69 2h1n h ARG 476 Ca -0.00 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.49 2h1n h ARG 476 Cb 0.44 0.00 -0.10 0.00 1.11 0.00 0.00 29.97 31.42 2h1n h ARG 476 CO 0.01 0.00 1.30 -1.14 0.10 0.00 0.00 179.97 180.25 2h1n s GLN 477 N -3.44 3.45 0.43 0.08 2.00 -0.32 -4.89 119.66 116.97 2h1n s GLN 477 Ca 0.04 -0.85 0.17 0.00 -2.00 0.00 0.00 55.36 52.72 2h1n s GLN 477 Cb 0.09 -4.92 1.09 0.00 0.80 0.00 0.00 33.01 30.06 2h1n s GLN 477 CO 0.54 -2.16 1.91 0.78 -0.50 0.00 0.00 175.29 175.86 2h1n h GLY 478 N 12.73 0.68 0.99 2.59 0.00 -1.86 -2.36 103.07 115.84 2h1n h GLY 478 Ca 0.03 -0.16 0.03 0.00 0.00 0.00 0.00 47.33 47.23 2h1n h GLY 478 CO 1.36 0.04 0.60 0.45 0.00 0.00 0.00 176.54 178.99 2h1n h HIS 479 N 0.38 1.11 -0.61 5.60 3.86 -1.91 0.80 115.15 124.38 2h1n h HIS 479 Ca 0.39 0.03 0.10 0.00 -1.16 0.00 0.00 60.37 59.72 2h1n h HIS 479 Cb 0.95 -0.37 -0.04 0.00 1.06 0.00 0.00 27.41 29.01 2h1n h HIS 479 CO -0.00 0.65 0.41 0.82 0.86 0.00 0.00 177.93 180.66 2h1n h ILE 480 N 1.15 0.90 0.00 2.45 2.04 -1.70 0.15 117.51 122.50 2h1n h ILE 480 Ca 0.36 -0.15 -0.08 0.00 1.00 0.00 0.00 64.86 65.99 2h1n h ILE 480 Cb 0.00 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 2h1n h ILE 480 CO -0.11 0.08 -0.57 1.88 0.00 0.00 0.00 178.15 179.44 2h1n h TYR 481 N 0.42 0.00 0.00 1.37 -1.99 -1.22 -3.42 116.97 112.14 2h1n h TYR 481 Ca 0.28 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 61.01 2h1n h TYR 481 Cb 0.54 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.27 2h1n h TYR 481 CO -0.00 0.77 -0.90 1.79 -0.00 0.00 0.00 178.16 179.81 2h1n h THR 482 N -1.00 0.01 -1.58 -2.88 1.35 -0.79 -3.43 112.91 104.59 2h1n h THR 482 Ca -0.12 -1.02 -0.48 0.00 -0.55 0.00 0.00 66.41 64.24 2h1n h THR 482 Cb 0.82 1.56 -0.34 0.00 -1.73 0.00 0.00 68.15 68.46 2h1n h THR 482 CO -0.07 0.01 -1.00 0.47 -0.25 0.00 0.00 175.52 174.68 2h1n n ASP 483 N -2.73 -0.32 0.00 5.36 8.00 0.50 -5.04 116.55 122.33 2h1n n ASP 483 Ca 0.00 -2.90 0.00 0.00 0.71 0.00 0.00 54.79 52.60 2h1n n ASP 483 Cb 0.55 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 2h1n n ASP 483 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 2h1n n PRO 484 N 1.18 0.00 -0.07 -0.24 -0.02 -1.24 -1.67 135.00 132.94 2h1n n PRO 484 Ca 0.19 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.69 2h1n n PRO 484 Cb 0.58 -0.06 0.06 0.00 -0.02 0.00 0.00 33.50 34.06 2h1n n PRO 484 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2h1n n PHE 485 N 0.00 0.19 -2.31 6.00 3.01 -1.26 -4.62 117.46 118.46 2h1n n PHE 485 Ca 0.00 -0.09 -0.35 0.00 1.01 0.00 0.00 57.45 58.02 2h1n n PHE 485 Cb 0.00 -0.03 -0.04 0.00 -0.01 0.00 0.00 39.48 39.41 2h1n n PHE 485 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 2h1n s TYR 486 N -1.75 2.14 0.00 1.38 6.04 -0.67 -3.98 117.35 120.51 2h1n s TYR 486 Ca 0.08 -0.04 0.00 0.00 0.04 0.00 0.00 57.07 57.15 2h1n s TYR 486 Cb 0.05 -4.38 0.00 0.00 -1.04 0.00 0.00 41.96 36.59 2h1n s TYR 486 CO 0.05 -1.91 0.00 0.98 -1.54 0.00 0.00 175.55 173.13 2h1n n TYR 487 N 11.29 -0.36 -0.36 4.97 9.36 -1.26 -4.86 117.16 135.94 2h1n n TYR 487 Ca 0.32 0.00 0.29 0.00 3.32 0.00 0.00 57.90 61.83 2h1n n TYR 487 Cb 0.49 0.07 0.59 0.00 -0.63 0.00 0.00 39.34 39.87 2h1n n TYR 487 CO 0.00 0.00 0.00 0.97 0.22 0.00 0.00 176.86 178.05 2h1n h ILE 488 N 0.00 0.40 -0.97 2.97 6.09 -1.79 -1.74 117.51 122.48 2h1n h ILE 488 Ca 0.00 -0.08 0.17 0.00 -1.37 0.00 0.00 64.86 63.57 2h1n h ILE 488 Cb 0.00 0.14 -0.10 0.00 0.47 0.00 0.00 36.82 37.33 2h1n h ILE 488 CO 0.00 0.04 0.57 0.44 -3.07 0.00 0.00 178.15 176.14 2h1n h ASP 489 N 0.24 0.75 -0.57 2.19 5.19 -1.91 0.52 116.42 122.84 2h1n h ASP 489 Ca 0.64 0.09 0.01 0.00 -0.62 0.00 0.00 57.03 57.15 2h1n h ASP 489 Cb 1.92 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 41.35 2h1n h ASP 489 CO -0.26 0.31 0.37 1.88 -3.12 0.00 0.00 179.24 178.42 2h1n h TYR 490 N 0.78 0.71 -0.03 4.55 -1.99 -1.67 -0.76 116.97 118.55 2h1n h TYR 490 Ca 0.54 0.02 -0.15 0.00 2.00 0.00 0.00 58.73 61.13 2h1n h TYR 490 Cb 0.76 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 39.23 2h1n h TYR 490 CO -0.03 0.44 -0.67 1.79 -0.00 0.00 0.00 178.16 179.70 2h1n h THR 491 N 0.76 1.44 0.00 -2.88 1.35 -1.06 -0.76 112.91 111.76 2h1n h THR 491 Ca 0.21 -2.19 -0.00 0.00 -0.55 0.00 0.00 66.41 63.88 2h1n h THR 491 Cb -0.08 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.50 2h1n h THR 491 CO -0.05 0.64 -0.00 -0.07 -0.25 0.00 0.00 175.52 175.79 2h1n h LEU 492 N 0.10 -0.00 -0.57 3.87 3.38 -0.97 -3.30 115.31 117.81 2h1n h LEU 492 Ca -0.01 -0.34 -0.13 0.00 0.09 0.00 0.00 57.88 57.48 2h1n h LEU 492 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2h1n h LEU 492 CO 0.10 0.34 -0.28 0.00 0.09 0.00 0.00 178.44 178.69 2h1n h ALA 493 N 0.65 0.76 -1.01 1.53 0.00 -1.09 -2.98 119.26 117.13 2h1n h ALA 493 Ca -0.00 -0.40 0.25 0.00 0.00 0.00 0.00 54.91 54.75 2h1n h ALA 493 Cb 0.34 -0.14 -0.12 0.00 0.00 0.00 0.00 17.79 17.87 2h1n h ALA 493 CO 0.00 0.66 0.60 0.37 0.00 0.00 0.00 179.25 180.87 2h1n h GLN 494 N 0.72 0.57 0.00 0.00 5.75 -1.24 0.27 115.11 121.18 2h1n h GLN 494 Ca 0.08 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.54 2h1n h GLN 494 Cb 0.83 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 29.25 2h1n h GLN 494 CO 0.07 0.37 -0.06 0.28 -2.65 0.00 0.00 178.83 176.84 2h1n h VAL 495 N 0.58 0.16 0.16 2.39 2.07 -1.60 -1.27 116.25 118.75 2h1n h VAL 495 Ca 0.64 -0.71 -0.29 0.00 0.82 0.00 0.00 66.70 67.16 2h1n h VAL 495 Cb 1.23 1.61 0.01 0.00 -1.52 0.00 0.00 31.29 32.62 2h1n h VAL 495 CO -0.47 0.06 -1.40 0.00 0.02 0.00 0.00 177.57 175.78 2h1n h ALA 497 N 0.05 1.62 -0.16 0.00 0.00 -0.74 0.15 119.26 120.19 2h1n h ALA 497 Ca -0.28 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2h1n h ALA 497 Cb 1.90 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 2h1n h ALA 497 CO 0.15 0.17 -0.00 0.74 0.00 0.00 0.00 179.25 180.30 2h1n h PHE 498 N 0.90 0.23 -0.13 0.00 0.05 -1.34 0.19 116.94 116.83 2h1n h PHE 498 Ca 0.44 -0.01 -0.19 0.00 3.82 0.00 0.00 57.97 62.03 2h1n h PHE 498 Cb 0.47 -0.07 0.01 0.00 2.00 0.00 0.00 35.95 38.36 2h1n h PHE 498 CO -0.00 0.25 -0.67 1.96 -0.18 0.00 0.00 178.31 179.67 2h1n h GLN 499 N 0.23 0.69 -0.56 1.51 4.20 -0.78 -2.30 115.11 118.11 2h1n h GLN 499 Ca 0.06 -0.56 -0.04 0.00 0.06 0.00 0.00 58.65 58.16 2h1n h GLN 499 Cb 0.16 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 2h1n h GLN 499 CO 0.00 1.18 0.19 0.74 -0.67 0.00 0.00 178.83 180.27 2h1n h PHE 500 N 0.37 0.89 -0.55 2.96 0.05 -0.77 -1.74 116.94 118.15 2h1n h PHE 500 Ca -0.05 -0.08 0.10 0.00 3.82 0.00 0.00 57.97 61.76 2h1n h PHE 500 Cb 1.31 -0.26 -0.08 0.00 2.00 0.00 0.00 35.95 38.92 2h1n h PHE 500 CO 0.10 0.74 0.13 2.35 -0.18 0.00 0.00 178.31 181.45 2h1n h TRP 501 N 0.78 0.22 -0.23 -0.55 7.01 -0.59 -0.20 115.95 122.39 2h1n h TRP 501 Ca 0.18 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.17 2h1n h TRP 501 Cb 0.26 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.30 2h1n h TRP 501 CO 0.01 0.01 -0.01 -0.22 -2.79 0.00 0.00 178.44 175.44 2h1n h LYS 502 N 0.28 0.41 -0.67 2.65 1.63 -1.23 -2.82 116.57 116.82 2h1n h LYS 502 Ca 0.28 -0.14 0.03 0.00 -0.85 0.00 0.00 60.65 59.97 2h1n h LYS 502 Cb 0.39 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 31.95 2h1n h LYS 502 CO -0.35 0.61 0.44 0.00 -3.45 0.00 0.00 179.45 176.70 2h1n h ARG 503 N 0.17 0.80 -0.52 1.90 3.08 -0.90 -1.92 114.38 116.99 2h1n h ARG 503 Ca 0.06 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 2h1n h ARG 503 Cb 0.43 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 2h1n h ARG 503 CO 0.01 0.53 0.16 0.00 -1.07 0.00 0.00 179.97 179.61 2h1n h ALA 504 N 1.60 1.30 -0.75 0.04 0.00 -0.81 0.82 119.26 121.47 2h1n h ALA 504 Ca 0.26 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2h1n h ALA 504 Cb 0.03 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2h1n h ALA 504 CO -0.07 0.50 0.30 1.96 0.00 0.00 0.00 179.25 181.94 2h1n h GLN 505 N 0.76 1.11 0.11 0.00 1.08 -1.14 -3.05 115.11 113.98 2h1n h GLN 505 Ca 0.18 -0.19 -0.19 0.00 -1.45 0.00 0.00 58.65 56.99 2h1n h GLN 505 Cb 0.23 -0.18 0.02 0.00 -0.05 0.00 0.00 27.48 27.49 2h1n h GLN 505 CO -0.01 0.90 -0.81 0.93 -0.95 0.00 0.00 178.83 178.89 2h1n h GLU 506 N 1.08 0.36 -0.94 1.46 5.08 -1.13 -3.45 114.58 117.05 2h1n h GLU 506 Ca 0.25 -0.53 -0.09 0.00 -1.00 0.00 0.00 59.36 58.00 2h1n h GLU 506 Cb 0.20 0.18 -0.18 0.00 0.50 0.00 0.00 28.75 29.46 2h1n h GLU 506 CO -0.02 1.22 -0.44 0.34 -1.00 0.00 0.00 179.01 179.11 2h1n s ASP 507 N -6.96 -1.41 0.25 1.42 -1.08 0.22 -5.06 116.67 104.06 2h1n s ASP 507 Ca -0.13 -1.14 0.03 0.00 -0.52 0.00 0.00 52.55 50.79 2h1n s ASP 507 Cb 0.02 1.82 0.30 0.00 -1.46 0.00 0.00 42.92 43.60 2h1n s ASP 507 CO 0.84 -0.11 1.61 0.08 0.52 0.00 0.00 175.17 178.11 2h1n h ARG 508 N 6.00 0.33 -0.90 4.34 0.11 -1.68 0.05 114.38 122.63 2h1n h ARG 508 Ca 0.05 -0.19 -0.02 0.00 0.10 0.00 0.00 59.98 59.92 2h1n h ARG 508 Cb 1.15 0.01 -0.04 0.00 1.11 0.00 0.00 29.97 32.20 2h1n h ARG 508 CO 0.05 0.75 0.50 0.00 0.10 0.00 0.00 179.97 181.37 2h1n h ALA 509 N 1.21 1.16 -0.20 0.08 0.00 -1.94 0.14 119.26 119.71 2h1n h ALA 509 Ca 0.01 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 2h1n h ALA 509 Cb 0.97 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2h1n h ALA 509 CO 0.08 0.66 -0.46 1.03 0.00 0.00 0.00 179.25 180.56 2h1n h SER 510 N 1.26 0.76 -0.72 0.00 0.87 -1.85 -2.21 113.55 111.66 2h1n h SER 510 Ca 0.32 -0.56 -0.03 0.00 -1.23 0.00 0.00 61.79 60.29 2h1n h SER 510 Cb 0.02 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 2h1n h SER 510 CO -0.05 1.18 0.34 0.00 -0.53 0.00 0.00 176.83 177.77 2h1n h ALA 511 N 0.60 0.93 -0.53 6.23 0.00 -0.79 -2.91 119.26 122.78 2h1n h ALA 511 Ca -0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2h1n h ALA 511 Cb 1.07 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2h1n h ALA 511 CO 0.10 0.50 0.24 2.35 0.00 0.00 0.00 179.25 182.44 2h1n h TRP 512 N 1.01 0.79 -0.79 0.00 2.91 -0.70 -2.21 115.95 116.97 2h1n h TRP 512 Ca 0.25 -0.05 0.04 0.00 1.13 0.00 0.00 58.89 60.26 2h1n h TRP 512 Cb 0.12 -0.24 -0.05 0.00 -0.51 0.00 0.00 29.16 28.48 2h1n h TRP 512 CO 0.01 0.63 0.49 0.00 -1.03 0.00 0.00 178.44 178.54 2h1n h ARG 513 N 0.72 0.92 -0.44 2.65 3.08 -1.25 -1.05 114.38 119.01 2h1n h ARG 513 Ca 0.18 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 60.04 2h1n h ARG 513 Cb 0.15 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 2h1n h ARG 513 CO -0.02 0.61 -0.27 -0.44 -1.07 0.00 0.00 179.97 178.77 2h1n h ASP 514 N 0.94 0.99 -0.20 7.04 3.32 -1.44 -1.40 116.42 125.68 2h1n h ASP 514 Ca 0.32 -0.40 0.03 0.00 0.02 0.00 0.00 57.03 57.00 2h1n h ASP 514 Cb 0.06 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 2h1n h ASP 514 CO -0.13 1.19 0.02 0.22 -1.72 0.00 0.00 179.24 178.82 2h1n h TYR 515 N 0.81 0.03 -0.43 4.55 3.20 -0.75 0.42 116.97 124.81 2h1n h TYR 515 Ca 0.09 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 2h1n h TYR 515 Cb 0.85 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.12 2h1n h TYR 515 CO 0.05 -0.00 0.08 0.28 -1.64 0.00 0.00 178.16 176.94 2h1n h VAL 516 N 0.10 1.24 -0.93 1.81 2.07 -1.15 -1.94 116.25 117.44 2h1n h VAL 516 Ca 0.09 -0.85 0.12 0.00 0.82 0.00 0.00 66.70 66.88 2h1n h VAL 516 Cb 0.10 0.97 -0.08 0.00 -1.52 0.00 0.00 31.29 30.76 2h1n h VAL 516 CO -0.14 0.30 0.56 0.00 0.02 0.00 0.00 177.57 178.30 2h1n h ALA 517 N 0.95 1.39 -0.18 1.67 0.00 -0.85 -1.57 119.26 120.67 2h1n h ALA 517 Ca 0.13 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 2h1n h ALA 517 Cb 0.35 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2h1n h ALA 517 CO 0.01 0.12 0.05 1.25 0.00 0.00 0.00 179.25 180.68 2h1n h LEU 518 N 0.87 0.26 -0.99 0.00 5.85 -0.52 -3.00 115.31 117.77 2h1n h LEU 518 Ca 0.47 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 59.04 2h1n h LEU 518 Cb 0.50 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.40 2h1n h LEU 518 CO -0.28 0.41 0.64 0.00 -0.34 0.00 0.00 178.44 178.86 2h1n h ARG 520 N 1.14 0.00 0.00 0.00 3.08 -1.18 -1.33 114.38 116.10 2h1n h ARG 520 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.49 2h1n h ARG 520 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2h1n h ARG 520 CO -0.18 0.00 0.00 -0.07 -1.07 0.00 0.00 179.97 178.65 2h1n h LEU 521 N 0.00 0.00 0.00 3.04 4.07 -1.25 -3.45 115.31 117.72 2h1n h LEU 521 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2h1n h LEU 521 Cb 0.43 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.17 2h1n h LEU 521 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.97 2h1n n GLY 522 N -0.12 2.89 1.64 0.83 0.00 -0.50 -1.88 105.19 108.07 2h1n n GLY 522 Ca 0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 46.02 45.79 2h1n n GLY 522 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h1n n GLY 523 N 0.00 4.88 0.00 -0.02 0.00 0.56 -3.94 105.19 106.67 2h1n n GLY 523 Ca 0.00 -1.29 0.15 0.00 0.00 0.00 0.00 46.02 44.88 2h1n n GLY 523 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2h1n n SER 524 N -1.11 0.01 -3.96 1.61 3.41 -0.79 -4.50 113.62 108.30 2h1n n SER 524 Ca 0.45 -0.53 -0.09 0.00 -0.26 0.00 0.00 58.87 58.44 2h1n n SER 524 Cb 1.24 -0.16 -0.11 0.00 -0.26 0.00 0.00 64.21 64.92 2h1n n SER 524 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2h1n s ARG 525 N -2.32 0.31 0.87 4.33 0.52 -1.26 -4.56 118.95 116.84 2h1n s ARG 525 Ca 0.37 -0.55 -0.11 0.00 -0.52 0.00 0.00 55.73 54.92 2h1n s ARG 525 Cb 0.21 0.11 0.11 0.00 0.52 0.00 0.00 34.95 35.91 2h1n s ARG 525 CO 0.42 -0.05 1.10 -1.25 0.02 0.00 0.00 175.30 175.54 2h1n s PRO 526 N -1.37 1.46 0.17 3.54 0.04 -1.26 -4.68 135.00 132.90 2h1n s PRO 526 Ca -0.15 1.12 -0.22 0.00 0.04 0.00 0.00 61.00 61.79 2h1n s PRO 526 Cb -0.09 -1.81 0.09 0.00 0.04 0.00 0.00 34.50 32.73 2h1n s PRO 526 CO -0.01 -2.19 1.60 0.35 0.04 0.00 0.00 177.00 176.79 2h1n h PHE 527 N -1.52 -0.87 -0.11 0.56 3.57 -1.96 -0.90 116.94 115.71 2h1n h PHE 527 Ca -0.47 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.07 2h1n h PHE 527 Cb 1.26 0.45 -0.01 0.00 2.79 0.00 0.00 35.95 40.44 2h1n h PHE 527 CO 0.49 -0.37 -0.07 1.79 -2.23 0.00 0.00 178.31 177.91 2h1n h THR 528 N -0.21 1.12 -0.03 4.41 1.35 -1.96 -0.42 112.91 117.17 2h1n h THR 528 Ca 0.20 -0.52 -0.21 0.00 -0.55 0.00 0.00 66.41 65.32 2h1n h THR 528 Cb 0.53 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 68.08 2h1n h THR 528 CO -0.58 0.16 -0.87 -0.33 -0.25 0.00 0.00 175.52 173.64 2h1n h GLU 529 N 0.15 0.43 -0.07 4.72 5.08 -1.70 -1.49 114.58 121.70 2h1n h GLU 529 Ca 0.03 -0.42 -0.00 0.00 -1.00 0.00 0.00 59.36 57.97 2h1n h GLU 529 Cb 0.24 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 2h1n h GLU 529 CO 0.01 1.08 0.04 -0.07 -1.00 0.00 0.00 179.01 179.07 2h1n h LEU 530 N 0.26 0.10 -0.50 1.33 3.38 -0.45 -0.97 115.31 118.46 2h1n h LEU 530 Ca -0.06 -0.10 0.10 0.00 0.09 0.00 0.00 57.88 57.91 2h1n h LEU 530 Cb 1.49 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 42.12 2h1n h LEU 530 CO 0.15 0.16 -0.14 0.58 0.09 0.00 0.00 178.44 179.28 2h1n h VAL 531 N 0.02 0.46 -0.47 1.22 2.07 -1.09 -2.48 116.25 115.98 2h1n h VAL 531 Ca 0.03 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 2h1n h VAL 531 Cb 0.09 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 2h1n h VAL 531 CO -0.00 0.00 0.27 0.50 0.02 0.00 0.00 177.57 178.36 2h1n h LYS 532 N -0.02 0.64 -0.84 1.57 3.64 -1.08 -1.92 116.57 118.56 2h1n h LYS 532 Ca 0.24 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.57 2h1n h LYS 532 Cb 0.39 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.04 2h1n h LYS 532 CO -0.53 0.49 0.55 0.66 -2.27 0.00 0.00 179.45 178.35 2h1n h SER 533 N 0.62 0.94 -0.36 4.20 4.64 -0.74 -1.05 113.55 121.81 2h1n h SER 533 Ca 0.17 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2h1n h SER 533 Cb 0.02 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 61.88 2h1n h SER 533 CO -0.03 0.67 0.00 0.00 -0.87 0.00 0.00 176.83 176.60 2h1n n ALA 534 N -2.41 2.64 -1.88 5.18 0.00 -1.02 -4.91 120.51 118.11 2h1n n ALA 534 Ca 0.10 -0.75 -0.21 0.00 0.00 0.00 0.00 53.44 52.58 2h1n n ALA 534 Cb 0.05 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.44 2h1n n ALA 534 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2h1n n ASN 535 N 0.54 -5.63 -4.80 0.00 3.02 -0.40 -5.00 115.26 103.00 2h1n n ASN 535 Ca 0.13 0.33 -0.34 0.00 -0.03 0.00 0.00 54.58 54.68 2h1n n ASN 535 Cb 0.43 -4.87 -0.02 0.00 -0.61 0.00 0.00 39.78 34.72 2h1n n ASN 535 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2h1n s LEU 536 N -5.20 3.73 0.18 3.41 2.01 -0.73 -5.02 118.68 117.06 2h1n s LEU 536 Ca 0.00 1.90 -0.22 0.00 0.01 0.00 0.00 54.13 55.82 2h1n s LEU 536 Cb 0.00 -4.55 -0.08 0.00 0.01 0.00 0.00 46.19 41.57 2h1n s LEU 536 CO 0.00 -0.92 0.73 -1.58 1.01 0.00 0.00 176.35 175.59 2h1n s GLN 537 N -3.52 4.39 0.26 1.70 0.74 -1.26 -4.52 119.66 117.45 2h1n s GLN 537 Ca 0.66 0.99 -0.30 0.00 0.05 0.00 0.00 55.36 56.76 2h1n s GLN 537 Cb -0.16 -3.08 -0.10 0.00 1.10 0.00 0.00 33.01 30.77 2h1n s GLN 537 CO 0.26 0.50 1.35 0.45 -0.55 0.00 0.00 175.29 177.30 2h1n s SER 538 N -1.37 6.77 0.55 6.67 0.15 -1.26 -4.90 113.70 120.31 2h1n s SER 538 Ca 0.38 2.59 0.24 0.00 0.70 0.00 0.00 55.95 59.86 2h1n s SER 538 Cb -0.20 -2.63 1.47 0.00 -1.71 0.00 0.00 66.02 62.96 2h1n s SER 538 CO 0.23 -0.59 2.10 1.55 1.20 0.00 0.00 173.24 177.74 2h1n h PRO 539 N 4.62 0.00 0.00 5.44 0.13 -1.93 -1.85 132.00 138.41 2h1n h PRO 539 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2h1n h PRO 539 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 2h1n h PRO 539 CO 0.74 0.00 -0.02 0.74 -0.23 0.00 0.00 178.00 179.22 2h1n h PHE 540 N 0.00 0.00 -3.64 1.56 -1.00 -1.96 -3.41 116.94 108.49 2h1n h PHE 540 Ca 0.09 0.00 -0.56 0.00 2.81 0.00 0.00 57.97 60.31 2h1n h PHE 540 Cb 0.42 0.00 0.17 0.00 3.61 0.00 0.00 35.95 40.15 2h1n h PHE 540 CO 0.00 0.02 0.08 0.00 -1.61 0.00 0.00 178.31 176.80 2h1n n ALA 541 N -2.10 -0.10 -1.68 2.45 0.00 -0.70 -4.86 120.51 113.52 2h1n n ALA 541 Ca 0.01 -0.09 -0.45 0.00 0.00 0.00 0.00 53.44 52.91 2h1n n ALA 541 Cb 0.36 -2.10 -0.04 0.00 0.00 0.00 0.00 19.45 17.68 2h1n n ALA 541 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2h1n n ASP 542 N -1.12 3.66 -1.47 0.00 8.00 -1.26 -2.10 116.55 122.26 2h1n n ASP 542 Ca 0.13 1.00 -0.17 0.00 0.71 0.00 0.00 54.79 56.46 2h1n n ASP 542 Cb 0.48 -1.46 -0.05 0.00 -0.02 0.00 0.00 41.12 40.07 2h1n n ASP 542 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h1n n GLY 543 N 4.13 1.07 0.14 0.44 0.00 -1.26 -4.91 105.19 104.80 2h1n n GLY 543 Ca 0.19 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 2h1n n GLY 543 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h1n h ALA 544 N 0.24 0.17 -0.54 4.61 0.00 -1.69 -2.70 119.26 119.34 2h1n h ALA 544 Ca -0.36 -0.41 0.07 0.00 0.00 0.00 0.00 54.91 54.20 2h1n h ALA 544 Cb 1.15 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 2h1n h ALA 544 CO 0.49 0.18 0.23 0.28 0.00 0.00 0.00 179.25 180.43 2h1n h VAL 545 N -0.08 0.87 -0.17 0.00 2.07 -1.82 -2.17 116.25 114.94 2h1n h VAL 545 Ca -0.01 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 2h1n h VAL 545 Cb 0.90 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 2h1n h VAL 545 CO 0.06 0.08 0.05 0.00 0.02 0.00 0.00 177.57 177.78 2h1n h ALA 546 N 1.33 0.23 -0.08 1.67 0.00 -1.92 -1.87 119.26 118.62 2h1n h ALA 546 Ca 0.25 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 2h1n h ALA 546 Cb 0.24 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2h1n h ALA 546 CO -0.22 -0.13 -0.66 0.66 0.00 0.00 0.00 179.25 178.89 2h1n h SER 547 N 0.10 0.39 -0.16 0.00 4.64 -1.37 -1.94 113.55 115.22 2h1n h SER 547 Ca 0.06 -0.24 -0.06 0.00 -0.47 0.00 0.00 61.79 61.07 2h1n h SER 547 Cb 0.25 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2h1n h SER 547 CO -0.00 0.94 -0.15 0.58 -0.87 0.00 0.00 176.83 177.34 2h1n h VAL 548 N 0.24 1.34 0.00 0.95 2.07 -1.38 -3.22 116.25 116.25 2h1n h VAL 548 Ca -0.02 -1.29 -0.06 0.00 0.82 0.00 0.00 66.70 66.15 2h1n h VAL 548 Cb 1.20 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.80 2h1n h VAL 548 CO 0.11 0.38 -0.27 0.58 0.02 0.00 0.00 177.57 178.39 2h1n h VAL 549 N 0.02 1.09 -0.98 2.57 2.07 -1.30 -3.10 116.25 116.62 2h1n h VAL 549 Ca 0.03 -0.96 0.16 0.00 0.82 0.00 0.00 66.70 66.75 2h1n h VAL 549 Cb 0.67 1.53 -0.09 0.00 -1.52 0.00 0.00 31.29 31.89 2h1n h VAL 549 CO 0.04 0.26 0.61 1.23 0.02 0.00 0.00 177.57 179.73 2h1n h GLY 550 N 0.94 1.55 0.88 2.17 0.00 -1.36 0.12 103.07 107.38 2h1n h GLY 550 Ca -0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 2h1n h GLY 550 CO 0.04 0.04 -0.16 0.45 0.00 0.00 0.00 176.54 176.91 2h1n h HIS 551 N 0.79 0.66 -0.01 5.60 3.86 -1.69 -2.01 115.15 122.34 2h1n h HIS 551 Ca 0.52 -0.17 0.01 0.00 -1.16 0.00 0.00 60.37 59.57 2h1n h HIS 551 Cb 0.78 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 29.08 2h1n h HIS 551 CO -0.00 0.84 -0.07 0.82 0.86 0.00 0.00 177.93 180.38 2h1n h ILE 552 N 0.29 0.83 -0.55 2.45 1.08 -1.39 -0.06 117.51 120.15 2h1n h ILE 552 Ca 0.05 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.51 2h1n h ILE 552 Cb 0.68 0.83 -0.03 0.00 -3.07 0.00 0.00 36.82 35.23 2h1n h ILE 552 CO 0.04 0.00 0.28 -0.08 -0.69 0.00 0.00 178.15 177.71 2h1n h GLU 553 N -0.11 0.79 -0.94 2.37 4.81 -0.99 -1.26 114.58 119.25 2h1n h GLU 553 Ca 0.03 -0.10 0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2h1n h GLU 553 Cb 0.15 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.33 2h1n h GLU 553 CO -0.08 0.63 0.61 0.00 -0.73 0.00 0.00 179.01 179.44 2h1n h ARG 554 N 0.75 1.16 -0.26 1.92 3.08 -1.20 -0.50 114.38 119.32 2h1n h ARG 554 Ca 0.19 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 2h1n h ARG 554 Cb 0.09 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.86 2h1n h ARG 554 CO -0.03 0.77 0.14 2.35 -1.07 0.00 0.00 179.97 182.13 2h1n h TRP 555 N 1.20 0.36 -0.13 3.04 7.01 -0.29 -2.23 115.95 124.91 2h1n h TRP 555 Ca 0.37 -0.01 -0.10 0.00 2.11 0.00 0.00 58.89 61.26 2h1n h TRP 555 Cb -0.02 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 2h1n h TRP 555 CO -0.01 0.31 -0.36 -0.07 -2.79 0.00 0.00 178.44 175.52 2h1n h LEU 556 N 0.31 0.28 -1.03 0.65 3.38 -1.04 -2.83 115.31 115.03 2h1n h LEU 556 Ca 0.09 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2h1n h LEU 556 Cb 0.07 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2h1n h LEU 556 CO -0.01 0.62 0.18 0.44 0.09 0.00 0.00 178.44 179.76 2h1n h ASP 557 N 0.23 0.81 1.17 -0.43 5.19 -0.87 -2.82 116.42 119.71 2h1n h ASP 557 Ca 0.03 -0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.31 2h1n h ASP 557 Cb 0.75 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 40.05 2h1n h ASP 557 CO 0.06 0.77 0.00 0.77 -3.12 0.00 0.00 179.24 177.71 2h1n h SER 558 N 0.85 0.00 -3.35 6.45 4.64 -1.15 -3.44 113.55 117.55 2h1n h SER 558 Ca 0.19 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.95 2h1n h SER 558 Cb 0.25 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.29 2h1n h SER 558 CO -0.01 0.00 0.32 -0.69 -0.87 0.00 0.00 176.83 175.58 2h1n s VAL 559 N -3.58 4.91 -1.08 0.95 1.01 -1.06 -4.98 120.40 116.57 2h1n s VAL 559 Ca 0.02 1.77 -0.22 0.00 0.00 0.00 0.00 61.98 63.55 2h1n s VAL 559 Cb 0.08 -4.19 -0.00 0.00 0.00 0.00 0.00 36.38 32.27 2h1n s VAL 559 CO 0.56 0.13 1.76 -0.62 0.00 0.00 0.00 175.10 176.93 2h1n s ASP 560 N 0.99 5.85 0.41 3.32 -1.08 -1.26 -4.83 116.67 120.06 2h1n s ASP 560 Ca 0.44 -1.49 0.10 0.00 -0.52 0.00 0.00 52.55 51.08 2h1n s ASP 560 Cb -0.19 -2.57 0.86 0.00 -1.46 0.00 0.00 42.92 39.56 2h1n s ASP 560 CO 0.20 -2.15 1.96 -2.24 0.52 0.00 0.00 175.17 173.46 2h1n h ASP 561 N 9.74 0.21 -0.55 -0.34 3.04 -1.93 -1.82 116.42 124.77 2h1n h ASP 561 Ca 0.23 -0.03 -0.02 0.00 -3.24 0.00 0.00 57.03 53.96 2h1n h ASP 561 Cb 0.96 -0.06 -0.03 0.00 -1.04 0.00 0.00 39.33 39.17 2h1n h ASP 561 CO 1.33 0.32 0.28 0.11 -2.04 0.00 0.00 179.24 179.23 2h1n h LYS 562 N 0.23 0.82 0.00 4.15 1.79 -1.97 -2.86 116.57 118.72 2h1n h LYS 562 Ca 0.05 -0.10 -0.10 0.00 -2.18 0.00 0.00 60.65 58.32 2h1n h LYS 562 Cb 0.27 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.75 2h1n h LYS 562 CO 0.01 0.64 -0.46 0.00 -1.08 0.00 0.00 179.45 178.56 2h1n h ALA 563 N 1.49 0.72 0.00 3.86 0.00 -1.74 -3.51 119.26 120.07 2h1n h ALA 563 Ca 0.20 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2h1n h ALA 563 Cb 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2h1n h ALA 563 CO -0.03 0.57 0.00 1.28 0.00 0.00 0.00 179.25 181.08