#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pmm h LYS 4 N 0.00 0.00 -0.27 1.97 3.64 -2.05 -1.07 116.57 118.79 1pmm h LYS 4 Ca 0.00 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 1pmm h LYS 4 Cb 0.00 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1pmm h LYS 4 CO 0.00 0.28 -0.36 0.37 -2.27 0.00 0.00 179.45 177.47 1pmm h GLN 5 N 0.00 0.61 -0.05 1.90 4.15 -2.05 0.62 115.11 120.29 1pmm h GLN 5 Ca -0.00 -0.29 -0.17 0.00 0.77 0.00 0.00 58.65 58.95 1pmm h GLN 5 Cb 0.63 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 1pmm h GLN 5 CO 0.04 0.88 -0.72 0.28 -1.93 0.00 0.00 178.83 177.38 1pmm h VAL 6 N 0.51 1.41 -0.14 2.39 2.07 -1.83 -2.35 116.25 118.33 1pmm h VAL 6 Ca 0.05 -2.21 -0.21 0.00 0.82 0.00 0.00 66.70 65.15 1pmm h VAL 6 Cb 0.86 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.80 1pmm h VAL 6 CO 0.07 0.65 -0.75 0.74 0.02 0.00 0.00 177.57 178.31 1pmm h THR 7 N 0.19 1.31 -0.46 2.57 2.02 -0.92 -1.77 112.91 115.85 1pmm h THR 7 Ca -0.03 -2.01 -0.13 0.00 0.77 0.00 0.00 66.41 65.01 1pmm h THR 7 Cb 1.29 2.00 -0.01 0.00 -1.74 0.00 0.00 68.15 69.69 1pmm h THR 7 CO 0.12 0.63 -0.23 0.44 0.37 0.00 0.00 175.52 176.85 1pmm h ASP 8 N 0.46 0.97 -0.69 4.18 3.32 -0.88 -2.48 116.42 121.30 1pmm h ASP 8 Ca -0.04 -0.37 -0.05 0.00 0.02 0.00 0.00 57.03 56.59 1pmm h ASP 8 Cb 1.36 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.62 1pmm h ASP 8 CO 0.15 1.15 0.24 0.25 -1.72 0.00 0.00 179.24 179.31 1pmm h LEU 9 N 0.81 0.98 -0.50 1.55 5.85 -1.38 0.57 115.31 123.19 1pmm h LEU 9 Ca 0.10 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.65 1pmm h LEU 9 Cb 0.79 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1pmm h LEU 9 CO 0.07 0.91 0.31 -0.09 -0.34 0.00 0.00 178.44 179.30 1pmm h ARG 10 N 1.00 0.61 -0.54 1.25 2.43 -1.15 -0.93 114.38 117.04 1pmm h ARG 10 Ca 0.23 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.27 1pmm h ARG 10 Cb 0.27 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 1pmm h ARG 10 CO -0.01 0.40 -0.01 0.77 -1.51 0.00 0.00 179.97 179.61 1pmm h SER 11 N 0.62 0.91 -0.19 -3.80 0.02 -1.08 -0.51 113.55 109.52 1pmm h SER 11 Ca 0.20 -0.25 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 1pmm h SER 11 Cb -0.01 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1pmm h SER 11 CO -0.07 0.98 0.09 -0.08 -1.14 0.00 0.00 176.83 176.61 1pmm h GLU 12 N 0.86 0.33 0.08 3.45 4.81 -0.19 0.24 114.58 124.17 1pmm h GLU 12 Ca 0.16 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.24 1pmm h GLU 12 Cb 0.52 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 29.85 1pmm h GLU 12 CO 0.03 0.28 -0.53 1.25 -0.73 0.00 0.00 179.01 179.31 1pmm h LEU 13 N 0.33 0.27 0.00 1.64 5.85 -0.64 -3.40 115.31 119.36 1pmm h LEU 13 Ca 0.09 -0.96 -0.08 0.00 0.84 0.00 0.00 57.88 57.77 1pmm h LEU 13 Cb 0.08 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1pmm h LEU 13 CO -0.01 1.25 -1.36 0.18 -0.34 0.00 0.00 178.44 178.16 1pmm n LEU 14 N -4.31 0.69 -4.67 2.25 4.77 -0.25 -4.98 117.00 110.50 1pmm n LEU 14 Ca -0.13 0.28 -0.41 0.00 -0.03 0.00 0.00 56.01 55.72 1pmm n LEU 14 Cb 0.69 0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.82 1pmm n LEU 14 CO 0.42 -0.01 0.77 0.47 -1.33 0.00 0.00 177.39 177.71 1pmm n ASP 15 N -2.69 2.03 -4.76 -1.43 8.00 0.83 -4.98 116.55 113.56 1pmm n ASP 15 Ca -0.06 1.07 -0.30 0.00 0.71 0.00 0.00 54.79 56.21 1pmm n ASP 15 Cb 0.68 -1.45 0.12 0.00 -0.02 0.00 0.00 41.12 40.46 1pmm n ASP 15 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1pmm s SER 16 N -0.65 3.90 0.20 -2.24 1.04 -1.26 -4.79 113.70 109.90 1pmm s SER 16 Ca 0.63 1.38 -0.19 0.00 0.48 0.00 0.00 55.95 58.25 1pmm s SER 16 Cb -0.52 -2.08 0.16 0.00 0.10 0.00 0.00 66.02 63.68 1pmm s SER 16 CO 0.57 -2.35 1.58 -0.09 0.98 0.00 0.00 173.24 173.92 1pmm h ARG 17 N -1.35 -0.11 -0.01 4.02 9.65 -1.99 -2.12 114.38 122.47 1pmm h ARG 17 Ca -0.48 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.40 1pmm h ARG 17 Cb 1.28 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.88 1pmm h ARG 17 CO 0.57 -0.07 -0.30 1.19 2.80 0.00 0.00 179.97 184.15 1pmm n PHE 18 N -5.45 0.00 1.10 2.20 3.72 -1.26 -3.78 117.46 113.99 1pmm n PHE 18 Ca 0.06 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.58 1pmm n PHE 18 Cb 0.37 -0.09 0.16 0.00 -0.94 0.00 0.00 39.48 38.98 1pmm n PHE 18 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pmm n GLY 19 N 1.36 -0.49 3.77 1.37 0.00 -0.85 -4.94 105.19 105.39 1pmm n GLY 19 Ca 0.12 -0.51 -0.38 0.00 0.00 0.00 0.00 46.02 45.25 1pmm n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pmm s ALA 20 N -2.61 3.02 0.26 4.61 0.00 -0.88 -4.83 121.76 121.34 1pmm s ALA 20 Ca 0.19 1.07 -0.01 0.00 0.00 0.00 0.00 51.96 53.21 1pmm s ALA 20 Cb 0.18 -3.44 0.34 0.00 0.00 0.00 0.00 23.12 20.20 1pmm s ALA 20 CO 0.60 -0.81 1.73 -0.22 0.00 0.00 0.00 175.76 177.06 1pmm h LYS 21 N 2.13 0.69 0.00 0.00 3.64 -1.92 -2.80 116.57 118.31 1pmm h LYS 21 Ca -0.50 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 58.66 1pmm h LYS 21 Cb 1.26 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1pmm h LYS 21 CO 0.60 0.79 0.00 0.66 -2.27 0.00 0.00 179.45 179.23 1pmm h SER 22 N 0.63 0.00 -0.69 4.20 4.64 -1.96 -1.92 113.55 118.45 1pmm h SER 22 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1pmm h SER 22 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1pmm h SER 22 CO 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 1pmm n ILE 23 N -2.69 1.07 1.58 0.95 3.06 -1.06 -4.31 119.36 117.95 1pmm n ILE 23 Ca -0.00 -1.02 0.14 0.00 -2.50 0.00 0.00 62.75 59.37 1pmm n ILE 23 Cb 0.17 0.47 0.59 0.00 0.54 0.00 0.00 39.64 41.41 1pmm n ILE 23 CO 0.00 0.00 0.00 -1.54 -2.50 0.00 0.00 176.55 172.51 1pmm n SER 24 N 1.50 1.26 -4.44 9.51 3.41 -0.72 -4.92 113.62 119.22 1pmm n SER 24 Ca 0.23 -1.42 -0.22 0.00 -0.26 0.00 0.00 58.87 57.20 1pmm n SER 24 Cb 0.62 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.47 1pmm n SER 24 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1pmm s THR 25 N -2.00 2.02 0.35 6.66 -4.23 -1.26 -5.13 115.64 112.06 1pmm s THR 25 Ca 0.39 -2.24 -0.27 0.00 -1.18 0.00 0.00 61.69 58.40 1pmm s THR 25 Cb 0.21 -2.34 -0.09 0.00 1.34 0.00 0.00 72.50 71.62 1pmm s THR 25 CO 0.34 -0.38 1.11 -0.63 -0.54 0.00 0.00 174.62 174.52 1pmm s ILE 26 N -2.78 3.45 0.44 2.99 1.01 -1.26 -4.99 121.20 120.06 1pmm s ILE 26 Ca 0.28 1.28 -0.25 0.00 0.00 0.00 0.00 60.65 61.96 1pmm s ILE 26 Cb -0.00 -3.74 -0.08 0.00 0.01 0.00 0.00 42.46 38.65 1pmm s ILE 26 CO 0.12 0.17 1.33 0.00 0.00 0.00 0.00 174.94 176.56 1pmm s ALA 27 N -1.39 3.17 0.42 9.38 0.00 -1.26 -4.96 121.76 127.12 1pmm s ALA 27 Ca 0.52 1.28 -0.26 0.00 0.00 0.00 0.00 51.96 53.50 1pmm s ALA 27 Cb -0.29 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.23 1pmm s ALA 27 CO 0.36 -0.97 1.38 -2.00 0.00 0.00 0.00 175.76 174.53 1pmm s GLU 28 N -2.43 3.87 0.00 0.00 2.56 -1.26 -4.93 118.70 116.52 1pmm s GLU 28 Ca 0.60 2.33 0.00 0.00 0.00 0.00 0.00 54.97 57.90 1pmm s GLU 28 Cb -0.39 -2.75 0.00 0.00 2.00 0.00 0.00 34.13 32.99 1pmm s GLU 28 CO 0.49 -0.63 0.00 -1.13 -0.56 0.00 0.00 175.26 173.43 1pmm n SER 29 N 0.05 0.00 -0.00 -1.70 3.41 -1.26 -4.96 113.62 109.16 1pmm n SER 29 Ca 0.04 -0.91 -0.00 0.00 -0.26 0.00 0.00 58.87 57.74 1pmm n SER 29 Cb 0.42 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.37 1pmm n SER 29 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1pmm n LYS 30 N 0.00 1.18 -4.31 4.33 5.02 -1.26 -5.09 118.16 118.02 1pmm n LYS 30 Ca 0.00 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.10 1pmm n LYS 30 Cb 0.23 -1.00 -0.11 0.00 -0.02 0.00 0.00 35.03 34.13 1pmm n LYS 30 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1pmm s ARG 31 N -2.00 1.23 0.08 1.97 0.52 -1.26 -5.10 118.95 114.38 1pmm s ARG 31 Ca -0.00 -1.45 -0.31 0.00 -0.52 0.00 0.00 55.73 53.45 1pmm s ARG 31 Cb 0.00 -1.11 -0.08 0.00 0.52 0.00 0.00 34.95 34.28 1pmm s ARG 31 CO 0.00 0.20 1.59 0.12 0.02 0.00 0.00 175.30 177.24 1pmm s PHE 32 N -2.53 2.64 0.46 -0.53 2.19 -1.26 -4.93 117.98 114.02 1pmm s PHE 32 Ca 0.17 0.48 -0.23 0.00 0.33 0.00 0.00 56.93 57.68 1pmm s PHE 32 Cb -0.03 -3.90 -0.09 0.00 -1.31 0.00 0.00 43.02 37.69 1pmm s PHE 32 CO 0.06 -3.52 1.02 -2.30 1.83 0.00 0.00 175.22 172.31 1pmm n PRO 33 N 5.18 1.31 -0.01 10.12 -0.02 -1.26 -4.97 135.00 145.34 1pmm n PRO 33 Ca 0.15 0.47 -0.20 0.00 -2.02 0.00 0.00 63.50 61.90 1pmm n PRO 33 Cb 0.41 -2.10 -0.13 0.00 -0.02 0.00 0.00 33.50 31.65 1pmm n PRO 33 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1pmm h LEU 34 N 1.35 0.27 -9.65 2.45 5.85 -2.07 -3.48 115.31 110.02 1pmm h LEU 34 Ca -0.46 -0.85 -0.57 0.00 0.84 0.00 0.00 57.88 56.85 1pmm h LEU 34 Cb 1.34 -0.09 -0.10 0.00 0.37 0.00 0.00 40.66 42.18 1pmm h LEU 34 CO 0.56 1.44 -0.60 -1.00 -0.34 0.00 0.00 178.44 178.50 1pmm s HIS 35 N -2.40 2.61 0.61 1.25 3.76 -1.26 -5.13 115.29 114.73 1pmm s HIS 35 Ca -0.20 -0.39 -0.09 0.00 -0.15 0.00 0.00 55.06 54.23 1pmm s HIS 35 Cb 0.03 -1.49 -0.01 0.00 1.11 0.00 0.00 32.58 32.21 1pmm s HIS 35 CO 0.74 0.45 0.97 -1.83 -0.85 0.00 0.00 174.74 174.22 1pmm s GLU 36 N -3.75 3.17 0.23 1.40 -1.05 -1.26 -5.09 118.70 112.34 1pmm s GLU 36 Ca 0.35 0.35 -0.03 0.00 -0.15 0.00 0.00 54.97 55.49 1pmm s GLU 36 Cb -0.02 -2.17 -0.03 0.00 -0.44 0.00 0.00 34.13 31.47 1pmm s GLU 36 CO 0.20 -0.68 0.23 0.00 0.95 0.00 0.00 175.26 175.96 1pmm s MET 37 N -5.10 1.36 0.14 -4.83 0.23 -1.26 -5.11 119.30 104.72 1pmm s MET 37 Ca 0.54 -1.60 -0.35 0.00 -1.03 0.00 0.00 55.69 53.26 1pmm s MET 37 Cb -0.11 0.32 -0.15 0.00 -1.53 0.00 0.00 34.83 33.37 1pmm s MET 37 CO 0.49 -0.49 1.52 0.54 -2.03 0.00 0.00 175.02 175.05 1pmm n ARG 38 N -0.34 1.88 0.13 3.16 1.74 -1.26 -4.87 116.66 117.11 1pmm n ARG 38 Ca 0.02 0.68 0.01 0.00 -0.77 0.00 0.00 57.85 57.79 1pmm n ARG 38 Cb 0.65 -2.42 0.34 0.00 -1.02 0.00 0.00 32.46 30.01 1pmm n ARG 38 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 1pmm h ASP 39 N 5.58 0.17 -0.10 0.55 3.04 -1.99 -2.48 116.42 121.18 1pmm h ASP 39 Ca -0.46 -0.05 -0.13 0.00 -3.24 0.00 0.00 57.03 53.16 1pmm h ASP 39 Cb 1.28 -0.04 -0.01 0.00 -1.04 0.00 0.00 39.33 39.51 1pmm h ASP 39 CO 0.86 0.44 -0.35 -2.24 -2.04 0.00 0.00 179.24 175.91 1pmm h ASP 40 N 0.15 0.62 -0.35 4.15 2.03 -1.99 -1.79 116.42 119.25 1pmm h ASP 40 Ca 0.02 -0.26 -0.12 0.00 -0.73 0.00 0.00 57.03 55.94 1pmm h ASP 40 Cb 0.56 -0.17 -0.01 0.00 -0.83 0.00 0.00 39.33 38.88 1pmm h ASP 40 CO 0.04 0.92 -0.26 0.58 -1.03 0.00 0.00 179.24 179.49 1pmm h VAL 41 N 0.50 1.29 -0.57 4.15 2.07 -1.88 0.04 116.25 121.86 1pmm h VAL 41 Ca 0.05 -1.42 -0.01 0.00 0.82 0.00 0.00 66.70 66.14 1pmm h VAL 41 Cb 0.84 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 1pmm h VAL 41 CO 0.07 0.47 0.31 0.00 0.02 0.00 0.00 177.57 178.44 1pmm h ALA 42 N 0.76 0.73 -0.35 1.67 0.00 -1.35 -1.54 119.26 119.18 1pmm h ALA 42 Ca 0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1pmm h ALA 42 Cb 0.83 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1pmm h ALA 42 CO 0.07 0.25 0.06 0.35 0.00 0.00 0.00 179.25 179.98 1pmm h PHE 43 N 0.77 0.62 -0.31 0.00 3.57 -1.20 -2.84 116.94 117.55 1pmm h PHE 43 Ca 0.20 -0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1pmm h PHE 43 Cb 0.05 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 1pmm h PHE 43 CO -0.01 0.64 0.20 0.37 -2.23 0.00 0.00 178.31 177.28 1pmm h GLN 44 N 0.42 0.39 -0.08 1.11 5.75 -0.74 0.13 115.11 122.10 1pmm h GLN 44 Ca 0.11 -0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.60 1pmm h GLN 44 Cb 0.35 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.79 1pmm h GLN 44 CO 0.01 0.26 -0.05 0.82 -2.65 0.00 0.00 178.83 177.22 1pmm h ILE 45 N 0.40 0.85 -0.37 2.39 1.08 -1.29 -0.64 117.51 119.94 1pmm h ILE 45 Ca 0.12 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.52 1pmm h ILE 45 Cb -0.03 0.85 -0.01 0.00 -3.07 0.00 0.00 36.82 34.55 1pmm h ILE 45 CO -0.04 0.00 -0.02 0.40 -0.69 0.00 0.00 178.15 177.80 1pmm h ILE 46 N -0.05 1.26 -0.56 -0.67 2.04 -1.34 -1.30 117.51 116.88 1pmm h ILE 46 Ca 0.05 -1.03 0.07 0.00 1.00 0.00 0.00 64.86 64.95 1pmm h ILE 46 Cb 0.12 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.34 1pmm h ILE 46 CO -0.11 0.34 0.25 -1.13 0.00 0.00 0.00 178.15 177.50 1pmm h ASN 47 N 0.47 0.30 -0.30 1.72 -1.24 -0.59 -2.16 115.58 113.78 1pmm h ASN 47 Ca 0.10 0.05 -0.13 0.00 0.71 0.00 0.00 56.30 57.04 1pmm h ASN 47 Cb 0.50 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.54 1pmm h ASN 47 CO 0.02 0.20 -0.27 0.44 -1.29 0.00 0.00 177.43 176.53 1pmm h ASP 48 N 0.46 0.83 -0.33 1.15 3.32 -0.95 -2.88 116.42 118.02 1pmm h ASP 48 Ca 0.27 -0.32 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1pmm h ASP 48 Cb 0.26 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1pmm h ASP 48 CO -0.23 1.05 0.14 -0.33 -1.72 0.00 0.00 179.24 178.15 1pmm h GLU 49 N 0.69 0.55 0.00 3.56 5.08 -0.79 -2.20 114.58 121.47 1pmm h GLU 49 Ca 0.09 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1pmm h GLU 49 Cb 0.80 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1pmm h GLU 49 CO 0.07 0.47 0.00 1.28 -1.00 0.00 0.00 179.01 179.82 1pmm n LEU 50 N -4.38 0.23 0.16 1.33 4.77 -0.85 -1.41 117.00 116.86 1pmm n LEU 50 Ca 0.02 0.58 0.13 0.00 -0.03 0.00 0.00 56.01 56.71 1pmm n LEU 50 Cb 0.15 -0.58 0.55 0.00 -2.33 0.00 0.00 43.42 41.22 1pmm n LEU 50 CO 0.37 -0.52 0.88 1.88 -1.33 0.00 0.00 177.39 178.68 1pmm h TYR 51 N 0.00 0.00 -0.00 -1.77 0.05 -1.48 -1.95 116.97 111.82 1pmm h TYR 51 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1pmm h TYR 51 Cb 0.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.89 1pmm h TYR 51 CO 0.00 0.00 -0.01 1.28 -1.05 0.00 0.00 178.16 178.38 1pmm n LEU 52 N -2.41 0.10 -4.86 3.88 7.99 -0.50 -4.75 117.00 116.46 1pmm n LEU 52 Ca 0.01 0.12 -0.31 0.00 -0.01 0.00 0.00 56.01 55.83 1pmm n LEU 52 Cb 0.22 -0.16 -0.03 0.00 -0.11 0.00 0.00 43.42 43.34 1pmm n LEU 52 CO 0.20 0.02 0.51 -1.81 -1.51 0.00 0.00 177.39 174.80 1pmm s ASP 53 N -2.33 6.57 0.53 -1.43 1.01 -0.74 -5.04 116.67 115.25 1pmm s ASP 53 Ca 0.36 1.28 -0.19 0.00 0.71 0.00 0.00 52.55 54.71 1pmm s ASP 53 Cb 0.21 -2.38 -0.06 0.00 1.01 0.00 0.00 42.92 41.69 1pmm s ASP 53 CO 0.43 -0.44 1.06 -0.83 0.21 0.00 0.00 175.17 175.60 1pmm s GLY 54 N -3.06 2.43 -0.10 0.21 0.00 -1.26 -4.93 107.32 100.62 1pmm s GLY 54 Ca 0.54 0.60 -0.29 0.00 0.00 0.00 0.00 44.72 45.56 1pmm s GLY 54 CO 0.30 0.93 1.82 0.21 0.00 0.00 0.00 173.10 176.36 1pmm s ASN 55 N -2.16 6.34 0.40 1.64 3.84 -1.26 -4.87 114.94 118.88 1pmm s ASN 55 Ca 0.68 2.15 0.11 0.00 0.21 0.00 0.00 52.86 56.01 1pmm s ASN 55 Cb -0.18 -2.53 0.93 0.00 -0.55 0.00 0.00 41.25 38.92 1pmm s ASN 55 CO 0.26 -1.21 1.95 0.00 -2.79 0.00 0.00 177.10 175.31 1pmm h ALA 56 N 11.01 1.93 0.00 1.71 0.00 -1.93 -0.99 119.26 130.98 1pmm h ALA 56 Ca -0.41 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.45 1pmm h ALA 56 Cb 1.20 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1pmm h ALA 56 CO 0.96 -0.08 -0.20 0.00 0.00 0.00 0.00 179.25 179.94 1pmm h ARG 57 N 0.54 0.00 -0.17 0.00 2.47 -1.89 -2.57 114.38 112.76 1pmm h ARG 57 Ca 0.32 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.04 1pmm h ARG 57 Cb 0.54 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 1pmm h ARG 57 CO -0.11 0.20 0.00 1.04 0.56 0.00 0.00 179.97 181.66 1pmm n GLN 58 N -3.46 2.27 -2.75 0.04 6.02 -0.42 -4.81 117.38 114.27 1pmm n GLN 58 Ca -0.00 -1.89 -0.42 0.00 -0.01 0.00 0.00 57.00 54.68 1pmm n GLN 58 Cb 0.37 -1.48 -0.04 0.00 1.02 0.00 0.00 30.24 30.12 1pmm n GLN 58 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1pmm s ASN 59 N -1.78 6.24 -0.08 1.08 2.47 -0.93 -1.65 114.94 120.28 1pmm s ASN 59 Ca 0.33 -0.59 0.16 0.00 0.42 0.00 0.00 52.86 53.19 1pmm s ASN 59 Cb 0.21 -2.47 0.61 0.00 -1.45 0.00 0.00 41.25 38.15 1pmm s ASN 59 CO 0.31 -1.49 1.50 0.18 -3.72 0.00 0.00 177.10 173.88 1pmm n LEU 60 N 8.12 4.01 -0.05 3.21 4.77 0.07 -4.12 117.00 133.01 1pmm n LEU 60 Ca 0.00 -2.02 -0.17 0.00 -0.03 0.00 0.00 56.01 53.80 1pmm n LEU 60 Cb 0.47 -0.51 -0.14 0.00 -2.33 0.00 0.00 43.42 40.91 1pmm n LEU 60 CO 0.66 0.73 -0.97 0.00 -1.33 0.00 0.00 177.39 176.49 1pmm n ALA 61 N 1.02 1.23 -1.77 -1.18 0.00 -1.10 -1.50 120.51 117.21 1pmm n ALA 61 Ca 0.22 -0.87 -0.34 0.00 0.00 0.00 0.00 53.44 52.45 1pmm n ALA 61 Cb 0.74 -0.48 -0.02 0.00 0.00 0.00 0.00 19.45 19.69 1pmm n ALA 61 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1pmm s THR 62 N -2.55 3.63 -0.81 0.00 -1.32 -1.26 -4.88 115.64 108.46 1pmm s THR 62 Ca -0.22 0.99 0.20 0.00 -1.21 0.00 0.00 61.69 61.45 1pmm s THR 62 Cb 0.07 -3.40 -0.24 0.00 -1.51 0.00 0.00 72.50 67.43 1pmm s THR 62 CO 0.74 -0.25 0.80 0.49 -2.21 0.00 0.00 174.62 174.18 1pmm n PHE 63 N -1.18 0.00 -2.83 9.09 3.01 -1.26 -4.85 117.46 119.44 1pmm n PHE 63 Ca 0.10 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.24 1pmm n PHE 63 Cb 0.52 -0.08 -0.05 0.00 -0.01 0.00 0.00 39.48 39.87 1pmm n PHE 63 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1pmm n GLN 65 N -0.99 2.08 -0.05 0.00 1.13 0.21 -4.88 117.38 114.89 1pmm n GLN 65 Ca 0.04 0.75 0.03 0.00 -1.94 0.00 0.00 57.00 55.89 1pmm n GLN 65 Cb 0.54 -2.50 0.06 0.00 0.11 0.00 0.00 30.24 28.44 1pmm n GLN 65 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1pmm n THR 66 N 3.26 1.28 -3.67 5.09 -2.24 -1.26 -4.73 114.28 112.00 1pmm n THR 66 Ca 0.17 -1.36 -0.14 0.00 -2.27 0.00 0.00 64.05 60.45 1pmm n THR 66 Cb 0.28 0.28 -0.08 0.00 -2.10 0.00 0.00 70.33 68.71 1pmm n THR 66 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1pmm s TRP 67 N -1.55 -0.59 0.01 4.78 -0.00 -1.26 -4.61 118.94 115.73 1pmm s TRP 67 Ca 0.12 1.37 0.00 0.00 -0.00 0.00 0.00 56.10 57.59 1pmm s TRP 67 Cb 0.10 0.22 -0.01 0.00 -0.00 0.00 0.00 33.47 33.77 1pmm s TRP 67 CO 0.02 -0.33 -0.02 -0.51 -0.00 0.00 0.00 176.95 176.11 1pmm s ASP 68 N 0.03 0.16 0.82 5.86 1.01 -1.26 -4.99 116.67 118.30 1pmm s ASP 68 Ca -0.02 -0.31 -0.12 0.00 0.71 0.00 0.00 52.55 52.81 1pmm s ASP 68 Cb -0.04 0.06 0.08 0.00 1.01 0.00 0.00 42.92 44.04 1pmm s ASP 68 CO 0.02 -0.18 1.10 1.51 0.21 0.00 0.00 175.17 177.82 1pmm s ASP 69 N -0.91 4.27 0.29 0.27 1.47 -1.26 -4.82 116.67 115.98 1pmm s ASP 69 Ca -0.10 1.30 0.02 0.00 1.18 0.00 0.00 52.55 54.96 1pmm s ASP 69 Cb -0.06 -2.01 0.61 0.00 -0.34 0.00 0.00 42.92 41.11 1pmm s ASP 69 CO -0.01 -2.11 1.81 -0.08 0.68 0.00 0.00 175.17 175.47 1pmm h GLU 70 N -1.19 0.88 -0.30 2.11 4.81 -2.01 -1.20 114.58 117.68 1pmm h GLU 70 Ca -0.48 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 1pmm h GLU 70 Cb 1.28 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.44 1pmm h GLU 70 CO 0.59 0.58 0.04 -0.91 -0.73 0.00 0.00 179.01 178.58 1pmm h ASN 71 N 0.90 0.40 -0.06 1.04 2.35 -1.99 -1.11 115.58 117.11 1pmm h ASN 71 Ca 0.52 -0.06 -0.17 0.00 -0.55 0.00 0.00 56.30 56.04 1pmm h ASN 71 Cb 0.62 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.89 1pmm h ASN 71 CO -0.31 0.43 -0.57 0.58 -1.65 0.00 0.00 177.43 175.92 1pmm h VAL 72 N 0.43 1.31 -0.83 2.81 2.07 -1.59 0.03 116.25 120.47 1pmm h VAL 72 Ca 0.10 -1.80 -0.03 0.00 0.82 0.00 0.00 66.70 65.79 1pmm h VAL 72 Cb 0.22 1.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.70 1pmm h VAL 72 CO 0.00 0.57 0.41 0.45 0.02 0.00 0.00 177.57 179.02 1pmm h HIS 73 N 0.50 1.18 -0.10 1.57 3.86 -0.87 0.18 115.15 121.47 1pmm h HIS 73 Ca 0.01 -0.05 -0.03 0.00 -1.16 0.00 0.00 60.37 59.14 1pmm h HIS 73 Cb 1.14 -0.37 -0.00 0.00 1.06 0.00 0.00 27.41 29.23 1pmm h HIS 73 CO 0.06 0.85 -0.04 0.87 0.86 0.00 0.00 177.93 180.53 1pmm h LYS 74 N 1.17 0.20 -0.77 2.45 1.57 -1.01 -1.42 116.57 118.77 1pmm h LYS 74 Ca 0.29 -0.08 0.02 0.00 -1.87 0.00 0.00 60.65 59.00 1pmm h LYS 74 Cb 0.10 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 1pmm h LYS 74 CO -0.04 0.54 0.50 -0.07 -0.57 0.00 0.00 179.45 179.81 1pmm h LEU 75 N -0.15 0.86 -0.31 2.94 3.38 -0.83 0.55 115.31 121.75 1pmm h LEU 75 Ca 0.02 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1pmm h LEU 75 Cb 0.48 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1pmm h LEU 75 CO 0.01 0.61 0.14 0.24 0.09 0.00 0.00 178.44 179.54 1pmm h MET 76 N 1.01 0.44 -0.79 1.13 2.86 -0.92 -0.81 114.93 117.85 1pmm h MET 76 Ca 0.29 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.84 1pmm h MET 76 Cb -0.07 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.47 1pmm h MET 76 CO -0.08 0.42 0.40 0.22 1.06 0.00 0.00 176.91 178.94 1pmm h ASP 77 N 0.36 1.01 0.45 1.22 3.58 -0.80 -1.19 116.42 121.05 1pmm h ASP 77 Ca 0.10 -0.12 -0.04 0.00 0.42 0.00 0.00 57.03 57.40 1pmm h ASP 77 Cb 0.13 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1pmm h ASP 77 CO -0.01 0.84 -0.20 -0.07 -2.88 0.00 0.00 179.24 176.92 1pmm h LEU 78 N 1.10 0.00 -2.57 2.28 3.38 -0.64 -3.04 115.31 115.83 1pmm h LEU 78 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1pmm h LEU 78 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1pmm h LEU 78 CO -0.04 0.20 0.00 -1.20 0.09 0.00 0.00 178.44 177.49 1pmm n SER 79 N -3.74 3.31 -0.25 -0.43 7.64 -0.33 -4.62 113.62 115.20 1pmm n SER 79 Ca -0.02 -1.95 0.32 0.00 1.01 0.00 0.00 58.87 58.24 1pmm n SER 79 Cb 0.31 -0.30 0.73 0.00 -1.01 0.00 0.00 64.21 63.94 1pmm n SER 79 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1pmm h ILE 80 N 3.40 0.41 -0.21 0.44 2.10 -1.12 -0.95 117.51 121.58 1pmm h ILE 80 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1pmm h ILE 80 Cb 0.86 0.44 0.00 0.00 -1.09 0.00 0.00 36.82 37.03 1pmm h ILE 80 CO 0.00 0.00 0.00 0.59 -1.08 0.00 0.00 178.15 177.66 1pmm n ASN 81 N -4.10 2.84 -4.64 2.19 3.02 -1.26 -4.88 115.26 108.42 1pmm n ASN 81 Ca 0.22 -2.30 -0.41 0.00 -0.03 0.00 0.00 54.58 52.06 1pmm n ASN 81 Cb 1.15 -0.26 -0.06 0.00 -0.61 0.00 0.00 39.78 40.01 1pmm n ASN 81 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1pmm s LYS 82 N -1.53 4.15 -0.39 3.52 1.02 -0.36 -5.02 119.74 121.13 1pmm s LYS 82 Ca 0.22 0.69 -0.23 0.00 0.02 0.00 0.00 55.97 56.67 1pmm s LYS 82 Cb 0.15 -3.64 0.01 0.00 -0.52 0.00 0.00 37.83 33.83 1pmm s LYS 82 CO 0.09 -0.42 0.76 1.21 -0.92 0.00 0.00 175.35 176.07 1pmm s ASN 83 N 1.39 6.49 0.41 2.83 3.84 -1.26 -1.32 114.94 127.32 1pmm s ASN 83 Ca 0.29 0.18 0.15 0.00 0.21 0.00 0.00 52.86 53.70 1pmm s ASN 83 Cb -0.15 -2.38 1.02 0.00 -0.55 0.00 0.00 41.25 39.19 1pmm s ASN 83 CO 0.08 -0.76 1.88 -0.25 -2.79 0.00 0.00 177.10 175.27 1pmm h TRP 84 N 8.62 0.57 0.00 0.43 7.01 -1.06 -2.70 115.95 128.82 1pmm h TRP 84 Ca -0.25 0.02 -0.15 0.00 2.11 0.00 0.00 58.89 60.61 1pmm h TRP 84 Cb 1.09 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.95 1pmm h TRP 84 CO 0.79 0.19 -0.73 0.97 -2.79 0.00 0.00 178.44 176.87 1pmm h ILE 85 N 0.46 1.50 -0.39 2.65 6.09 -1.77 -3.39 117.51 122.66 1pmm h ILE 85 Ca 0.43 -2.51 -0.69 0.00 -1.37 0.00 0.00 64.86 60.71 1pmm h ILE 85 Cb 0.96 2.36 -0.06 0.00 0.47 0.00 0.00 36.82 40.55 1pmm h ILE 85 CO -0.16 0.71 2.71 0.47 -3.07 0.00 0.00 178.15 178.81 1pmm n ASP 86 N -3.64 4.34 -0.16 2.19 8.00 -1.02 -4.80 116.55 121.48 1pmm n ASP 86 Ca -0.01 -2.87 0.14 0.00 0.71 0.00 0.00 54.79 52.76 1pmm n ASP 86 Cb 0.72 -1.70 0.49 0.00 -0.02 0.00 0.00 41.12 40.61 1pmm n ASP 86 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1pmm h LYS 87 N 6.73 0.42 0.04 -1.24 1.79 -1.83 -0.97 116.57 121.51 1pmm h LYS 87 Ca 0.51 -0.03 -0.24 0.00 -2.18 0.00 0.00 60.65 58.72 1pmm h LYS 87 Cb 0.75 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 31.28 1pmm h LYS 87 CO 1.69 0.28 -1.17 1.49 -1.08 0.00 0.00 179.45 180.66 1pmm h GLU 88 N 0.44 0.09 0.00 3.15 4.57 -1.87 -2.79 114.58 118.16 1pmm h GLU 88 Ca 0.36 -0.15 -0.23 0.00 -1.18 0.00 0.00 59.36 58.16 1pmm h GLU 88 Cb 0.78 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 29.38 1pmm h GLU 88 CO -0.11 1.02 -1.20 0.93 -1.18 0.00 0.00 179.01 178.46 1pmm h GLU 89 N 0.02 0.00 -2.13 1.92 5.08 -1.81 -3.36 114.58 114.30 1pmm h GLU 89 Ca -0.08 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.71 1pmm h GLU 89 Cb 1.86 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.70 1pmm h GLU 89 CO 0.15 0.82 -0.85 0.66 -1.00 0.00 0.00 179.01 178.78 1pmm n TYR 90 N -3.25 2.07 0.09 4.33 4.02 -0.43 -4.97 117.16 119.04 1pmm n TYR 90 Ca -0.05 -3.90 0.05 0.00 -0.01 0.00 0.00 57.90 53.98 1pmm n TYR 90 Cb 0.97 -0.46 0.48 0.00 -0.02 0.00 0.00 39.34 40.30 1pmm n TYR 90 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1pmm h PRO 91 N 3.60 0.34 0.07 -0.72 0.13 -1.66 -2.32 132.00 131.44 1pmm h PRO 91 Ca 0.13 -0.03 -0.24 0.00 -0.87 0.00 0.00 66.00 64.99 1pmm h PRO 91 Cb 0.74 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.78 1pmm h PRO 91 CO 0.67 0.26 -1.12 0.37 -0.23 0.00 0.00 178.00 177.95 1pmm h GLN 92 N 0.35 0.15 -0.76 0.86 5.75 -1.93 -0.98 115.11 118.54 1pmm h GLN 92 Ca 0.09 -0.25 -0.04 0.00 -0.15 0.00 0.00 58.65 58.30 1pmm h GLN 92 Cb 0.02 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.63 1pmm h GLN 92 CO -0.01 1.11 0.30 0.77 -2.65 0.00 0.00 178.83 178.35 1pmm h SER 93 N 0.04 1.04 -0.72 -0.69 0.02 -1.90 -0.15 113.55 111.20 1pmm h SER 93 Ca -0.08 -0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 60.65 1pmm h SER 93 Cb 1.87 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 64.11 1pmm h SER 93 CO 0.17 0.92 0.20 0.00 -1.14 0.00 0.00 176.83 176.98 1pmm h ALA 94 N 1.22 0.94 -0.56 3.77 0.00 -1.28 -1.93 119.26 121.43 1pmm h ALA 94 Ca 0.25 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1pmm h ALA 94 Cb 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1pmm h ALA 94 CO -0.02 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1pmm h ALA 95 N 1.10 0.76 -0.72 0.00 0.00 -0.54 -2.00 119.26 117.85 1pmm h ALA 95 Ca 0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1pmm h ALA 95 Cb 0.34 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1pmm h ALA 95 CO -0.00 0.58 0.33 0.82 0.00 0.00 0.00 179.25 180.98 1pmm h ILE 96 N 0.87 1.24 -0.58 0.00 2.04 -0.85 -1.88 117.51 118.35 1pmm h ILE 96 Ca 0.16 -0.70 0.01 0.00 1.00 0.00 0.00 64.86 65.32 1pmm h ILE 96 Cb 0.54 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 1pmm h ILE 96 CO 0.03 0.29 0.39 -0.78 0.00 0.00 0.00 178.15 178.07 1pmm h ASP 97 N 1.02 0.67 -0.02 1.72 1.82 -1.14 -1.97 116.42 118.52 1pmm h ASP 97 Ca 0.25 -0.02 -0.03 0.00 -0.39 0.00 0.00 57.03 56.84 1pmm h ASP 97 Cb 0.15 -0.17 -0.01 0.00 0.68 0.00 0.00 39.33 39.98 1pmm h ASP 97 CO -0.03 0.48 -0.06 -0.07 -1.61 0.00 0.00 179.24 177.95 1pmm h LEU 98 N 0.79 0.19 -0.40 2.28 3.38 -0.91 -1.70 115.31 118.93 1pmm h LEU 98 Ca 0.21 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.05 1pmm h LEU 98 Cb -0.09 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1pmm h LEU 98 CO -0.05 0.28 -0.17 0.03 0.09 0.00 0.00 178.44 178.63 1pmm h ARG 99 N 0.20 0.83 -0.82 1.13 3.08 -0.65 -2.52 114.38 115.63 1pmm h ARG 99 Ca 0.05 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.73 1pmm h ARG 99 Cb 0.25 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 1pmm h ARG 99 CO 0.01 0.98 0.44 0.00 -1.07 0.00 0.00 179.97 180.33 1pmm h VAL 101 N 1.15 1.00 -0.54 0.00 2.07 -1.16 0.13 116.25 118.89 1pmm h VAL 101 Ca 0.29 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.56 1pmm h VAL 101 Cb 0.05 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1pmm h VAL 101 CO -0.04 0.12 0.22 0.78 0.02 0.00 0.00 177.57 178.66 1pmm h ASN 102 N 0.64 0.75 -0.58 0.57 2.35 -0.96 -1.73 115.58 116.62 1pmm h ASN 102 Ca 0.26 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.75 1pmm h ASN 102 Cb 0.12 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1pmm h ASN 102 CO -0.15 0.71 0.02 0.24 -1.65 0.00 0.00 177.43 176.60 1pmm h MET 103 N 0.74 1.01 -0.37 0.81 2.86 -0.37 -0.69 114.93 118.91 1pmm h MET 103 Ca 0.18 -0.31 -0.10 0.00 -2.06 0.00 0.00 59.70 57.41 1pmm h MET 103 Cb 0.20 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 1pmm h MET 103 CO -0.01 0.99 -0.14 0.28 1.06 0.00 0.00 176.91 179.09 1pmm h VAL 104 N 0.90 1.28 -0.86 -2.22 2.07 -0.70 -0.74 116.25 115.98 1pmm h VAL 104 Ca 0.17 -1.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.42 1pmm h VAL 104 Cb 0.53 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 1pmm h VAL 104 CO 0.03 0.41 0.47 0.00 0.02 0.00 0.00 177.57 178.50 1pmm h ALA 105 N 0.81 1.10 -0.59 1.67 0.00 -1.21 -1.62 119.26 119.43 1pmm h ALA 105 Ca 0.09 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1pmm h ALA 105 Cb 0.68 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1pmm h ALA 105 CO 0.05 0.62 0.14 0.22 0.00 0.00 0.00 179.25 180.27 1pmm h ASP 106 N 1.20 0.89 -0.38 0.00 3.58 -0.93 -0.10 116.42 120.68 1pmm h ASP 106 Ca 0.30 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.52 1pmm h ASP 106 Cb 0.03 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.83 1pmm h ASP 106 CO -0.05 0.90 0.24 0.25 -2.88 0.00 0.00 179.24 177.70 1pmm h LEU 107 N 0.85 0.45 -2.86 2.28 5.85 -0.53 -1.96 115.31 119.39 1pmm h LEU 107 Ca 0.18 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1pmm h LEU 107 Cb 0.36 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1pmm h LEU 107 CO 0.00 0.34 0.00 0.79 -0.34 0.00 0.00 178.44 179.23 1pmm n TRP 108 N -4.47 1.48 -2.78 1.25 8.01 -0.66 -4.93 117.44 115.34 1pmm n TRP 108 Ca 0.03 -0.54 -0.20 0.00 -1.31 0.00 0.00 57.50 55.47 1pmm n TRP 108 Cb 0.07 -0.33 0.01 0.00 -2.01 0.00 0.00 31.31 29.04 1pmm n TRP 108 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 1pmm n HIS 109 N 0.67 -1.56 -2.01 -5.99 8.25 -0.74 -2.48 115.22 111.37 1pmm n HIS 109 Ca 0.22 0.27 -0.36 0.00 -0.26 0.00 0.00 57.72 57.59 1pmm n HIS 109 Cb 0.90 -3.85 0.03 0.00 1.12 0.00 0.00 29.99 28.20 1pmm n HIS 109 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pmm s ALA 110 N -3.01 2.54 0.31 -1.41 0.00 -0.08 -4.42 121.76 115.69 1pmm s ALA 110 Ca 0.17 1.00 -0.29 0.00 0.00 0.00 0.00 51.96 52.85 1pmm s ALA 110 Cb -0.08 -3.45 -0.12 0.00 0.00 0.00 0.00 23.12 19.46 1pmm s ALA 110 CO 0.21 -1.16 1.35 -2.30 0.00 0.00 0.00 175.76 173.86 1pmm n PRO 111 N -1.60 2.17 -1.68 0.00 -0.02 -1.26 -4.81 135.00 127.81 1pmm n PRO 111 Ca 0.14 0.76 -0.46 0.00 -2.02 0.00 0.00 63.50 61.92 1pmm n PRO 111 Cb 0.50 -2.39 -0.04 0.00 -0.02 0.00 0.00 33.50 31.55 1pmm n PRO 111 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pmm n ALA 112 N 0.89 1.47 -1.93 3.55 0.00 -1.26 -4.89 120.51 118.34 1pmm n ALA 112 Ca 0.07 0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.47 1pmm n ALA 112 Cb 0.35 -2.42 -0.03 0.00 0.00 0.00 0.00 19.45 17.35 1pmm n ALA 112 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1pmm s PRO 113 N 1.80 3.79 0.23 0.00 0.02 -1.26 -4.91 135.00 134.67 1pmm s PRO 113 Ca 0.82 1.97 -0.08 0.00 0.02 0.00 0.00 61.00 63.73 1pmm s PRO 113 Cb -0.64 -4.11 0.27 0.00 0.02 0.00 0.00 34.50 30.03 1pmm s PRO 113 CO 0.40 -1.32 1.85 0.87 -0.33 0.00 0.00 177.00 178.47 1pmm h LYS 114 N 11.33 0.89 -0.30 5.54 1.57 -1.90 -1.48 116.57 132.21 1pmm h LYS 114 Ca -0.39 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1pmm h LYS 114 Cb 1.19 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1pmm h LYS 114 CO 0.98 0.59 0.00 0.27 -0.57 0.00 0.00 179.45 180.71 1pmm n ASN 115 N -4.65 1.61 0.00 0.86 0.23 -1.26 -4.91 115.26 107.14 1pmm n ASN 115 Ca 0.10 -2.00 0.00 0.00 -0.53 0.00 0.00 54.58 52.15 1pmm n ASN 115 Cb 0.14 -0.20 0.00 0.00 -2.08 0.00 0.00 39.78 37.63 1pmm n ASN 115 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1pmm n GLY 116 N 0.96 0.72 2.77 4.83 0.00 -0.56 -5.01 105.19 108.91 1pmm n GLY 116 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1pmm n GLY 116 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1pmm s GLN 117 N -0.08 0.75 0.78 1.61 2.00 -1.26 -4.98 119.66 118.49 1pmm s GLN 117 Ca 0.00 -0.18 -0.12 0.00 -2.00 0.00 0.00 55.36 53.05 1pmm s GLN 117 Cb 0.00 -1.57 0.07 0.00 0.80 0.00 0.00 33.01 32.31 1pmm s GLN 117 CO 0.00 -0.45 1.14 0.00 -0.50 0.00 0.00 175.29 175.48 1pmm s ALA 118 N 1.88 2.02 -0.40 1.58 0.00 -1.26 -4.86 121.76 120.72 1pmm s ALA 118 Ca 0.02 0.57 -0.20 0.00 0.00 0.00 0.00 51.96 52.35 1pmm s ALA 118 Cb -0.14 -3.38 0.01 0.00 0.00 0.00 0.00 23.12 19.61 1pmm s ALA 118 CO -0.07 -2.01 0.60 0.08 0.00 0.00 0.00 175.76 174.36 1pmm s VAL 119 N -2.50 4.90 0.00 0.00 1.01 -1.26 -4.87 120.40 117.68 1pmm s VAL 119 Ca 0.67 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.86 1pmm s VAL 119 Cb -0.22 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.03 1pmm s VAL 119 CO 0.51 -0.46 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1pmm n GLY 120 N 4.93 -0.77 3.37 4.51 0.00 -1.26 -0.45 105.19 115.51 1pmm n GLY 120 Ca -0.03 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 1pmm n GLY 120 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1pmm s THR 121 N -2.00 0.04 0.38 2.61 -1.32 -0.34 -5.01 115.64 110.01 1pmm s THR 121 Ca 0.00 -0.32 -0.11 0.00 -1.21 0.00 0.00 61.69 60.05 1pmm s THR 121 Cb 0.00 -1.06 -0.07 0.00 -1.51 0.00 0.00 72.50 69.86 1pmm s THR 121 CO 0.00 -0.18 0.75 0.21 -2.21 0.00 0.00 174.62 173.19 1pmm s ASN 122 N -2.50 6.57 0.26 8.08 3.84 -1.26 -2.17 114.94 127.75 1pmm s ASN 122 Ca -0.00 1.14 -0.03 0.00 0.21 0.00 0.00 52.86 54.18 1pmm s ASN 122 Cb 0.00 -2.32 -0.02 0.00 -0.55 0.00 0.00 41.25 38.36 1pmm s ASN 122 CO -0.09 -0.35 0.31 0.42 -2.79 0.00 0.00 177.10 174.60 1pmm s THR 123 N -2.28 0.00 0.35 -5.21 -4.23 0.08 -4.95 115.64 99.41 1pmm s THR 123 Ca 0.51 -1.78 0.10 0.00 -1.18 0.00 0.00 61.69 59.35 1pmm s THR 123 Cb -0.10 -2.46 0.09 0.00 1.34 0.00 0.00 72.50 71.37 1pmm s THR 123 CO 0.28 0.00 1.81 0.40 -0.54 0.00 0.00 174.62 176.58 1pmm h ILE 124 N 2.35 1.26 -1.94 2.99 1.08 -1.84 0.70 117.51 122.10 1pmm h ILE 124 Ca -0.30 -1.21 0.15 0.00 -0.39 0.00 0.00 64.86 63.10 1pmm h ILE 124 Cb 1.24 1.56 -0.03 0.00 -3.07 0.00 0.00 36.82 36.53 1pmm h ILE 124 CO 0.43 0.36 0.43 0.61 -0.69 0.00 0.00 178.15 179.29 1pmm n GLY 125 N -0.49 0.64 0.25 5.37 0.00 -1.26 -0.75 105.19 108.95 1pmm n GLY 125 Ca -0.01 -1.01 0.11 0.00 0.00 0.00 0.00 46.02 45.11 1pmm n GLY 125 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1pmm h SER 126 N 1.15 0.00 0.43 1.61 0.02 -1.84 -2.51 113.55 112.41 1pmm h SER 126 Ca -0.14 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.79 1pmm h SER 126 Cb 0.69 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1pmm h SER 126 CO 0.20 0.16 -0.22 -1.28 -1.14 0.00 0.00 176.83 174.54 1pmm h SER 127 N 0.00 -0.53 -0.60 3.07 0.87 -1.95 0.69 113.55 115.10 1pmm h SER 127 Ca -0.00 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1pmm h SER 127 Cb 0.42 0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.49 1pmm h SER 127 CO 0.02 -0.37 0.27 -0.08 -0.53 0.00 0.00 176.83 176.14 1pmm h GLU 128 N -0.60 0.89 -0.80 2.24 4.81 -1.94 -1.54 114.58 117.63 1pmm h GLU 128 Ca -0.06 -0.14 0.04 0.00 -0.13 0.00 0.00 59.36 59.07 1pmm h GLU 128 Cb 0.47 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.64 1pmm h GLU 128 CO 0.09 0.73 0.50 0.00 -0.73 0.00 0.00 179.01 179.60 1pmm h ALA 129 N 1.11 1.06 -0.29 2.92 0.00 -1.08 -0.03 119.26 122.96 1pmm h ALA 129 Ca 0.20 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 1pmm h ALA 129 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1pmm h ALA 129 CO -0.02 0.30 -0.25 0.00 0.00 0.00 0.00 179.25 179.28 1pmm h MET 131 N 0.49 0.57 -0.31 0.00 2.86 -0.44 0.11 114.93 118.21 1pmm h MET 131 Ca 0.07 -0.30 -0.07 0.00 -2.06 0.00 0.00 59.70 57.34 1pmm h MET 131 Cb 0.70 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 1pmm h MET 131 CO 0.05 0.89 -0.08 -0.07 1.06 0.00 0.00 176.91 178.76 1pmm h LEU 132 N 0.47 0.60 -0.88 1.22 3.38 -0.84 -0.96 115.31 118.30 1pmm h LEU 132 Ca 0.04 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 1pmm h LEU 132 Cb 0.94 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1pmm h LEU 132 CO 0.08 0.83 0.21 1.23 0.09 0.00 0.00 178.44 180.89 1pmm h GLY 133 N 0.36 1.12 1.09 0.83 0.00 -1.03 -2.13 103.07 103.32 1pmm h GLY 133 Ca 0.08 -0.64 -0.12 0.00 0.00 0.00 0.00 47.33 46.64 1pmm h GLY 133 CO 0.03 0.60 -0.17 -1.33 0.00 0.00 0.00 176.54 175.67 1pmm h GLY 134 N 1.07 1.08 1.00 4.60 0.00 -0.64 -1.11 103.07 109.07 1pmm h GLY 134 Ca 0.22 -0.93 -0.03 0.00 0.00 0.00 0.00 47.33 46.60 1pmm h GLY 134 CO -0.01 0.84 0.26 -0.33 0.00 0.00 0.00 176.54 177.31 1pmm h MET 135 N 0.86 0.90 -0.71 4.80 2.07 -0.99 0.12 114.93 121.98 1pmm h MET 135 Ca 0.12 -0.15 -0.07 0.00 -2.07 0.00 0.00 59.70 57.52 1pmm h MET 135 Cb 0.75 -0.15 -0.03 0.00 -1.87 0.00 0.00 31.60 30.30 1pmm h MET 135 CO 0.06 0.76 0.16 0.00 1.07 0.00 0.00 176.91 178.96 1pmm h ALA 136 N 1.10 0.95 -0.24 6.32 0.00 -1.27 -1.10 119.26 125.03 1pmm h ALA 136 Ca 0.21 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1pmm h ALA 136 Cb 0.18 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1pmm h ALA 136 CO -0.02 0.67 0.10 0.52 0.00 0.00 0.00 179.25 180.53 1pmm h MET 137 N 1.08 0.35 -0.74 0.00 2.86 -0.80 -0.89 114.93 116.78 1pmm h MET 137 Ca 0.22 -0.06 0.03 0.00 -2.06 0.00 0.00 59.70 57.84 1pmm h MET 137 Cb 0.39 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.94 1pmm h MET 137 CO 0.00 0.37 0.47 -0.22 1.06 0.00 0.00 176.91 178.59 1pmm h LYS 138 N 0.24 0.88 -0.43 1.72 3.64 -0.73 0.14 116.57 122.03 1pmm h LYS 138 Ca 0.08 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 1pmm h LYS 138 Cb 0.15 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 1pmm h LYS 138 CO -0.01 0.59 0.06 2.35 -2.27 0.00 0.00 179.45 180.17 1pmm h TRP 139 N 0.91 0.77 -0.62 1.91 2.91 -1.00 -0.69 115.95 120.14 1pmm h TRP 139 Ca 0.30 -0.11 -0.06 0.00 1.13 0.00 0.00 58.89 60.14 1pmm h TRP 139 Cb 0.02 -0.21 -0.03 0.00 -0.51 0.00 0.00 29.16 28.43 1pmm h TRP 139 CO -0.04 0.74 0.13 0.00 -1.03 0.00 0.00 178.44 178.25 1pmm h ARG 140 N 0.58 0.99 -0.21 2.65 3.08 -0.76 -1.64 114.38 119.06 1pmm h ARG 140 Ca 0.13 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 1pmm h ARG 140 Cb 0.39 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1pmm h ARG 140 CO 0.01 0.89 0.07 2.35 -1.07 0.00 0.00 179.97 182.22 1pmm h TRP 141 N 0.94 0.33 -0.80 3.04 7.01 -0.72 -1.10 115.95 124.65 1pmm h TRP 141 Ca 0.20 -0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.19 1pmm h TRP 141 Cb 0.37 -0.10 -0.04 0.00 -2.10 0.00 0.00 29.16 27.29 1pmm h TRP 141 CO 0.02 0.40 0.53 0.00 -2.79 0.00 0.00 178.44 176.60 1pmm h ARG 142 N 0.17 1.00 -0.59 2.65 3.08 -0.87 -0.15 114.38 119.66 1pmm h ARG 142 Ca 0.07 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 59.96 1pmm h ARG 142 Cb 0.22 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1pmm h ARG 142 CO -0.00 0.66 -0.01 0.87 -1.07 0.00 0.00 179.97 180.42 1pmm h LYS 143 N 1.03 1.04 -0.52 0.04 1.79 -1.03 0.21 116.57 119.13 1pmm h LYS 143 Ca 0.31 -0.33 -0.05 0.00 -2.18 0.00 0.00 60.65 58.40 1pmm h LYS 143 Cb -0.04 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 1pmm h LYS 143 CO -0.08 1.02 0.15 -0.09 -1.08 0.00 0.00 179.45 179.37 1pmm h ARG 144 N 0.95 0.83 -0.31 3.15 2.43 -0.24 -0.39 114.38 120.80 1pmm h ARG 144 Ca 0.17 -0.19 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1pmm h ARG 144 Cb 0.56 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1pmm h ARG 144 CO 0.03 0.78 -0.17 0.52 -1.51 0.00 0.00 179.97 179.62 1pmm h MET 145 N 0.73 0.67 -0.54 0.20 2.86 -0.82 -3.05 114.93 114.98 1pmm h MET 145 Ca 0.17 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1pmm h MET 145 Cb 0.31 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.93 1pmm h MET 145 CO -0.00 0.90 0.29 0.93 1.06 0.00 0.00 176.91 180.08 1pmm h GLU 146 N 0.43 0.75 0.00 1.72 5.08 -0.41 -0.37 114.58 121.78 1pmm h GLU 146 Ca 0.07 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1pmm h GLU 146 Cb 0.71 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1pmm h GLU 146 CO 0.05 0.56 0.00 0.00 -1.00 0.00 0.00 179.01 178.62 1pmm h ALA 147 N 1.56 1.00 -0.28 3.43 0.00 -0.95 -0.14 119.26 123.88 1pmm h ALA 147 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1pmm h ALA 147 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1pmm h ALA 147 CO -0.03 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.22 1pmm n ALA 148 N -2.04 2.34 -1.50 0.00 0.00 -0.40 -4.98 120.51 113.94 1pmm n ALA 148 Ca -0.02 -1.44 -0.16 0.00 0.00 0.00 0.00 53.44 51.83 1pmm n ALA 148 Cb 0.13 -0.45 -0.07 0.00 0.00 0.00 0.00 19.45 19.07 1pmm n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pmm n GLY 149 N 0.12 1.54 3.90 0.00 0.00 -0.07 -5.00 105.19 105.68 1pmm n GLY 149 Ca 0.13 -0.26 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 1pmm n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pmm s LYS 150 N -3.41 3.66 0.64 1.61 1.02 -0.29 -4.97 119.74 118.00 1pmm s LYS 150 Ca 0.00 0.05 -0.17 0.00 0.02 0.00 0.00 55.97 55.87 1pmm s LYS 150 Cb 0.00 -2.64 -0.01 0.00 -0.52 0.00 0.00 37.83 34.66 1pmm s LYS 150 CO 0.00 0.22 1.20 -2.14 -0.92 0.00 0.00 175.35 173.71 1pmm s PRO 151 N -3.46 2.70 -0.15 -1.68 0.02 -1.26 -4.18 135.00 127.01 1pmm s PRO 151 Ca 0.44 1.76 0.15 0.00 0.02 0.00 0.00 61.00 63.37 1pmm s PRO 151 Cb -0.11 -1.90 0.37 0.00 0.02 0.00 0.00 34.50 32.88 1pmm s PRO 151 CO 0.29 -1.40 1.18 0.25 -0.33 0.00 0.00 177.00 176.99 1pmm n THR 152 N -2.01 1.63 1.31 0.99 -2.24 -1.26 -4.79 114.28 107.91 1pmm n THR 152 Ca 0.13 -2.47 0.13 0.00 -2.27 0.00 0.00 64.05 59.58 1pmm n THR 152 Cb 0.50 0.02 0.39 0.00 -2.10 0.00 0.00 70.33 69.13 1pmm n THR 152 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1pmm n ASP 153 N -0.84 1.51 -2.50 3.42 5.75 -1.26 -4.46 116.55 118.16 1pmm n ASP 153 Ca 0.15 -1.32 -0.22 0.00 -0.01 0.00 0.00 54.79 53.40 1pmm n ASP 153 Cb 0.76 0.09 0.01 0.00 -1.03 0.00 0.00 41.12 40.95 1pmm n ASP 153 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1pmm n LYS 154 N -0.04 2.84 -2.17 0.11 5.02 -1.26 -5.09 118.16 117.57 1pmm n LYS 154 Ca 0.15 -4.16 -0.37 0.00 -2.02 0.00 0.00 58.31 51.92 1pmm n LYS 154 Cb 0.39 -1.99 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 1pmm n LYS 154 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1pmm s PRO 155 N -3.45 3.52 0.10 1.97 0.04 -1.26 -4.79 135.00 131.13 1pmm s PRO 155 Ca 0.43 1.81 0.01 0.00 0.04 0.00 0.00 61.00 63.29 1pmm s PRO 155 Cb 0.41 -2.27 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 1pmm s PRO 155 CO -0.12 -0.76 -0.04 0.54 0.04 0.00 0.00 177.00 176.67 1pmm s ASN 156 N -1.40 0.93 -0.08 6.66 2.20 -0.20 -1.36 114.94 121.69 1pmm s ASN 156 Ca 0.68 -1.04 0.02 0.00 -0.94 0.00 0.00 52.86 51.58 1pmm s ASN 156 Cb -0.30 0.14 0.02 0.00 -2.00 0.00 0.00 41.25 39.11 1pmm s ASN 156 CO 0.35 -0.53 -0.12 -0.22 -2.94 0.00 0.00 177.10 173.64 1pmm s LEU 157 N -3.03 1.57 -0.15 3.54 2.96 0.56 -0.81 118.68 123.32 1pmm s LEU 157 Ca 0.13 -0.33 -0.13 0.00 -0.22 0.00 0.00 54.13 53.58 1pmm s LEU 157 Cb 0.06 -0.88 -0.05 0.00 0.50 0.00 0.00 46.19 45.82 1pmm s LEU 157 CO -0.05 0.00 0.28 -0.69 -1.32 0.00 0.00 176.35 174.57 1pmm s VAL 158 N 0.93 5.31 0.38 1.68 1.01 -1.00 -0.23 120.40 128.48 1pmm s VAL 158 Ca -0.09 0.52 -0.15 0.00 0.00 0.00 0.00 61.98 62.26 1pmm s VAL 158 Cb -0.15 -3.61 0.05 0.00 0.00 0.00 0.00 36.38 32.67 1pmm s VAL 158 CO 0.00 0.42 0.76 0.00 0.00 0.00 0.00 175.10 176.29 1pmm n GLY 160 N -0.53 3.36 3.31 0.00 0.00 -1.26 -0.27 105.19 109.80 1pmm n GLY 160 Ca -0.07 -1.73 -0.37 0.00 0.00 0.00 0.00 46.02 43.84 1pmm n GLY 160 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pmm n PRO 161 N 0.00 1.92 -1.69 1.61 -0.04 -1.26 -4.44 135.00 131.10 1pmm n PRO 161 Ca 0.00 -2.36 -0.30 0.00 -0.04 0.00 0.00 63.50 60.79 1pmm n PRO 161 Cb 0.00 -3.35 0.06 0.00 -0.04 0.00 0.00 33.50 30.17 1pmm n PRO 161 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1pmm s VAL 162 N 7.01 3.57 0.62 0.52 -7.23 -1.26 -4.67 120.40 118.95 1pmm s VAL 162 Ca 0.60 0.51 -0.14 0.00 -1.81 0.00 0.00 61.98 61.14 1pmm s VAL 162 Cb 0.07 -3.36 -0.03 0.00 0.56 0.00 0.00 36.38 33.63 1pmm s VAL 162 CO 0.10 -0.66 1.04 -1.58 -0.31 0.00 0.00 175.10 173.69 1pmm s GLN 163 N -5.20 3.33 0.59 4.82 -0.44 -1.26 -4.92 119.66 116.57 1pmm s GLN 163 Ca 0.59 1.03 0.29 0.00 -2.50 0.00 0.00 55.36 54.77 1pmm s GLN 163 Cb -0.13 -2.04 1.46 0.00 -1.64 0.00 0.00 33.01 30.66 1pmm s GLN 163 CO 0.54 -0.79 1.88 0.97 0.50 0.00 0.00 175.29 178.39 1pmm h ILE 164 N 0.06 0.37 -0.28 -2.34 6.09 -2.01 -2.07 117.51 117.34 1pmm h ILE 164 Ca -0.46 0.00 0.07 0.00 -1.37 0.00 0.00 64.86 63.10 1pmm h ILE 164 Cb 1.21 0.60 -0.01 0.00 0.47 0.00 0.00 36.82 39.08 1pmm h ILE 164 CO 0.58 0.00 0.20 0.00 -3.07 0.00 0.00 178.15 175.86 1pmm h TRP 166 N 0.06 0.00 -0.09 0.00 4.06 -1.74 -0.12 115.95 118.11 1pmm h TRP 166 Ca 0.13 0.00 -0.21 0.00 2.06 0.00 0.00 58.89 60.87 1pmm h TRP 166 Cb 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.60 1pmm h TRP 166 CO -0.00 0.38 -0.79 0.45 -3.56 0.00 0.00 178.44 174.93 1pmm h HIS 167 N 0.00 0.75 -0.43 0.49 3.86 -1.13 -1.96 115.15 116.73 1pmm h HIS 167 Ca -0.00 -0.35 -0.14 0.00 -1.16 0.00 0.00 60.37 58.72 1pmm h HIS 167 Cb 0.92 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.26 1pmm h HIS 167 CO 0.00 1.14 -0.27 0.87 0.86 0.00 0.00 177.93 180.53 1pmm h LYS 168 N 0.36 0.92 -0.08 2.45 1.57 -1.01 -1.28 116.57 119.50 1pmm h LYS 168 Ca -0.05 -0.41 0.01 0.00 -1.87 0.00 0.00 60.65 58.33 1pmm h LYS 168 Cb 1.39 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.67 1pmm h LYS 168 CO 0.15 1.07 0.02 0.35 -0.57 0.00 0.00 179.45 180.47 1pmm h PHE 169 N 0.79 0.04 -0.91 -1.35 3.57 -0.93 0.21 116.94 118.35 1pmm h PHE 169 Ca 0.09 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.63 1pmm h PHE 169 Cb 0.83 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.51 1pmm h PHE 169 CO 0.05 0.02 0.59 0.00 -2.23 0.00 0.00 178.31 176.74 1pmm h ALA 170 N 1.05 1.20 0.01 2.41 0.00 -1.20 -0.63 119.26 122.10 1pmm h ALA 170 Ca 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1pmm h ALA 170 Cb 0.02 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1pmm h ALA 170 CO -0.04 0.47 -0.01 -0.09 0.00 0.00 0.00 179.25 179.58 1pmm h ARG 171 N 1.16 -0.02 -0.02 0.00 9.65 -0.83 -0.38 114.38 123.95 1pmm h ARG 171 Ca 0.36 0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 59.15 1pmm h ARG 171 Cb -0.02 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.55 1pmm h ARG 171 CO -0.11 0.47 -0.39 1.88 2.80 0.00 0.00 179.97 184.62 1pmm h TYR 172 N -0.52 0.04 -0.32 2.20 0.05 -0.47 -3.17 116.97 114.78 1pmm h TYR 172 Ca -0.00 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1pmm h TYR 172 Cb 0.50 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.23 1pmm h TYR 172 CO 0.10 0.42 0.00 0.91 -1.05 0.00 0.00 178.16 178.54 1pmm n TRP 173 N -4.07 0.99 -3.84 4.88 8.01 -0.25 -5.00 117.44 118.16 1pmm n TRP 173 Ca -0.02 -0.79 -0.29 0.00 -1.31 0.00 0.00 57.50 55.09 1pmm n TRP 173 Cb 0.43 -0.28 0.01 0.00 -2.01 0.00 0.00 31.31 29.46 1pmm n TRP 173 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1pmm n ASP 174 N -0.15 -2.68 -4.30 -0.99 8.00 -0.84 -4.99 116.55 110.60 1pmm n ASP 174 Ca 0.20 -1.03 -0.32 0.00 0.71 0.00 0.00 54.79 54.36 1pmm n ASP 174 Cb 0.84 -3.13 -0.16 0.00 -0.02 0.00 0.00 41.12 38.66 1pmm n ASP 174 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pmm s VAL 175 N -3.72 2.37 -0.18 2.53 1.01 -0.21 -4.77 120.40 117.44 1pmm s VAL 175 Ca 0.23 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 1pmm s VAL 175 Cb -0.09 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.36 1pmm s VAL 175 CO 0.88 0.56 1.35 -0.70 0.00 0.00 0.00 175.10 177.19 1pmm s GLU 176 N -0.03 4.14 -0.32 2.72 2.12 -0.46 -4.52 118.70 122.35 1pmm s GLU 176 Ca -0.06 1.65 -0.23 0.00 0.36 0.00 0.00 54.97 56.69 1pmm s GLU 176 Cb -0.15 -3.83 0.00 0.00 0.26 0.00 0.00 34.13 30.41 1pmm s GLU 176 CO 0.05 -0.84 0.76 -1.17 -0.54 0.00 0.00 175.26 173.52 1pmm s LEU 177 N 3.85 4.11 -0.96 2.70 2.96 -1.26 -0.33 118.68 129.76 1pmm s LEU 177 Ca 0.59 0.56 -0.09 0.00 -0.22 0.00 0.00 54.13 54.96 1pmm s LEU 177 Cb -0.22 -3.02 0.24 0.00 0.50 0.00 0.00 46.19 43.68 1pmm s LEU 177 CO 0.19 -0.62 0.91 -0.13 -1.32 0.00 0.00 176.35 175.38 1pmm s ARG 178 N 2.94 3.78 -0.34 1.98 0.52 0.68 -4.93 118.95 123.58 1pmm s ARG 178 Ca 0.31 -2.93 -0.21 0.00 -0.52 0.00 0.00 55.73 52.37 1pmm s ARG 178 Cb -0.14 -4.38 0.00 0.00 0.52 0.00 0.00 34.95 30.95 1pmm s ARG 178 CO 0.13 -1.26 0.68 -2.00 0.02 0.00 0.00 175.30 172.88 1pmm s GLU 179 N -0.73 3.79 -0.11 3.54 2.12 -1.26 -1.97 118.70 124.08 1pmm s GLU 179 Ca 0.25 0.24 -0.30 0.00 0.36 0.00 0.00 54.97 55.53 1pmm s GLU 179 Cb -0.10 -3.77 -0.03 0.00 0.26 0.00 0.00 34.13 30.48 1pmm s GLU 179 CO -0.09 -0.70 1.34 0.42 -0.54 0.00 0.00 175.26 175.69 1pmm s ILE 180 N 2.79 4.09 0.54 -3.70 1.09 0.63 -4.97 121.20 121.66 1pmm s ILE 180 Ca 0.27 1.35 -0.18 0.00 -1.10 0.00 0.00 60.65 60.99 1pmm s ILE 180 Cb -0.14 -3.87 -0.06 0.00 -1.06 0.00 0.00 42.46 37.32 1pmm s ILE 180 CO 0.14 -0.09 1.04 -2.16 -0.10 0.00 0.00 174.94 173.77 1pmm s PRO 181 N 3.28 3.59 0.52 2.79 0.04 -1.26 -4.03 135.00 139.93 1pmm s PRO 181 Ca 0.59 1.26 -0.19 0.00 0.04 0.00 0.00 61.00 62.70 1pmm s PRO 181 Cb -0.25 -2.07 -0.07 0.00 0.04 0.00 0.00 34.50 32.15 1pmm s PRO 181 CO 0.20 -0.59 1.05 -1.64 0.04 0.00 0.00 177.00 176.06 1pmm s MET 182 N -3.67 3.64 0.03 4.56 -1.94 -1.26 -4.77 119.30 115.89 1pmm s MET 182 Ca 0.65 1.34 -0.15 0.00 -1.71 0.00 0.00 55.69 55.82 1pmm s MET 182 Cb -0.16 -2.07 0.03 0.00 2.01 0.00 0.00 34.83 34.64 1pmm s MET 182 CO 0.28 -0.56 0.34 -0.98 -0.01 0.00 0.00 175.02 174.09 1pmm s ARG 183 N -3.45 0.82 -0.04 2.03 1.70 -0.69 -0.71 118.95 118.61 1pmm s ARG 183 Ca 0.67 -0.42 -0.40 0.00 -0.47 0.00 0.00 55.73 55.11 1pmm s ARG 183 Cb -0.17 0.36 -0.19 0.00 -0.57 0.00 0.00 34.95 34.38 1pmm s ARG 183 CO 0.25 -0.27 1.22 -2.30 -1.08 0.00 0.00 175.30 173.12 1pmm n PRO 184 N 0.65 0.32 -0.59 3.89 -0.02 -1.26 0.12 135.00 138.11 1pmm n PRO 184 Ca -0.19 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1pmm n PRO 184 Cb 0.59 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 1pmm n PRO 184 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pmm n GLY 185 N 2.13 1.71 2.64 -1.23 0.00 -1.26 -4.88 105.19 104.30 1pmm n GLY 185 Ca 0.21 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 1pmm n GLY 185 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1pmm n GLN 186 N -2.00 0.52 -0.96 1.61 7.27 0.12 -5.01 117.38 118.93 1pmm n GLN 186 Ca 0.00 -2.30 -0.17 0.00 0.07 0.00 0.00 57.00 54.59 1pmm n GLN 186 Cb 0.00 -1.49 0.02 0.00 2.41 0.00 0.00 30.24 31.18 1pmm n GLN 186 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1pmm n LEU 187 N 2.55 6.38 -3.84 1.69 4.77 -1.22 -1.70 117.00 125.63 1pmm n LEU 187 Ca 0.19 -3.36 -0.07 0.00 -0.03 0.00 0.00 56.01 52.73 1pmm n LEU 187 Cb 0.55 -1.10 -0.01 0.00 -2.33 0.00 0.00 43.42 40.54 1pmm n LEU 187 CO 0.03 1.30 0.50 0.72 -1.33 0.00 0.00 177.39 178.61 1pmm s PHE 188 N -1.64 -0.10 -0.43 -1.77 -0.12 -1.26 -4.87 117.98 107.79 1pmm s PHE 188 Ca 0.34 -0.40 -0.27 0.00 -0.05 0.00 0.00 56.93 56.55 1pmm s PHE 188 Cb 0.25 0.74 0.02 0.00 -0.63 0.00 0.00 43.02 43.41 1pmm s PHE 188 CO -0.04 -1.30 0.99 1.41 -0.05 0.00 0.00 175.22 176.23 1pmm s MET 189 N -3.45 3.70 0.39 1.99 -2.45 -1.26 -4.86 119.30 113.35 1pmm s MET 189 Ca 0.12 0.43 -0.01 0.00 -1.25 0.00 0.00 55.69 54.99 1pmm s MET 189 Cb -0.05 -3.88 -0.03 0.00 1.25 0.00 0.00 34.83 32.12 1pmm s MET 189 CO 0.08 -1.17 0.61 0.16 1.05 0.00 0.00 175.02 175.75 1pmm s ASP 190 N 2.18 6.24 0.21 1.11 -4.77 -1.26 -4.94 116.67 115.44 1pmm s ASP 190 Ca 0.41 0.54 -0.09 0.00 -3.30 0.00 0.00 52.55 50.10 1pmm s ASP 190 Cb -0.10 -2.03 0.31 0.00 -1.09 0.00 0.00 42.92 40.01 1pmm s ASP 190 CO 0.25 -0.40 1.71 -0.65 0.70 0.00 0.00 175.17 176.78 1pmm h PRO 191 N 0.60 0.29 0.00 2.11 0.11 -1.96 -1.68 132.00 131.48 1pmm h PRO 191 Ca -0.49 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1pmm h PRO 191 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1pmm h PRO 191 CO 0.61 0.19 -0.00 -0.22 -0.21 0.00 0.00 178.00 178.37 1pmm h LYS 192 N 0.29 -0.01 -0.14 1.05 3.64 -1.98 -1.99 116.57 117.44 1pmm h LYS 192 Ca 0.32 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.60 1pmm h LYS 192 Cb 0.48 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1pmm h LYS 192 CO -0.39 0.09 -0.38 0.00 -2.27 0.00 0.00 179.45 176.49 1pmm h ARG 193 N -0.09 0.30 -0.09 1.90 3.08 -1.95 -1.83 114.38 115.70 1pmm h ARG 193 Ca -0.00 -0.13 0.01 0.00 0.07 0.00 0.00 59.98 59.93 1pmm h ARG 193 Cb 0.09 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1pmm h ARG 193 CO 0.00 0.64 0.01 1.98 -1.07 0.00 0.00 179.97 181.53 1pmm h MET 194 N 0.25 0.04 -0.75 0.04 4.05 -1.16 -1.46 114.93 115.95 1pmm h MET 194 Ca 0.03 -0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1pmm h MET 194 Cb 0.79 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.55 1pmm h MET 194 CO 0.06 0.03 0.42 0.82 0.23 0.00 0.00 176.91 178.47 1pmm h ILE 195 N 0.04 1.22 -0.86 1.77 1.08 -1.13 -1.11 117.51 118.52 1pmm h ILE 195 Ca 0.04 -0.53 -0.01 0.00 -0.39 0.00 0.00 64.86 63.97 1pmm h ILE 195 Cb 0.04 0.19 -0.04 0.00 -3.07 0.00 0.00 36.82 33.94 1pmm h ILE 195 CO -0.06 0.24 0.51 -0.33 -0.69 0.00 0.00 178.15 177.82 1pmm h GLU 196 N 1.05 1.18 0.00 2.37 5.08 -0.81 -2.68 114.58 120.76 1pmm h GLU 196 Ca 0.27 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.41 1pmm h GLU 196 Cb 0.01 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 1pmm h GLU 196 CO -0.05 0.84 -0.49 0.00 -1.00 0.00 0.00 179.01 178.31 1pmm h ALA 197 N 1.36 0.88 -2.71 3.43 0.00 -0.40 -3.46 119.26 118.36 1pmm h ALA 197 Ca 0.31 -0.44 -0.50 0.00 0.00 0.00 0.00 54.91 54.28 1pmm h ALA 197 Cb -0.03 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1pmm h ALA 197 CO -0.06 0.61 0.44 0.00 0.00 0.00 0.00 179.25 180.24 1pmm n ASP 199 N 0.88 -0.54 0.32 0.00 5.68 -1.26 -4.97 116.55 116.65 1pmm n ASP 199 Ca 0.00 -1.47 0.19 0.00 -0.50 0.00 0.00 54.79 53.02 1pmm n ASP 199 Cb 0.46 0.93 1.05 0.00 -1.14 0.00 0.00 41.12 42.43 1pmm n ASP 199 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1pmm h GLU 200 N 0.00 0.00 -0.10 0.11 4.11 -1.99 -1.87 114.58 114.83 1pmm h GLU 200 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.34 1pmm h GLU 200 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1pmm h GLU 200 CO 0.11 0.01 0.00 0.09 0.07 0.00 0.00 179.01 179.29 1pmm n ASN 201 N -3.43 1.73 -4.64 3.06 3.02 -1.26 -4.87 115.26 108.87 1pmm n ASN 201 Ca -0.03 -1.64 -0.43 0.00 -0.03 0.00 0.00 54.58 52.45 1pmm n ASN 201 Cb 0.09 -0.06 -0.02 0.00 -0.61 0.00 0.00 39.78 39.18 1pmm n ASN 201 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1pmm s THR 202 N -1.88 4.30 -0.09 3.41 2.01 -0.71 -1.03 115.64 121.65 1pmm s THR 202 Ca 0.35 1.50 0.26 0.00 0.31 0.00 0.00 61.69 64.11 1pmm s THR 202 Cb 0.19 -4.22 0.29 0.00 0.01 0.00 0.00 72.50 68.78 1pmm s THR 202 CO 0.30 -0.41 1.76 0.16 -0.69 0.00 0.00 174.62 175.74 1pmm h ILE 203 N 5.79 0.25 0.00 1.82 3.07 -1.31 -3.48 117.51 123.65 1pmm h ILE 203 Ca -0.24 -1.04 0.00 0.00 1.55 0.00 0.00 64.86 65.13 1pmm h ILE 203 Cb 1.09 1.84 0.00 0.00 -0.27 0.00 0.00 36.82 39.48 1pmm h ILE 203 CO 1.02 0.12 0.00 0.61 -1.05 0.00 0.00 178.15 178.85 1pmm n GLY 204 N 0.55 1.13 3.41 0.16 0.00 -1.26 -4.58 105.19 104.59 1pmm n GLY 204 Ca 0.02 -1.00 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 1pmm n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pmm s VAL 205 N -2.00 2.99 -0.47 1.61 1.01 -0.42 -2.37 120.40 120.75 1pmm s VAL 205 Ca 0.00 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.28 1pmm s VAL 205 Cb 0.00 -2.21 0.12 0.00 0.00 0.00 0.00 36.38 34.29 1pmm s VAL 205 CO 0.00 0.56 0.22 -0.69 0.00 0.00 0.00 175.10 175.19 1pmm s VAL 206 N -0.15 2.78 0.35 2.92 1.01 -0.36 -1.74 120.40 125.22 1pmm s VAL 206 Ca -0.01 -2.80 -0.26 0.00 0.00 0.00 0.00 61.98 58.91 1pmm s VAL 206 Cb -0.14 -2.93 -0.09 0.00 0.00 0.00 0.00 36.38 33.22 1pmm s VAL 206 CO 0.03 -0.74 1.01 -2.84 0.00 0.00 0.00 175.10 172.57 1pmm s PRO 207 N 0.29 4.40 -0.47 2.72 0.02 -1.24 -4.21 135.00 136.52 1pmm s PRO 207 Ca 0.14 1.47 -0.14 0.00 0.02 0.00 0.00 61.00 62.49 1pmm s PRO 207 Cb -0.22 -2.73 0.08 0.00 0.02 0.00 0.00 34.50 31.65 1pmm s PRO 207 CO -0.04 0.08 0.37 0.99 -0.33 0.00 0.00 177.00 178.08 1pmm s THR 208 N -1.58 4.98 -1.47 0.99 2.01 -1.26 -2.05 115.64 117.25 1pmm s THR 208 Ca 0.53 -1.19 -0.12 0.00 0.31 0.00 0.00 61.69 61.22 1pmm s THR 208 Cb -0.22 -4.01 0.03 0.00 0.01 0.00 0.00 72.50 68.31 1pmm s THR 208 CO 0.28 -0.59 2.38 0.33 -0.69 0.00 0.00 174.62 176.33 1pmm n PHE 209 N 5.13 3.13 0.00 4.92 7.35 -0.48 -2.39 117.46 135.12 1pmm n PHE 209 Ca -0.12 -2.98 0.00 0.00 -0.76 0.00 0.00 57.45 53.59 1pmm n PHE 209 Cb 0.43 -2.43 0.00 0.00 0.35 0.00 0.00 39.48 37.83 1pmm n PHE 209 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1pmm n GLY 210 N 3.68 0.43 3.69 7.13 0.00 -1.25 -2.02 105.19 116.85 1pmm n GLY 210 Ca 0.58 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 1pmm n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pmm s VAL 211 N 0.00 3.48 0.16 1.61 1.01 0.42 -4.73 120.40 122.35 1pmm s VAL 211 Ca 0.00 0.92 -0.16 0.00 0.00 0.00 0.00 61.98 62.74 1pmm s VAL 211 Cb 0.00 -3.59 0.02 0.00 0.00 0.00 0.00 36.38 32.81 1pmm s VAL 211 CO 0.00 0.01 1.81 0.71 0.00 0.00 0.00 175.10 177.63 1pmm h THR 212 N 4.78 1.07 -0.22 3.92 1.35 -1.89 0.73 112.91 122.65 1pmm h THR 212 Ca -0.40 -0.18 -0.04 0.00 -0.55 0.00 0.00 66.41 65.24 1pmm h THR 212 Cb 1.19 0.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.09 1pmm h THR 212 CO 0.90 0.10 -0.04 1.88 -0.25 0.00 0.00 175.52 178.11 1pmm h TYR 213 N 0.52 0.34 0.00 4.73 0.05 -1.92 -3.33 116.97 117.36 1pmm h TYR 213 Ca 0.16 -0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.91 1pmm h TYR 213 Cb -0.02 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 37.62 1pmm h TYR 213 CO -0.06 0.38 -1.05 0.25 -1.05 0.00 0.00 178.16 176.63 1pmm n THR 214 N -4.32 0.00 -0.63 -2.88 -2.24 -1.19 -4.97 114.28 98.05 1pmm n THR 214 Ca 0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1pmm n THR 214 Cb 0.22 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 1pmm n THR 214 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmm n GLY 215 N 2.47 1.04 3.90 3.38 0.00 0.25 -4.41 105.19 111.83 1pmm n GLY 215 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1pmm n GLY 215 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pmm s ASN 216 N -3.06 6.45 0.28 1.61 0.01 -1.25 -0.84 114.94 118.14 1pmm s ASN 216 Ca 0.00 0.71 -0.23 0.00 -0.71 0.00 0.00 52.86 52.63 1pmm s ASN 216 Cb 0.00 -2.14 -0.09 0.00 0.41 0.00 0.00 41.25 39.43 1pmm s ASN 216 CO 0.00 -0.17 0.83 -0.31 -1.51 0.00 0.00 177.10 175.94 1pmm s TYR 217 N -2.05 3.65 -0.29 2.20 2.02 -0.31 -0.43 117.35 122.13 1pmm s TYR 217 Ca 0.44 1.57 -0.10 0.00 -0.37 0.00 0.00 57.07 58.61 1pmm s TYR 217 Cb -0.11 -2.76 -0.03 0.00 -0.40 0.00 0.00 41.96 38.66 1pmm s TYR 217 CO 0.29 0.26 0.17 -1.21 -1.57 0.00 0.00 175.55 173.48 1pmm s GLU 218 N -2.08 3.63 -0.32 -0.62 2.02 -1.00 -4.88 118.70 115.45 1pmm s GLU 218 Ca 0.47 -0.53 -0.28 0.00 0.02 0.00 0.00 54.97 54.65 1pmm s GLU 218 Cb -0.17 -3.60 0.02 0.00 0.10 0.00 0.00 34.13 30.48 1pmm s GLU 218 CO 0.22 -0.30 1.04 -0.06 0.02 0.00 0.00 175.26 176.18 1pmm s PHE 219 N 1.68 3.15 0.36 1.61 0.08 -1.26 -4.41 117.98 119.20 1pmm s PHE 219 Ca 0.06 1.14 0.05 0.00 0.12 0.00 0.00 56.93 58.30 1pmm s PHE 219 Cb -0.16 -3.64 0.69 0.00 -0.57 0.00 0.00 43.02 39.33 1pmm s PHE 219 CO 0.08 -0.75 1.96 -1.35 -0.10 0.00 0.00 175.22 175.07 1pmm h PRO 220 N 8.11 0.61 -0.32 0.24 0.11 -1.88 -3.30 132.00 135.56 1pmm h PRO 220 Ca -0.21 -0.08 0.07 0.00 0.11 0.00 0.00 66.00 65.90 1pmm h PRO 220 Cb 1.06 -0.12 -0.08 0.00 0.11 0.00 0.00 31.00 31.98 1pmm h PRO 220 CO 1.02 0.50 -0.30 0.37 -0.21 0.00 0.00 178.00 179.37 1pmm h GLN 221 N 0.61 -0.26 -0.45 1.05 5.75 -1.92 0.36 115.11 120.24 1pmm h GLN 221 Ca 0.15 0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.62 1pmm h GLN 221 Cb 0.11 0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.69 1pmm h GLN 221 CO -0.02 -0.17 0.06 -1.35 -2.65 0.00 0.00 178.83 174.70 1pmm h PRO 222 N -0.27 0.70 -0.31 -2.39 0.11 -1.93 -1.66 132.00 126.25 1pmm h PRO 222 Ca 0.15 -0.15 -0.11 0.00 0.11 0.00 0.00 66.00 66.00 1pmm h PRO 222 Cb 0.52 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 1pmm h PRO 222 CO -0.47 0.68 -0.26 -0.07 -0.21 0.00 0.00 178.00 177.66 1pmm h LEU 223 N 0.68 0.63 -0.51 2.35 3.38 -1.47 -2.51 115.31 117.86 1pmm h LEU 223 Ca 0.15 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1pmm h LEU 223 Cb 0.33 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1pmm h LEU 223 CO 0.01 0.87 0.05 -0.74 0.09 0.00 0.00 178.44 178.72 1pmm h HIS 224 N 0.54 0.94 -0.86 1.13 2.76 0.28 -1.18 115.15 118.75 1pmm h HIS 224 Ca 0.07 -0.14 -0.02 0.00 -2.20 0.00 0.00 60.37 58.08 1pmm h HIS 224 Cb 0.73 -0.25 -0.04 0.00 1.55 0.00 0.00 27.41 29.40 1pmm h HIS 224 CO 0.03 0.86 0.48 -0.44 -1.30 0.00 0.00 177.93 177.56 1pmm h ASP 225 N 0.75 1.07 -0.65 3.26 3.32 -1.16 -1.46 116.42 121.55 1pmm h ASP 225 Ca 0.15 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 1pmm h ASP 225 Cb 0.45 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 1pmm h ASP 225 CO 0.02 0.85 0.20 0.00 -1.72 0.00 0.00 179.24 178.59 1pmm h ALA 226 N 1.32 0.86 -0.22 3.45 0.00 -1.04 -1.98 119.26 121.65 1pmm h ALA 226 Ca 0.30 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1pmm h ALA 226 Cb 0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1pmm h ALA 226 CO -0.05 0.53 -0.22 -0.07 0.00 0.00 0.00 179.25 179.44 1pmm h LEU 227 N 0.95 0.39 -0.38 0.00 3.38 -0.75 0.88 115.31 119.78 1pmm h LEU 227 Ca 0.21 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1pmm h LEU 227 Cb 0.30 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1pmm h LEU 227 CO -0.01 0.62 0.15 0.44 0.09 0.00 0.00 178.44 179.73 1pmm h ASP 228 N 0.36 0.53 -0.02 -0.43 3.32 -0.87 -0.70 116.42 118.60 1pmm h ASP 228 Ca 0.06 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 56.83 1pmm h ASP 228 Cb 0.59 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1pmm h ASP 228 CO 0.04 0.55 -0.31 0.50 -1.72 0.00 0.00 179.24 178.31 1pmm h LYS 229 N 0.47 0.47 -0.41 3.56 3.64 -1.02 -1.99 116.57 121.29 1pmm h LYS 229 Ca 0.13 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1pmm h LYS 229 Cb 0.19 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 1pmm h LYS 229 CO -0.01 0.73 0.23 0.35 -2.27 0.00 0.00 179.45 178.48 1pmm h PHE 230 N 0.41 0.55 -0.27 1.91 3.57 -0.37 -0.19 116.94 122.56 1pmm h PHE 230 Ca 0.05 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 1pmm h PHE 230 Cb 0.74 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1pmm h PHE 230 CO 0.02 0.42 -0.15 0.37 -2.23 0.00 0.00 178.31 176.74 1pmm h GLN 231 N 0.53 0.46 -0.52 1.11 4.15 -0.95 0.44 115.11 120.33 1pmm h GLN 231 Ca 0.14 -0.13 -0.06 0.00 0.77 0.00 0.00 58.65 59.37 1pmm h GLN 231 Cb 0.04 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 1pmm h GLN 231 CO -0.02 0.60 0.09 0.00 -1.93 0.00 0.00 178.83 177.57 1pmm h ALA 232 N 1.43 0.68 0.02 3.38 0.00 -0.70 0.22 119.26 124.30 1pmm h ALA 232 Ca 0.08 -0.23 -0.24 0.00 0.00 0.00 0.00 54.91 54.52 1pmm h ALA 232 Cb 0.51 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1pmm h ALA 232 CO 0.03 0.41 -1.17 -0.44 0.00 0.00 0.00 179.25 178.09 1pmm h ASP 233 N 0.73 0.07 0.00 0.00 3.32 -0.72 -3.40 116.42 116.42 1pmm h ASP 233 Ca 0.16 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1pmm h ASP 233 Cb 0.38 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1pmm h ASP 233 CO 0.01 1.07 -1.11 0.35 -1.72 0.00 0.00 179.24 177.84 1pmm n THR 234 N -3.33 0.00 -0.38 0.35 -2.24 0.12 -5.00 114.28 103.80 1pmm n THR 234 Ca -0.04 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1pmm n THR 234 Cb 0.97 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 1pmm n THR 234 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmm n GLY 235 N 2.20 1.26 3.62 3.38 0.00 0.78 -5.01 105.19 111.43 1pmm n GLY 235 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1pmm n GLY 235 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pmm s ILE 236 N -3.01 4.66 -0.44 -0.61 1.01 -1.26 -4.96 121.20 116.59 1pmm s ILE 236 Ca 0.00 1.44 -0.16 0.00 0.00 0.00 0.00 60.65 61.94 1pmm s ILE 236 Cb 0.00 -4.27 0.04 0.00 0.01 0.00 0.00 42.46 38.24 1pmm s ILE 236 CO 0.00 -0.36 0.36 -0.62 0.00 0.00 0.00 174.94 174.33 1pmm s ASP 237 N 1.63 6.14 -0.13 3.58 2.15 -1.26 -3.56 116.67 125.21 1pmm s ASP 237 Ca 0.38 -1.02 -0.02 0.00 0.43 0.00 0.00 52.55 52.32 1pmm s ASP 237 Cb -0.13 -2.18 -0.02 0.00 -0.30 0.00 0.00 42.92 40.28 1pmm s ASP 237 CO 0.14 -0.55 -0.07 -0.63 -0.17 0.00 0.00 175.17 173.89 1pmm s ILE 238 N 1.76 3.65 0.63 4.11 1.01 -1.26 -5.08 121.20 126.02 1pmm s ILE 238 Ca 0.06 -0.46 -0.04 0.00 0.00 0.00 0.00 60.65 60.22 1pmm s ILE 238 Cb -0.21 -2.56 0.04 0.00 0.01 0.00 0.00 42.46 39.74 1pmm s ILE 238 CO 0.09 0.52 0.91 -1.81 0.00 0.00 0.00 174.94 174.65 1pmm s ASP 239 N 0.17 5.08 0.09 3.58 1.01 -1.26 -4.92 116.67 120.41 1pmm s ASP 239 Ca -0.03 0.32 0.07 0.00 0.71 0.00 0.00 52.55 53.61 1pmm s ASP 239 Cb -0.14 -1.10 -0.03 0.00 1.01 0.00 0.00 42.92 42.66 1pmm s ASP 239 CO 0.03 -1.37 -0.18 -0.04 0.21 0.00 0.00 175.17 173.83 1pmm s MET 240 N -5.04 0.97 -0.09 8.23 -1.94 0.28 -1.30 119.30 120.42 1pmm s MET 240 Ca 0.58 -1.05 0.01 0.00 -1.71 0.00 0.00 55.69 53.51 1pmm s MET 240 Cb -0.11 -1.11 0.02 0.00 2.01 0.00 0.00 34.83 35.65 1pmm s MET 240 CO 0.42 0.25 -0.09 -1.58 -0.01 0.00 0.00 175.02 174.02 1pmm s HIS 241 N -1.21 1.39 -0.21 -0.03 2.46 -0.71 -1.99 115.29 114.98 1pmm s HIS 241 Ca 0.02 -0.61 -0.17 0.00 0.47 0.00 0.00 55.06 54.76 1pmm s HIS 241 Cb -0.10 -1.12 -0.03 0.00 -0.13 0.00 0.00 32.58 31.19 1pmm s HIS 241 CO 0.03 -0.41 0.47 0.42 -2.47 0.00 0.00 174.74 172.79 1pmm s ILE 242 N 1.32 5.13 -0.81 0.89 -1.09 -0.74 -3.59 121.20 122.32 1pmm s ILE 242 Ca -0.03 0.84 -0.19 0.00 -2.23 0.00 0.00 60.65 59.05 1pmm s ILE 242 Cb -0.14 -3.80 0.13 0.00 -1.58 0.00 0.00 42.46 37.07 1pmm s ILE 242 CO -0.04 0.19 0.99 -0.62 -1.23 0.00 0.00 174.94 174.23 1pmm s ASP 243 N 1.20 6.49 -0.56 3.58 -1.08 -0.87 -1.52 116.67 123.92 1pmm s ASP 243 Ca 0.22 -1.83 0.01 0.00 -0.52 0.00 0.00 52.55 50.43 1pmm s ASP 243 Cb -0.15 -2.37 0.45 0.00 -1.46 0.00 0.00 42.92 39.39 1pmm s ASP 243 CO 0.09 -1.09 1.76 0.00 0.52 0.00 0.00 175.17 176.45 1pmm n ALA 244 N 6.43 5.92 -0.32 3.66 0.00 0.22 -1.38 120.51 135.05 1pmm n ALA 244 Ca 0.12 -3.63 0.15 0.00 0.00 0.00 0.00 53.44 50.08 1pmm n ALA 244 Cb 0.47 -1.32 0.31 0.00 0.00 0.00 0.00 19.45 18.91 1pmm n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmm h ALA 245 N 2.12 1.26 0.00 0.00 0.00 -1.82 0.50 119.26 121.32 1pmm h ALA 245 Ca 0.53 0.29 -0.34 0.00 0.00 0.00 0.00 54.91 55.39 1pmm h ALA 245 Cb 0.99 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 19.21 1pmm h ALA 245 CO 1.32 -0.57 -2.12 -1.13 0.00 0.00 0.00 179.25 176.75 1pmm n SER 246 N -5.38 1.77 -0.10 0.00 3.41 -1.26 -1.40 113.62 110.66 1pmm n SER 246 Ca 0.23 0.31 0.18 0.00 -0.26 0.00 0.00 58.87 59.32 1pmm n SER 246 Cb 0.76 -0.73 0.59 0.00 -0.26 0.00 0.00 64.21 64.57 1pmm n SER 246 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1pmm h GLY 247 N -0.89 0.39 1.82 5.00 0.00 -1.29 -2.87 103.07 105.22 1pmm h GLY 247 Ca -0.52 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 46.72 1pmm h GLY 247 CO -0.31 0.04 0.08 -1.33 0.00 0.00 0.00 176.54 175.01 1pmm h GLY 248 N 0.23 0.00 -1.09 4.60 0.00 -1.12 -1.93 103.07 103.76 1pmm h GLY 248 Ca 0.32 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.61 1pmm h GLY 248 CO -0.07 0.00 -0.12 0.69 0.00 0.00 0.00 176.54 177.04 1pmm n PHE 249 N -3.50 0.49 0.02 5.60 3.72 -1.08 -4.62 117.46 118.10 1pmm n PHE 249 Ca -0.02 -1.23 0.00 0.00 -0.05 0.00 0.00 57.45 56.15 1pmm n PHE 249 Cb 0.16 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.40 1pmm n PHE 249 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1pmm n LEU 250 N -1.08 0.30 -0.32 4.37 4.77 -0.76 -4.74 117.00 119.55 1pmm n LEU 250 Ca 0.22 0.08 0.10 0.00 -0.03 0.00 0.00 56.01 56.38 1pmm n LEU 250 Cb 0.81 -0.06 0.27 0.00 -2.33 0.00 0.00 43.42 42.10 1pmm n LEU 250 CO 0.08 -0.59 1.13 0.00 -1.33 0.00 0.00 177.39 176.67 1pmm h ALA 251 N 0.00 1.44 -0.24 -1.18 0.00 -1.77 -0.56 119.26 116.95 1pmm h ALA 251 Ca 0.00 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1pmm h ALA 251 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1pmm h ALA 251 CO 0.00 -0.10 0.26 -1.35 0.00 0.00 0.00 179.25 178.06 1pmm h PRO 252 N 0.65 0.00 0.01 0.00 0.11 -1.81 0.02 132.00 130.98 1pmm h PRO 252 Ca 0.52 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 66.23 1pmm h PRO 252 Cb 0.79 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.83 1pmm h PRO 252 CO -0.39 0.00 -2.45 1.19 -0.21 0.00 0.00 178.00 176.14 1pmm n PHE 253 N -3.79 0.09 0.74 0.65 3.72 -0.29 -4.39 117.46 114.19 1pmm n PHE 253 Ca 0.03 0.02 0.07 0.00 -0.05 0.00 0.00 57.45 57.53 1pmm n PHE 253 Cb 0.39 -1.01 -0.08 0.00 -0.94 0.00 0.00 39.48 37.84 1pmm n PHE 253 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1pmm n VAL 254 N -3.44 0.00 -2.94 -4.37 0.24 -0.79 -4.69 118.33 102.34 1pmm n VAL 254 Ca -0.46 -0.15 -0.13 0.00 -2.04 0.00 0.00 64.34 61.56 1pmm n VAL 254 Cb 0.97 1.02 0.04 0.00 -1.47 0.00 0.00 33.84 34.40 1pmm n VAL 254 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1pmm n ALA 255 N -1.26 0.46 0.30 2.33 0.00 -0.06 -4.88 120.51 117.39 1pmm n ALA 255 Ca 0.03 -2.33 0.19 0.00 0.00 0.00 0.00 53.44 51.33 1pmm n ALA 255 Cb 0.25 -1.06 1.01 0.00 0.00 0.00 0.00 19.45 19.65 1pmm n ALA 255 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1pmm h PRO 256 N 3.01 0.00 0.00 0.00 0.13 -1.62 -2.48 132.00 131.03 1pmm h PRO 256 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1pmm h PRO 256 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1pmm h PRO 256 CO 0.30 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.82 1pmm n ASP 257 N -3.43 0.00 -4.66 1.44 8.00 -1.26 -4.72 116.55 111.91 1pmm n ASP 257 Ca -0.02 0.38 -0.43 0.00 0.71 0.00 0.00 54.79 55.44 1pmm n ASP 257 Cb 0.17 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.12 40.78 1pmm n ASP 257 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1pmm s ILE 258 N -2.92 4.18 -0.61 0.53 1.01 -0.94 -4.95 121.20 117.50 1pmm s ILE 258 Ca 0.16 1.44 -0.22 0.00 0.00 0.00 0.00 60.65 62.03 1pmm s ILE 258 Cb 0.19 -3.93 0.07 0.00 0.01 0.00 0.00 42.46 38.80 1pmm s ILE 258 CO 0.51 -0.11 0.88 -0.69 0.00 0.00 0.00 174.94 175.52 1pmm s VAL 259 N 3.44 4.48 0.00 2.92 1.01 -1.26 -4.74 120.40 126.25 1pmm s VAL 259 Ca 0.57 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.16 1pmm s VAL 259 Cb -0.24 -4.59 0.00 0.00 0.00 0.00 0.00 36.38 31.56 1pmm s VAL 259 CO 0.17 -1.28 0.00 -2.67 0.00 0.00 0.00 175.10 171.32 1pmm n TRP 260 N 7.27 0.00 -0.47 5.22 4.27 -1.26 -3.84 117.44 128.62 1pmm n TRP 260 Ca -0.04 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.57 1pmm n TRP 260 Cb 0.45 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.40 1pmm n TRP 260 CO 0.00 0.00 0.00 -0.40 -2.29 0.00 0.00 177.69 175.00 1pmm n ASP 261 N -0.33 0.00 0.00 -0.67 5.68 -1.26 -4.84 116.55 115.13 1pmm n ASP 261 Ca 0.00 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.32 1pmm n ASP 261 Cb 0.00 0.00 0.15 0.00 -1.14 0.00 0.00 41.12 40.13 1pmm n ASP 261 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 1pmm n PHE 262 N 0.00 0.00 0.31 2.11 3.72 -1.03 -1.05 117.46 121.51 1pmm n PHE 262 Ca 0.00 0.00 0.20 0.00 -0.05 0.00 0.00 57.45 57.60 1pmm n PHE 262 Cb 0.00 -0.41 0.94 0.00 -0.94 0.00 0.00 39.48 39.07 1pmm n PHE 262 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1pmm h ARG 263 N 0.00 0.00 -5.18 -1.08 3.08 -1.78 -3.39 114.38 106.03 1pmm h ARG 263 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 1pmm h ARG 263 Cb 0.09 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 29.99 1pmm h ARG 263 CO 0.00 0.00 -0.18 -0.51 -1.07 0.00 0.00 179.97 178.21 1pmm s LEU 264 N -6.03 4.12 0.26 3.04 1.43 -0.21 -4.99 118.68 116.30 1pmm s LEU 264 Ca -0.02 0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 53.29 1pmm s LEU 264 Cb 0.11 -2.48 0.56 0.00 0.03 0.00 0.00 46.19 44.40 1pmm s LEU 264 CO 0.46 -0.26 1.67 -0.65 0.23 0.00 0.00 176.35 177.80 1pmm h PRO 265 N 8.22 0.26 0.00 1.29 0.11 -1.87 -1.44 132.00 138.57 1pmm h PRO 265 Ca -0.30 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1pmm h PRO 265 Cb 1.15 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1pmm h PRO 265 CO 0.68 0.17 0.00 0.54 -0.21 0.00 0.00 178.00 179.18 1pmm n ARG 266 N -5.17 0.10 -2.56 1.05 1.74 -1.26 -4.58 116.66 105.98 1pmm n ARG 266 Ca 0.17 0.36 -0.43 0.00 -0.77 0.00 0.00 57.85 57.18 1pmm n ARG 266 Cb 0.54 -1.70 -0.02 0.00 -1.02 0.00 0.00 32.46 30.25 1pmm n ARG 266 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1pmm s VAL 267 N -3.18 4.09 -0.34 1.55 1.01 -0.54 -0.55 120.40 122.44 1pmm s VAL 267 Ca 0.05 1.07 0.22 0.00 0.00 0.00 0.00 61.98 63.32 1pmm s VAL 267 Cb 0.09 -4.60 -0.25 0.00 0.00 0.00 0.00 36.38 31.62 1pmm s VAL 267 CO 0.32 -1.10 0.70 0.29 0.00 0.00 0.00 175.10 175.32 1pmm n LYS 268 N 8.10 0.46 -3.46 2.72 4.01 -0.84 -4.70 118.16 124.44 1pmm n LYS 268 Ca 0.11 -0.10 -0.14 0.00 -0.51 0.00 0.00 58.31 57.68 1pmm n LYS 268 Cb 0.49 -1.55 -0.04 0.00 -0.51 0.00 0.00 35.03 33.42 1pmm n LYS 268 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1pmm s SER 269 N -4.19 -0.59 -0.05 4.39 1.04 -1.25 -0.98 113.70 112.08 1pmm s SER 269 Ca -0.02 0.27 -0.05 0.00 0.48 0.00 0.00 55.95 56.63 1pmm s SER 269 Cb 0.14 0.56 0.01 0.00 0.10 0.00 0.00 66.02 66.83 1pmm s SER 269 CO 0.87 -0.81 0.13 -0.63 0.98 0.00 0.00 173.24 173.78 1pmm s ILE 270 N -2.74 0.01 0.19 -1.02 1.01 -0.44 -1.79 121.20 116.42 1pmm s ILE 270 Ca -0.03 -0.05 0.08 0.00 0.00 0.00 0.00 60.65 60.65 1pmm s ILE 270 Cb -0.01 -0.20 -0.05 0.00 0.01 0.00 0.00 42.46 42.21 1pmm s ILE 270 CO -0.04 -0.03 -0.15 -0.94 0.00 0.00 0.00 174.94 173.78 1pmm s SER 271 N -0.03 2.56 0.02 3.58 1.04 -0.57 -0.93 113.70 119.36 1pmm s SER 271 Ca -0.01 -0.98 -0.28 0.00 0.48 0.00 0.00 55.95 55.16 1pmm s SER 271 Cb -0.01 -0.14 0.10 0.00 0.10 0.00 0.00 66.02 66.07 1pmm s SER 271 CO 0.00 -0.15 0.83 0.00 0.98 0.00 0.00 173.24 174.90 1pmm s ALA 272 N -2.78 -1.78 -0.35 5.32 0.00 0.03 -0.61 121.76 121.59 1pmm s ALA 272 Ca 0.21 0.95 -0.14 0.00 0.00 0.00 0.00 51.96 52.98 1pmm s ALA 272 Cb -0.02 0.42 -0.01 0.00 0.00 0.00 0.00 23.12 23.52 1pmm s ALA 272 CO 0.07 -0.67 0.32 -1.12 0.00 0.00 0.00 175.76 174.36 1pmm s SER 273 N -2.39 6.13 0.31 0.00 0.01 -0.50 -0.56 113.70 116.69 1pmm s SER 273 Ca 0.03 -0.37 0.01 0.00 1.31 0.00 0.00 55.95 56.93 1pmm s SER 273 Cb -0.01 -2.18 0.49 0.00 0.21 0.00 0.00 66.02 64.54 1pmm s SER 273 CO -0.08 -0.32 1.86 1.23 0.41 0.00 0.00 173.24 176.33 1pmm h GLY 274 N 8.67 0.78 0.40 3.44 0.00 -1.34 -2.12 103.07 112.90 1pmm h GLY 274 Ca -0.30 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.60 1pmm h GLY 274 CO 0.68 0.41 0.00 -2.39 0.00 0.00 0.00 176.54 175.24 1pmm n HIS 275 N -4.29 0.00 0.00 5.60 1.44 -0.95 -0.81 115.22 116.21 1pmm n HIS 275 Ca 0.03 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.74 1pmm n HIS 275 Cb 0.21 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.32 1pmm n HIS 275 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1pmm n LYS 276 N -0.70 0.00 0.00 -1.40 5.02 -0.80 -0.62 118.16 119.67 1pmm n LYS 276 Ca 0.09 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.49 1pmm n LYS 276 Cb 0.04 0.00 0.66 0.00 -0.02 0.00 0.00 35.03 35.71 1pmm n LYS 276 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1pmm n PHE 277 N 0.00 0.00 1.02 2.13 3.01 -1.25 -2.59 117.46 119.78 1pmm n PHE 277 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.58 1pmm n PHE 277 Cb 0.00 0.00 0.57 0.00 -0.01 0.00 0.00 39.48 40.04 1pmm n PHE 277 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1pmm n GLY 278 N 0.60 -1.18 2.50 1.37 0.00 -0.90 -4.83 105.19 102.75 1pmm n GLY 278 Ca 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 46.02 46.06 1pmm n GLY 278 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pmm n LEU 279 N -1.37 0.26 -4.90 0.99 4.77 -0.52 -4.87 117.00 111.37 1pmm n LEU 279 Ca 0.09 0.06 -0.28 0.00 -0.03 0.00 0.00 56.01 55.85 1pmm n LEU 279 Cb 0.23 -1.64 -0.01 0.00 -2.33 0.00 0.00 43.42 39.67 1pmm n LEU 279 CO 0.20 -0.56 0.41 0.00 -1.33 0.00 0.00 177.39 176.11 1pmm s ALA 280 N -1.65 3.42 0.63 -1.18 0.00 0.01 -4.97 121.76 118.03 1pmm s ALA 280 Ca 0.00 -0.47 -0.14 0.00 0.00 0.00 0.00 51.96 51.35 1pmm s ALA 280 Cb 0.00 -2.56 -0.02 0.00 0.00 0.00 0.00 23.12 20.54 1pmm s ALA 280 CO 0.00 -0.22 1.07 -1.25 0.00 0.00 0.00 175.76 175.36 1pmm s PRO 281 N -4.45 3.12 -0.02 0.00 0.04 -1.26 -3.99 135.00 128.44 1pmm s PRO 281 Ca 0.47 1.18 -0.40 0.00 0.04 0.00 0.00 61.00 62.29 1pmm s PRO 281 Cb -0.10 -2.01 -0.19 0.00 0.04 0.00 0.00 34.50 32.24 1pmm s PRO 281 CO 0.41 -0.97 1.18 1.28 0.04 0.00 0.00 177.00 178.93 1pmm n LEU 282 N -2.38 0.47 0.00 -3.56 4.77 -1.26 -3.90 117.00 111.14 1pmm n LEU 282 Ca 0.09 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.22 1pmm n LEU 282 Cb 0.53 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 1pmm n LEU 282 CO 0.49 -1.63 0.00 0.61 -1.33 0.00 0.00 177.39 175.54 1pmm n GLY 283 N 1.93 1.74 2.90 -0.72 0.00 -1.25 -4.93 105.19 104.86 1pmm n GLY 283 Ca 0.20 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 1pmm n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pmm s GLY 285 N 1.84 1.16 -0.01 0.00 0.00 0.24 -0.95 107.32 109.61 1pmm s GLY 285 Ca -0.02 -1.56 -0.02 0.00 0.00 0.00 0.00 44.72 43.12 1pmm s GLY 285 CO -0.06 -1.44 0.04 -0.98 0.00 0.00 0.00 173.10 170.66 1pmm s TRP 286 N -3.90 -0.01 -0.02 1.90 0.52 0.27 -0.74 118.94 116.96 1pmm s TRP 286 Ca 0.26 0.04 -0.00 0.00 0.02 0.00 0.00 56.10 56.41 1pmm s TRP 286 Cb 0.07 -0.01 0.03 0.00 -1.15 0.00 0.00 33.47 32.41 1pmm s TRP 286 CO 0.04 -0.06 0.04 0.54 0.02 0.00 0.00 176.95 177.53 1pmm s VAL 287 N -0.22 -0.06 0.03 4.03 0.11 -0.92 -0.79 120.40 122.58 1pmm s VAL 287 Ca -0.03 0.26 0.08 0.00 -2.93 0.00 0.00 61.98 59.36 1pmm s VAL 287 Cb -0.02 -0.10 -0.02 0.00 -1.53 0.00 0.00 36.38 34.71 1pmm s VAL 287 CO 0.00 0.11 -0.23 -0.63 -3.33 0.00 0.00 175.10 171.03 1pmm s ILE 288 N 1.30 1.81 0.09 7.04 -1.09 -0.11 -1.20 121.20 129.04 1pmm s ILE 288 Ca -0.06 -1.17 0.05 0.00 -2.23 0.00 0.00 60.65 57.24 1pmm s ILE 288 Cb -0.13 -1.54 -0.04 0.00 -1.58 0.00 0.00 42.46 39.17 1pmm s ILE 288 CO -0.03 0.33 -0.03 0.26 -1.23 0.00 0.00 174.94 174.24 1pmm s TRP 289 N -0.72 2.92 0.23 3.97 0.51 0.40 -1.33 118.94 124.92 1pmm s TRP 289 Ca 0.09 -0.06 -0.06 0.00 -2.12 0.00 0.00 56.10 53.95 1pmm s TRP 289 Cb -0.09 -1.51 0.34 0.00 -0.81 0.00 0.00 33.47 31.40 1pmm s TRP 289 CO 0.01 0.47 1.80 -0.09 -0.51 0.00 0.00 176.95 178.63 1pmm h ARG 290 N 3.48 0.71 0.00 4.98 2.43 -1.34 -3.40 114.38 121.24 1pmm h ARG 290 Ca -0.48 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 58.74 1pmm h ARG 290 Cb 1.16 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 1pmm h ARG 290 CO 0.58 0.47 0.37 -0.40 -1.51 0.00 0.00 179.97 179.48 1pmm n ASP 291 N -4.78 -1.22 -0.31 -3.80 5.68 -1.26 -4.16 116.55 106.70 1pmm n ASP 291 Ca 0.11 -1.67 -0.01 0.00 -0.50 0.00 0.00 54.79 52.73 1pmm n ASP 291 Cb 0.24 1.99 0.12 0.00 -1.14 0.00 0.00 41.12 42.33 1pmm n ASP 291 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1pmm h GLU 292 N 0.00 1.00 -0.02 0.11 5.08 -1.92 -1.90 114.58 116.93 1pmm h GLU 292 Ca -0.19 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1pmm h GLU 292 Cb 0.81 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 1pmm h GLU 292 CO 0.25 0.66 0.01 0.93 -1.00 0.00 0.00 179.01 179.87 1pmm h GLU 293 N 1.03 0.00 0.00 2.33 5.08 -2.00 -1.79 114.58 119.23 1pmm h GLU 293 Ca 0.35 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.70 1pmm h GLU 293 Cb 0.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.32 1pmm h GLU 293 CO -0.14 0.00 -0.05 0.00 -1.00 0.00 0.00 179.01 177.82 1pmm h ALA 294 N 1.99 1.01 -3.66 3.43 0.00 -1.68 -3.41 119.26 116.93 1pmm h ALA 294 Ca 0.01 -0.05 -0.68 0.00 0.00 0.00 0.00 54.91 54.19 1pmm h ALA 294 Cb 0.04 -0.01 -0.35 0.00 0.00 0.00 0.00 17.79 17.46 1pmm h ALA 294 CO -0.00 0.07 -0.74 -1.17 0.00 0.00 0.00 179.25 177.41 1pmm s LEU 295 N -6.33 3.89 0.04 0.00 2.96 -0.67 -4.89 118.68 113.68 1pmm s LEU 295 Ca 0.02 -1.47 -0.33 0.00 -0.22 0.00 0.00 54.13 52.13 1pmm s LEU 295 Cb 0.09 -1.64 -0.12 0.00 0.50 0.00 0.00 46.19 45.02 1pmm s LEU 295 CO 0.58 -0.26 1.82 -2.65 -1.32 0.00 0.00 176.35 174.51 1pmm n PRO 296 N 4.50 2.44 0.28 0.98 -0.02 -1.26 -4.86 135.00 137.05 1pmm n PRO 296 Ca -0.11 0.89 0.12 0.00 -2.02 0.00 0.00 63.50 62.38 1pmm n PRO 296 Cb 0.42 -2.75 0.79 0.00 -0.02 0.00 0.00 33.50 31.95 1pmm n PRO 296 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 1pmm h GLN 297 N 8.50 0.00 0.00 -0.52 3.07 -1.94 -1.77 115.11 122.44 1pmm h GLN 297 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.27 1pmm h GLN 297 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.81 1pmm h GLN 297 CO 0.93 0.01 0.00 0.93 0.09 0.00 0.00 178.83 180.80 1pmm h GLU 298 N 0.00 0.00 -0.00 0.06 3.07 -2.03 -0.15 114.58 115.53 1pmm h GLU 298 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1pmm h GLU 298 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1pmm h GLU 298 CO 0.00 0.00 -0.61 1.28 -1.40 0.00 0.00 179.01 178.29 1pmm n LEU 299 N -3.01 0.66 -4.74 1.33 4.77 -0.67 -4.89 117.00 110.45 1pmm n LEU 299 Ca -0.02 -0.14 -0.36 0.00 -0.03 0.00 0.00 56.01 55.46 1pmm n LEU 299 Cb 0.10 -0.18 -0.07 0.00 -2.33 0.00 0.00 43.42 40.94 1pmm n LEU 299 CO 0.20 0.16 -0.08 -0.69 -1.33 0.00 0.00 177.39 175.65 1pmm s VAL 300 N -2.97 5.35 -0.32 4.08 1.01 -0.07 -4.74 120.40 122.74 1pmm s VAL 300 Ca 0.11 0.41 -0.06 0.00 0.00 0.00 0.00 61.98 62.44 1pmm s VAL 300 Cb 0.17 -3.56 0.03 0.00 0.00 0.00 0.00 36.38 33.02 1pmm s VAL 300 CO 0.73 0.43 0.08 -0.36 0.00 0.00 0.00 175.10 175.98 1pmm s PHE 301 N 0.25 3.20 0.37 5.22 0.40 -0.05 -4.88 117.98 122.50 1pmm s PHE 301 Ca 0.14 -1.29 -0.25 0.00 -0.60 0.00 0.00 56.93 54.93 1pmm s PHE 301 Cb -0.12 -2.25 -0.09 0.00 0.51 0.00 0.00 43.02 41.07 1pmm s PHE 301 CO 0.02 -0.68 1.03 -0.80 0.70 0.00 0.00 175.22 175.49 1pmm s ASN 302 N 1.43 6.92 0.06 1.36 0.02 -1.26 -1.45 114.94 122.02 1pmm s ASN 302 Ca -0.00 2.01 0.03 0.00 -1.02 0.00 0.00 52.86 53.88 1pmm s ASN 302 Cb -0.18 -2.59 -0.03 0.00 0.02 0.00 0.00 41.25 38.47 1pmm s ASN 302 CO 0.02 -0.37 -0.10 0.68 0.02 0.00 0.00 177.10 177.34 1pmm s VAL 303 N -1.62 0.82 0.37 1.60 -7.23 -0.49 -4.94 120.40 108.90 1pmm s VAL 303 Ca 0.55 -1.28 -0.27 0.00 -1.81 0.00 0.00 61.98 59.17 1pmm s VAL 303 Cb -0.22 -0.93 -0.09 0.00 0.56 0.00 0.00 36.38 35.70 1pmm s VAL 303 CO 0.27 -0.37 1.31 -1.81 -0.31 0.00 0.00 175.10 174.20 1pmm s ASP 304 N -1.83 6.50 -0.29 4.85 1.01 -1.26 -0.87 116.67 124.79 1pmm s ASP 304 Ca -0.04 2.68 -0.00 0.00 0.71 0.00 0.00 52.55 55.90 1pmm s ASP 304 Cb -0.08 -2.64 0.18 0.00 1.01 0.00 0.00 42.92 41.38 1pmm s ASP 304 CO 0.01 -0.72 0.55 -0.47 0.21 0.00 0.00 175.17 174.75 1pmm s TYR 305 N -1.21 -1.49 -1.20 4.23 5.04 0.19 -4.50 117.35 118.41 1pmm s TYR 305 Ca 0.53 1.44 -0.18 0.00 -2.44 0.00 0.00 57.07 56.43 1pmm s TYR 305 Cb -0.39 0.42 -0.00 0.00 0.35 0.00 0.00 41.96 42.34 1pmm s TYR 305 CO 0.51 -0.88 0.70 1.28 -1.34 0.00 0.00 175.55 175.82 1pmm n LEU 306 N 5.41 -2.48 0.00 6.97 4.77 -1.26 -1.33 117.00 129.09 1pmm n LEU 306 Ca -0.01 -1.04 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 1pmm n LEU 306 Cb 0.51 -2.29 0.00 0.00 -2.33 0.00 0.00 43.42 39.31 1pmm n LEU 306 CO 0.02 0.50 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1pmm n GLY 307 N -1.78 2.61 0.00 -0.72 0.00 -1.26 -4.92 105.19 99.12 1pmm n GLY 307 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1pmm n GLY 307 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pmm n GLY 308 N -2.00 5.22 3.04 -0.02 0.00 -0.44 -5.17 105.19 105.81 1pmm n GLY 308 Ca 0.00 -1.53 -0.11 0.00 0.00 0.00 0.00 46.02 44.39 1pmm n GLY 308 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pmm s GLN 309 N 2.08 0.35 -0.05 1.61 -0.21 -1.26 -0.64 119.66 121.54 1pmm s GLN 309 Ca 0.00 -0.35 0.06 0.00 0.02 0.00 0.00 55.36 55.09 1pmm s GLN 309 Cb 0.00 0.14 -0.01 0.00 1.00 0.00 0.00 33.01 34.14 1pmm s GLN 309 CO 0.00 -0.07 -0.25 -1.50 -2.12 0.00 0.00 175.29 171.35 1pmm s ILE 310 N -1.10 2.03 0.24 1.08 2.07 -0.04 -4.85 121.20 120.62 1pmm s ILE 310 Ca -0.12 -1.06 -0.30 0.00 -1.41 0.00 0.00 60.65 57.76 1pmm s ILE 310 Cb -0.07 -1.71 -0.09 0.00 0.13 0.00 0.00 42.46 40.72 1pmm s ILE 310 CO 0.00 0.56 0.95 -0.83 -1.91 0.00 0.00 174.94 173.72 1pmm s GLY 311 N -0.22 3.11 -0.02 1.50 0.00 -1.26 -1.40 107.32 109.03 1pmm s GLY 311 Ca -0.02 0.64 0.05 0.00 0.00 0.00 0.00 44.72 45.39 1pmm s GLY 311 CO 0.03 1.23 -0.16 -0.51 0.00 0.00 0.00 173.10 173.69 1pmm s THR 312 N -1.13 1.25 -0.27 0.90 -4.23 -0.53 -4.96 115.64 106.68 1pmm s THR 312 Ca 0.42 -0.66 -0.03 0.00 -1.18 0.00 0.00 61.69 60.23 1pmm s THR 312 Cb -0.26 -1.05 0.10 0.00 1.34 0.00 0.00 72.50 72.63 1pmm s THR 312 CO 0.33 0.36 0.17 0.12 -0.54 0.00 0.00 174.62 175.05 1pmm s PHE 313 N -0.23 0.09 0.08 3.99 5.36 -1.26 -0.87 117.98 125.14 1pmm s PHE 313 Ca 0.03 -0.59 -0.19 0.00 -0.96 0.00 0.00 56.93 55.22 1pmm s PHE 313 Cb -0.08 -0.75 0.04 0.00 -0.34 0.00 0.00 43.02 41.90 1pmm s PHE 313 CO 0.00 -0.81 0.45 0.00 -1.46 0.00 0.00 175.22 173.40 1pmm s ALA 314 N 2.18 -1.10 -0.20 11.12 0.00 -1.26 -4.94 121.76 127.55 1pmm s ALA 314 Ca 0.08 0.29 -0.08 0.00 0.00 0.00 0.00 51.96 52.25 1pmm s ALA 314 Cb -0.15 0.50 -0.20 0.00 0.00 0.00 0.00 23.12 23.26 1pmm s ALA 314 CO -0.32 -0.55 0.06 -0.89 0.00 0.00 0.00 175.76 174.07 1pmm n ILE 315 N 0.20 1.62 -1.75 0.00 5.41 -1.26 -4.93 119.36 118.64 1pmm n ILE 315 Ca -0.18 -0.47 -0.30 0.00 1.00 0.00 0.00 62.75 62.80 1pmm n ILE 315 Cb 0.61 -1.73 0.05 0.00 -0.71 0.00 0.00 39.64 37.87 1pmm n ILE 315 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1pmm s ASN 316 N -6.93 5.36 0.00 4.38 0.01 -1.26 -5.06 114.94 111.44 1pmm s ASN 316 Ca -0.30 1.31 0.00 0.00 -0.71 0.00 0.00 52.86 53.16 1pmm s ASN 316 Cb 0.08 -2.15 0.00 0.00 0.41 0.00 0.00 41.25 39.59 1pmm s ASN 316 CO 0.65 -1.42 0.00 0.33 -1.51 0.00 0.00 177.10 175.15 1pmm n PHE 317 N -3.08 0.00 -1.98 2.20 7.35 -1.26 -5.05 117.46 115.63 1pmm n PHE 317 Ca 0.07 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.36 1pmm n PHE 317 Cb 0.56 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.38 1pmm n PHE 317 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 1pmm s SER 318 N 0.92 6.43 -0.26 -2.13 0.01 -1.26 -4.30 113.70 113.11 1pmm s SER 318 Ca 0.00 2.80 -0.34 0.00 1.31 0.00 0.00 55.95 59.72 1pmm s SER 318 Cb 0.00 -2.65 0.17 0.00 0.21 0.00 0.00 66.02 63.74 1pmm s SER 318 CO 0.00 -0.78 1.31 0.00 0.41 0.00 0.00 173.24 174.18 1pmm s ARG 319 N -2.07 0.13 0.44 12.44 1.70 -1.26 -4.99 118.95 125.34 1pmm s ARG 319 Ca 0.53 -0.02 -0.25 0.00 -0.47 0.00 0.00 55.73 55.52 1pmm s ARG 319 Cb -0.41 0.06 -0.08 0.00 -0.57 0.00 0.00 34.95 33.94 1pmm s ARG 319 CO 0.55 -0.05 1.41 -1.25 -1.08 0.00 0.00 175.30 174.88 1pmm s PRO 320 N -1.70 3.74 0.00 3.89 0.04 -1.26 -0.54 135.00 139.18 1pmm s PRO 320 Ca 0.09 2.39 0.25 0.00 0.04 0.00 0.00 61.00 63.78 1pmm s PRO 320 Cb -0.01 -2.68 0.45 0.00 0.04 0.00 0.00 34.50 32.29 1pmm s PRO 320 CO -0.05 -0.76 1.38 0.00 0.04 0.00 0.00 177.00 177.61 1pmm n ALA 321 N -0.12 3.06 -0.29 8.56 0.00 -0.43 -4.45 120.51 126.83 1pmm n ALA 321 Ca 0.05 -0.54 -0.00 0.00 0.00 0.00 0.00 53.44 52.94 1pmm n ALA 321 Cb 0.42 -0.97 0.13 0.00 0.00 0.00 0.00 19.45 19.03 1pmm n ALA 321 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1pmm h GLY 322 N 4.85 1.22 1.00 0.00 0.00 -1.82 -2.41 103.07 105.92 1pmm h GLY 322 Ca 0.00 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 1pmm h GLY 322 CO 0.00 0.25 0.43 1.46 0.00 0.00 0.00 176.54 178.69 1pmm h GLN 323 N 0.93 0.97 -0.10 4.80 7.50 -1.87 0.12 115.11 127.45 1pmm h GLN 323 Ca 0.35 -0.09 -0.15 0.00 0.50 0.00 0.00 58.65 59.26 1pmm h GLN 323 Cb 0.15 -0.20 -0.01 0.00 0.05 0.00 0.00 27.48 27.47 1pmm h GLN 323 CO -0.17 0.69 -0.60 -0.24 -1.50 0.00 0.00 178.83 177.01 1pmm h VAL 324 N 0.97 1.36 -0.44 -0.54 3.04 -1.83 0.68 116.25 119.50 1pmm h VAL 324 Ca 0.26 -1.94 -0.05 0.00 -1.01 0.00 0.00 66.70 63.96 1pmm h VAL 324 Cb -0.04 1.94 -0.02 0.00 -2.01 0.00 0.00 31.29 31.17 1pmm h VAL 324 CO -0.05 0.58 0.10 0.40 -1.01 0.00 0.00 177.57 177.59 1pmm h ILE 325 N 0.26 1.24 -0.76 3.17 2.04 -1.10 -0.83 117.51 121.53 1pmm h ILE 325 Ca -0.00 -0.84 -0.04 0.00 1.00 0.00 0.00 64.86 64.98 1pmm h ILE 325 Cb 1.12 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 1pmm h ILE 325 CO 0.10 0.30 0.32 0.00 0.00 0.00 0.00 178.15 178.87 1pmm h ALA 326 N 0.96 1.13 -0.62 1.87 0.00 -0.53 -1.37 119.26 120.70 1pmm h ALA 326 Ca 0.14 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1pmm h ALA 326 Cb 0.34 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1pmm h ALA 326 CO 0.00 0.63 0.38 0.37 0.00 0.00 0.00 179.25 180.63 1pmm h GLN 327 N 1.10 0.85 -0.70 0.00 5.75 -0.37 -0.86 115.11 120.87 1pmm h GLN 327 Ca 0.26 -0.08 -0.05 0.00 -0.15 0.00 0.00 58.65 58.63 1pmm h GLN 327 Cb 0.18 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.52 1pmm h GLN 327 CO -0.03 0.60 0.25 -0.92 -2.65 0.00 0.00 178.83 176.09 1pmm h TYR 328 N 0.84 1.10 -0.45 3.99 3.20 -0.79 -1.17 116.97 123.70 1pmm h TYR 328 Ca 0.22 -0.10 0.04 0.00 3.14 0.00 0.00 58.73 62.04 1pmm h TYR 328 Cb -0.02 -0.32 -0.04 0.00 1.54 0.00 0.00 36.73 37.88 1pmm h TYR 328 CO -0.02 0.86 0.21 -0.92 -1.64 0.00 0.00 178.16 176.65 1pmm h TYR 329 N 1.01 0.38 -0.53 -3.82 3.20 -0.62 -0.28 116.97 116.32 1pmm h TYR 329 Ca 0.23 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.10 1pmm h TYR 329 Cb 0.25 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 1pmm h TYR 329 CO 0.02 0.18 0.27 0.93 -1.64 0.00 0.00 178.16 177.92 1pmm h GLU 330 N 0.42 0.75 -0.27 1.82 4.39 -0.77 0.32 114.58 121.24 1pmm h GLU 330 Ca 0.20 -0.10 0.03 0.00 0.34 0.00 0.00 59.36 59.83 1pmm h GLU 330 Cb 0.12 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 1pmm h GLU 330 CO -0.15 0.61 0.06 0.74 -1.16 0.00 0.00 179.01 179.10 1pmm h PHE 331 N 0.70 0.10 -0.23 4.33 0.04 -0.69 0.13 116.94 121.32 1pmm h PHE 331 Ca 0.18 0.02 -0.16 0.00 2.80 0.00 0.00 57.97 60.81 1pmm h PHE 331 Cb 0.09 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.24 1pmm h PHE 331 CO -0.01 0.03 -0.47 -0.07 -0.60 0.00 0.00 178.31 177.19 1pmm h LEU 332 N 0.16 0.82 -0.30 1.54 3.38 -0.82 -0.75 115.31 119.33 1pmm h LEU 332 Ca 0.12 -0.55 -0.18 0.00 0.09 0.00 0.00 57.88 57.36 1pmm h LEU 332 Cb 0.12 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1pmm h LEU 332 CO -0.16 1.21 -0.53 -0.09 0.09 0.00 0.00 178.44 178.97 1pmm h ARG 333 N 0.45 0.89 0.01 1.13 1.12 -0.23 -3.38 114.38 114.38 1pmm h ARG 333 Ca 0.01 -0.56 -0.36 0.00 -1.11 0.00 0.00 59.98 57.96 1pmm h ARG 333 Cb 1.08 0.06 -0.05 0.00 -0.01 0.00 0.00 29.97 31.05 1pmm h ARG 333 CO 0.10 1.20 -1.98 1.28 -3.11 0.00 0.00 179.97 177.46 1pmm n LEU 334 N -4.02 2.05 0.00 3.80 4.77 0.44 -4.91 117.00 119.13 1pmm n LEU 334 Ca -0.04 0.33 0.05 0.00 -0.03 0.00 0.00 56.01 56.32 1pmm n LEU 334 Cb 0.62 -0.91 -0.01 0.00 -2.33 0.00 0.00 43.42 40.79 1pmm n LEU 334 CO 0.50 0.50 -0.07 0.61 -1.33 0.00 0.00 177.39 177.61 1pmm n GLY 335 N 1.46 -1.58 0.33 -0.72 0.00 -0.29 0.09 105.19 104.48 1pmm n GLY 335 Ca -0.43 -1.19 -0.03 0.00 0.00 0.00 0.00 46.02 44.37 1pmm n GLY 335 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1pmm h ARG 336 N 0.00 1.14 -0.04 1.61 3.08 -1.97 -1.51 114.38 116.69 1pmm h ARG 336 Ca 0.01 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 60.02 1pmm h ARG 336 Cb 0.35 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 1pmm h ARG 336 CO 0.00 0.76 -0.13 1.49 -1.07 0.00 0.00 179.97 181.02 1pmm h GLU 337 N 1.18 -0.18 -0.41 0.04 4.81 -2.00 0.21 114.58 118.23 1pmm h GLU 337 Ca 0.32 0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.52 1pmm h GLU 337 Cb -0.12 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1pmm h GLU 337 CO -0.08 -0.12 0.07 0.78 -0.73 0.00 0.00 179.01 178.93 1pmm h GLY 338 N -0.19 0.72 1.16 1.92 0.00 -0.09 -2.08 103.07 104.50 1pmm h GLY 338 Ca 0.06 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 1pmm h GLY 338 CO -0.16 0.45 0.20 -0.97 0.00 0.00 0.00 176.54 176.06 1pmm h TYR 339 N 0.52 1.09 -0.39 5.60 -1.99 -1.16 -0.73 116.97 119.91 1pmm h TYR 339 Ca 0.12 -0.11 -0.00 0.00 2.00 0.00 0.00 58.73 60.75 1pmm h TYR 339 Cb 0.37 -0.32 -0.02 0.00 2.00 0.00 0.00 36.73 38.76 1pmm h TYR 339 CO 0.02 0.87 0.24 1.15 -0.00 0.00 0.00 178.16 180.45 1pmm h THR 340 N 1.01 1.13 -0.54 -2.88 2.02 -0.77 0.57 112.91 113.45 1pmm h THR 340 Ca 0.22 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 67.08 1pmm h THR 340 Cb 0.30 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1pmm h THR 340 CO -0.01 0.13 0.19 0.11 0.37 0.00 0.00 175.52 176.31 1pmm h LYS 341 N 0.52 0.82 -0.19 6.66 1.57 -1.08 0.30 116.57 125.17 1pmm h LYS 341 Ca 0.14 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1pmm h LYS 341 Cb -0.00 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1pmm h LYS 341 CO -0.03 0.74 0.01 0.28 -0.57 0.00 0.00 179.45 179.89 1pmm h VAL 342 N 0.74 1.24 -0.45 0.50 2.07 -0.85 -2.22 116.25 117.28 1pmm h VAL 342 Ca 0.18 -0.80 -0.09 0.00 0.82 0.00 0.00 66.70 66.80 1pmm h VAL 342 Cb 0.25 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1pmm h VAL 342 CO -0.01 0.24 -0.10 1.56 0.02 0.00 0.00 177.57 179.28 1pmm h GLN 343 N 0.09 0.80 -0.66 1.57 1.08 -0.83 -2.53 115.11 114.64 1pmm h GLN 343 Ca 0.05 -0.27 0.01 0.00 -1.45 0.00 0.00 58.65 57.00 1pmm h GLN 343 Cb 0.35 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.68 1pmm h GLN 343 CO 0.01 0.87 0.44 -0.91 -0.95 0.00 0.00 178.83 178.29 1pmm h ASN 344 N 0.73 0.74 -0.52 1.46 -0.26 -0.83 -1.29 115.58 115.61 1pmm h ASN 344 Ca 0.12 -0.02 -0.09 0.00 -0.56 0.00 0.00 56.30 55.76 1pmm h ASN 344 Cb 0.59 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.64 1pmm h ASN 344 CO 0.04 0.53 0.01 0.00 -1.06 0.00 0.00 177.43 176.94 1pmm h ALA 345 N 1.59 0.96 -0.37 -0.83 0.00 -0.98 -0.99 119.26 118.64 1pmm h ALA 345 Ca 0.25 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1pmm h ALA 345 Cb -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1pmm h ALA 345 CO -0.06 0.63 0.07 0.77 0.00 0.00 0.00 179.25 180.66 1pmm h SER 346 N 0.88 0.58 -0.20 0.00 0.02 -1.05 -2.26 113.55 111.52 1pmm h SER 346 Ca 0.16 -0.25 -0.07 0.00 -0.84 0.00 0.00 61.79 60.79 1pmm h SER 346 Cb 0.51 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.87 1pmm h SER 346 CO 0.02 0.69 -0.09 1.88 -1.14 0.00 0.00 176.83 178.20 1pmm h TYR 347 N 0.45 0.59 -0.65 3.45 0.05 -1.08 -1.18 116.97 118.60 1pmm h TYR 347 Ca 0.11 -0.08 -0.04 0.00 0.05 0.00 0.00 58.73 58.77 1pmm h TYR 347 Cb 0.35 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 37.90 1pmm h TYR 347 CO 0.02 0.63 0.26 0.37 -1.05 0.00 0.00 178.16 178.39 1pmm h GLN 348 N 0.51 0.98 -0.19 4.88 4.15 -1.00 -0.22 115.11 124.22 1pmm h GLN 348 Ca 0.10 -0.18 -0.03 0.00 0.77 0.00 0.00 58.65 59.31 1pmm h GLN 348 Cb 0.46 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 1pmm h GLN 348 CO 0.02 0.82 -0.01 0.28 -1.93 0.00 0.00 178.83 178.02 1pmm h VAL 349 N 0.92 1.26 -0.33 2.39 2.07 -1.02 -0.88 116.25 120.66 1pmm h VAL 349 Ca 0.22 -0.89 0.02 0.00 0.82 0.00 0.00 66.70 66.86 1pmm h VAL 349 Cb 0.21 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1pmm h VAL 349 CO -0.02 0.27 0.19 0.00 0.02 0.00 0.00 177.57 178.03 1pmm h ALA 350 N 0.78 0.41 -0.94 1.67 0.00 -1.06 -0.71 119.26 119.41 1pmm h ALA 350 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1pmm h ALA 350 Cb 0.41 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1pmm h ALA 350 CO 0.01 -0.18 0.61 0.00 0.00 0.00 0.00 179.25 179.69 1pmm h ALA 351 N 1.15 1.19 0.29 0.00 0.00 -0.97 -0.70 119.26 120.22 1pmm h ALA 351 Ca 0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1pmm h ALA 351 Cb 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.43 1pmm h ALA 351 CO -0.07 0.61 -0.14 -0.92 0.00 0.00 0.00 179.25 178.73 1pmm h TYR 352 N 1.28 -0.36 -0.77 0.00 3.20 -0.52 -1.83 116.97 117.97 1pmm h TYR 352 Ca 0.34 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.22 1pmm h TYR 352 Cb -0.12 0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 1pmm h TYR 352 CO -0.00 -0.19 0.50 -0.07 -1.64 0.00 0.00 178.16 176.76 1pmm h LEU 353 N -0.43 0.85 -0.52 2.82 3.38 -0.90 -0.52 115.31 119.98 1pmm h LEU 353 Ca -0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1pmm h LEU 353 Cb 0.33 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1pmm h LEU 353 CO 0.06 0.60 0.32 0.00 0.09 0.00 0.00 178.44 179.52 1pmm h ALA 354 N 1.31 0.67 -0.50 1.53 0.00 -1.03 0.21 119.26 121.44 1pmm h ALA 354 Ca 0.30 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 1pmm h ALA 354 Cb -0.05 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1pmm h ALA 354 CO -0.09 0.14 -0.08 0.22 0.00 0.00 0.00 179.25 179.44 1pmm h ASP 355 N 0.70 0.94 -0.15 0.00 3.58 -0.89 -2.30 116.42 118.30 1pmm h ASP 355 Ca 0.19 -0.34 -0.21 0.00 0.42 0.00 0.00 57.03 57.09 1pmm h ASP 355 Cb -0.03 -0.25 0.01 0.00 1.72 0.00 0.00 39.33 40.77 1pmm h ASP 355 CO -0.04 1.06 -0.71 -0.33 -2.88 0.00 0.00 179.24 176.34 1pmm h GLU 356 N 0.80 0.75 -0.13 0.28 4.39 -0.88 -3.23 114.58 116.56 1pmm h GLU 356 Ca 0.13 -0.60 -0.09 0.00 0.34 0.00 0.00 59.36 59.14 1pmm h GLU 356 Cb 0.63 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.39 1pmm h GLU 356 CO 0.04 1.21 -0.31 0.82 -1.16 0.00 0.00 179.01 179.61 1pmm h ILE 357 N 0.47 1.27 -0.14 3.13 2.04 -0.61 -2.97 117.51 120.69 1pmm h ILE 357 Ca -0.05 -1.27 0.04 0.00 1.00 0.00 0.00 64.86 64.58 1pmm h ILE 357 Cb 1.34 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.93 1pmm h ILE 357 CO 0.15 0.38 0.12 0.00 0.00 0.00 0.00 178.15 178.80 1pmm h ALA 358 N 1.46 2.00 -0.33 1.87 0.00 -1.42 -1.39 119.26 121.45 1pmm h ALA 358 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1pmm h ALA 358 Cb 0.67 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1pmm h ALA 358 CO 0.05 -0.19 0.00 0.36 0.00 0.00 0.00 179.25 179.47 1pmm n LYS 359 N -4.27 2.07 0.00 0.00 2.85 -1.12 -3.95 118.16 113.74 1pmm n LYS 359 Ca 0.01 -1.63 0.10 0.00 -1.05 0.00 0.00 58.31 55.73 1pmm n LYS 359 Cb 0.24 -1.42 -0.09 0.00 -0.65 0.00 0.00 35.03 33.11 1pmm n LYS 359 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1pmm n LEU 360 N 0.84 1.17 -3.79 -5.58 4.77 -0.52 -5.05 117.00 108.84 1pmm n LEU 360 Ca 0.17 -0.56 0.00 0.00 -0.03 0.00 0.00 56.01 55.59 1pmm n LEU 360 Cb 0.43 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1pmm n LEU 360 CO 0.13 0.26 0.97 -0.83 -1.33 0.00 0.00 177.39 176.59 1pmm s GLY 361 N -2.74 -0.20 -1.33 -0.72 0.00 -1.24 -5.07 107.32 96.02 1pmm s GLY 361 Ca 0.10 0.22 -0.17 0.00 0.00 0.00 0.00 44.72 44.87 1pmm s GLY 361 CO 0.74 2.03 1.93 -1.55 0.00 0.00 0.00 173.10 176.25 1pmm n PRO 362 N -0.64 2.91 -4.24 2.90 -0.04 -1.26 -4.86 135.00 129.78 1pmm n PRO 362 Ca -0.04 -2.94 -0.27 0.00 -0.04 0.00 0.00 63.50 60.21 1pmm n PRO 362 Cb 0.61 -3.42 -0.09 0.00 -0.04 0.00 0.00 33.50 30.56 1pmm n PRO 362 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1pmm s TYR 363 N 4.31 2.76 -0.15 0.54 2.02 -1.26 -1.33 117.35 124.25 1pmm s TYR 363 Ca 0.53 -0.17 0.01 0.00 -0.37 0.00 0.00 57.07 57.07 1pmm s TYR 363 Cb 0.08 -1.36 0.02 0.00 -0.40 0.00 0.00 41.96 40.30 1pmm s TYR 363 CO 0.03 0.50 -0.16 -2.00 -1.57 0.00 0.00 175.55 172.35 1pmm s GLU 364 N -2.79 2.47 0.10 -0.62 2.12 0.25 -4.76 118.70 115.46 1pmm s GLU 364 Ca 0.26 -0.63 -0.17 0.00 0.36 0.00 0.00 54.97 54.78 1pmm s GLU 364 Cb -0.09 -2.18 -0.07 0.00 0.26 0.00 0.00 34.13 32.05 1pmm s GLU 364 CO 0.17 -0.19 0.56 -0.06 -0.54 0.00 0.00 175.26 175.20 1pmm s PHE 365 N 1.32 3.72 -0.18 5.30 0.40 -1.26 -1.35 117.98 125.93 1pmm s PHE 365 Ca 0.02 1.18 0.08 0.00 -0.60 0.00 0.00 56.93 57.62 1pmm s PHE 365 Cb -0.13 -2.44 -0.17 0.00 0.51 0.00 0.00 43.02 40.79 1pmm s PHE 365 CO -0.09 0.52 -0.06 -0.89 0.70 0.00 0.00 175.22 175.41 1pmm n ILE 366 N 1.34 1.14 -3.77 0.64 5.41 0.11 -4.96 119.36 119.26 1pmm n ILE 366 Ca -0.08 -0.57 -0.15 0.00 1.00 0.00 0.00 62.75 62.95 1pmm n ILE 366 Cb 0.51 -0.88 -0.16 0.00 -0.71 0.00 0.00 39.64 38.40 1pmm n ILE 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1pmm n THR 368 N 4.10 1.59 -2.38 0.00 -2.24 -1.25 -1.11 114.28 113.00 1pmm n THR 368 Ca -0.27 -2.21 -0.09 0.00 -2.27 0.00 0.00 64.05 59.22 1pmm n THR 368 Cb 0.51 -0.04 0.01 0.00 -2.10 0.00 0.00 70.33 68.71 1pmm n THR 368 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pmm n GLY 369 N -0.98 0.09 3.64 3.38 0.00 -0.55 -3.87 105.19 106.91 1pmm n GLY 369 Ca 0.14 -0.46 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 1pmm n GLY 369 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pmm s ARG 370 N -4.73 4.17 0.59 1.61 0.52 -1.26 -4.48 118.95 115.36 1pmm s ARG 370 Ca 0.06 0.61 0.32 0.00 -0.52 0.00 0.00 55.73 56.20 1pmm s ARG 370 Cb -0.03 -3.61 1.87 0.00 0.52 0.00 0.00 34.95 33.69 1pmm s ARG 370 CO 0.08 -0.33 2.24 -1.00 0.02 0.00 0.00 175.30 176.31 1pmm h PRO 371 N 7.67 0.00 -0.00 3.54 0.13 -1.90 -1.48 132.00 139.96 1pmm h PRO 371 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1pmm h PRO 371 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1pmm h PRO 371 CO 0.78 0.02 -0.19 -0.40 -0.23 0.00 0.00 178.00 177.98 1pmm n ASP 372 N -3.66 0.52 -0.02 1.44 5.75 -1.26 -4.06 116.55 115.27 1pmm n ASP 372 Ca -0.03 -0.44 0.01 0.00 -0.01 0.00 0.00 54.79 54.32 1pmm n ASP 372 Cb 0.11 -0.03 -0.05 0.00 -1.03 0.00 0.00 41.12 40.12 1pmm n ASP 372 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1pmm n GLU 373 N -1.06 1.37 0.00 0.11 1.02 -0.63 -5.02 120.64 116.42 1pmm n GLU 373 Ca 0.12 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 1pmm n GLU 373 Cb 0.31 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 1pmm n GLU 373 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pmm n GLY 374 N 2.31 -0.78 3.96 0.62 0.00 -0.74 -1.16 105.19 109.39 1pmm n GLY 374 Ca -0.05 -0.32 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 1pmm n GLY 374 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pmm s ILE 375 N -4.00 2.39 -1.22 -0.61 -4.36 -0.02 -4.43 121.20 108.95 1pmm s ILE 375 Ca 0.00 -0.47 -0.20 0.00 -0.26 0.00 0.00 60.65 59.71 1pmm s ILE 375 Cb 0.00 -2.92 -0.03 0.00 1.25 0.00 0.00 42.46 40.77 1pmm s ILE 375 CO 0.00 0.00 1.87 -2.65 0.24 0.00 0.00 174.94 174.40 1pmm n PRO 376 N -2.71 2.27 -3.93 0.37 -0.02 -1.26 -4.36 135.00 125.36 1pmm n PRO 376 Ca 0.10 -2.75 -0.08 0.00 -2.02 0.00 0.00 63.50 58.74 1pmm n PRO 376 Cb 0.60 -3.57 -0.08 0.00 -0.02 0.00 0.00 33.50 30.43 1pmm n PRO 376 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pmm s ALA 377 N 7.68 -0.00 -0.15 3.55 0.00 -1.26 -1.75 121.76 129.83 1pmm s ALA 377 Ca 0.61 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.78 1pmm s ALA 377 Cb 0.03 0.49 0.02 0.00 0.00 0.00 0.00 23.12 23.66 1pmm s ALA 377 CO 0.10 -0.49 -0.19 0.08 0.00 0.00 0.00 175.76 175.26 1pmm s VAL 378 N -3.89 1.89 -0.04 0.00 1.01 -0.44 -1.48 120.40 117.44 1pmm s VAL 378 Ca 0.07 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.21 1pmm s VAL 378 Cb 0.05 -1.71 0.02 0.00 0.00 0.00 0.00 36.38 34.75 1pmm s VAL 378 CO -0.09 0.51 -0.04 0.00 0.00 0.00 0.00 175.10 175.48 1pmm s PHE 380 N 0.93 0.09 0.14 0.00 -0.71 -0.89 0.06 117.98 117.60 1pmm s PHE 380 Ca -0.11 -0.46 -0.02 0.00 -1.04 0.00 0.00 56.93 55.30 1pmm s PHE 380 Cb -0.14 0.30 -0.03 0.00 -1.21 0.00 0.00 43.02 41.93 1pmm s PHE 380 CO 0.00 -0.95 0.10 -1.59 -1.34 0.00 0.00 175.22 171.44 1pmm s LYS 381 N -3.94 0.98 0.32 1.99 -2.85 -0.45 -1.09 119.74 114.69 1pmm s LYS 381 Ca 0.14 -1.40 -0.28 0.00 -1.00 0.00 0.00 55.97 53.43 1pmm s LYS 381 Cb -0.01 0.27 -0.09 0.00 -2.06 0.00 0.00 37.83 35.93 1pmm s LYS 381 CO 0.02 -0.29 1.13 -0.51 0.10 0.00 0.00 175.35 175.80 1pmm s LEU 382 N -3.04 4.44 0.55 2.77 1.43 -1.26 -0.59 118.68 122.98 1pmm s LEU 382 Ca 0.24 2.31 -0.21 0.00 -1.03 0.00 0.00 54.13 55.43 1pmm s LEU 382 Cb 0.07 -3.75 -0.05 0.00 0.03 0.00 0.00 46.19 42.49 1pmm s LEU 382 CO 0.02 -0.31 1.26 0.29 0.23 0.00 0.00 176.35 177.84 1pmm n LYS 383 N 0.84 1.51 -1.66 1.70 5.02 -0.44 -4.73 118.16 120.39 1pmm n LYS 383 Ca 0.00 0.56 -0.47 0.00 -2.02 0.00 0.00 58.31 56.38 1pmm n LYS 383 Cb 0.45 -2.45 -0.05 0.00 -0.02 0.00 0.00 35.03 32.96 1pmm n LYS 383 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1pmm n ASP 384 N -0.83 3.01 -0.09 4.39 8.00 -1.26 -1.63 116.55 128.14 1pmm n ASP 384 Ca 0.11 1.06 -0.01 0.00 0.71 0.00 0.00 54.79 56.66 1pmm n ASP 384 Cb 0.45 -1.39 -0.01 0.00 -0.02 0.00 0.00 41.12 40.15 1pmm n ASP 384 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pmm n GLY 385 N 3.55 0.50 3.51 0.44 0.00 -1.26 -5.03 105.19 106.90 1pmm n GLY 385 Ca 0.18 -0.45 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 1pmm n GLY 385 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pmm s GLU 386 N -1.17 3.71 -0.43 1.61 0.41 -0.65 -5.07 118.70 117.11 1pmm s GLU 386 Ca 0.00 -0.50 0.02 0.00 -0.41 0.00 0.00 54.97 54.09 1pmm s GLU 386 Cb 0.00 -2.96 0.13 0.00 -1.78 0.00 0.00 34.13 29.52 1pmm s GLU 386 CO 0.00 0.24 0.20 0.34 -0.49 0.00 0.00 175.26 175.55 1pmm s ASP 387 N 0.39 4.00 0.00 -0.19 -1.08 -1.26 -4.79 116.67 113.74 1pmm s ASP 387 Ca -0.03 -2.55 0.23 0.00 -0.52 0.00 0.00 52.55 49.68 1pmm s ASP 387 Cb -0.14 -1.24 1.29 0.00 -1.46 0.00 0.00 42.92 41.37 1pmm s ASP 387 CO 0.03 -0.29 1.74 -0.81 0.52 0.00 0.00 175.17 176.36 1pmm n PRO 388 N 3.68 0.57 -0.02 4.34 -0.04 -1.26 -4.82 135.00 137.45 1pmm n PRO 388 Ca 0.06 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1pmm n PRO 388 Cb 0.36 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.32 1pmm n PRO 388 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pmm n GLY 389 N 0.51 0.99 3.43 0.55 0.00 -1.26 -4.97 105.19 104.44 1pmm n GLY 389 Ca 0.15 -0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 1pmm n GLY 389 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1pmm s TYR 390 N -2.00 -0.53 0.36 1.61 -0.85 -1.26 -4.85 117.35 109.83 1pmm s TYR 390 Ca 0.00 0.35 0.08 0.00 -0.52 0.00 0.00 57.07 56.98 1pmm s TYR 390 Cb 0.00 0.55 -0.03 0.00 0.38 0.00 0.00 41.96 42.86 1pmm s TYR 390 CO 0.00 -0.81 0.24 0.95 -1.52 0.00 0.00 175.55 174.41 1pmm s THR 391 N -3.59 3.02 -0.11 -3.49 -4.23 -1.26 -5.00 115.64 100.98 1pmm s THR 391 Ca 0.01 -1.52 0.29 0.00 -1.18 0.00 0.00 61.69 59.29 1pmm s THR 391 Cb -0.01 -3.05 0.32 0.00 1.34 0.00 0.00 72.50 71.11 1pmm s THR 391 CO -0.12 -0.12 1.88 -0.07 -0.54 0.00 0.00 174.62 175.65 1pmm h LEU 392 N 1.33 0.00 -0.38 4.79 3.38 -1.97 -2.05 115.31 120.42 1pmm h LEU 392 Ca -0.43 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.41 1pmm h LEU 392 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1pmm h LEU 392 CO 0.61 0.00 -0.26 1.88 0.09 0.00 0.00 178.44 180.76 1pmm h TYR 393 N 0.00 1.00 -0.33 1.13 0.05 -1.94 -0.72 116.97 116.15 1pmm h TYR 393 Ca 0.00 -0.27 -0.02 0.00 0.05 0.00 0.00 58.73 58.49 1pmm h TYR 393 Cb 0.35 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 1pmm h TYR 393 CO 0.00 1.05 0.12 -0.44 -1.05 0.00 0.00 178.16 177.85 1pmm h ASP 394 N 0.65 0.46 -0.45 3.88 3.32 -1.77 -1.94 116.42 120.58 1pmm h ASP 394 Ca 0.07 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 56.95 1pmm h ASP 394 Cb 0.84 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.24 1pmm h ASP 394 CO 0.07 0.52 0.29 0.25 -1.72 0.00 0.00 179.24 178.65 1pmm h LEU 395 N 0.38 0.49 -0.85 1.55 5.85 -1.39 -0.81 115.31 120.54 1pmm h LEU 395 Ca 0.11 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.87 1pmm h LEU 395 Cb 0.21 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 1pmm h LEU 395 CO -0.01 0.35 0.53 -1.28 -0.34 0.00 0.00 178.44 177.70 1pmm h SER 396 N 0.59 0.86 -0.41 1.25 0.87 -0.97 -1.54 113.55 114.20 1pmm h SER 396 Ca 0.17 0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.67 1pmm h SER 396 Cb -0.05 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 1pmm h SER 396 CO -0.05 0.57 0.03 -0.08 -0.53 0.00 0.00 176.83 176.78 1pmm h GLU 397 N 1.01 0.71 -0.24 2.24 4.81 -0.69 -2.36 114.58 120.06 1pmm h GLU 397 Ca 0.35 -0.21 0.01 0.00 -0.13 0.00 0.00 59.36 59.38 1pmm h GLU 397 Cb 0.09 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1pmm h GLU 397 CO -0.14 0.78 0.15 0.00 -0.73 0.00 0.00 179.01 179.06 1pmm h ARG 398 N 0.55 0.30 -0.51 1.92 2.47 -0.69 -2.13 114.38 116.30 1pmm h ARG 398 Ca 0.12 -0.02 0.07 0.00 -1.26 0.00 0.00 59.98 58.89 1pmm h ARG 398 Cb 0.43 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.66 1pmm h ARG 398 CO 0.02 0.20 0.34 -0.07 0.56 0.00 0.00 179.97 181.01 1pmm h LEU 399 N 0.30 0.35 -2.08 3.04 3.38 -1.21 -0.65 115.31 118.45 1pmm h LEU 399 Ca 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1pmm h LEU 399 Cb -0.02 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1pmm h LEU 399 CO -0.03 0.23 -0.06 -0.09 0.09 0.00 0.00 178.44 178.58 1pmm h ARG 400 N 0.40 0.00 0.00 1.13 2.43 -0.83 -1.65 114.38 115.86 1pmm h ARG 400 Ca 0.22 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 1pmm h ARG 400 Cb 0.37 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1pmm h ARG 400 CO -0.06 0.06 0.00 -0.07 -1.51 0.00 0.00 179.97 178.39 1pmm h LEU 401 N 0.00 0.00 -2.85 3.80 3.38 -1.05 -1.53 115.31 117.06 1pmm h LEU 401 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1pmm h LEU 401 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1pmm h LEU 401 CO 0.01 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.08 1pmm n ARG 402 N -2.74 2.84 0.00 1.13 5.12 -0.63 -4.96 116.66 117.41 1pmm n ARG 402 Ca -0.00 -2.29 0.00 0.00 -1.93 0.00 0.00 57.85 53.63 1pmm n ARG 402 Cb 0.19 -1.39 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 1pmm n ARG 402 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1pmm n GLY 403 N 0.91 0.82 3.75 -0.13 0.00 -0.58 -5.06 105.19 104.90 1pmm n GLY 403 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 1pmm n GLY 403 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pmm s TRP 404 N -2.22 3.70 -0.43 1.61 0.52 -1.14 -4.67 118.94 116.32 1pmm s TRP 404 Ca 0.00 1.75 -0.01 0.00 0.02 0.00 0.00 56.10 57.86 1pmm s TRP 404 Cb 0.00 -3.20 0.12 0.00 -1.15 0.00 0.00 33.47 29.24 1pmm s TRP 404 CO 0.00 -0.26 0.21 -0.65 0.02 0.00 0.00 176.95 176.27 1pmm s GLN 405 N -1.25 1.97 -0.29 4.98 -0.21 -0.66 -3.36 119.66 120.84 1pmm s GLN 405 Ca 0.44 -1.95 0.03 0.00 0.02 0.00 0.00 55.36 53.90 1pmm s GLN 405 Cb -0.30 -3.53 0.08 0.00 1.00 0.00 0.00 33.01 30.26 1pmm s GLN 405 CO 0.38 -1.06 -0.04 0.08 -2.12 0.00 0.00 175.29 172.52 1pmm s VAL 406 N 0.90 2.14 0.30 1.09 1.01 -1.26 -0.75 120.40 123.83 1pmm s VAL 406 Ca 0.10 -1.86 -0.29 0.00 0.00 0.00 0.00 61.98 59.93 1pmm s VAL 406 Cb -0.22 -2.38 -0.10 0.00 0.00 0.00 0.00 36.38 33.68 1pmm s VAL 406 CO -0.05 -0.26 1.17 -2.16 0.00 0.00 0.00 175.10 173.81 1pmm s PRO 407 N 1.06 4.53 -0.09 2.72 0.04 -1.25 -4.67 135.00 137.34 1pmm s PRO 407 Ca -0.01 1.94 0.03 0.00 0.04 0.00 0.00 61.00 63.00 1pmm s PRO 407 Cb -0.19 -3.13 0.01 0.00 0.04 0.00 0.00 34.50 31.22 1pmm s PRO 407 CO -0.07 0.07 -0.19 0.00 0.04 0.00 0.00 177.00 176.85 1pmm s ALA 408 N -1.17 1.81 0.17 8.56 0.00 -1.26 -1.75 121.76 128.12 1pmm s ALA 408 Ca 0.46 -0.76 -0.17 0.00 0.00 0.00 0.00 51.96 51.49 1pmm s ALA 408 Cb -0.34 -0.74 0.03 0.00 0.00 0.00 0.00 23.12 22.07 1pmm s ALA 408 CO 0.45 0.18 0.48 -0.59 0.00 0.00 0.00 175.76 176.28 1pmm s PHE 409 N 0.54 -0.17 0.23 0.00 -0.12 0.22 -4.95 117.98 113.73 1pmm s PHE 409 Ca -0.16 -0.15 -0.13 0.00 -0.05 0.00 0.00 56.93 56.44 1pmm s PHE 409 Cb -0.17 0.35 -0.08 0.00 -0.63 0.00 0.00 43.02 42.49 1pmm s PHE 409 CO 0.06 -0.83 0.61 0.95 -0.05 0.00 0.00 175.22 175.95 1pmm s THR 410 N -3.84 4.82 0.84 -4.49 -4.23 -1.26 -0.14 115.64 107.34 1pmm s THR 410 Ca 0.07 0.74 -0.12 0.00 -1.18 0.00 0.00 61.69 61.20 1pmm s THR 410 Cb 0.00 -3.67 0.09 0.00 1.34 0.00 0.00 72.50 70.27 1pmm s THR 410 CO -0.07 0.00 1.17 -0.76 -0.54 0.00 0.00 174.62 174.42 1pmm s LEU 411 N -2.57 2.37 0.00 4.79 1.43 -0.43 -4.93 118.68 119.34 1pmm s LEU 411 Ca 0.46 0.84 0.00 0.00 -1.03 0.00 0.00 54.13 54.40 1pmm s LEU 411 Cb -0.12 -3.29 0.00 0.00 0.03 0.00 0.00 46.19 42.80 1pmm s LEU 411 CO 0.20 -2.08 0.00 0.61 0.23 0.00 0.00 176.35 175.31 1pmm n GLY 412 N -2.99 2.21 7.00 -3.19 0.00 -1.26 -3.49 105.19 103.46 1pmm n GLY 412 Ca 0.08 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.11 1pmm n GLY 412 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pmm n GLY 413 N 5.00 3.43 2.07 -0.02 0.00 -1.26 -1.51 105.19 112.90 1pmm n GLY 413 Ca 0.00 0.03 -0.24 0.00 0.00 0.00 0.00 46.02 45.81 1pmm n GLY 413 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pmm n GLU 414 N 14.00 2.41 -1.29 1.61 1.02 0.11 -4.14 120.64 134.36 1pmm n GLU 414 Ca 0.00 -3.21 0.04 0.00 -0.02 0.00 0.00 57.16 53.97 1pmm n GLU 414 Cb 0.00 -2.16 0.04 0.00 -0.02 0.00 0.00 31.44 29.30 1pmm n GLU 414 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1pmm n ALA 415 N -1.05 2.44 0.31 0.62 0.00 -0.57 -4.35 120.51 117.93 1pmm n ALA 415 Ca 0.56 -2.30 0.06 0.00 0.00 0.00 0.00 53.44 51.76 1pmm n ALA 415 Cb 1.21 -0.67 0.27 0.00 0.00 0.00 0.00 19.45 20.25 1pmm n ALA 415 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1pmm n THR 416 N 0.27 1.27 0.29 0.00 -2.24 -1.23 -1.53 114.28 111.11 1pmm n THR 416 Ca 0.07 0.36 0.12 0.00 -2.27 0.00 0.00 64.05 62.33 1pmm n THR 416 Cb 1.05 -1.23 0.14 0.00 -2.10 0.00 0.00 70.33 68.19 1pmm n THR 416 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 1pmm h ASP 417 N 0.00 0.00 -3.37 3.42 2.03 -1.89 -3.42 116.42 113.18 1pmm h ASP 417 Ca 0.00 -0.04 -0.58 0.00 -0.73 0.00 0.00 57.03 55.68 1pmm h ASP 417 Cb 0.17 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 38.59 1pmm h ASP 417 CO 0.00 0.02 0.18 -0.63 -1.03 0.00 0.00 179.24 177.78 1pmm s ILE 418 N -3.24 4.99 -0.17 4.15 1.01 -0.58 -5.01 121.20 122.35 1pmm s ILE 418 Ca 0.05 1.35 -0.06 0.00 0.00 0.00 0.00 60.65 61.99 1pmm s ILE 418 Cb 0.09 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 1pmm s ILE 418 CO 0.71 0.12 0.03 -0.69 0.00 0.00 0.00 174.94 175.10 1pmm s VAL 419 N 1.75 4.47 0.20 2.92 1.01 -1.26 -1.31 120.40 128.18 1pmm s VAL 419 Ca 0.33 -0.15 0.07 0.00 0.00 0.00 0.00 61.98 62.23 1pmm s VAL 419 Cb -0.16 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 1pmm s VAL 419 CO 0.12 0.48 -0.13 0.68 0.00 0.00 0.00 175.10 176.25 1pmm s VAL 420 N 0.28 1.64 -0.04 2.92 -7.23 0.80 -4.39 120.40 114.38 1pmm s VAL 420 Ca 0.01 -2.18 0.07 0.00 -1.81 0.00 0.00 61.98 58.07 1pmm s VAL 420 Cb -0.13 -2.05 -0.01 0.00 0.56 0.00 0.00 36.38 34.74 1pmm s VAL 420 CO 0.01 -0.59 -0.25 -0.32 -0.31 0.00 0.00 175.10 173.65 1pmm s MET 421 N -3.67 2.32 -0.05 4.82 -2.45 -0.25 -0.61 119.30 119.41 1pmm s MET 421 Ca 0.22 -0.89 0.03 0.00 -1.25 0.00 0.00 55.69 53.81 1pmm s MET 421 Cb 0.00 -2.06 0.01 0.00 1.25 0.00 0.00 34.83 34.03 1pmm s MET 421 CO 0.06 0.43 -0.14 0.50 1.05 0.00 0.00 175.02 176.93 1pmm s ARG 422 N -0.31 1.63 -0.19 4.11 3.52 -0.72 -2.10 118.95 124.89 1pmm s ARG 422 Ca 0.01 -0.47 0.01 0.00 -0.13 0.00 0.00 55.73 55.15 1pmm s ARG 422 Cb -0.12 -1.38 0.03 0.00 -1.56 0.00 0.00 34.95 31.91 1pmm s ARG 422 CO 0.02 0.12 -0.18 0.42 -0.81 0.00 0.00 175.30 174.86 1pmm s ILE 423 N 0.37 2.11 -0.11 4.11 1.01 0.25 -3.94 121.20 125.00 1pmm s ILE 423 Ca -0.09 -1.03 -0.17 0.00 0.00 0.00 0.00 60.65 59.36 1pmm s ILE 423 Cb -0.13 -1.94 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1pmm s ILE 423 CO 0.03 0.45 0.43 -0.04 0.00 0.00 0.00 174.94 175.81 1pmm s MET 424 N 1.27 4.28 -0.65 2.79 -1.94 -0.56 -1.33 119.30 123.16 1pmm s MET 424 Ca 0.03 0.37 -0.04 0.00 -1.71 0.00 0.00 55.69 54.34 1pmm s MET 424 Cb -0.14 -3.41 0.17 0.00 2.01 0.00 0.00 34.83 33.45 1pmm s MET 424 CO -0.12 0.23 0.47 0.00 -0.01 0.00 0.00 175.02 175.59 1pmm s ARG 426 N -0.06 1.77 0.28 0.00 0.52 -1.26 -4.73 118.95 115.47 1pmm s ARG 426 Ca 0.17 -1.40 -0.30 0.00 -0.52 0.00 0.00 55.73 53.69 1pmm s ARG 426 Cb -0.19 -2.43 -0.10 0.00 0.52 0.00 0.00 34.95 32.74 1pmm s ARG 426 CO -0.04 -1.35 1.44 0.50 0.02 0.00 0.00 175.30 175.87 1pmm s ARG 427 N -5.02 4.25 0.00 3.54 3.52 -1.26 -2.12 118.95 121.85 1pmm s ARG 427 Ca 0.66 2.35 0.00 0.00 -0.13 0.00 0.00 55.73 58.61 1pmm s ARG 427 Cb -0.04 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.27 1pmm s ARG 427 CO 0.43 -0.42 0.00 0.41 -0.81 0.00 0.00 175.30 174.92 1pmm n GLY 428 N 1.74 0.78 2.72 8.12 0.00 -1.26 -4.69 105.19 112.59 1pmm n GLY 428 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1pmm n GLY 428 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1pmm n PHE 429 N -2.09 3.83 -0.81 1.61 7.35 -0.90 -5.06 117.46 121.40 1pmm n PHE 429 Ca 0.00 -4.00 -0.31 0.00 -0.76 0.00 0.00 57.45 52.38 1pmm n PHE 429 Cb 0.00 -0.55 0.15 0.00 0.35 0.00 0.00 39.48 39.43 1pmm n PHE 429 CO 0.00 0.00 0.00 -1.83 -0.76 0.00 0.00 176.76 174.17 1pmm s GLU 430 N -3.07 1.24 0.26 -4.13 1.03 -1.26 -4.67 118.70 108.10 1pmm s GLU 430 Ca 0.45 1.46 -0.03 0.00 0.03 0.00 0.00 54.97 56.88 1pmm s GLU 430 Cb 0.22 -1.76 0.53 0.00 -0.80 0.00 0.00 34.13 32.31 1pmm s GLU 430 CO -0.08 -2.44 1.70 1.98 -1.33 0.00 0.00 175.26 175.09 1pmm h MET 431 N -1.73 0.35 -0.52 -4.83 1.85 -1.98 -0.43 114.93 107.64 1pmm h MET 431 Ca -0.43 -0.02 -0.04 0.00 -0.61 0.00 0.00 59.70 58.60 1pmm h MET 431 Cb 1.26 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 33.19 1pmm h MET 431 CO 0.44 0.23 0.16 0.22 -0.40 0.00 0.00 176.91 177.56 1pmm h ASP 432 N 0.36 0.71 -0.30 1.39 3.58 -2.00 -0.59 116.42 119.57 1pmm h ASP 432 Ca 0.45 -0.11 -0.14 0.00 0.42 0.00 0.00 57.03 57.66 1pmm h ASP 432 Cb 0.77 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.63 1pmm h ASP 432 CO -0.48 0.68 -0.36 0.15 -2.88 0.00 0.00 179.24 176.35 1pmm h PHE 433 N 0.76 0.94 0.00 0.28 3.57 -1.51 -2.98 116.94 117.99 1pmm h PHE 433 Ca 0.17 -0.29 -0.06 0.00 3.53 0.00 0.00 57.97 61.32 1pmm h PHE 433 Cb 0.22 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1pmm h PHE 433 CO 0.01 1.07 -0.29 0.00 -2.23 0.00 0.00 178.31 176.87 1pmm h ALA 434 N 0.70 1.48 -0.47 2.41 0.00 -0.70 -2.10 119.26 120.59 1pmm h ALA 434 Ca 0.04 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1pmm h ALA 434 Cb 0.94 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1pmm h ALA 434 CO 0.09 0.37 0.01 1.49 0.00 0.00 0.00 179.25 181.20 1pmm h GLU 435 N 0.00 0.77 -0.45 0.00 4.22 -0.97 -0.64 114.58 117.50 1pmm h GLU 435 Ca -0.00 -0.20 -0.08 0.00 0.08 0.00 0.00 59.36 59.16 1pmm h GLU 435 Cb 0.53 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1pmm h GLU 435 CO 0.04 0.77 -0.04 -0.07 -2.18 0.00 0.00 179.01 177.53 1pmm h LEU 436 N 0.72 0.74 -0.51 1.64 3.38 -1.28 -0.50 115.31 119.50 1pmm h LEU 436 Ca 0.14 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1pmm h LEU 436 Cb 0.43 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1pmm h LEU 436 CO 0.02 0.83 0.00 0.25 0.09 0.00 0.00 178.44 179.63 1pmm h LEU 437 N 0.71 0.87 -0.45 1.67 5.85 -1.13 -2.10 115.31 120.73 1pmm h LEU 437 Ca 0.13 -0.31 0.02 0.00 0.84 0.00 0.00 57.88 58.57 1pmm h LEU 437 Cb 0.49 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1pmm h LEU 437 CO 0.03 0.97 0.27 0.25 -0.34 0.00 0.00 178.44 179.61 1pmm h LEU 438 N 0.76 0.43 -1.00 2.25 6.46 -0.57 0.27 115.31 123.91 1pmm h LEU 438 Ca 0.14 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 57.94 1pmm h LEU 438 Cb 0.52 -0.09 -0.06 0.00 -0.73 0.00 0.00 40.66 40.30 1pmm h LEU 438 CO 0.03 0.31 0.66 -0.33 -0.62 0.00 0.00 178.44 178.48 1pmm h GLU 439 N 0.53 1.24 0.00 1.25 5.08 -0.89 -0.20 114.58 121.60 1pmm h GLU 439 Ca 0.18 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.39 1pmm h GLU 439 Cb 0.01 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 1pmm h GLU 439 CO -0.08 0.82 -0.35 -0.44 -1.00 0.00 0.00 179.01 177.96 1pmm h ASP 440 N 1.28 0.00 -0.13 1.42 3.32 -0.66 -1.69 116.42 119.96 1pmm h ASP 440 Ca 0.39 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.37 1pmm h ASP 440 Cb -0.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1pmm h ASP 440 CO -0.12 0.35 -0.21 0.22 -1.72 0.00 0.00 179.24 177.76 1pmm h TYR 441 N 0.00 0.46 -0.73 4.55 5.03 0.45 -0.86 116.97 125.86 1pmm h TYR 441 Ca -0.00 -0.16 -0.02 0.00 2.58 0.00 0.00 58.73 61.13 1pmm h TYR 441 Cb 0.82 -0.09 -0.03 0.00 1.55 0.00 0.00 36.73 38.98 1pmm h TYR 441 CO 0.00 0.82 0.38 0.87 -1.32 0.00 0.00 178.16 178.91 1pmm h LYS 442 N -0.04 1.04 -0.49 1.82 1.57 -0.89 -1.66 116.57 117.91 1pmm h LYS 442 Ca 0.01 -0.14 -0.06 0.00 -1.87 0.00 0.00 60.65 58.59 1pmm h LYS 442 Cb 0.78 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 1pmm h LYS 442 CO 0.05 0.79 0.06 0.00 -0.57 0.00 0.00 179.45 179.77 1pmm h ALA 443 N 1.19 0.66 -0.69 3.86 0.00 -1.29 -1.84 119.26 121.15 1pmm h ALA 443 Ca 0.25 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1pmm h ALA 443 Cb 0.07 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1pmm h ALA 443 CO -0.04 0.41 0.44 0.77 0.00 0.00 0.00 179.25 180.83 1pmm h SER 444 N 0.70 0.82 -0.50 0.00 0.02 -0.85 -1.17 113.55 112.56 1pmm h SER 444 Ca 0.15 -0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 60.97 1pmm h SER 444 Cb 0.43 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 1pmm h SER 444 CO 0.01 0.62 0.02 -0.07 -1.14 0.00 0.00 176.83 176.27 1pmm h LEU 445 N 0.94 0.89 -0.61 5.07 3.38 -1.16 -0.61 115.31 123.22 1pmm h LEU 445 Ca 0.25 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1pmm h LEU 445 Cb -0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1pmm h LEU 445 CO -0.05 0.93 0.13 0.50 0.09 0.00 0.00 178.44 180.05 1pmm h LYS 446 N 0.86 0.98 0.14 1.13 3.64 -0.88 -0.25 116.57 122.19 1pmm h LYS 446 Ca 0.16 -0.24 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1pmm h LYS 446 Cb 0.47 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1pmm h LYS 446 CO 0.02 0.90 -0.07 -0.92 -2.27 0.00 0.00 179.45 177.12 1pmm h TYR 447 N 0.89 -0.18 -0.51 1.91 3.20 -0.87 0.65 116.97 122.07 1pmm h TYR 447 Ca 0.19 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 62.17 1pmm h TYR 447 Cb 0.37 0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.68 1pmm h TYR 447 CO 0.03 -0.03 0.35 -0.07 -1.64 0.00 0.00 178.16 176.80 1pmm h LEU 448 N -0.28 0.15 -0.18 2.82 3.38 -0.94 -0.19 115.31 120.06 1pmm h LEU 448 Ca -0.02 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 1pmm h LEU 448 Cb 0.22 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1pmm h LEU 448 CO 0.03 0.09 -0.32 -1.28 0.09 0.00 0.00 178.44 177.05 1pmm h SER 449 N 0.16 0.60 0.00 -0.43 0.87 -0.19 -2.94 113.55 111.63 1pmm h SER 449 Ca 0.24 -0.54 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 1pmm h SER 449 Cb 0.74 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 1pmm h SER 449 CO -0.04 1.03 0.00 0.47 -0.53 0.00 0.00 176.83 177.76 1pmm n ASP 450 N -4.33 0.00 -3.06 6.23 8.00 0.14 -3.99 116.55 119.54 1pmm n ASP 450 Ca -0.06 -1.40 -0.18 0.00 0.71 0.00 0.00 54.79 53.86 1pmm n ASP 450 Cb 0.49 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.57 1pmm n ASP 450 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1pmm n HIS 451 N -0.78 -0.98 0.15 1.24 8.25 -0.25 -5.06 115.22 117.80 1pmm n HIS 451 Ca 0.13 -3.18 0.01 0.00 -0.26 0.00 0.00 57.72 54.43 1pmm n HIS 451 Cb 0.06 0.19 0.07 0.00 1.12 0.00 0.00 29.99 31.43 1pmm n HIS 451 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68