#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pmm h GLN 5 N 0.00 -0.60 -0.53 1.64 5.75 -2.05 -0.01 115.11 119.31 1pmm h GLN 5 Ca 0.00 0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.53 1pmm h GLN 5 Cb 0.00 0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 1pmm h GLN 5 CO 0.00 -0.40 0.28 0.28 -2.65 0.00 0.00 178.83 176.34 1pmm h VAL 6 N -0.62 1.17 -0.09 2.39 2.07 -2.05 -1.57 116.25 117.55 1pmm h VAL 6 Ca 0.02 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 1pmm h VAL 6 Cb 0.63 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1pmm h VAL 6 CO -0.18 0.19 0.04 0.74 0.02 0.00 0.00 177.57 178.38 1pmm h THR 7 N 0.74 1.12 -0.33 2.57 2.02 -1.84 -1.26 112.91 115.93 1pmm h THR 7 Ca 0.19 -0.35 -0.10 0.00 0.77 0.00 0.00 66.41 66.92 1pmm h THR 7 Cb 0.05 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1pmm h THR 7 CO -0.03 0.10 -0.20 0.44 0.37 0.00 0.00 175.52 176.20 1pmm h ASP 8 N 0.01 0.61 -0.73 4.18 3.32 -0.76 -2.72 116.42 120.33 1pmm h ASP 8 Ca 0.03 -0.20 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 1pmm h ASP 8 Cb 0.13 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1pmm h ASP 8 CO -0.00 0.82 0.25 0.25 -1.72 0.00 0.00 179.24 178.83 1pmm h LEU 9 N 0.55 1.05 -0.33 1.55 5.85 -1.09 0.68 115.31 123.56 1pmm h LEU 9 Ca 0.08 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.62 1pmm h LEU 9 Cb 0.65 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1pmm h LEU 9 CO 0.05 0.97 0.19 -0.09 -0.34 0.00 0.00 178.44 179.21 1pmm h ARG 10 N 1.08 0.38 -0.78 1.25 2.43 -0.98 -1.32 114.38 116.43 1pmm h ARG 10 Ca 0.24 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 1pmm h ARG 10 Cb 0.28 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 1pmm h ARG 10 CO -0.01 0.25 0.35 0.77 -1.51 0.00 0.00 179.97 179.82 1pmm h SER 11 N 0.39 1.04 -0.65 -3.80 0.02 -1.15 -1.09 113.55 108.30 1pmm h SER 11 Ca 0.13 -0.14 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1pmm h SER 11 Cb 0.01 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.25 1pmm h SER 11 CO -0.07 0.89 0.43 -0.33 -1.14 0.00 0.00 176.83 176.61 1pmm h GLU 12 N 1.12 0.77 0.12 3.45 5.08 -0.15 0.13 114.58 125.10 1pmm h GLU 12 Ca 0.27 -0.05 -0.23 0.00 -1.00 0.00 0.00 59.36 58.35 1pmm h GLU 12 Cb 0.15 -0.17 0.02 0.00 0.50 0.00 0.00 28.75 29.25 1pmm h GLU 12 CO -0.03 0.51 -0.99 1.25 -1.00 0.00 0.00 179.01 178.75 1pmm h LEU 13 N 0.80 0.66 0.00 1.33 5.85 -0.60 -3.40 115.31 119.96 1pmm h LEU 13 Ca 0.26 -0.87 -0.12 0.00 0.84 0.00 0.00 57.88 57.99 1pmm h LEU 13 Cb 0.04 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 1pmm h LEU 13 CO -0.07 1.47 -1.74 0.18 -0.34 0.00 0.00 178.44 177.94 1pmm n LEU 14 N -3.99 0.39 -4.68 2.25 4.77 -0.48 -4.99 117.00 110.28 1pmm n LEU 14 Ca -0.13 0.16 -0.39 0.00 -0.03 0.00 0.00 56.01 55.62 1pmm n LEU 14 Cb 0.88 0.11 0.04 0.00 -2.33 0.00 0.00 43.42 42.11 1pmm n LEU 14 CO 0.53 0.11 0.77 0.47 -1.33 0.00 0.00 177.39 177.93 1pmm n ASP 15 N -2.61 1.85 -4.83 -1.43 8.00 0.45 -4.99 116.55 112.99 1pmm n ASP 15 Ca -0.11 0.96 -0.30 0.00 0.71 0.00 0.00 54.79 56.05 1pmm n ASP 15 Cb 0.76 -1.47 0.08 0.00 -0.02 0.00 0.00 41.12 40.47 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 -0.92 4.71 0.25 -2.24 1.04 -1.26 -4.78 113.70 110.49 1pmm s SER 16 Ca 0.70 1.24 -0.05 0.00 0.48 0.00 0.00 55.95 58.32 1pmm s SER 16 Cb -0.46 -1.97 0.49 0.00 0.10 0.00 0.00 66.02 64.18 1pmm s SER 16 CO 0.51 -1.82 1.66 -0.09 0.98 0.00 0.00 173.24 174.48 1pmm h ARG 17 N -0.99 0.19 -0.00 4.02 2.43 -1.98 -1.25 114.38 116.80 1pmm h ARG 17 Ca -0.47 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1pmm h ARG 17 Cb 1.27 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1pmm h ARG 17 CO 0.61 0.12 -0.61 1.19 -1.51 0.00 0.00 179.97 179.77 1pmm n PHE 18 N -5.24 0.00 0.85 2.20 3.72 -1.26 -3.81 117.46 113.92 1pmm n PHE 18 Ca 0.15 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.66 1pmm n PHE 18 Cb 0.50 -0.18 0.08 0.00 -0.94 0.00 0.00 39.48 38.94 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 1.49 -1.18 3.75 1.37 0.00 -0.80 -4.93 105.19 104.89 1pmm n GLY 19 Ca 0.06 -0.43 -0.38 0.00 0.00 0.00 0.00 46.02 45.27 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 -3.07 2.85 0.20 4.61 0.00 -0.54 -4.84 121.76 120.97 1pmm s ALA 20 Ca 0.08 1.32 -0.09 0.00 0.00 0.00 0.00 51.96 53.26 1pmm s ALA 20 Cb 0.16 -3.56 0.12 0.00 0.00 0.00 0.00 23.12 19.84 1pmm s ALA 20 CO 0.77 -1.32 1.73 -0.22 0.00 0.00 0.00 175.76 176.73 1pmm h LYS 21 N 1.54 1.10 0.00 0.00 1.63 -1.91 -2.93 116.57 116.00 1pmm h LYS 21 Ca -0.51 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.06 1pmm h LYS 21 Cb 1.29 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.76 1pmm h LYS 21 CO 0.58 0.94 0.00 -1.13 -3.45 0.00 0.00 179.45 176.38 1pmm n SER 22 N -4.30 0.29 -0.90 4.20 3.41 -1.26 -1.68 113.62 113.38 1pmm n SER 22 Ca 0.05 0.61 0.07 0.00 -0.26 0.00 0.00 58.87 59.34 1pmm n SER 22 Cb 0.22 -0.65 0.22 0.00 -0.26 0.00 0.00 64.21 63.73 1pmm n SER 22 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pmm n ILE 23 N -1.86 1.33 1.44 -1.33 3.06 -1.10 -4.41 119.36 116.48 1pmm n ILE 23 Ca 0.01 -1.17 0.14 0.00 -2.50 0.00 0.00 62.75 59.22 1pmm n ILE 23 Cb 0.09 0.33 0.50 0.00 0.54 0.00 0.00 39.64 41.10 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 0.58 1.26 -4.49 9.51 3.41 -0.68 -4.92 113.62 118.29 1pmm n SER 24 Ca 0.17 -1.26 -0.24 0.00 -0.26 0.00 0.00 58.87 57.28 1pmm n SER 24 Cb 0.59 0.04 -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 -2.17 1.91 0.29 6.66 -4.23 -1.26 -5.13 115.64 111.72 1pmm s THR 25 Ca 0.34 -2.15 -0.28 0.00 -1.18 0.00 0.00 61.69 58.42 1pmm s THR 25 Cb 0.20 -2.59 -0.09 0.00 1.34 0.00 0.00 72.50 71.37 1pmm s THR 25 CO 0.40 -0.22 1.03 -0.63 -0.54 0.00 0.00 174.62 174.65 1pmm s ILE 26 N -2.83 3.77 0.46 2.99 1.01 -1.26 -5.00 121.20 120.34 1pmm s ILE 26 Ca 0.31 1.67 -0.25 0.00 0.00 0.00 0.00 60.65 62.38 1pmm s ILE 26 Cb 0.04 -4.02 -0.08 0.00 0.01 0.00 0.00 42.46 38.41 1pmm s ILE 26 CO 0.14 0.32 1.39 0.00 0.00 0.00 0.00 174.94 176.79 1pmm s ALA 27 N -1.30 3.18 0.48 9.38 0.00 -1.26 -4.95 121.76 127.29 1pmm s ALA 27 Ca 0.46 1.40 -0.24 0.00 0.00 0.00 0.00 51.96 53.58 1pmm s ALA 27 Cb -0.27 -3.57 -0.07 0.00 0.00 0.00 0.00 23.12 19.21 1pmm s ALA 27 CO 0.34 -1.15 1.42 -2.00 0.00 0.00 0.00 175.76 174.37 1pmm s GLU 28 N -2.49 3.54 0.00 0.00 2.56 -1.26 -4.92 118.70 116.14 1pmm s GLU 28 Ca 0.62 2.39 0.00 0.00 0.00 0.00 0.00 54.97 57.97 1pmm s GLU 28 Cb -0.42 -2.56 0.00 0.00 2.00 0.00 0.00 34.13 33.15 1pmm s GLU 28 CO 0.54 -0.92 0.00 -1.13 -0.56 0.00 0.00 175.26 173.18 1pmm n SER 29 N -0.41 0.00 -0.06 -1.70 3.41 -1.26 -4.95 113.62 108.65 1pmm n SER 29 Ca 0.06 -0.56 -0.10 0.00 -0.26 0.00 0.00 58.87 58.01 1pmm n SER 29 Cb 0.42 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.33 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 0.27 -4.28 4.33 5.02 -1.26 -5.08 118.16 117.15 1pmm n LYS 30 Ca 0.00 0.09 -0.15 0.00 -2.02 0.00 0.00 58.31 56.22 1pmm n LYS 30 Cb 0.14 -1.07 -0.10 0.00 -0.02 0.00 0.00 35.03 33.97 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 -2.22 1.17 0.25 1.97 0.52 -1.26 -5.11 118.95 114.26 1pmm s ARG 31 Ca -0.16 -1.54 -0.31 0.00 -0.52 0.00 0.00 55.73 53.20 1pmm s ARG 31 Cb 0.05 -0.66 -0.12 0.00 0.52 0.00 0.00 34.95 34.74 1pmm s ARG 31 CO 0.24 0.03 1.67 0.34 0.02 0.00 0.00 175.30 177.59 1pmm n PHE 32 N -0.29 2.80 -1.45 -0.53 7.35 -1.26 -4.93 117.46 119.16 1pmm n PHE 32 Ca -0.08 0.13 -0.35 0.00 -0.76 0.00 0.00 57.45 56.39 1pmm n PHE 32 Cb 0.62 -2.64 0.10 0.00 0.35 0.00 0.00 39.48 37.90 1pmm n PHE 32 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 1pmm s PRO 33 N 0.44 2.12 -0.15 -7.13 0.02 -1.26 -4.97 135.00 124.07 1pmm s PRO 33 Ca 0.70 1.90 -0.20 0.00 0.02 0.00 0.00 61.00 63.42 1pmm s PRO 33 Cb -0.50 -1.81 -0.17 0.00 0.02 0.00 0.00 34.50 32.03 1pmm s PRO 33 CO 0.39 -1.88 0.38 1.25 -0.33 0.00 0.00 177.00 176.81 1pmm h LEU 34 N -0.15 0.00-10.23 -5.54 5.85 -2.07 -3.48 115.31 99.68 1pmm h LEU 34 Ca -0.49 -0.59 -0.46 0.00 0.84 0.00 0.00 57.88 57.19 1pmm h LEU 34 Cb 1.32 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 1pmm h LEU 34 CO 0.50 1.04 -0.38 -1.00 -0.34 0.00 0.00 178.44 178.26 1pmm s HIS 35 N -2.16 3.12 0.68 1.25 3.76 -1.26 -5.11 115.29 115.57 1pmm s HIS 35 Ca -0.18 -0.20 -0.11 0.00 -0.15 0.00 0.00 55.06 54.41 1pmm s HIS 35 Cb 0.01 -1.87 -0.00 0.00 1.11 0.00 0.00 32.58 31.82 1pmm s HIS 35 CO 0.50 0.11 1.06 -1.21 -0.85 0.00 0.00 174.74 174.35 1pmm s GLU 36 N -4.10 3.11 0.19 1.40 2.02 -1.26 -5.08 118.70 114.99 1pmm s GLU 36 Ca 0.42 0.80 -0.05 0.00 0.02 0.00 0.00 54.97 56.16 1pmm s GLU 36 Cb -0.09 -2.02 -0.03 0.00 0.10 0.00 0.00 34.13 32.10 1pmm s GLU 36 CO 0.30 -0.93 0.23 0.00 0.02 0.00 0.00 175.26 174.87 1pmm s MET 37 N -5.14 1.22 0.20 1.61 0.23 -1.26 -5.12 119.30 111.05 1pmm s MET 37 Ca 0.57 -1.42 -0.32 0.00 -1.03 0.00 0.00 55.69 53.48 1pmm s MET 37 Cb -0.13 0.33 -0.13 0.00 -1.53 0.00 0.00 34.83 33.38 1pmm s MET 37 CO 0.54 -0.43 1.61 0.54 -2.03 0.00 0.00 175.02 175.25 1pmm n ARG 38 N -0.25 2.44 0.14 3.16 1.74 -1.26 -4.87 116.66 117.76 1pmm n ARG 38 Ca -0.02 0.88 0.03 0.00 -0.77 0.00 0.00 57.85 57.97 1pmm n ARG 38 Cb 0.64 -2.66 0.41 0.00 -1.02 0.00 0.00 32.46 29.82 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 5.89 0.17 0.11 0.55 3.04 -1.99 -2.03 116.42 122.15 1pmm h ASP 39 Ca -0.44 -0.04 -0.13 0.00 -3.24 0.00 0.00 57.03 53.18 1pmm h ASP 39 Cb 1.23 -0.04 -0.01 0.00 -1.04 0.00 0.00 39.33 39.47 1pmm h ASP 39 CO 0.89 0.35 -0.47 -2.24 -2.04 0.00 0.00 179.24 175.73 1pmm h ASP 40 N 0.17 0.46 -0.16 4.15 2.03 -1.99 -1.37 116.42 119.71 1pmm h ASP 40 Ca 0.03 -0.22 -0.10 0.00 -0.73 0.00 0.00 57.03 56.01 1pmm h ASP 40 Cb 0.39 -0.13 0.00 0.00 -0.83 0.00 0.00 39.33 38.76 1pmm h ASP 40 CO 0.02 0.86 -0.31 0.58 -1.03 0.00 0.00 179.24 179.37 1pmm h VAL 41 N 0.34 1.35 -0.40 4.15 2.07 -1.84 -1.03 116.25 120.89 1pmm h VAL 41 Ca 0.02 -1.56 0.03 0.00 0.82 0.00 0.00 66.70 66.01 1pmm h VAL 41 Cb 0.96 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.66 1pmm h VAL 41 CO 0.08 0.47 0.20 0.00 0.02 0.00 0.00 177.57 178.34 1pmm h ALA 42 N 0.57 0.50 -0.33 1.67 0.00 -1.29 -1.29 119.26 119.09 1pmm h ALA 42 Ca 0.01 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1pmm h ALA 42 Cb 0.90 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1pmm h ALA 42 CO 0.07 -0.16 0.10 0.35 0.00 0.00 0.00 179.25 179.61 1pmm h PHE 43 N 0.41 0.53 -0.46 0.00 3.57 -1.24 -2.92 116.94 116.83 1pmm h PHE 43 Ca 0.17 -0.06 0.04 0.00 3.53 0.00 0.00 57.97 61.65 1pmm h PHE 43 Cb 0.07 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 1pmm h PHE 43 CO -0.10 0.54 0.23 0.37 -2.23 0.00 0.00 178.31 177.12 1pmm h GLN 44 N 0.37 0.45 -0.27 1.11 5.75 -0.84 0.53 115.11 122.21 1pmm h GLN 44 Ca 0.10 -0.03 0.03 0.00 -0.15 0.00 0.00 58.65 58.61 1pmm h GLN 44 Cb 0.26 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 1pmm h GLN 44 CO -0.00 0.30 0.09 0.82 -2.65 0.00 0.00 178.83 177.38 1pmm h ILE 45 N 0.46 0.93 -0.25 2.39 2.04 -1.22 -0.65 117.51 121.22 1pmm h ILE 45 Ca 0.20 -0.07 -0.09 0.00 1.00 0.00 0.00 64.86 65.90 1pmm h ILE 45 Cb 0.09 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1pmm h ILE 45 CO -0.13 0.04 -0.19 0.40 0.00 0.00 0.00 178.15 178.27 1pmm h ILE 46 N 0.21 1.31 -0.70 -0.67 2.04 -1.31 -2.00 117.51 116.39 1pmm h ILE 46 Ca 0.12 -1.32 0.10 0.00 1.00 0.00 0.00 64.86 64.75 1pmm h ILE 46 Cb 0.09 1.62 -0.07 0.00 -0.74 0.00 0.00 36.82 37.71 1pmm h ILE 46 CO -0.12 0.41 0.34 -1.13 0.00 0.00 0.00 178.15 177.64 1pmm h ASN 47 N 0.28 0.42 -0.23 1.72 -1.24 -0.75 -2.31 115.58 113.47 1pmm h ASN 47 Ca 0.05 0.07 -0.07 0.00 0.71 0.00 0.00 56.30 57.06 1pmm h ASN 47 Cb 0.73 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.77 1pmm h ASN 47 CO 0.05 0.23 -0.12 0.44 -1.29 0.00 0.00 177.43 176.74 1pmm h ASP 48 N 0.56 0.50 0.78 1.15 3.32 -0.98 -3.03 116.42 118.73 1pmm h ASP 48 Ca 0.35 -0.42 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 1pmm h ASP 48 Cb 0.40 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 1pmm h ASP 48 CO -0.29 0.81 -0.00 1.05 -1.72 0.00 0.00 179.24 179.09 1pmm h GLU 49 N 0.20 0.00 0.00 3.56 4.11 -1.09 -1.67 114.58 119.68 1pmm h GLU 49 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.48 1pmm h GLU 49 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1pmm h GLU 49 CO 0.04 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.40 1pmm n LEU 50 N -3.09 0.29 0.16 3.06 4.77 -0.89 -1.23 117.00 120.06 1pmm n LEU 50 Ca -0.00 0.58 0.13 0.00 -0.03 0.00 0.00 56.01 56.68 1pmm n LEU 50 Cb 0.25 -0.55 0.55 0.00 -2.33 0.00 0.00 43.42 41.34 1pmm n LEU 50 CO 0.25 -0.43 0.88 1.88 -1.33 0.00 0.00 177.39 178.65 1pmm h TYR 51 N 0.00 0.00 0.00 -1.77 0.05 -1.38 -1.72 116.97 112.15 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 0.26 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.00 1pmm h TYR 51 CO 0.00 0.00 0.00 1.28 -1.05 0.00 0.00 178.16 178.39 1pmm n LEU 52 N -2.38 0.00 -4.88 3.88 7.99 -0.37 -4.75 117.00 116.50 1pmm n LEU 52 Ca 0.01 0.29 -0.30 0.00 -0.01 0.00 0.00 56.01 56.00 1pmm n LEU 52 Cb 0.22 -0.29 -0.00 0.00 -0.11 0.00 0.00 43.42 43.24 1pmm n LEU 52 CO 0.20 -0.01 0.62 -1.81 -1.51 0.00 0.00 177.39 174.87 1pmm s ASP 53 N -2.58 6.31 0.44 -1.43 1.01 -0.65 -5.03 116.67 114.74 1pmm s ASP 53 Ca 0.27 1.28 -0.21 0.00 0.71 0.00 0.00 52.55 54.60 1pmm s ASP 53 Cb 0.20 -2.40 -0.10 0.00 1.01 0.00 0.00 42.92 41.63 1pmm s ASP 53 CO 0.45 -0.72 1.00 -0.83 0.21 0.00 0.00 175.17 175.28 1pmm s GLY 54 N -3.95 2.51 -0.05 0.21 0.00 -1.26 -4.95 107.32 99.84 1pmm s GLY 54 Ca 0.53 0.53 -0.30 0.00 0.00 0.00 0.00 44.72 45.48 1pmm s GLY 54 CO 0.47 0.85 1.92 0.21 0.00 0.00 0.00 173.10 176.55 1pmm s ASN 55 N -1.99 6.31 0.28 1.64 3.84 -1.26 -4.87 114.94 118.89 1pmm s ASN 55 Ca 0.63 2.37 0.01 0.00 0.21 0.00 0.00 52.86 56.07 1pmm s ASN 55 Cb -0.14 -2.53 0.53 0.00 -0.55 0.00 0.00 41.25 38.56 1pmm s ASN 55 CO 0.18 -1.20 1.85 0.00 -2.79 0.00 0.00 177.10 175.14 1pmm h ALA 56 N 11.17 1.50 0.00 1.71 0.00 -1.93 -0.67 119.26 131.05 1pmm h ALA 56 Ca -0.45 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1pmm h ALA 56 Cb 1.22 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1pmm h ALA 56 CO 0.95 0.28 -0.05 0.00 0.00 0.00 0.00 179.25 180.42 1pmm h ARG 57 N 1.03 0.00 -0.02 0.00 2.47 -1.89 -1.67 114.38 114.30 1pmm h ARG 57 Ca 0.48 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.20 1pmm h ARG 57 Cb 0.41 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 1pmm h ARG 57 CO -0.24 0.05 -0.30 1.04 0.56 0.00 0.00 179.97 181.09 1pmm n GLN 58 N -3.27 1.56 -2.56 0.04 6.02 -0.33 -4.81 117.38 114.03 1pmm n GLN 58 Ca -0.01 -1.27 -0.41 0.00 -0.01 0.00 0.00 57.00 55.30 1pmm n GLN 58 Cb 0.24 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 30.00 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 -2.31 6.23 0.00 1.08 3.84 -0.63 -2.03 114.94 121.12 1pmm s ASN 59 Ca 0.23 -0.31 0.20 0.00 0.21 0.00 0.00 52.86 53.18 1pmm s ASN 59 Cb 0.19 -2.56 0.57 0.00 -0.55 0.00 0.00 41.25 38.90 1pmm s ASN 59 CO 0.47 -1.75 1.47 0.18 -2.79 0.00 0.00 177.10 174.69 1pmm n LEU 60 N 9.13 3.43 -0.03 3.21 4.77 -0.26 -4.15 117.00 133.11 1pmm n LEU 60 Ca 0.04 -1.71 -0.12 0.00 -0.03 0.00 0.00 56.01 54.19 1pmm n LEU 60 Cb 0.49 -0.42 -0.14 0.00 -2.33 0.00 0.00 43.42 41.01 1pmm n LEU 60 CO 0.71 0.85 -0.72 0.00 -1.33 0.00 0.00 177.39 176.90 1pmm n ALA 61 N 1.38 1.34 -1.77 -1.18 0.00 -1.12 -1.54 120.51 117.61 1pmm n ALA 61 Ca 0.21 -0.82 -0.33 0.00 0.00 0.00 0.00 53.44 52.50 1pmm n ALA 61 Cb 0.54 -0.68 -0.03 0.00 0.00 0.00 0.00 19.45 19.28 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 -2.57 3.95 -0.71 0.00 -1.32 -1.26 -4.90 115.64 108.83 1pmm s THR 62 Ca -0.11 1.11 0.20 0.00 -1.21 0.00 0.00 61.69 61.67 1pmm s THR 62 Cb 0.07 -3.48 -0.24 0.00 -1.51 0.00 0.00 72.50 67.35 1pmm s THR 62 CO 0.80 -0.37 0.74 0.49 -2.21 0.00 0.00 174.62 174.08 1pmm n PHE 63 N -1.26 0.00 -2.53 9.09 3.01 -1.26 -4.84 117.46 119.67 1pmm n PHE 63 Ca 0.09 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.23 1pmm n PHE 63 Cb 0.53 -0.11 -0.04 0.00 -0.01 0.00 0.00 39.48 39.85 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 -1.45 2.44 -0.02 0.00 1.13 0.07 -4.88 117.38 114.66 1pmm n GLN 65 Ca 0.06 0.87 0.03 0.00 -1.94 0.00 0.00 57.00 56.02 1pmm n GLN 65 Cb 0.54 -2.64 0.04 0.00 0.11 0.00 0.00 30.24 28.29 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 2.79 1.24 -3.69 5.09 -2.24 -1.26 -4.75 114.28 111.45 1pmm n THR 66 Ca 0.13 -1.36 -0.14 0.00 -2.27 0.00 0.00 64.05 60.41 1pmm n THR 66 Cb 0.33 0.29 -0.09 0.00 -2.10 0.00 0.00 70.33 68.76 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 -1.54 -0.45 -0.02 4.78 -0.00 -1.26 -4.59 118.94 115.86 1pmm s TRP 67 Ca 0.10 0.98 -0.04 0.00 -0.00 0.00 0.00 56.10 57.13 1pmm s TRP 67 Cb 0.08 0.19 0.00 0.00 -0.00 0.00 0.00 33.47 33.75 1pmm s TRP 67 CO 0.01 -0.35 0.09 -0.51 -0.00 0.00 0.00 176.95 176.19 1pmm s ASP 68 N -0.41 -0.01 0.89 5.86 1.01 -1.26 -4.98 116.67 117.77 1pmm s ASP 68 Ca -0.05 -0.04 -0.12 0.00 0.71 0.00 0.00 52.55 53.04 1pmm s ASP 68 Cb -0.03 0.19 0.12 0.00 1.01 0.00 0.00 42.92 44.21 1pmm s ASP 68 CO 0.03 -0.18 1.13 1.51 0.21 0.00 0.00 175.17 177.87 1pmm s ASP 69 N -0.64 3.74 0.38 0.27 1.47 -1.26 -4.81 116.67 115.81 1pmm s ASP 69 Ca -0.07 1.00 0.09 0.00 1.18 0.00 0.00 52.55 54.75 1pmm s ASP 69 Cb -0.04 -1.59 0.85 0.00 -0.34 0.00 0.00 42.92 41.79 1pmm s ASP 69 CO 0.00 -2.41 1.93 -0.08 0.68 0.00 0.00 175.17 175.29 1pmm h GLU 70 N -1.40 0.62 -0.07 2.11 4.81 -2.01 -1.67 114.58 116.97 1pmm h GLU 70 Ca -0.50 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 58.59 1pmm h GLU 70 Cb 1.32 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 1pmm h GLU 70 CO 0.62 0.41 -0.44 -0.91 -0.73 0.00 0.00 179.01 177.95 1pmm h ASN 71 N 0.64 0.18 -0.06 1.04 2.35 -1.99 -1.30 115.58 116.43 1pmm h ASN 71 Ca 0.35 -0.08 -0.20 0.00 -0.55 0.00 0.00 56.30 55.82 1pmm h ASN 71 Cb 0.51 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.84 1pmm h ASN 71 CO -0.13 0.60 -0.71 0.58 -1.65 0.00 0.00 177.43 176.12 1pmm h VAL 72 N 0.14 1.30 -0.54 2.81 2.07 -1.68 0.82 116.25 121.17 1pmm h VAL 72 Ca 0.01 -1.96 0.01 0.00 0.82 0.00 0.00 66.70 65.58 1pmm h VAL 72 Cb 0.84 1.94 -0.03 0.00 -1.52 0.00 0.00 31.29 32.52 1pmm h VAL 72 CO 0.07 0.61 0.35 0.45 0.02 0.00 0.00 177.57 179.07 1pmm h HIS 73 N 0.49 0.66 -0.00 1.57 3.86 -1.14 0.61 115.15 121.20 1pmm h HIS 73 Ca -0.03 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1pmm h HIS 73 Cb 1.32 -0.22 -0.00 0.00 1.06 0.00 0.00 27.41 29.57 1pmm h HIS 73 CO 0.07 0.41 0.00 0.87 0.86 0.00 0.00 177.93 180.14 1pmm h LYS 74 N 0.71 0.00 -0.98 2.45 1.57 -1.06 -1.67 116.57 117.59 1pmm h LYS 74 Ca 0.20 -0.00 0.06 0.00 -1.87 0.00 0.00 60.65 59.04 1pmm h LYS 74 Cb -0.06 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.19 1pmm h LYS 74 CO -0.06 0.16 0.64 -0.07 -0.57 0.00 0.00 179.45 179.55 1pmm h LEU 75 N -0.15 1.03 -0.38 2.94 3.38 -0.55 0.45 115.31 122.02 1pmm h LEU 75 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1pmm h LEU 75 Cb 0.16 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1pmm h LEU 75 CO -0.00 0.67 -0.05 0.24 0.09 0.00 0.00 178.44 179.39 1pmm h MET 76 N 1.17 0.70 -0.37 1.13 2.86 -0.74 -1.26 114.93 118.44 1pmm h MET 76 Ca 0.41 -0.25 -0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1pmm h MET 76 Cb 0.12 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1pmm h MET 76 CO -0.15 0.83 -0.11 0.22 1.06 0.00 0.00 176.91 178.76 1pmm h ASP 77 N 0.51 0.62 0.51 1.22 3.58 -0.69 -0.93 116.42 121.24 1pmm h ASP 77 Ca 0.10 -0.17 -0.10 0.00 0.42 0.00 0.00 57.03 57.29 1pmm h ASP 77 Cb 0.54 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.42 1pmm h ASP 77 CO 0.03 0.76 -0.46 -0.07 -2.88 0.00 0.00 179.24 176.62 1pmm h LEU 78 N 0.58 0.00 -2.57 2.28 3.38 -0.76 -3.10 115.31 115.13 1pmm h LEU 78 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1pmm h LEU 78 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1pmm h LEU 78 CO 0.03 0.46 0.00 -1.20 0.09 0.00 0.00 178.44 177.82 1pmm n SER 79 N -3.92 3.59 -0.20 -0.43 7.64 -0.49 -4.60 113.62 115.21 1pmm n SER 79 Ca -0.01 -1.98 0.30 0.00 1.01 0.00 0.00 58.87 58.19 1pmm n SER 79 Cb 0.49 -0.35 0.72 0.00 -1.01 0.00 0.00 64.21 64.06 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 4.02 0.38 -0.15 0.44 2.10 -1.10 -0.90 117.51 122.30 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 0.94 0.44 0.00 0.00 -1.09 0.00 0.00 36.82 37.12 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 -4.01 2.70 -4.62 2.19 3.02 -1.26 -4.91 115.26 108.37 1pmm n ASN 81 Ca 0.20 -2.43 -0.41 0.00 -0.03 0.00 0.00 54.58 51.92 1pmm n ASN 81 Cb 1.09 -0.26 -0.06 0.00 -0.61 0.00 0.00 39.78 39.95 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 -1.75 4.07 -0.44 3.52 1.02 -0.34 -5.02 119.74 120.79 1pmm s LYS 82 Ca 0.21 0.57 -0.24 0.00 0.02 0.00 0.00 55.97 56.53 1pmm s LYS 82 Cb 0.16 -3.67 0.02 0.00 -0.52 0.00 0.00 37.83 33.82 1pmm s LYS 82 CO 0.07 -0.49 0.86 1.21 -0.92 0.00 0.00 175.35 176.08 1pmm s ASN 83 N 1.50 6.48 0.38 2.83 3.84 -1.26 -1.24 114.94 127.47 1pmm s ASN 83 Ca 0.28 0.08 0.15 0.00 0.21 0.00 0.00 52.86 53.58 1pmm s ASN 83 Cb -0.15 -2.42 1.00 0.00 -0.55 0.00 0.00 41.25 39.13 1pmm s ASN 83 CO 0.09 -0.96 1.80 -0.25 -2.79 0.00 0.00 177.10 174.99 1pmm h TRP 84 N 8.96 0.72 0.00 0.43 7.01 -0.80 -2.41 115.95 129.87 1pmm h TRP 84 Ca -0.24 0.02 -0.13 0.00 2.11 0.00 0.00 58.89 60.66 1pmm h TRP 84 Cb 1.08 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.91 1pmm h TRP 84 CO 0.84 0.14 -0.60 0.97 -2.79 0.00 0.00 178.44 177.00 1pmm h ILE 85 N 0.50 1.32 -0.95 2.65 6.09 -1.76 -3.39 117.51 121.96 1pmm h ILE 85 Ca 0.55 -2.13 -0.70 0.00 -1.37 0.00 0.00 64.86 61.21 1pmm h ILE 85 Cb 1.22 2.18 -0.09 0.00 0.47 0.00 0.00 36.82 40.60 1pmm h ILE 85 CO -0.27 0.59 2.22 0.47 -3.07 0.00 0.00 178.15 178.08 1pmm n ASP 86 N -3.67 4.82 -0.19 2.19 8.00 -0.91 -4.81 116.55 121.98 1pmm n ASP 86 Ca -0.01 -2.92 0.07 0.00 0.71 0.00 0.00 54.79 52.64 1pmm n ASP 86 Cb 0.63 -1.70 0.36 0.00 -0.02 0.00 0.00 41.12 40.39 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 7.17 0.72 0.00 -1.24 1.79 -1.83 -0.74 116.57 122.44 1pmm h LYS 87 Ca 0.45 -0.04 -0.17 0.00 -2.18 0.00 0.00 60.65 58.71 1pmm h LYS 87 Cb 0.82 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 31.29 1pmm h LYS 87 CO 1.50 0.48 -0.86 1.49 -1.08 0.00 0.00 179.45 180.97 1pmm h GLU 88 N 0.74 0.00 0.07 3.15 4.57 -1.87 -2.67 114.58 118.56 1pmm h GLU 88 Ca 0.33 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 58.24 1pmm h GLU 88 Cb 0.33 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.90 1pmm h GLU 88 CO -0.12 0.70 -1.33 0.93 -1.18 0.00 0.00 179.01 178.01 1pmm h GLU 89 N 0.00 0.14 -2.16 1.92 5.08 -1.84 -3.36 114.58 114.36 1pmm h GLU 89 Ca -0.04 -0.24 -0.57 0.00 -1.00 0.00 0.00 59.36 57.51 1pmm h GLU 89 Cb 1.61 0.09 -0.41 0.00 0.50 0.00 0.00 28.75 30.54 1pmm h GLU 89 CO 0.09 1.02 -0.81 0.66 -1.00 0.00 0.00 179.01 178.97 1pmm n TYR 90 N -3.38 2.50 0.20 4.33 4.01 -0.33 -4.95 117.16 119.53 1pmm n TYR 90 Ca -0.10 -3.94 0.08 0.00 -0.16 0.00 0.00 57.90 53.78 1pmm n TYR 90 Cb 1.01 -0.48 0.60 0.00 -0.31 0.00 0.00 39.34 40.16 1pmm n TYR 90 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1pmm h PRO 91 N 3.51 0.10 0.14 -0.72 0.13 -1.63 -2.32 132.00 131.21 1pmm h PRO 91 Ca 0.14 -0.01 -0.28 0.00 -0.87 0.00 0.00 66.00 64.98 1pmm h PRO 91 Cb 0.70 -0.02 0.01 0.00 0.13 0.00 0.00 31.00 31.81 1pmm h PRO 91 CO 0.71 0.07 -1.27 0.37 -0.23 0.00 0.00 178.00 177.64 1pmm h GLN 92 N 0.11 0.30 -0.81 0.86 5.75 -1.93 -1.48 115.11 117.91 1pmm h GLN 92 Ca 0.04 -0.51 0.01 0.00 -0.15 0.00 0.00 58.65 58.03 1pmm h GLN 92 Cb 0.03 0.19 -0.04 0.00 1.07 0.00 0.00 27.48 28.73 1pmm h GLN 92 CO -0.01 1.24 0.53 0.77 -2.65 0.00 0.00 178.83 178.72 1pmm h SER 93 N 0.08 0.94 -0.46 -0.69 0.02 -1.88 0.60 113.55 112.17 1pmm h SER 93 Ca -0.15 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.73 1pmm h SER 93 Cb 1.99 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 64.28 1pmm h SER 93 CO 0.21 0.69 0.15 0.00 -1.14 0.00 0.00 176.83 176.74 1pmm h ALA 94 N 1.29 0.60 -0.62 3.77 0.00 -1.36 -1.58 119.26 121.36 1pmm h ALA 94 Ca 0.30 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1pmm h ALA 94 Cb -0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1pmm h ALA 94 CO -0.06 0.24 0.39 0.00 0.00 0.00 0.00 179.25 179.81 1pmm h ALA 95 N 1.00 0.79 -0.93 0.00 0.00 -0.63 -1.30 119.26 118.19 1pmm h ALA 95 Ca 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1pmm h ALA 95 Cb 0.26 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1pmm h ALA 95 CO -0.01 0.25 0.56 0.82 0.00 0.00 0.00 179.25 180.88 1pmm h ILE 96 N 0.84 1.25 -0.44 0.00 2.04 -0.68 -1.83 117.51 118.69 1pmm h ILE 96 Ca 0.22 -0.55 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 1pmm h ILE 96 Cb -0.05 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 35.95 1pmm h ILE 96 CO -0.04 0.27 0.27 -0.78 0.00 0.00 0.00 178.15 177.87 1pmm h ASP 97 N 1.28 0.52 0.21 1.72 1.82 -0.64 -2.43 116.42 118.90 1pmm h ASP 97 Ca 0.33 -0.04 -0.04 0.00 -0.39 0.00 0.00 57.03 56.89 1pmm h ASP 97 Cb -0.06 -0.13 -0.01 0.00 0.68 0.00 0.00 39.33 39.81 1pmm h ASP 97 CO -0.06 0.41 -0.20 -0.07 -1.61 0.00 0.00 179.24 177.71 1pmm h LEU 98 N 0.59 0.00 -0.41 2.28 3.38 -0.60 -1.74 115.31 118.81 1pmm h LEU 98 Ca 0.16 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 1pmm h LEU 98 Cb -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1pmm h LEU 98 CO -0.03 0.20 -0.17 0.03 0.09 0.00 0.00 178.44 178.56 1pmm h ARG 99 N 0.00 0.84 -0.72 1.13 3.08 -0.93 -2.40 114.38 115.38 1pmm h ARG 99 Ca -0.00 -0.36 -0.00 0.00 0.07 0.00 0.00 59.98 59.69 1pmm h ARG 99 Cb 0.36 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.35 1pmm h ARG 99 CO 0.03 0.99 0.43 0.00 -1.07 0.00 0.00 179.97 180.35 1pmm h VAL 101 N 0.98 0.94 -0.18 0.00 2.07 -1.15 0.48 116.25 119.39 1pmm h VAL 101 Ca 0.26 -0.20 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1pmm h VAL 101 Cb -0.03 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1pmm h VAL 101 CO -0.05 0.11 0.10 0.78 0.02 0.00 0.00 177.57 178.53 1pmm h ASN 102 N 0.58 0.22 -0.79 0.57 2.35 -0.86 -1.40 115.58 116.26 1pmm h ASN 102 Ca 0.27 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 1pmm h ASN 102 Cb 0.18 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 38.46 1pmm h ASN 102 CO -0.18 0.22 0.41 0.24 -1.65 0.00 0.00 177.43 176.47 1pmm h MET 103 N 0.20 1.11 -0.32 0.81 2.86 -0.50 0.05 114.93 119.14 1pmm h MET 103 Ca 0.06 -0.14 -0.16 0.00 -2.06 0.00 0.00 59.70 57.41 1pmm h MET 103 Cb 0.04 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 31.49 1pmm h MET 103 CO -0.01 0.84 -0.41 0.28 1.06 0.00 0.00 176.91 178.67 1pmm h VAL 104 N 1.10 1.28 -0.64 -2.22 2.07 -0.84 -0.96 116.25 116.04 1pmm h VAL 104 Ca 0.27 -1.59 0.01 0.00 0.82 0.00 0.00 66.70 66.22 1pmm h VAL 104 Cb 0.07 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 1pmm h VAL 104 CO -0.04 0.52 0.41 0.00 0.02 0.00 0.00 177.57 178.48 1pmm h ALA 105 N 0.72 0.82 -0.39 1.67 0.00 -0.97 -1.47 119.26 119.64 1pmm h ALA 105 Ca 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1pmm h ALA 105 Cb 1.00 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1pmm h ALA 105 CO 0.10 0.21 0.21 0.22 0.00 0.00 0.00 179.25 179.98 1pmm h ASP 106 N 0.83 0.49 -0.73 0.00 3.58 -0.85 -0.32 116.42 119.43 1pmm h ASP 106 Ca 0.24 -0.10 0.10 0.00 0.42 0.00 0.00 57.03 57.70 1pmm h ASP 106 Cb -0.05 -0.13 -0.05 0.00 1.72 0.00 0.00 39.33 40.82 1pmm h ASP 106 CO -0.07 0.45 0.48 0.25 -2.88 0.00 0.00 179.24 177.46 1pmm h LEU 107 N 0.50 0.55 -2.77 2.28 5.85 -0.54 -1.07 115.31 120.11 1pmm h LEU 107 Ca 0.14 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1pmm h LEU 107 Cb 0.07 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1pmm h LEU 107 CO -0.02 0.33 0.00 0.79 -0.34 0.00 0.00 178.44 179.19 1pmm n TRP 108 N -4.49 1.42 -2.74 1.25 8.01 -0.61 -4.93 117.44 115.34 1pmm n TRP 108 Ca 0.12 -0.52 -0.21 0.00 -1.31 0.00 0.00 57.50 55.58 1pmm n TRP 108 Cb 0.35 -0.33 0.01 0.00 -2.01 0.00 0.00 31.31 29.34 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 0.64 -1.52 -2.12 -5.99 8.25 -0.40 -2.59 115.22 111.48 1pmm n HIS 109 Ca 0.21 0.26 -0.39 0.00 -0.26 0.00 0.00 57.72 57.54 1pmm n HIS 109 Cb 0.87 -4.01 -0.00 0.00 1.12 0.00 0.00 29.99 27.97 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 -3.05 3.13 0.18 -1.41 0.00 -0.18 -4.49 121.76 115.94 1pmm s ALA 110 Ca 0.16 1.12 -0.33 0.00 0.00 0.00 0.00 51.96 52.91 1pmm s ALA 110 Cb -0.07 -3.45 -0.15 0.00 0.00 0.00 0.00 23.12 19.45 1pmm s ALA 110 CO 0.20 -0.78 1.38 -2.30 0.00 0.00 0.00 175.76 174.26 1pmm n PRO 111 N -0.12 1.70 -1.67 0.00 -0.02 -1.26 -4.77 135.00 128.86 1pmm n PRO 111 Ca 0.05 0.61 -0.49 0.00 -2.02 0.00 0.00 63.50 61.66 1pmm n PRO 111 Cb 0.45 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.63 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 2.29 0.79 -2.23 3.55 0.00 -1.26 -4.89 120.51 118.76 1pmm n ALA 112 Ca 0.15 0.39 -0.42 0.00 0.00 0.00 0.00 53.44 53.55 1pmm n ALA 112 Cb 0.27 -2.37 -0.03 0.00 0.00 0.00 0.00 19.45 17.32 1pmm n ALA 112 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1pmm s PRO 113 N 2.32 4.27 0.31 0.00 0.04 -1.26 -4.92 135.00 135.76 1pmm s PRO 113 Ca 0.86 1.95 0.01 0.00 0.04 0.00 0.00 61.00 63.86 1pmm s PRO 113 Cb -0.75 -3.65 0.50 0.00 0.04 0.00 0.00 34.50 30.65 1pmm s PRO 113 CO 0.47 -0.62 1.88 1.57 0.04 0.00 0.00 177.00 180.34 1pmm h LYS 114 N 8.08 0.76 -0.18 4.56 2.10 -1.91 -1.51 116.57 128.47 1pmm h LYS 114 Ca -0.37 -0.13 0.00 0.00 -2.00 0.00 0.00 60.65 58.16 1pmm h LYS 114 Cb 1.17 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.37 1pmm h LYS 114 CO 0.92 0.65 0.00 0.27 -2.00 0.00 0.00 179.45 179.29 1pmm n ASN 115 N -4.32 1.15 -0.00 7.07 6.94 -1.26 -4.90 115.26 119.94 1pmm n ASN 115 Ca 0.04 -1.85 -0.00 0.00 -0.02 0.00 0.00 54.58 52.75 1pmm n ASN 115 Cb 0.19 -0.12 -0.00 0.00 -2.36 0.00 0.00 39.78 37.49 1pmm n ASN 115 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1pmm n GLY 116 N 0.92 0.41 2.74 4.83 0.00 -0.57 -5.01 105.19 108.51 1pmm n GLY 116 Ca 0.11 -0.01 -0.25 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 -0.40 0.54 0.67 1.61 2.00 -1.26 -4.99 119.66 117.83 1pmm s GLN 117 Ca 0.00 -0.09 -0.15 0.00 -2.00 0.00 0.00 55.36 53.12 1pmm s GLN 117 Cb 0.00 -1.44 0.01 0.00 0.80 0.00 0.00 33.01 32.38 1pmm s GLN 117 CO 0.00 -0.46 1.15 0.00 -0.50 0.00 0.00 175.29 175.48 1pmm s ALA 118 N 1.96 2.37 -0.33 1.58 0.00 -1.26 -4.85 121.76 121.23 1pmm s ALA 118 Ca 0.03 0.70 -0.22 0.00 0.00 0.00 0.00 51.96 52.47 1pmm s ALA 118 Cb -0.14 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.60 1pmm s ALA 118 CO -0.06 -1.43 0.70 0.08 0.00 0.00 0.00 175.76 175.04 1pmm s VAL 119 N -2.15 4.85 0.00 0.00 1.01 -1.26 -4.86 120.40 117.99 1pmm s VAL 119 Ca 0.70 0.87 0.00 0.00 0.00 0.00 0.00 61.98 63.55 1pmm s VAL 119 Cb -0.24 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.05 1pmm s VAL 119 CO 0.41 -0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.85 1pmm n GLY 120 N 4.45 -0.42 3.40 4.51 0.00 -1.26 -1.18 105.19 114.69 1pmm n GLY 120 Ca 0.01 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.80 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 0.03 0.44 2.61 -1.32 -0.47 -5.01 115.64 109.92 1pmm s THR 121 Ca 0.00 -0.22 -0.15 0.00 -1.21 0.00 0.00 61.69 60.12 1pmm s THR 121 Cb 0.00 -1.01 -0.08 0.00 -1.51 0.00 0.00 72.50 69.90 1pmm s THR 121 CO 0.00 -0.12 0.87 0.21 -2.21 0.00 0.00 174.62 173.37 1pmm s ASN 122 N -2.25 6.65 0.29 8.08 3.84 -1.26 -2.33 114.94 127.95 1pmm s ASN 122 Ca -0.03 1.39 0.00 0.00 0.21 0.00 0.00 52.86 54.43 1pmm s ASN 122 Cb -0.00 -2.43 -0.02 0.00 -0.55 0.00 0.00 41.25 38.25 1pmm s ASN 122 CO -0.05 -0.44 0.31 0.42 -2.79 0.00 0.00 177.10 174.55 1pmm s THR 123 N -2.39 0.00 0.24 -5.21 -4.23 0.17 -4.95 115.64 99.27 1pmm s THR 123 Ca 0.56 -1.83 0.15 0.00 -1.18 0.00 0.00 61.69 59.38 1pmm s THR 123 Cb -0.10 -2.51 0.07 0.00 1.34 0.00 0.00 72.50 71.30 1pmm s THR 123 CO 0.27 0.00 1.71 0.40 -0.54 0.00 0.00 174.62 176.46 1pmm h ILE 124 N 2.28 1.15 -1.73 2.99 1.08 -1.84 0.49 117.51 121.92 1pmm h ILE 124 Ca -0.29 -1.70 0.14 0.00 -0.39 0.00 0.00 64.86 62.62 1pmm h ILE 124 Cb 1.24 1.97 -0.03 0.00 -3.07 0.00 0.00 36.82 36.93 1pmm h ILE 124 CO 0.42 0.46 0.39 0.61 -0.69 0.00 0.00 178.15 179.33 1pmm n GLY 125 N 0.12 0.57 0.20 5.37 0.00 -1.26 -0.98 105.19 109.22 1pmm n GLY 125 Ca -0.01 -0.96 0.04 0.00 0.00 0.00 0.00 46.02 45.09 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 0.94 0.02 0.31 1.61 0.02 -1.85 -2.76 113.55 111.84 1pmm h SER 126 Ca -0.11 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 1pmm h SER 126 Cb 0.56 -0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.07 1pmm h SER 126 CO 0.15 0.30 -0.36 -1.28 -1.14 0.00 0.00 176.83 174.51 1pmm h SER 127 N 0.02 -0.99 -0.70 3.07 0.87 -1.95 0.60 113.55 114.47 1pmm h SER 127 Ca 0.00 0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.64 1pmm h SER 127 Cb 0.51 0.34 -0.03 0.00 -0.44 0.00 0.00 62.40 62.78 1pmm h SER 127 CO 0.04 -0.49 0.38 -0.08 -0.53 0.00 0.00 176.83 176.15 1pmm h GLU 128 N -0.71 0.97 -0.90 2.24 4.81 -1.96 -0.98 114.58 118.06 1pmm h GLU 128 Ca -0.01 -0.11 0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1pmm h GLU 128 Cb 0.66 -0.19 -0.06 0.00 0.63 0.00 0.00 28.75 29.79 1pmm h GLU 128 CO -0.10 0.73 0.58 0.00 -0.73 0.00 0.00 179.01 179.49 1pmm h ALA 129 N 1.19 1.21 -0.41 2.92 0.00 -1.13 0.76 119.26 123.80 1pmm h ALA 129 Ca 0.25 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 1pmm h ALA 129 Cb 0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1pmm h ALA 129 CO -0.04 0.40 -0.18 0.00 0.00 0.00 0.00 179.25 179.43 1pmm h MET 131 N 0.66 0.96 -0.31 0.00 2.07 -0.47 0.67 114.93 118.52 1pmm h MET 131 Ca 0.09 -0.16 -0.06 0.00 -2.07 0.00 0.00 59.70 57.50 1pmm h MET 131 Cb 0.74 -0.16 -0.01 0.00 -1.87 0.00 0.00 31.60 30.30 1pmm h MET 131 CO 0.06 0.79 -0.05 -0.07 1.07 0.00 0.00 176.91 178.71 1pmm h LEU 132 N 0.95 0.58 -0.81 1.22 3.38 -0.71 0.38 115.31 120.31 1pmm h LEU 132 Ca 0.22 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 1pmm h LEU 132 Cb 0.19 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1pmm h LEU 132 CO -0.02 0.80 0.31 1.23 0.09 0.00 0.00 178.44 180.85 1pmm h GLY 133 N 0.36 1.28 0.92 0.83 0.00 -0.58 -1.86 103.07 104.03 1pmm h GLY 133 Ca 0.08 -0.70 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 1pmm h GLY 133 CO 0.03 0.66 0.12 -1.33 0.00 0.00 0.00 176.54 176.02 1pmm h GLY 134 N 1.17 0.45 0.99 4.60 0.00 0.62 0.17 103.07 111.07 1pmm h GLY 134 Ca 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 1pmm h GLY 134 CO -0.02 0.23 0.32 -0.33 0.00 0.00 0.00 176.54 176.73 1pmm h MET 135 N 0.32 0.75 -0.81 4.80 2.07 -0.76 0.23 114.93 121.53 1pmm h MET 135 Ca 0.10 -0.08 -0.04 0.00 -2.07 0.00 0.00 59.70 57.61 1pmm h MET 135 Cb 0.16 -0.15 -0.04 0.00 -1.87 0.00 0.00 31.60 29.70 1pmm h MET 135 CO -0.01 0.56 0.36 0.00 1.07 0.00 0.00 176.91 178.90 1pmm h ALA 136 N 1.15 1.05 -0.23 6.32 0.00 -1.18 0.27 119.26 126.64 1pmm h ALA 136 Ca 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1pmm h ALA 136 Cb 0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1pmm h ALA 136 CO -0.03 0.64 0.10 1.98 0.00 0.00 0.00 179.25 181.94 1pmm h MET 137 N 1.17 0.33 -0.71 0.00 -1.53 -0.44 -0.62 114.93 113.12 1pmm h MET 137 Ca 0.28 -0.05 -0.01 0.00 -3.44 0.00 0.00 59.70 56.47 1pmm h MET 137 Cb 0.16 -0.06 -0.03 0.00 -0.55 0.00 0.00 31.60 31.12 1pmm h MET 137 CO -0.03 0.36 0.40 -0.22 0.14 0.00 0.00 176.91 177.56 1pmm h LYS 138 N 0.22 0.99 -0.47 0.39 3.64 -0.11 -1.75 116.57 119.49 1pmm h LYS 138 Ca 0.08 -0.11 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 1pmm h LYS 138 Cb 0.15 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 1pmm h LYS 138 CO -0.01 0.74 -0.01 -1.49 -2.27 0.00 0.00 179.45 176.41 1pmm h TRP 139 N 0.98 0.92 -0.84 1.91 6.55 -0.77 -0.76 115.95 123.95 1pmm h TRP 139 Ca 0.25 -0.16 -0.02 0.00 0.95 0.00 0.00 58.89 59.90 1pmm h TRP 139 Cb 0.03 -0.24 -0.04 0.00 -0.86 0.00 0.00 29.16 28.05 1pmm h TRP 139 CO -0.00 0.88 0.43 0.00 -1.05 0.00 0.00 178.44 178.70 1pmm h ARG 140 N 0.70 1.19 -0.25 0.49 3.08 -0.91 -1.20 114.38 117.48 1pmm h ARG 140 Ca 0.13 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1pmm h ARG 140 Cb 0.52 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1pmm h ARG 140 CO 0.03 0.89 0.09 2.35 -1.07 0.00 0.00 179.97 182.26 1pmm h TRP 141 N 1.19 0.40 -0.60 3.04 7.01 -1.04 -1.43 115.95 124.52 1pmm h TRP 141 Ca 0.29 -0.04 0.07 0.00 2.11 0.00 0.00 58.89 61.32 1pmm h TRP 141 Cb 0.07 -0.12 -0.06 0.00 -2.10 0.00 0.00 29.16 26.96 1pmm h TRP 141 CO 0.01 0.43 0.29 0.00 -2.79 0.00 0.00 178.44 176.38 1pmm h ARG 142 N 0.25 0.51 -0.69 2.65 3.08 -0.73 -0.05 114.38 119.39 1pmm h ARG 142 Ca 0.08 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1pmm h ARG 142 Cb 0.22 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1pmm h ARG 142 CO -0.00 0.34 0.31 0.87 -1.07 0.00 0.00 179.97 180.42 1pmm h LYS 143 N 0.53 1.00 -0.28 0.04 1.57 -1.04 0.69 116.57 119.08 1pmm h LYS 143 Ca 0.28 -0.14 -0.04 0.00 -1.87 0.00 0.00 60.65 58.87 1pmm h LYS 143 Cb 0.24 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1pmm h LYS 143 CO -0.22 0.78 0.00 -0.09 -0.57 0.00 0.00 179.45 179.36 1pmm h ARG 144 N 0.99 0.49 -0.58 3.15 2.43 -0.30 -1.37 114.38 119.19 1pmm h ARG 144 Ca 0.24 -0.16 -0.09 0.00 -0.81 0.00 0.00 59.98 59.16 1pmm h ARG 144 Cb 0.13 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1pmm h ARG 144 CO -0.03 0.64 -0.01 0.52 -1.51 0.00 0.00 179.97 179.59 1pmm h MET 145 N 0.28 1.02 -0.51 0.20 2.86 -0.75 -1.39 114.93 116.65 1pmm h MET 145 Ca 0.08 -0.32 -0.05 0.00 -2.06 0.00 0.00 59.70 57.35 1pmm h MET 145 Cb 0.42 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 1pmm h MET 145 CO 0.01 1.00 0.10 0.93 1.06 0.00 0.00 176.91 180.02 1pmm h GLU 146 N 0.93 0.78 -0.24 1.72 5.08 -0.76 0.36 114.58 122.46 1pmm h GLU 146 Ca 0.17 -0.16 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1pmm h GLU 146 Cb 0.55 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 1pmm h GLU 146 CO 0.03 0.72 -0.27 0.00 -1.00 0.00 0.00 179.01 178.49 1pmm h ALA 147 N 1.36 1.09 -0.00 3.43 0.00 -0.83 -2.14 119.26 122.17 1pmm h ALA 147 Ca 0.16 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1pmm h ALA 147 Cb 0.31 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1pmm h ALA 147 CO 0.00 0.56 -0.19 0.00 0.00 0.00 0.00 179.25 179.63 1pmm n ALA 148 N -2.49 2.79 -2.35 0.00 0.00 -0.56 -4.94 120.51 112.97 1pmm n ALA 148 Ca -0.01 -0.19 -0.07 0.00 0.00 0.00 0.00 53.44 53.17 1pmm n ALA 148 Cb 0.42 -1.34 0.01 0.00 0.00 0.00 0.00 19.45 18.53 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 1.50 0.20 3.59 0.00 0.00 0.10 -5.05 105.19 105.53 1pmm n GLY 149 Ca 0.06 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 45.28 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 -4.67 2.14 0.71 1.61 1.02 0.21 -5.00 119.74 115.76 1pmm s LYS 150 Ca 0.06 -1.22 -0.16 0.00 0.02 0.00 0.00 55.97 54.67 1pmm s LYS 150 Cb -0.03 -2.21 0.03 0.00 -0.52 0.00 0.00 37.83 35.10 1pmm s LYS 150 CO 0.07 0.44 1.26 -2.14 -0.92 0.00 0.00 175.35 174.07 1pmm s PRO 151 N -2.82 2.16 -0.13 -1.68 0.02 -1.26 -4.29 135.00 127.00 1pmm s PRO 151 Ca 0.25 1.95 0.15 0.00 0.02 0.00 0.00 61.00 63.37 1pmm s PRO 151 Cb -0.09 -1.81 0.35 0.00 0.02 0.00 0.00 34.50 32.97 1pmm s PRO 151 CO 0.16 -1.87 1.17 0.25 -0.33 0.00 0.00 177.00 176.38 1pmm n THR 152 N -2.48 1.51 1.28 0.99 -2.24 -1.26 -4.78 114.28 107.30 1pmm n THR 152 Ca 0.15 -2.28 0.13 0.00 -2.27 0.00 0.00 64.05 59.78 1pmm n THR 152 Cb 0.49 0.06 0.35 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 -0.79 2.12 -2.69 3.42 5.75 -1.26 -4.47 116.55 118.63 1pmm n ASP 153 Ca 0.14 -1.71 -0.19 0.00 -0.01 0.00 0.00 54.79 53.02 1pmm n ASP 153 Cb 0.76 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.85 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 0.66 2.23 -2.32 0.11 4.76 -1.26 -5.10 118.16 117.23 1pmm n LYS 154 Ca 0.17 -3.93 -0.38 0.00 -2.87 0.00 0.00 58.31 51.30 1pmm n LYS 154 Cb 0.45 -1.79 -0.02 0.00 -1.84 0.00 0.00 35.03 31.83 1pmm n LYS 154 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1pmm s PRO 155 N -3.24 4.05 0.12 1.97 0.04 -1.26 -4.80 135.00 131.89 1pmm s PRO 155 Ca 0.39 1.80 0.03 0.00 0.04 0.00 0.00 61.00 63.26 1pmm s PRO 155 Cb 0.40 -2.65 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1pmm s PRO 155 CO -0.08 -0.31 -0.07 0.54 0.04 0.00 0.00 177.00 177.11 1pmm s ASN 156 N -1.19 1.42 -0.05 6.66 2.20 0.02 -1.21 114.94 122.79 1pmm s ASN 156 Ca 0.57 -1.02 0.02 0.00 -0.94 0.00 0.00 52.86 51.49 1pmm s ASN 156 Cb -0.30 0.05 0.02 0.00 -2.00 0.00 0.00 41.25 39.02 1pmm s ASN 156 CO 0.37 -0.42 -0.09 -0.22 -2.94 0.00 0.00 177.10 173.80 1pmm s LEU 157 N -3.11 1.54 -0.16 3.54 2.96 0.55 -0.54 118.68 123.46 1pmm s LEU 157 Ca 0.15 -0.22 -0.08 0.00 -0.22 0.00 0.00 54.13 53.76 1pmm s LEU 157 Cb 0.04 -0.65 -0.04 0.00 0.50 0.00 0.00 46.19 46.04 1pmm s LEU 157 CO -0.02 0.00 0.11 -0.69 -1.32 0.00 0.00 176.35 174.43 1pmm s VAL 158 N 0.71 5.24 0.36 1.68 1.01 -1.08 0.05 120.40 128.37 1pmm s VAL 158 Ca -0.13 0.12 -0.15 0.00 0.00 0.00 0.00 61.98 61.82 1pmm s VAL 158 Cb -0.15 -3.33 0.04 0.00 0.00 0.00 0.00 36.38 32.94 1pmm s VAL 158 CO 0.02 0.52 0.73 0.00 0.00 0.00 0.00 175.10 176.38 1pmm n GLY 160 N -0.51 2.85 3.27 0.00 0.00 -1.26 -0.30 105.19 109.23 1pmm n GLY 160 Ca -0.06 -1.78 -0.38 0.00 0.00 0.00 0.00 46.02 43.79 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 2.04 -1.71 1.61 -0.04 -1.26 -4.49 135.00 131.15 1pmm n PRO 161 Ca 0.00 -2.40 -0.31 0.00 -0.04 0.00 0.00 63.50 60.75 1pmm n PRO 161 Cb 0.00 -3.32 0.03 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 6.43 4.19 0.72 0.52 -7.23 -1.26 -4.69 120.40 119.08 1pmm s VAL 162 Ca 0.58 0.75 -0.12 0.00 -1.81 0.00 0.00 61.98 61.38 1pmm s VAL 162 Cb 0.08 -3.52 0.03 0.00 0.56 0.00 0.00 36.38 33.53 1pmm s VAL 162 CO 0.08 -0.90 1.08 -1.58 -0.31 0.00 0.00 175.10 173.48 1pmm s GLN 163 N -4.97 2.60 0.60 4.82 -0.44 -1.26 -4.91 119.66 116.10 1pmm s GLN 163 Ca 0.58 1.16 0.29 0.00 -2.50 0.00 0.00 55.36 54.89 1pmm s GLN 163 Cb -0.13 -1.94 1.52 0.00 -1.64 0.00 0.00 33.01 30.81 1pmm s GLN 163 CO 0.53 -1.38 1.92 0.97 0.50 0.00 0.00 175.29 177.82 1pmm h ILE 164 N -0.70 0.32 -0.13 -2.34 6.09 -2.02 -2.50 117.51 116.24 1pmm h ILE 164 Ca -0.44 0.00 0.04 0.00 -1.37 0.00 0.00 64.86 63.08 1pmm h ILE 164 Cb 1.23 0.65 -0.01 0.00 0.47 0.00 0.00 36.82 39.16 1pmm h ILE 164 CO 0.54 0.00 0.10 0.00 -3.07 0.00 0.00 178.15 175.71 1pmm h TRP 166 N 0.00 0.00 -0.15 0.00 4.06 -1.81 -0.79 115.95 117.26 1pmm h TRP 166 Ca 0.06 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.84 1pmm h TRP 166 Cb 0.26 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.41 1pmm h TRP 166 CO 0.00 0.47 -0.63 0.45 -3.56 0.00 0.00 178.44 175.17 1pmm h HIS 167 N 0.00 0.67 -0.34 0.49 3.86 -1.27 -1.68 115.15 116.89 1pmm h HIS 167 Ca -0.00 -0.26 -0.17 0.00 -1.16 0.00 0.00 60.37 58.77 1pmm h HIS 167 Cb 1.11 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 29.46 1pmm h HIS 167 CO 0.00 1.01 -0.46 0.87 0.86 0.00 0.00 177.93 180.21 1pmm h LYS 168 N 0.38 0.91 -0.20 2.45 1.57 -1.13 -1.92 116.57 118.63 1pmm h LYS 168 Ca -0.01 -0.53 0.02 0.00 -1.87 0.00 0.00 60.65 58.26 1pmm h LYS 168 Cb 1.19 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.52 1pmm h LYS 168 CO 0.12 1.17 0.08 0.35 -0.57 0.00 0.00 179.45 180.60 1pmm h PHE 169 N 0.72 0.15 -0.60 -1.35 3.57 -1.05 0.24 116.94 118.63 1pmm h PHE 169 Ca 0.04 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.61 1pmm h PHE 169 Cb 1.06 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.70 1pmm h PHE 169 CO 0.07 0.08 0.30 0.00 -2.23 0.00 0.00 178.31 176.52 1pmm h ALA 170 N 1.11 0.79 -0.14 2.41 0.00 -1.19 -0.47 119.26 121.78 1pmm h ALA 170 Ca 0.08 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1pmm h ALA 170 Cb 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1pmm h ALA 170 CO -0.07 -0.06 -0.16 -0.09 0.00 0.00 0.00 179.25 178.86 1pmm h ARG 171 N 0.55 0.35 0.00 0.00 9.65 -0.92 0.22 114.38 124.22 1pmm h ARG 171 Ca 0.28 -0.19 -0.11 0.00 -1.10 0.00 0.00 59.98 58.85 1pmm h ARG 171 Cb 0.22 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.80 1pmm h ARG 171 CO -0.21 0.76 -0.52 1.88 2.80 0.00 0.00 179.97 184.68 1pmm h TYR 172 N -0.04 0.00 -0.31 2.20 0.05 -0.34 -3.19 116.97 115.34 1pmm h TYR 172 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1pmm h TYR 172 Cb 0.70 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.44 1pmm h TYR 172 CO 0.09 0.52 0.00 0.91 -1.05 0.00 0.00 178.16 178.63 1pmm n TRP 173 N -3.90 0.85 -3.77 4.88 8.01 -0.20 -5.00 117.44 118.31 1pmm n TRP 173 Ca -0.01 -0.75 -0.26 0.00 -1.31 0.00 0.00 57.50 55.17 1pmm n TRP 173 Cb 0.53 -0.23 0.02 0.00 -2.01 0.00 0.00 31.31 29.62 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 -0.10 -2.33 -4.38 -0.99 8.00 -0.87 -5.00 116.55 110.87 1pmm n ASP 174 Ca 0.19 -0.94 -0.33 0.00 0.71 0.00 0.00 54.79 54.42 1pmm n ASP 174 Cb 0.76 -3.53 -0.14 0.00 -0.02 0.00 0.00 41.12 38.19 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 -3.70 2.86 -0.10 2.53 1.01 0.01 -4.74 120.40 118.28 1pmm s VAL 175 Ca 0.16 -0.76 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 1pmm s VAL 175 Cb -0.06 -2.15 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 1pmm s VAL 175 CO 0.85 0.55 1.31 -0.70 0.00 0.00 0.00 175.10 177.12 1pmm s GLU 176 N -0.08 4.27 -0.20 2.72 2.12 -0.35 -4.53 118.70 122.65 1pmm s GLU 176 Ca -0.03 1.77 -0.21 0.00 0.36 0.00 0.00 54.97 56.86 1pmm s GLU 176 Cb -0.14 -3.70 -0.02 0.00 0.26 0.00 0.00 34.13 30.53 1pmm s GLU 176 CO 0.04 -0.63 0.63 -1.17 -0.54 0.00 0.00 175.26 173.59 1pmm s LEU 177 N 3.02 4.13 -0.80 2.70 2.96 -1.26 -0.33 118.68 129.11 1pmm s LEU 177 Ca 0.58 0.82 -0.03 0.00 -0.22 0.00 0.00 54.13 55.28 1pmm s LEU 177 Cb -0.25 -2.89 0.20 0.00 0.50 0.00 0.00 46.19 43.75 1pmm s LEU 177 CO 0.20 -0.29 0.66 -0.13 -1.32 0.00 0.00 176.35 175.48 1pmm s ARG 178 N 1.99 3.08 -0.17 1.98 0.52 0.11 -4.92 118.95 121.53 1pmm s ARG 178 Ca 0.28 -2.93 -0.21 0.00 -0.52 0.00 0.00 55.73 52.35 1pmm s ARG 178 Cb -0.16 -3.94 -0.03 0.00 0.52 0.00 0.00 34.95 31.35 1pmm s ARG 178 CO 0.10 -1.23 0.65 -2.00 0.02 0.00 0.00 175.30 172.84 1pmm s GLU 179 N -0.74 4.27 -0.22 3.54 2.12 -1.26 -2.19 118.70 124.21 1pmm s GLU 179 Ca 0.23 0.69 -0.29 0.00 0.36 0.00 0.00 54.97 55.96 1pmm s GLU 179 Cb -0.12 -3.55 -0.00 0.00 0.26 0.00 0.00 34.13 30.72 1pmm s GLU 179 CO -0.09 -0.17 1.17 0.42 -0.54 0.00 0.00 175.26 176.05 1pmm s ILE 180 N 1.67 4.43 0.53 -3.70 1.09 0.59 -4.97 121.20 120.84 1pmm s ILE 180 Ca 0.31 1.71 -0.20 0.00 -1.10 0.00 0.00 60.65 61.37 1pmm s ILE 180 Cb -0.16 -4.18 -0.06 0.00 -1.06 0.00 0.00 42.46 37.00 1pmm s ILE 180 CO 0.12 -0.23 1.12 -2.16 -0.10 0.00 0.00 174.94 173.69 1pmm s PRO 181 N 3.49 3.44 0.53 2.79 0.04 -1.26 -4.18 135.00 139.86 1pmm s PRO 181 Ca 0.50 1.61 -0.19 0.00 0.04 0.00 0.00 61.00 62.96 1pmm s PRO 181 Cb -0.18 -2.06 -0.06 0.00 0.04 0.00 0.00 34.50 32.24 1pmm s PRO 181 CO 0.13 -0.77 1.06 -1.64 0.04 0.00 0.00 177.00 175.81 1pmm s MET 182 N -3.21 3.56 0.03 4.56 -1.94 -1.26 -4.77 119.30 116.27 1pmm s MET 182 Ca 0.71 1.35 -0.17 0.00 -1.71 0.00 0.00 55.69 55.87 1pmm s MET 182 Cb -0.24 -2.06 0.03 0.00 2.01 0.00 0.00 34.83 34.58 1pmm s MET 182 CO 0.27 -0.63 0.38 -0.98 -0.01 0.00 0.00 175.02 174.05 1pmm s ARG 183 N -3.53 0.87 -0.21 2.03 1.70 -0.88 0.68 118.95 119.62 1pmm s ARG 183 Ca 0.67 -0.35 -0.43 0.00 -0.47 0.00 0.00 55.73 55.15 1pmm s ARG 183 Cb -0.17 0.39 -0.20 0.00 -0.57 0.00 0.00 34.95 34.40 1pmm s ARG 183 CO 0.27 -0.29 1.33 -2.30 -1.08 0.00 0.00 175.30 173.23 1pmm n PRO 184 N 0.63 0.12 -0.37 3.89 -0.02 -1.26 0.29 135.00 138.27 1pmm n PRO 184 Ca -0.19 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 1pmm n PRO 184 Cb 0.59 -1.56 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 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 2.69 2.14 2.46 -1.23 0.00 -1.26 -4.88 105.19 105.11 1pmm n GLY 185 Ca 0.25 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.09 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 0.55 -0.93 1.61 7.27 0.15 -5.00 117.38 119.03 1pmm n GLN 186 Ca 0.00 -2.68 -0.13 0.00 0.07 0.00 0.00 57.00 54.26 1pmm n GLN 186 Cb 0.00 -1.43 -0.05 0.00 2.41 0.00 0.00 30.24 31.17 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 2.11 5.82 -3.82 1.69 4.77 -1.23 -2.06 117.00 124.28 1pmm n LEU 187 Ca 0.20 -3.16 -0.06 0.00 -0.03 0.00 0.00 56.01 52.96 1pmm n LEU 187 Cb 0.54 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 1pmm n LEU 187 CO 0.09 1.39 0.64 0.72 -1.33 0.00 0.00 177.39 178.90 1pmm s PHE 188 N -0.53 -0.03 -0.45 -1.77 -0.12 -1.26 -4.87 117.98 108.94 1pmm s PHE 188 Ca 0.37 -0.43 -0.26 0.00 -0.05 0.00 0.00 56.93 56.57 1pmm s PHE 188 Cb 0.22 0.72 0.03 0.00 -0.63 0.00 0.00 43.02 43.36 1pmm s PHE 188 CO -0.04 -1.14 0.95 1.41 -0.05 0.00 0.00 175.22 176.35 1pmm s MET 189 N -2.92 3.58 0.44 1.99 -2.45 -1.26 -4.84 119.30 113.84 1pmm s MET 189 Ca 0.15 0.24 -0.04 0.00 -1.25 0.00 0.00 55.69 54.79 1pmm s MET 189 Cb -0.04 -3.91 -0.04 0.00 1.25 0.00 0.00 34.83 32.09 1pmm s MET 189 CO 0.06 -1.22 0.72 0.16 1.05 0.00 0.00 175.02 175.79 1pmm s ASP 190 N 2.25 6.28 0.19 1.11 -4.77 -1.26 -4.94 116.67 115.54 1pmm s ASP 190 Ca 0.38 0.80 -0.13 0.00 -3.30 0.00 0.00 52.55 50.31 1pmm s ASP 190 Cb -0.10 -2.19 0.21 0.00 -1.09 0.00 0.00 42.92 39.75 1pmm s ASP 190 CO 0.26 -0.49 1.71 -0.65 0.70 0.00 0.00 175.17 176.70 1pmm h PRO 191 N 0.42 0.21 0.02 2.11 0.11 -1.96 -1.55 132.00 131.37 1pmm h PRO 191 Ca -0.48 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.63 1pmm h PRO 191 Cb 1.21 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1pmm h PRO 191 CO 0.62 0.14 -0.08 -0.22 -0.21 0.00 0.00 178.00 178.25 1pmm h LYS 192 N 0.22 -0.14 0.00 1.05 3.64 -1.98 -1.73 116.57 117.63 1pmm h LYS 192 Ca 0.26 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.55 1pmm h LYS 192 Cb 0.36 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 1pmm h LYS 192 CO -0.35 -0.10 -0.47 0.00 -2.27 0.00 0.00 179.45 176.26 1pmm h ARG 193 N -0.15 0.00 0.52 1.90 3.08 -1.94 -2.10 114.38 115.69 1pmm h ARG 193 Ca 0.02 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 1pmm h ARG 193 Cb 0.18 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.23 1pmm h ARG 193 CO -0.07 0.47 -0.25 1.98 -1.07 0.00 0.00 179.97 181.03 1pmm h MET 194 N 0.00 -0.68 -1.00 0.04 4.05 -0.98 -2.82 114.93 113.54 1pmm h MET 194 Ca -0.00 0.05 0.08 0.00 -0.28 0.00 0.00 59.70 59.54 1pmm h MET 194 Cb 0.89 0.15 -0.07 0.00 -0.80 0.00 0.00 31.60 31.77 1pmm h MET 194 CO 0.06 -0.41 0.64 0.82 0.23 0.00 0.00 176.91 178.25 1pmm h ILE 195 N -0.80 1.05 -0.05 1.77 1.08 -1.24 -0.43 117.51 118.89 1pmm h ILE 195 Ca -0.07 -0.39 0.02 0.00 -0.39 0.00 0.00 64.86 64.02 1pmm h ILE 195 Cb 0.58 -0.18 -0.00 0.00 -3.07 0.00 0.00 36.82 34.15 1pmm h ILE 195 CO 0.12 0.21 0.06 -0.33 -0.69 0.00 0.00 178.15 177.52 1pmm h GLU 196 N 1.14 0.00 0.00 2.37 5.08 -1.22 -1.56 114.58 120.39 1pmm h GLU 196 Ca 0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.80 1pmm h GLU 196 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1pmm h GLU 196 CO -0.19 0.00 -0.95 0.00 -1.00 0.00 0.00 179.01 176.87 1pmm n ALA 197 N -2.31 3.58 -1.81 3.43 0.00 -0.20 -4.96 120.51 118.24 1pmm n ALA 197 Ca -0.02 -0.42 -0.36 0.00 0.00 0.00 0.00 53.44 52.64 1pmm n ALA 197 Cb 0.16 -0.97 -0.07 0.00 0.00 0.00 0.00 19.45 18.57 1pmm n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmm n ASP 199 N 0.37 -0.89 0.04 0.00 5.68 -1.26 -5.01 116.55 115.47 1pmm n ASP 199 Ca 0.02 -1.70 0.07 0.00 -0.50 0.00 0.00 54.79 52.68 1pmm n ASP 199 Cb 0.51 1.51 0.29 0.00 -1.14 0.00 0.00 41.12 42.29 1pmm n ASP 199 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1pmm n GLU 200 N -0.23 0.05 -0.02 0.11 0.28 -1.26 -2.00 120.64 117.57 1pmm n GLU 200 Ca -0.03 0.38 0.12 0.00 -0.16 0.00 0.00 57.16 57.47 1pmm n GLU 200 Cb 0.25 -1.61 0.24 0.00 1.43 0.00 0.00 31.44 31.75 1pmm n GLU 200 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1pmm n ASN 201 N -1.71 2.58 -4.65 -1.84 3.02 -1.26 -4.88 115.26 106.52 1pmm n ASN 201 Ca 0.02 -1.85 -0.43 0.00 -0.03 0.00 0.00 54.58 52.29 1pmm n ASN 201 Cb 0.13 -0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.25 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 -1.95 4.28 -0.42 3.41 2.01 -0.85 -0.80 115.64 121.33 1pmm s THR 202 Ca 0.32 1.52 0.26 0.00 0.31 0.00 0.00 61.69 64.09 1pmm s THR 202 Cb 0.20 -4.09 0.33 0.00 0.01 0.00 0.00 72.50 68.95 1pmm s THR 202 CO 0.31 -0.26 1.74 0.16 -0.69 0.00 0.00 174.62 175.88 1pmm h ILE 203 N 5.64 0.00 0.00 1.82 3.07 -1.16 -3.47 117.51 123.41 1pmm h ILE 203 Ca -0.25 -0.68 0.00 0.00 1.55 0.00 0.00 64.86 65.48 1pmm h ILE 203 Cb 1.10 1.65 0.00 0.00 -0.27 0.00 0.00 36.82 39.30 1pmm h ILE 203 CO 0.99 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 178.70 1pmm n GLY 204 N 0.84 -0.26 3.30 0.16 0.00 -1.26 -4.63 105.19 103.33 1pmm n GLY 204 Ca 0.04 -1.19 -0.30 0.00 0.00 0.00 0.00 46.02 44.56 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 1.98 -0.37 1.61 1.01 -0.51 -2.63 120.40 119.49 1pmm s VAL 205 Ca 0.00 -1.13 0.04 0.00 0.00 0.00 0.00 61.98 60.88 1pmm s VAL 205 Cb 0.00 -1.66 0.11 0.00 0.00 0.00 0.00 36.38 34.83 1pmm s VAL 205 CO 0.00 0.50 0.10 -0.69 0.00 0.00 0.00 175.10 175.01 1pmm s VAL 206 N -0.64 2.22 0.34 2.92 1.01 -0.41 -1.95 120.40 123.88 1pmm s VAL 206 Ca 0.10 -2.47 -0.25 0.00 0.00 0.00 0.00 61.98 59.36 1pmm s VAL 206 Cb -0.10 -2.62 -0.10 0.00 0.00 0.00 0.00 36.38 33.56 1pmm s VAL 206 CO -0.00 -0.65 0.94 -2.84 0.00 0.00 0.00 175.10 172.54 1pmm s PRO 207 N 0.71 4.51 -0.43 2.72 0.02 -1.24 -4.09 135.00 137.21 1pmm s PRO 207 Ca 0.12 1.28 -0.12 0.00 0.02 0.00 0.00 61.00 62.30 1pmm s PRO 207 Cb -0.20 -2.70 0.07 0.00 0.02 0.00 0.00 34.50 31.68 1pmm s PRO 207 CO -0.08 0.23 0.30 0.99 -0.33 0.00 0.00 177.00 178.12 1pmm s THR 208 N -1.71 4.68 -1.38 0.99 2.01 -1.26 -1.81 115.64 117.17 1pmm s THR 208 Ca 0.52 -1.16 -0.12 0.00 0.31 0.00 0.00 61.69 61.23 1pmm s THR 208 Cb -0.17 -3.79 0.09 0.00 0.01 0.00 0.00 72.50 68.65 1pmm s THR 208 CO 0.22 -0.48 2.06 0.33 -0.69 0.00 0.00 174.62 176.05 1pmm n PHE 209 N 5.04 3.38 0.00 4.92 7.35 -0.39 -1.81 117.46 135.96 1pmm n PHE 209 Ca -0.11 -2.91 0.00 0.00 -0.76 0.00 0.00 57.45 53.67 1pmm n PHE 209 Cb 0.44 -2.32 0.00 0.00 0.35 0.00 0.00 39.48 37.95 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 3.64 0.58 3.70 7.13 0.00 -1.25 -1.86 105.19 117.14 1pmm n GLY 210 Ca 0.47 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 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 3.23 0.15 1.61 1.01 0.08 -4.72 120.40 121.77 1pmm s VAL 211 Ca 0.00 0.79 -0.16 0.00 0.00 0.00 0.00 61.98 62.61 1pmm s VAL 211 Cb 0.00 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.88 1pmm s VAL 211 CO 0.00 0.03 1.81 0.71 0.00 0.00 0.00 175.10 177.65 1pmm h THR 212 N 4.50 1.08 -0.24 3.92 1.35 -1.89 0.75 112.91 122.39 1pmm h THR 212 Ca -0.41 -0.18 -0.04 0.00 -0.55 0.00 0.00 66.41 65.23 1pmm h THR 212 Cb 1.20 0.53 -0.01 0.00 -1.73 0.00 0.00 68.15 68.13 1pmm h THR 212 CO 0.90 0.09 -0.05 1.88 -0.25 0.00 0.00 175.52 178.09 1pmm h TYR 213 N 0.51 0.37 0.00 4.73 0.05 -1.91 -3.34 116.97 117.38 1pmm h TYR 213 Ca 0.15 -0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.87 1pmm h TYR 213 Cb -0.04 -0.11 -0.00 0.00 1.01 0.00 0.00 36.73 37.59 1pmm h TYR 213 CO -0.06 0.42 -1.19 0.25 -1.05 0.00 0.00 178.16 176.54 1pmm n THR 214 N -4.30 0.07 -0.31 -2.88 -2.24 -1.17 -4.98 114.28 98.48 1pmm n THR 214 Ca 0.00 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1pmm n THR 214 Cb 0.24 -0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 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 2.45 1.45 3.87 3.38 0.00 0.26 -4.46 105.19 112.14 1pmm n GLY 215 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.18 6.64 0.30 1.61 0.01 -1.25 -1.04 114.94 118.03 1pmm s ASN 216 Ca 0.00 0.99 -0.26 0.00 -0.71 0.00 0.00 52.86 52.87 1pmm s ASN 216 Cb 0.00 -2.25 -0.10 0.00 0.41 0.00 0.00 41.25 39.31 1pmm s ASN 216 CO 0.00 -0.11 0.92 -0.31 -1.51 0.00 0.00 177.10 176.09 1pmm s TYR 217 N -1.87 3.75 -0.24 2.20 2.02 -0.45 -0.74 117.35 122.02 1pmm s TYR 217 Ca 0.49 1.77 -0.13 0.00 -0.37 0.00 0.00 57.07 58.83 1pmm s TYR 217 Cb -0.11 -2.91 -0.04 0.00 -0.40 0.00 0.00 41.96 38.50 1pmm s TYR 217 CO 0.21 0.27 0.28 -1.21 -1.57 0.00 0.00 175.55 173.54 1pmm s GLU 218 N -1.87 4.08 -0.28 -0.62 2.02 -0.75 -4.86 118.70 116.43 1pmm s GLU 218 Ca 0.48 -0.06 -0.26 0.00 0.02 0.00 0.00 54.97 55.15 1pmm s GLU 218 Cb -0.20 -3.57 0.00 0.00 0.10 0.00 0.00 34.13 30.46 1pmm s GLU 218 CO 0.25 -0.07 0.89 -0.06 0.02 0.00 0.00 175.26 176.29 1pmm s PHE 219 N 1.42 3.24 0.39 1.61 0.08 -1.26 -4.39 117.98 119.07 1pmm s PHE 219 Ca 0.13 1.07 0.13 0.00 0.12 0.00 0.00 56.93 58.38 1pmm s PHE 219 Cb -0.15 -3.27 0.81 0.00 -0.57 0.00 0.00 43.02 39.84 1pmm s PHE 219 CO 0.07 -0.55 1.88 -1.35 -0.10 0.00 0.00 175.22 175.17 1pmm h PRO 220 N 7.90 0.00 0.18 0.24 0.11 -1.88 -3.33 132.00 135.22 1pmm h PRO 220 Ca -0.22 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.89 1pmm h PRO 220 Cb 1.08 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1pmm h PRO 220 CO 0.92 0.32 -0.24 0.37 -0.21 0.00 0.00 178.00 179.16 1pmm h GLN 221 N 0.00 -0.46 -0.38 1.05 4.15 -1.92 0.55 115.11 118.10 1pmm h GLN 221 Ca -0.00 0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 1pmm h GLN 221 Cb 0.56 0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.34 1pmm h GLN 221 CO 0.04 -0.31 0.15 -1.35 -1.93 0.00 0.00 178.83 175.44 1pmm h PRO 222 N -0.48 0.53 -0.20 -2.39 0.11 -1.94 0.15 132.00 127.79 1pmm h PRO 222 Ca 0.01 -0.06 -0.15 0.00 0.11 0.00 0.00 66.00 65.90 1pmm h PRO 222 Cb 0.47 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.47 1pmm h PRO 222 CO -0.09 0.44 -0.51 -0.07 -0.21 0.00 0.00 178.00 177.56 1pmm h LEU 223 N 0.53 0.61 -0.73 2.35 3.38 -1.57 -2.37 115.31 117.50 1pmm h LEU 223 Ca 0.13 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 1pmm h LEU 223 Cb 0.10 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1pmm h LEU 223 CO -0.01 1.01 0.09 -0.74 0.09 0.00 0.00 178.44 178.87 1pmm h HIS 224 N 0.44 1.12 -0.81 1.13 2.76 0.12 -1.60 115.15 118.30 1pmm h HIS 224 Ca 0.02 -0.16 -0.02 0.00 -2.20 0.00 0.00 60.37 58.01 1pmm h HIS 224 Cb 1.04 -0.31 -0.04 0.00 1.55 0.00 0.00 27.41 29.65 1pmm h HIS 224 CO 0.04 0.95 0.42 -0.44 -1.30 0.00 0.00 177.93 177.60 1pmm h ASP 225 N 0.99 1.04 -0.58 3.26 3.32 -0.81 -1.44 116.42 122.20 1pmm h ASP 225 Ca 0.19 -0.12 -0.08 0.00 0.02 0.00 0.00 57.03 57.05 1pmm h ASP 225 Cb 0.44 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1pmm h ASP 225 CO 0.01 0.86 0.08 0.00 -1.72 0.00 0.00 179.24 178.47 1pmm h ALA 226 N 1.22 0.99 -0.13 3.45 0.00 -0.94 -1.88 119.26 121.97 1pmm h ALA 226 Ca 0.28 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1pmm h ALA 226 Cb 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1pmm h ALA 226 CO -0.04 0.63 -0.37 -0.07 0.00 0.00 0.00 179.25 179.40 1pmm h LEU 227 N 0.94 0.28 -0.22 0.00 3.38 -0.92 0.36 115.31 119.14 1pmm h LEU 227 Ca 0.19 -0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1pmm h LEU 227 Cb 0.44 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1pmm h LEU 227 CO 0.01 0.63 0.00 0.44 0.09 0.00 0.00 178.44 179.62 1pmm h ASP 228 N 0.23 0.38 -0.73 -0.43 3.32 -0.90 -1.62 116.42 116.68 1pmm h ASP 228 Ca 0.03 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.76 1pmm h ASP 228 Cb 0.76 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 1pmm h ASP 228 CO 0.06 0.59 0.40 0.50 -1.72 0.00 0.00 179.24 179.08 1pmm h LYS 229 N 0.15 1.01 -0.60 3.56 3.64 -1.14 -1.74 116.57 121.44 1pmm h LYS 229 Ca 0.06 -0.11 0.05 0.00 -1.27 0.00 0.00 60.65 59.38 1pmm h LYS 229 Cb 0.40 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 31.97 1pmm h LYS 229 CO 0.01 0.74 0.33 0.35 -2.27 0.00 0.00 179.45 178.61 1pmm h PHE 230 N 1.00 0.61 -0.36 1.91 3.57 -0.69 0.10 116.94 123.08 1pmm h PHE 230 Ca 0.26 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.65 1pmm h PHE 230 Cb 0.02 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 1pmm h PHE 230 CO -0.00 0.30 -0.28 0.37 -2.23 0.00 0.00 178.31 176.47 1pmm h GLN 231 N 0.63 0.75 -0.32 1.11 4.15 -0.94 0.21 115.11 120.69 1pmm h GLN 231 Ca 0.26 -0.33 -0.08 0.00 0.77 0.00 0.00 58.65 59.28 1pmm h GLN 231 Cb 0.14 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 1pmm h GLN 231 CO -0.16 0.94 -0.12 0.00 -1.93 0.00 0.00 178.83 177.56 1pmm h ALA 232 N 1.04 1.19 0.23 3.38 0.00 -0.64 0.51 119.26 124.98 1pmm h ALA 232 Ca 0.08 -0.28 -0.34 0.00 0.00 0.00 0.00 54.91 54.37 1pmm h ALA 232 Cb 0.80 -0.14 0.03 0.00 0.00 0.00 0.00 17.79 18.47 1pmm h ALA 232 CO 0.07 0.52 -1.57 -0.44 0.00 0.00 0.00 179.25 177.83 1pmm h ASP 233 N 0.51 0.77 0.00 0.00 3.32 -0.59 -3.41 116.42 117.02 1pmm h ASP 233 Ca 0.09 -0.93 0.00 0.00 0.02 0.00 0.00 57.03 56.22 1pmm h ASP 233 Cb 0.51 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1pmm h ASP 233 CO 0.03 1.74 -0.93 0.35 -1.72 0.00 0.00 179.24 178.71 1pmm n THR 234 N -3.69 0.00 -0.53 0.35 -2.24 0.71 -5.00 114.28 103.88 1pmm n THR 234 Ca -0.20 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1pmm n THR 234 Cb 1.09 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 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 1.83 1.18 3.65 3.38 0.00 0.18 -5.01 105.19 110.39 1pmm n GLY 235 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.25 4.84 -0.47 -0.61 1.01 -1.26 -4.96 121.20 116.50 1pmm s ILE 236 Ca 0.00 1.62 -0.14 0.00 0.00 0.00 0.00 60.65 62.13 1pmm s ILE 236 Cb 0.00 -4.13 0.09 0.00 0.01 0.00 0.00 42.46 38.42 1pmm s ILE 236 CO 0.00 -0.06 0.38 -0.62 0.00 0.00 0.00 174.94 174.64 1pmm s ASP 237 N 1.29 6.02 -0.14 3.58 2.15 -1.26 -3.47 116.67 124.83 1pmm s ASP 237 Ca 0.36 -1.47 -0.03 0.00 0.43 0.00 0.00 52.55 51.84 1pmm s ASP 237 Cb -0.16 -2.13 -0.03 0.00 -0.30 0.00 0.00 42.92 40.30 1pmm s ASP 237 CO 0.08 -0.66 -0.03 -0.63 -0.17 0.00 0.00 175.17 173.76 1pmm s ILE 238 N 1.57 3.96 0.51 4.11 1.01 -1.26 -5.06 121.20 126.05 1pmm s ILE 238 Ca 0.04 -0.34 0.08 0.00 0.00 0.00 0.00 60.65 60.43 1pmm s ILE 238 Cb -0.25 -2.72 0.05 0.00 0.01 0.00 0.00 42.46 39.56 1pmm s ILE 238 CO 0.05 0.52 0.70 -1.81 0.00 0.00 0.00 174.94 174.39 1pmm s ASP 239 N 0.07 5.33 0.13 3.58 1.01 -1.26 -4.94 116.67 120.59 1pmm s ASP 239 Ca 0.00 -0.63 0.08 0.00 0.71 0.00 0.00 52.55 52.71 1pmm s ASP 239 Cb -0.13 -0.15 -0.04 0.00 1.01 0.00 0.00 42.92 43.60 1pmm s ASP 239 CO 0.03 -1.10 -0.19 -0.04 0.21 0.00 0.00 175.17 174.08 1pmm s MET 240 N -4.54 1.15 -0.11 8.23 -1.94 0.21 -1.42 119.30 120.89 1pmm s MET 240 Ca 0.59 -1.26 0.01 0.00 -1.71 0.00 0.00 55.69 53.32 1pmm s MET 240 Cb -0.08 -1.27 0.02 0.00 2.01 0.00 0.00 34.83 35.51 1pmm s MET 240 CO 0.37 0.27 -0.10 -1.58 -0.01 0.00 0.00 175.02 173.97 1pmm s HIS 241 N -1.65 1.63 -0.24 -0.03 2.46 -0.82 -1.96 115.29 114.68 1pmm s HIS 241 Ca 0.10 -0.78 -0.18 0.00 0.47 0.00 0.00 55.06 54.67 1pmm s HIS 241 Cb -0.08 -1.26 -0.03 0.00 -0.13 0.00 0.00 32.58 31.08 1pmm s HIS 241 CO 0.05 -0.48 0.51 0.42 -2.47 0.00 0.00 174.74 172.78 1pmm s ILE 242 N 1.35 5.09 -0.86 0.89 -1.09 -0.73 -3.59 121.20 122.25 1pmm s ILE 242 Ca -0.01 0.90 -0.20 0.00 -2.23 0.00 0.00 60.65 59.11 1pmm s ILE 242 Cb -0.14 -3.83 0.11 0.00 -1.58 0.00 0.00 42.46 37.02 1pmm s ILE 242 CO -0.05 0.12 1.10 -0.62 -1.23 0.00 0.00 174.94 174.26 1pmm s ASP 243 N 1.39 6.50 -0.55 3.58 -1.08 -0.75 -1.65 116.67 124.11 1pmm s ASP 243 Ca 0.22 -1.73 0.01 0.00 -0.52 0.00 0.00 52.55 50.53 1pmm s ASP 243 Cb -0.15 -2.41 0.47 0.00 -1.46 0.00 0.00 42.92 39.37 1pmm s ASP 243 CO 0.09 -1.19 1.81 0.00 0.52 0.00 0.00 175.17 176.40 1pmm n ALA 244 N 6.98 5.88 -0.33 3.66 0.00 0.07 -1.26 120.51 135.52 1pmm n ALA 244 Ca 0.17 -3.48 0.08 0.00 0.00 0.00 0.00 53.44 50.20 1pmm n ALA 244 Cb 0.48 -1.37 0.16 0.00 0.00 0.00 0.00 19.45 18.72 1pmm n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pmm n ALA 245 N -0.90 0.28 -0.11 0.00 0.00 -1.20 -0.89 120.51 117.69 1pmm n ALA 245 Ca 0.57 1.01 -0.19 0.00 0.00 0.00 0.00 53.44 54.83 1pmm n ALA 245 Cb 0.84 -0.64 -0.07 0.00 0.00 0.00 0.00 19.45 19.58 1pmm n ALA 245 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1pmm n SER 246 N -5.47 1.93 0.05 0.00 3.41 -1.26 -1.71 113.62 110.57 1pmm n SER 246 Ca 0.16 0.37 0.17 0.00 -0.26 0.00 0.00 58.87 59.32 1pmm n SER 246 Cb 0.52 -0.81 0.67 0.00 -0.26 0.00 0.00 64.21 64.34 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 -1.00 0.02 0.94 5.00 0.00 -1.29 -2.96 103.07 103.79 1pmm h GLY 247 Ca -0.34 -0.01 0.14 0.00 0.00 0.00 0.00 47.33 47.12 1pmm h GLY 247 CO -0.21 0.00 0.39 -1.33 0.00 0.00 0.00 176.54 175.40 1pmm h GLY 248 N 0.02 0.00 -1.13 4.60 0.00 -1.25 -1.24 103.07 104.07 1pmm h GLY 248 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 1pmm h GLY 248 CO -0.01 0.00 -0.00 0.69 0.00 0.00 0.00 176.54 177.22 1pmm n PHE 249 N -4.14 0.66 0.01 5.60 3.72 -1.12 -4.59 117.46 117.60 1pmm n PHE 249 Ca 0.09 -0.94 -0.00 0.00 -0.05 0.00 0.00 57.45 56.54 1pmm n PHE 249 Cb 0.60 -0.27 -0.00 0.00 -0.94 0.00 0.00 39.48 38.87 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 -0.81 0.35 -0.34 4.37 4.77 -0.51 -4.75 117.00 120.08 1pmm n LEU 250 Ca 0.20 0.05 0.14 0.00 -0.03 0.00 0.00 56.01 56.37 1pmm n LEU 250 Cb 0.82 -0.14 0.34 0.00 -2.33 0.00 0.00 43.42 42.11 1pmm n LEU 250 CO 0.11 -0.57 1.15 0.00 -1.33 0.00 0.00 177.39 176.75 1pmm h ALA 251 N -0.12 1.65 -0.16 -1.18 0.00 -1.74 -0.50 119.26 117.22 1pmm h ALA 251 Ca 0.00 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1pmm h ALA 251 Cb 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1pmm h ALA 251 CO 0.00 -0.19 0.13 -1.35 0.00 0.00 0.00 179.25 177.84 1pmm h PRO 252 N 0.62 0.00 0.04 0.00 0.11 -1.81 -0.01 132.00 130.94 1pmm h PRO 252 Ca 0.59 0.00 -0.37 0.00 0.11 0.00 0.00 66.00 66.33 1pmm h PRO 252 Cb 1.04 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.10 1pmm h PRO 252 CO -0.44 0.00 -2.25 1.19 -0.21 0.00 0.00 178.00 176.29 1pmm n PHE 253 N -4.25 0.48 0.45 0.65 3.72 -0.26 -4.38 117.46 113.87 1pmm n PHE 253 Ca 0.01 0.12 0.05 0.00 -0.05 0.00 0.00 57.45 57.57 1pmm n PHE 253 Cb 0.26 -1.07 -0.02 0.00 -0.94 0.00 0.00 39.48 37.71 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 -3.23 0.00 -2.86 -4.37 0.24 -0.78 -4.76 118.33 102.56 1pmm n VAL 254 Ca -0.37 -0.35 -0.12 0.00 -2.04 0.00 0.00 64.34 61.46 1pmm n VAL 254 Cb 1.04 1.07 0.05 0.00 -1.47 0.00 0.00 33.84 34.54 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 -0.63 -0.02 0.32 2.33 0.00 -0.08 -4.87 120.51 117.56 1pmm n ALA 255 Ca 0.03 -2.00 0.20 0.00 0.00 0.00 0.00 53.44 51.67 1pmm n ALA 255 Cb 0.19 -1.10 1.10 0.00 0.00 0.00 0.00 19.45 19.63 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 3.04 0.00 0.00 0.00 0.13 -1.58 -2.52 132.00 131.07 1pmm h PRO 256 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1pmm h PRO 256 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1pmm h PRO 256 CO 0.24 0.00 -0.04 -0.25 -0.23 0.00 0.00 178.00 177.72 1pmm n ASP 257 N -3.22 0.22 -4.68 1.44 8.00 -1.26 -4.73 116.55 112.32 1pmm n ASP 257 Ca -0.02 0.47 -0.42 0.00 0.71 0.00 0.00 54.79 55.52 1pmm n ASP 257 Cb 0.14 -0.51 -0.03 0.00 -0.02 0.00 0.00 41.12 40.70 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 -3.02 3.84 -0.61 0.53 1.01 -0.95 -4.94 121.20 117.05 1pmm s ILE 258 Ca 0.13 1.14 -0.20 0.00 0.00 0.00 0.00 60.65 61.72 1pmm s ILE 258 Cb 0.17 -3.73 0.09 0.00 0.01 0.00 0.00 42.46 39.00 1pmm s ILE 258 CO 0.56 -0.04 0.80 -0.69 0.00 0.00 0.00 174.94 175.56 1pmm s VAL 259 N 2.96 4.64 0.00 2.92 1.01 -1.26 -4.74 120.40 125.93 1pmm s VAL 259 Ca 0.63 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1pmm s VAL 259 Cb -0.29 -4.56 0.00 0.00 0.00 0.00 0.00 36.38 31.53 1pmm s VAL 259 CO 0.24 -1.24 0.00 -2.67 0.00 0.00 0.00 175.10 171.43 1pmm n TRP 260 N 6.82 0.00 -0.43 5.22 4.27 -1.26 -3.87 117.44 128.19 1pmm n TRP 260 Ca -0.07 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.54 1pmm n TRP 260 Cb 0.44 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.39 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 -0.63 0.00 0.00 -0.67 5.68 -1.26 -4.84 116.55 114.83 1pmm n ASP 261 Ca 0.00 0.00 0.04 0.00 -0.50 0.00 0.00 54.79 54.33 1pmm n ASP 261 Cb 0.00 0.00 0.20 0.00 -1.14 0.00 0.00 41.12 40.18 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 0.28 2.11 3.72 -1.07 -1.17 117.46 121.33 1pmm n PHE 262 Ca 0.00 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.55 1pmm n PHE 262 Cb 0.00 -0.27 0.80 0.00 -0.94 0.00 0.00 39.48 39.08 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 -5.37 -1.08 3.08 -1.79 -3.39 114.38 105.84 1pmm h ARG 263 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 1pmm h ARG 263 Cb 0.07 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 29.99 1pmm h ARG 263 CO 0.00 0.08 0.02 -0.51 -1.07 0.00 0.00 179.97 178.48 1pmm s LEU 264 N -6.84 4.11 0.28 3.04 1.43 -0.32 -4.99 118.68 115.40 1pmm s LEU 264 Ca -0.02 0.43 0.01 0.00 -1.03 0.00 0.00 54.13 53.51 1pmm s LEU 264 Cb 0.12 -2.68 0.65 0.00 0.03 0.00 0.00 46.19 44.31 1pmm s LEU 264 CO 0.55 -0.36 1.66 -0.65 0.23 0.00 0.00 176.35 177.78 1pmm h PRO 265 N 8.12 0.23 0.00 1.29 0.11 -1.87 -1.89 132.00 137.99 1pmm h PRO 265 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1pmm h PRO 265 Cb 1.13 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1pmm h PRO 265 CO 0.74 0.15 0.00 0.54 -0.21 0.00 0.00 178.00 179.22 1pmm n ARG 266 N -5.20 0.16 -2.43 1.05 1.74 -1.26 -4.60 116.66 106.13 1pmm n ARG 266 Ca 0.20 0.33 -0.42 0.00 -0.77 0.00 0.00 57.85 57.19 1pmm n ARG 266 Cb 0.63 -1.77 -0.03 0.00 -1.02 0.00 0.00 32.46 30.27 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 -3.20 3.80 -0.16 1.55 1.01 -0.71 -0.62 120.40 122.07 1pmm s VAL 267 Ca 0.06 0.66 0.21 0.00 0.00 0.00 0.00 61.98 62.92 1pmm s VAL 267 Cb 0.10 -4.52 -0.12 0.00 0.00 0.00 0.00 36.38 31.84 1pmm s VAL 267 CO 0.41 -1.26 0.81 0.29 0.00 0.00 0.00 175.10 175.35 1pmm n LYS 268 N 8.72 0.63 -3.62 2.72 4.76 -0.83 -4.69 118.16 125.86 1pmm n LYS 268 Ca 0.11 0.06 -0.13 0.00 -2.87 0.00 0.00 58.31 55.48 1pmm n LYS 268 Cb 0.49 -1.74 -0.06 0.00 -1.84 0.00 0.00 35.03 31.89 1pmm n LYS 268 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1pmm s SER 269 N -5.27 -0.35 -0.02 4.39 1.04 -1.24 -0.65 113.70 111.59 1pmm s SER 269 Ca -0.03 0.05 -0.03 0.00 0.48 0.00 0.00 55.95 56.42 1pmm s SER 269 Cb 0.10 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.69 1pmm s SER 269 CO 0.82 -0.71 0.06 -0.63 0.98 0.00 0.00 173.24 173.77 1pmm s ILE 270 N -2.61 0.02 0.14 -1.02 1.01 -0.26 -1.77 121.20 116.71 1pmm s ILE 270 Ca -0.04 -0.14 0.07 0.00 0.00 0.00 0.00 60.65 60.54 1pmm s ILE 270 Cb -0.01 -0.14 -0.04 0.00 0.01 0.00 0.00 42.46 42.28 1pmm s ILE 270 CO -0.03 -0.08 -0.16 -0.94 0.00 0.00 0.00 174.94 173.73 1pmm s SER 271 N -0.21 2.28 0.15 3.58 1.04 -0.66 -0.77 113.70 119.10 1pmm s SER 271 Ca -0.03 -0.83 -0.23 0.00 0.48 0.00 0.00 55.95 55.34 1pmm s SER 271 Cb -0.02 -0.10 0.07 0.00 0.10 0.00 0.00 66.02 66.07 1pmm s SER 271 CO 0.00 -0.10 0.60 0.00 0.98 0.00 0.00 173.24 174.72 1pmm s ALA 272 N -2.10 -1.59 -0.35 5.32 0.00 0.63 -0.75 121.76 122.91 1pmm s ALA 272 Ca 0.12 0.52 -0.15 0.00 0.00 0.00 0.00 51.96 52.45 1pmm s ALA 272 Cb -0.05 0.83 -0.01 0.00 0.00 0.00 0.00 23.12 23.89 1pmm s ALA 272 CO 0.04 -0.74 0.34 -1.12 0.00 0.00 0.00 175.76 174.28 1pmm s SER 273 N -2.66 6.15 0.34 0.00 0.01 -0.69 -0.08 113.70 116.77 1pmm s SER 273 Ca 0.00 -0.36 0.05 0.00 1.31 0.00 0.00 55.95 56.95 1pmm s SER 273 Cb -0.01 -2.18 0.61 0.00 0.21 0.00 0.00 66.02 64.65 1pmm s SER 273 CO -0.12 -0.35 1.86 1.23 0.41 0.00 0.00 173.24 176.28 1pmm h GLY 274 N 8.71 0.49 0.35 3.44 0.00 -0.87 -2.36 103.07 112.83 1pmm h GLY 274 Ca -0.30 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.73 1pmm h GLY 274 CO 0.69 0.29 0.00 -2.39 0.00 0.00 0.00 176.54 175.13 1pmm n HIS 275 N -4.25 0.02 0.00 5.60 1.44 -0.77 -0.96 115.22 116.30 1pmm n HIS 275 Ca 0.01 -0.01 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 1pmm n HIS 275 Cb 0.27 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.38 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 -0.64 0.00 0.00 -1.40 5.02 -0.89 -0.75 118.16 119.50 1pmm n LYS 276 Ca 0.11 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.54 1pmm n LYS 276 Cb 0.07 0.00 0.82 0.00 -0.02 0.00 0.00 35.03 35.90 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 1.32 2.13 3.72 -1.25 -2.90 117.46 120.48 1pmm n PHE 277 Ca 0.00 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.53 1pmm n PHE 277 Cb 0.00 0.00 0.69 0.00 -0.94 0.00 0.00 39.48 39.23 1pmm n PHE 277 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1pmm n GLY 278 N 0.86 -1.09 2.51 1.37 0.00 -1.01 -4.84 105.19 103.00 1pmm n GLY 278 Ca 0.21 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.23 -0.14 -4.91 0.99 4.77 -0.81 -4.88 117.00 110.79 1pmm n LEU 279 Ca 0.14 0.16 -0.27 0.00 -0.03 0.00 0.00 56.01 56.01 1pmm n LEU 279 Cb 0.18 -1.89 -0.02 0.00 -2.33 0.00 0.00 43.42 39.37 1pmm n LEU 279 CO 0.19 -0.67 0.24 0.00 -1.33 0.00 0.00 177.39 175.82 1pmm s ALA 280 N -1.91 3.60 0.73 -1.18 0.00 -0.14 -4.96 121.76 117.89 1pmm s ALA 280 Ca 0.00 -0.63 -0.12 0.00 0.00 0.00 0.00 51.96 51.21 1pmm s ALA 280 Cb 0.00 -2.31 0.03 0.00 0.00 0.00 0.00 23.12 20.85 1pmm s ALA 280 CO 0.00 0.08 1.09 -1.25 0.00 0.00 0.00 175.76 175.68 1pmm s PRO 281 N -3.92 2.53 0.05 0.00 0.04 -1.26 -3.99 135.00 128.45 1pmm s PRO 281 Ca 0.44 1.19 -0.38 0.00 0.04 0.00 0.00 61.00 62.29 1pmm s PRO 281 Cb -0.10 -1.93 -0.18 0.00 0.04 0.00 0.00 34.50 32.33 1pmm s PRO 281 CO 0.34 -1.43 1.23 1.28 0.04 0.00 0.00 177.00 178.45 1pmm n LEU 282 N -3.14 0.97 0.00 -3.56 4.77 -1.26 -3.89 117.00 110.89 1pmm n LEU 282 Ca 0.09 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.21 1pmm n LEU 282 Cb 0.53 -1.08 0.00 0.00 -2.33 0.00 0.00 43.42 40.54 1pmm n LEU 282 CO 0.52 -1.40 0.00 0.61 -1.33 0.00 0.00 177.39 175.79 1pmm n GLY 283 N 2.11 1.66 2.90 -0.72 0.00 -1.25 -4.94 105.19 104.95 1pmm n GLY 283 Ca 0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 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 2.35 1.46 -0.01 0.00 0.00 0.17 -0.18 107.32 111.10 1pmm s GLY 285 Ca 0.02 -1.72 -0.01 0.00 0.00 0.00 0.00 44.72 43.02 1pmm s GLY 285 CO -0.07 -1.61 0.03 -0.98 0.00 0.00 0.00 173.10 170.47 1pmm s TRP 286 N -3.55 0.01 -0.04 1.90 0.52 0.89 -0.66 118.94 118.00 1pmm s TRP 286 Ca 0.28 -0.00 -0.02 0.00 0.02 0.00 0.00 56.10 56.38 1pmm s TRP 286 Cb 0.06 -0.02 0.03 0.00 -1.15 0.00 0.00 33.47 32.40 1pmm s TRP 286 CO 0.08 -0.05 0.08 0.54 0.02 0.00 0.00 176.95 177.62 1pmm s VAL 287 N -0.24 -0.10 -0.01 4.03 0.11 -0.98 -0.27 120.40 122.94 1pmm s VAL 287 Ca -0.03 0.28 0.07 0.00 -2.93 0.00 0.00 61.98 59.38 1pmm s VAL 287 Cb -0.02 -0.17 -0.02 0.00 -1.53 0.00 0.00 36.38 34.65 1pmm s VAL 287 CO -0.00 0.12 -0.23 -0.63 -3.33 0.00 0.00 175.10 171.02 1pmm s ILE 288 N 1.56 1.84 0.08 7.04 -1.09 0.05 -1.36 121.20 129.31 1pmm s ILE 288 Ca -0.04 -1.04 0.04 0.00 -2.23 0.00 0.00 60.65 57.38 1pmm s ILE 288 Cb -0.12 -1.54 -0.04 0.00 -1.58 0.00 0.00 42.46 39.18 1pmm s ILE 288 CO -0.04 0.48 0.04 0.26 -1.23 0.00 0.00 174.94 174.44 1pmm s TRP 289 N -0.59 3.09 0.33 3.97 0.51 -0.33 -1.11 118.94 124.82 1pmm s TRP 289 Ca 0.09 0.03 0.20 0.00 -2.12 0.00 0.00 56.10 54.30 1pmm s TRP 289 Cb -0.09 -1.58 1.00 0.00 -0.81 0.00 0.00 33.47 31.99 1pmm s TRP 289 CO -0.00 0.50 1.91 0.07 -0.51 0.00 0.00 176.95 178.91 1pmm h ARG 290 N 3.44 0.00 -2.37 4.98 0.11 -1.16 -3.40 114.38 115.98 1pmm h ARG 290 Ca -0.47 0.00 0.18 0.00 0.10 0.00 0.00 59.98 59.79 1pmm h ARG 290 Cb 1.16 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 32.18 1pmm h ARG 290 CO 0.62 0.26 0.55 0.16 0.10 0.00 0.00 179.97 181.67 1pmm s ASP 291 N -6.51 -0.08 0.30 0.08 1.47 -1.26 -4.19 116.67 106.47 1pmm s ASP 291 Ca -0.02 -0.52 0.02 0.00 1.18 0.00 0.00 52.55 53.21 1pmm s ASP 291 Cb 0.13 0.47 0.59 0.00 -0.34 0.00 0.00 42.92 43.77 1pmm s ASP 291 CO 0.66 -0.91 1.88 1.05 0.68 0.00 0.00 175.17 178.53 1pmm h GLU 292 N 2.00 0.93 -0.01 2.11 4.11 -1.93 -1.64 114.58 120.15 1pmm h GLU 292 Ca -0.26 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.12 1pmm h GLU 292 Cb 1.22 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1pmm h GLU 292 CO 0.31 0.62 0.01 1.49 0.07 0.00 0.00 179.01 181.50 1pmm h GLU 293 N 0.96 0.00 0.00 1.06 4.81 -2.00 -2.01 114.58 117.40 1pmm h GLU 293 Ca 0.44 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.67 1pmm h GLU 293 Cb 0.39 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1pmm h GLU 293 CO -0.20 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.08 1pmm n ALA 294 N -2.52 2.04 -3.83 2.92 0.00 -0.62 -4.56 120.51 113.94 1pmm n ALA 294 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.08 1pmm n ALA 294 Cb 0.10 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 17.99 1pmm n ALA 294 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1pmm s LEU 295 N -4.24 4.50 -0.01 0.00 2.96 -0.76 -4.86 118.68 116.27 1pmm s LEU 295 Ca 0.09 -1.75 -0.35 0.00 -0.22 0.00 0.00 54.13 51.90 1pmm s LEU 295 Cb 0.12 -1.71 -0.13 0.00 0.50 0.00 0.00 46.19 44.97 1pmm s LEU 295 CO 0.50 -0.37 1.73 -2.65 -1.32 0.00 0.00 176.35 174.23 1pmm n PRO 296 N 4.50 1.99 0.14 0.98 -0.02 -1.26 -4.86 135.00 136.46 1pmm n PRO 296 Ca -0.05 0.73 0.10 0.00 -2.02 0.00 0.00 63.50 62.25 1pmm n PRO 296 Cb 0.42 -2.51 0.60 0.00 -0.02 0.00 0.00 33.50 31.99 1pmm n PRO 296 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1pmm h GLN 297 N 7.57 0.13 0.00 -0.52 5.75 -1.95 -1.28 115.11 124.81 1pmm h GLN 297 Ca -0.47 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.02 1pmm h GLN 297 Cb 1.28 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.80 1pmm h GLN 297 CO 0.92 0.08 0.11 0.93 -2.65 0.00 0.00 178.83 178.22 1pmm h GLU 298 N 0.13 0.00 0.00 1.69 3.07 -2.03 -0.14 114.58 117.30 1pmm h GLU 298 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 1pmm h GLU 298 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1pmm h GLU 298 CO -0.01 0.00 -0.82 1.28 -1.40 0.00 0.00 179.01 178.05 1pmm n LEU 299 N -3.00 0.64 -4.78 1.33 4.32 -0.48 -4.91 117.00 110.11 1pmm n LEU 299 Ca -0.03 0.06 -0.37 0.00 -0.02 0.00 0.00 56.01 55.66 1pmm n LEU 299 Cb 0.17 -0.14 -0.07 0.00 -1.62 0.00 0.00 43.42 41.76 1pmm n LEU 299 CO 0.18 0.02 -0.04 -0.69 -1.22 0.00 0.00 177.39 175.64 1pmm s VAL 300 N -3.16 5.30 -0.32 4.08 1.01 -0.07 -4.74 120.40 122.51 1pmm s VAL 300 Ca 0.05 0.50 -0.05 0.00 0.00 0.00 0.00 61.98 62.49 1pmm s VAL 300 Cb 0.14 -3.59 0.04 0.00 0.00 0.00 0.00 36.38 32.98 1pmm s VAL 300 CO 0.76 0.47 0.07 -0.36 0.00 0.00 0.00 175.10 176.04 1pmm s PHE 301 N -0.09 3.24 0.35 5.22 0.40 0.29 -4.87 117.98 122.52 1pmm s PHE 301 Ca 0.17 -1.52 -0.26 0.00 -0.60 0.00 0.00 56.93 54.72 1pmm s PHE 301 Cb -0.13 -2.22 -0.09 0.00 0.51 0.00 0.00 43.02 41.09 1pmm s PHE 301 CO 0.05 -0.74 1.03 -0.80 0.70 0.00 0.00 175.22 175.46 1pmm s ASN 302 N 1.37 7.02 0.04 1.36 0.01 -1.26 -1.73 114.94 121.74 1pmm s ASN 302 Ca -0.02 2.02 0.03 0.00 -0.71 0.00 0.00 52.86 54.18 1pmm s ASN 302 Cb -0.19 -2.59 -0.02 0.00 0.41 0.00 0.00 41.25 38.85 1pmm s ASN 302 CO 0.01 -0.31 -0.10 0.68 -1.51 0.00 0.00 177.10 175.88 1pmm s VAL 303 N -1.55 0.76 0.37 1.60 -7.23 -0.56 -4.94 120.40 108.84 1pmm s VAL 303 Ca 0.53 -1.00 -0.28 0.00 -1.81 0.00 0.00 61.98 59.42 1pmm s VAL 303 Cb -0.23 -0.75 -0.11 0.00 0.56 0.00 0.00 36.38 35.85 1pmm s VAL 303 CO 0.29 -0.20 1.51 -1.81 -0.31 0.00 0.00 175.10 174.57 1pmm s ASP 304 N -1.33 6.33 -0.28 4.85 1.01 -1.26 -0.89 116.67 125.10 1pmm s ASP 304 Ca -0.04 3.05 -0.02 0.00 0.71 0.00 0.00 52.55 56.25 1pmm s ASP 304 Cb -0.08 -2.66 0.17 0.00 1.01 0.00 0.00 42.92 41.35 1pmm s ASP 304 CO 0.01 -0.89 0.51 -0.47 0.21 0.00 0.00 175.17 174.54 1pmm s TYR 305 N -0.96 -1.29 -1.25 4.23 5.04 0.16 -4.49 117.35 118.79 1pmm s TYR 305 Ca 0.54 1.38 -0.13 0.00 -2.44 0.00 0.00 57.07 56.42 1pmm s TYR 305 Cb -0.47 0.36 -0.00 0.00 0.35 0.00 0.00 41.96 42.19 1pmm s TYR 305 CO 0.61 -0.81 0.65 1.28 -1.34 0.00 0.00 175.55 175.94 1pmm n LEU 306 N 5.40 -2.48 0.00 6.97 4.77 -1.26 -0.68 117.00 129.73 1pmm n LEU 306 Ca -0.02 -1.02 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 1pmm n LEU 306 Cb 0.51 -2.30 0.00 0.00 -2.33 0.00 0.00 43.42 39.30 1pmm n LEU 306 CO 0.04 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1pmm n GLY 307 N -1.81 1.55 0.00 -0.72 0.00 -1.26 -4.93 105.19 98.02 1pmm n GLY 307 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 5.64 3.01 -0.02 0.00 0.15 -5.17 105.19 106.79 1pmm n GLY 308 Ca 0.00 -1.52 -0.11 0.00 0.00 0.00 0.00 46.02 44.38 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 1.66 0.40 -0.05 1.61 -0.21 -1.25 0.36 119.66 122.17 1pmm s GLN 309 Ca 0.00 -0.62 0.03 0.00 0.02 0.00 0.00 55.36 54.80 1pmm s GLN 309 Cb 0.00 -0.10 0.00 0.00 1.00 0.00 0.00 33.01 33.91 1pmm s GLN 309 CO 0.00 0.01 -0.15 -1.50 -2.12 0.00 0.00 175.29 171.52 1pmm s ILE 310 N -1.27 1.33 0.28 1.08 1.10 -0.07 -4.83 121.20 118.82 1pmm s ILE 310 Ca -0.11 -0.63 -0.29 0.00 -0.51 0.00 0.00 60.65 59.11 1pmm s ILE 310 Cb -0.09 -1.17 -0.09 0.00 0.15 0.00 0.00 42.46 41.26 1pmm s ILE 310 CO -0.00 0.39 1.05 -0.83 -2.11 0.00 0.00 174.94 173.44 1pmm s GLY 311 N 0.31 3.04 0.00 1.50 0.00 -1.26 -1.50 107.32 109.41 1pmm s GLY 311 Ca -0.09 0.80 0.04 0.00 0.00 0.00 0.00 44.72 45.47 1pmm s GLY 311 CO 0.03 1.37 -0.14 -0.51 0.00 0.00 0.00 173.10 173.86 1pmm s THR 312 N -1.23 1.07 -0.29 0.90 -4.23 -0.71 -4.95 115.64 106.21 1pmm s THR 312 Ca 0.45 -0.67 -0.02 0.00 -1.18 0.00 0.00 61.69 60.27 1pmm s THR 312 Cb -0.29 -0.91 0.12 0.00 1.34 0.00 0.00 72.50 72.76 1pmm s THR 312 CO 0.37 0.23 0.22 0.12 -0.54 0.00 0.00 174.62 175.02 1pmm s PHE 313 N -0.44 -0.08 0.03 3.99 5.36 -1.26 -0.55 117.98 125.04 1pmm s PHE 313 Ca 0.04 -0.54 -0.15 0.00 -0.96 0.00 0.00 56.93 55.33 1pmm s PHE 313 Cb -0.06 -0.67 0.02 0.00 -0.34 0.00 0.00 43.02 41.98 1pmm s PHE 313 CO -0.00 -0.88 0.33 0.00 -1.46 0.00 0.00 175.22 173.21 1pmm s ALA 314 N 2.20 -0.77 -0.14 11.12 0.00 -1.26 -4.96 121.76 127.96 1pmm s ALA 314 Ca 0.10 0.12 -0.04 0.00 0.00 0.00 0.00 51.96 52.14 1pmm s ALA 314 Cb -0.15 0.29 -0.25 0.00 0.00 0.00 0.00 23.12 23.01 1pmm s ALA 314 CO -0.34 -0.40 0.29 -0.89 0.00 0.00 0.00 175.76 174.43 1pmm n ILE 315 N 0.67 1.72 -2.29 0.00 5.41 -1.26 -4.92 119.36 118.70 1pmm n ILE 315 Ca -0.19 -0.66 -0.28 0.00 1.00 0.00 0.00 62.75 62.63 1pmm n ILE 315 Cb 0.59 -1.63 0.03 0.00 -0.71 0.00 0.00 39.64 37.92 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 -6.88 5.65 0.00 4.38 0.01 -1.26 -5.07 114.94 111.77 1pmm s ASN 316 Ca -0.23 0.85 0.00 0.00 -0.71 0.00 0.00 52.86 52.77 1pmm s ASN 316 Cb 0.07 -1.84 0.00 0.00 0.41 0.00 0.00 41.25 39.89 1pmm s ASN 316 CO 0.75 -1.07 0.00 0.33 -1.51 0.00 0.00 177.10 175.60 1pmm n PHE 317 N -2.65 0.00 -2.12 2.20 7.35 -1.26 -5.05 117.46 115.93 1pmm n PHE 317 Ca 0.05 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.33 1pmm n PHE 317 Cb 0.57 0.00 -0.02 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 0.73 6.79 -0.07 -2.13 0.01 -1.26 -4.26 113.70 113.50 1pmm s SER 318 Ca 0.00 2.59 -0.31 0.00 1.31 0.00 0.00 55.95 59.54 1pmm s SER 318 Cb 0.00 -2.63 0.12 0.00 0.21 0.00 0.00 66.02 63.72 1pmm s SER 318 CO 0.00 -0.57 1.07 0.00 0.41 0.00 0.00 173.24 174.15 1pmm s ARG 319 N -0.89 0.59 0.35 12.44 1.70 -1.26 -4.99 118.95 126.90 1pmm s ARG 319 Ca 0.54 -0.24 -0.29 0.00 -0.47 0.00 0.00 55.73 55.27 1pmm s ARG 319 Cb -0.39 0.26 -0.11 0.00 -0.57 0.00 0.00 34.95 34.13 1pmm s ARG 319 CO 0.46 -0.26 1.51 -2.14 -1.08 0.00 0.00 175.30 173.78 1pmm s PRO 320 N -2.77 4.12 0.00 3.89 0.02 -1.26 -0.18 135.00 138.82 1pmm s PRO 320 Ca 0.08 2.56 0.25 0.00 0.02 0.00 0.00 61.00 63.91 1pmm s PRO 320 Cb -0.01 -2.99 0.41 0.00 0.02 0.00 0.00 34.50 31.93 1pmm s PRO 320 CO -0.06 -0.55 1.35 0.00 -0.33 0.00 0.00 177.00 177.41 1pmm n ALA 321 N 0.94 3.25 -0.18 -1.55 0.00 -0.38 -4.46 120.51 118.13 1pmm n ALA 321 Ca 0.03 -0.53 -0.02 0.00 0.00 0.00 0.00 53.44 52.93 1pmm n ALA 321 Cb 0.39 -0.97 0.08 0.00 0.00 0.00 0.00 19.45 18.95 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 4.88 0.74 0.95 0.00 0.00 -1.82 -2.49 103.07 105.34 1pmm h GLY 322 Ca 0.00 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.25 1pmm h GLY 322 CO 0.00 -0.01 0.47 1.46 0.00 0.00 0.00 176.54 178.46 1pmm h GLN 323 N 0.37 0.92 -0.37 4.80 7.50 -1.87 0.16 115.11 126.62 1pmm h GLN 323 Ca 0.27 -0.06 -0.13 0.00 0.50 0.00 0.00 58.65 59.24 1pmm h GLN 323 Cb 0.32 -0.21 -0.01 0.00 0.05 0.00 0.00 27.48 27.63 1pmm h GLN 323 CO -0.28 0.61 -0.30 -0.24 -1.50 0.00 0.00 178.83 177.12 1pmm h VAL 324 N 0.94 1.28 -0.66 -0.54 3.04 -1.83 0.24 116.25 118.73 1pmm h VAL 324 Ca 0.28 -1.44 -0.05 0.00 -1.01 0.00 0.00 66.70 64.47 1pmm h VAL 324 Cb -0.06 1.31 -0.03 0.00 -2.01 0.00 0.00 31.29 30.51 1pmm h VAL 324 CO -0.08 0.48 0.22 0.40 -1.01 0.00 0.00 177.57 177.57 1pmm h ILE 325 N 0.67 1.25 -0.55 3.17 2.04 -0.99 -0.22 117.51 122.88 1pmm h ILE 325 Ca 0.08 -0.84 -0.07 0.00 1.00 0.00 0.00 64.86 65.03 1pmm h ILE 325 Cb 0.83 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1pmm h ILE 325 CO 0.07 0.33 0.09 0.00 0.00 0.00 0.00 178.15 178.64 1pmm h ALA 326 N 1.09 0.73 -0.56 1.87 0.00 -0.36 -1.68 119.26 120.36 1pmm h ALA 326 Ca 0.21 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1pmm h ALA 326 Cb 0.28 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1pmm h ALA 326 CO -0.01 0.48 0.34 0.37 0.00 0.00 0.00 179.25 180.43 1pmm h GLN 327 N 0.80 0.65 -0.90 0.00 5.75 -0.01 -1.67 115.11 119.74 1pmm h GLN 327 Ca 0.17 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.61 1pmm h GLN 327 Cb 0.41 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 28.77 1pmm h GLN 327 CO 0.01 0.43 0.49 -0.92 -2.65 0.00 0.00 178.83 176.19 1pmm h TYR 328 N 0.67 1.24 -0.29 3.99 3.20 -0.74 -1.74 116.97 123.31 1pmm h TYR 328 Ca 0.22 -0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.08 1pmm h TYR 328 Cb 0.01 -0.40 -0.02 0.00 1.54 0.00 0.00 36.73 37.86 1pmm h TYR 328 CO -0.06 0.86 0.15 -0.92 -1.64 0.00 0.00 178.16 176.55 1pmm h TYR 329 N 1.26 0.27 -0.72 -3.82 3.20 -0.62 -1.19 116.97 115.36 1pmm h TYR 329 Ca 0.32 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.20 1pmm h TYR 329 Cb 0.03 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.19 1pmm h TYR 329 CO 0.01 0.15 0.46 0.93 -1.64 0.00 0.00 178.16 178.08 1pmm h GLU 330 N 0.31 0.96 -0.17 1.82 4.39 -0.93 0.46 114.58 121.42 1pmm h GLU 330 Ca 0.12 -0.07 0.02 0.00 0.34 0.00 0.00 59.36 59.77 1pmm h GLU 330 Cb 0.03 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 1pmm h GLU 330 CO -0.08 0.65 0.02 0.74 -1.16 0.00 0.00 179.01 179.18 1pmm h PHE 331 N 0.98 0.03 -0.25 4.33 0.04 -0.85 0.14 116.94 121.36 1pmm h PHE 331 Ca 0.26 0.01 -0.18 0.00 2.80 0.00 0.00 57.97 60.86 1pmm h PHE 331 Cb -0.08 0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.08 1pmm h PHE 331 CO -0.02 0.00 -0.55 -0.07 -0.60 0.00 0.00 178.31 177.07 1pmm h LEU 332 N 0.08 0.91 -0.36 1.54 3.38 -0.90 -0.58 115.31 119.39 1pmm h LEU 332 Ca 0.08 -0.55 -0.18 0.00 0.09 0.00 0.00 57.88 57.32 1pmm h LEU 332 Cb 0.08 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1pmm h LEU 332 CO -0.11 1.30 -0.50 -0.09 0.09 0.00 0.00 178.44 179.13 1pmm h ARG 333 N 0.57 0.86 0.01 1.13 1.12 0.04 -3.38 114.38 114.72 1pmm h ARG 333 Ca 0.00 -0.51 -0.40 0.00 -1.11 0.00 0.00 59.98 57.96 1pmm h ARG 333 Cb 1.16 0.05 -0.06 0.00 -0.01 0.00 0.00 29.97 31.11 1pmm h ARG 333 CO 0.12 1.15 -2.22 1.28 -3.11 0.00 0.00 179.97 177.19 1pmm n LEU 334 N -4.02 2.16 0.00 3.80 4.77 0.46 -4.93 117.00 119.24 1pmm n LEU 334 Ca -0.04 0.27 0.08 0.00 -0.03 0.00 0.00 56.01 56.30 1pmm n LEU 334 Cb 0.60 -0.89 -0.02 0.00 -2.33 0.00 0.00 43.42 40.78 1pmm n LEU 334 CO 0.49 0.59 -0.11 0.61 -1.33 0.00 0.00 177.39 177.64 1pmm n GLY 335 N 1.51 -1.67 0.29 -0.72 0.00 -0.23 -0.33 105.19 104.04 1pmm n GLY 335 Ca -0.47 -1.19 -0.02 0.00 0.00 0.00 0.00 46.02 44.34 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 0.85 0.04 1.61 3.08 -1.96 -1.20 114.38 116.79 1pmm h ARG 336 Ca 0.01 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.04 1pmm h ARG 336 Cb 0.57 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 1pmm h ARG 336 CO 0.00 0.56 -0.22 1.49 -1.07 0.00 0.00 179.97 180.74 1pmm h GLU 337 N 0.88 -0.35 -0.37 0.04 4.81 -2.00 -0.88 114.58 116.71 1pmm h GLU 337 Ca 0.31 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.55 1pmm h GLU 337 Cb 0.09 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1pmm h GLU 337 CO -0.14 -0.23 0.18 0.78 -0.73 0.00 0.00 179.01 178.86 1pmm h GLY 338 N -0.36 0.58 1.09 1.92 0.00 -0.34 -2.07 103.07 103.89 1pmm h GLY 338 Ca 0.05 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 1pmm h GLY 338 CO -0.17 0.28 0.41 -0.97 0.00 0.00 0.00 176.54 176.09 1pmm h TYR 339 N 0.46 1.17 -0.65 5.60 -1.99 -1.10 -1.05 116.97 119.42 1pmm h TYR 339 Ca 0.13 -0.05 -0.02 0.00 2.00 0.00 0.00 58.73 60.79 1pmm h TYR 339 Cb 0.13 -0.37 -0.03 0.00 2.00 0.00 0.00 36.73 38.46 1pmm h TYR 339 CO -0.01 0.84 0.32 1.15 -0.00 0.00 0.00 178.16 180.45 1pmm h THR 340 N 1.17 1.22 -0.51 -2.88 2.02 -0.96 0.85 112.91 113.83 1pmm h THR 340 Ca 0.29 -0.61 -0.06 0.00 0.77 0.00 0.00 66.41 66.80 1pmm h THR 340 Cb 0.09 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 1pmm h THR 340 CO -0.04 0.25 0.09 0.11 0.37 0.00 0.00 175.52 176.31 1pmm h LYS 341 N 0.89 0.83 -0.17 6.66 1.57 -0.98 0.11 116.57 125.48 1pmm h LYS 341 Ca 0.22 -0.22 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1pmm h LYS 341 Cb 0.11 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1pmm h LYS 341 CO -0.03 0.82 0.00 0.28 -0.57 0.00 0.00 179.45 179.95 1pmm h VAL 342 N 0.71 1.25 -0.36 0.50 2.07 -0.91 -2.33 116.25 117.19 1pmm h VAL 342 Ca 0.16 -0.84 -0.10 0.00 0.82 0.00 0.00 66.70 66.73 1pmm h VAL 342 Cb 0.38 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1pmm h VAL 342 CO 0.01 0.25 -0.20 1.56 0.02 0.00 0.00 177.57 179.21 1pmm h GLN 343 N 0.06 0.68 -0.58 1.57 1.08 -0.76 -2.42 115.11 114.74 1pmm h GLN 343 Ca 0.05 -0.26 -0.00 0.00 -1.45 0.00 0.00 58.65 56.99 1pmm h GLN 343 Cb 0.37 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.73 1pmm h GLN 343 CO 0.01 0.83 0.35 -0.91 -0.95 0.00 0.00 178.83 178.16 1pmm h ASN 344 N 0.60 0.69 -0.50 1.46 2.35 -0.71 -1.78 115.58 117.70 1pmm h ASN 344 Ca 0.09 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1pmm h ASN 344 Cb 0.67 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.85 1pmm h ASN 344 CO 0.05 0.53 0.23 0.00 -1.65 0.00 0.00 177.43 176.59 1pmm h ALA 345 N 1.59 0.65 -0.53 -0.83 0.00 -0.92 -0.47 119.26 118.74 1pmm h ALA 345 Ca 0.21 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1pmm h ALA 345 Cb -0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1pmm h ALA 345 CO -0.04 0.22 0.14 0.77 0.00 0.00 0.00 179.25 180.35 1pmm h SER 346 N 0.66 0.79 -0.45 0.00 0.02 -1.18 -1.97 113.55 111.43 1pmm h SER 346 Ca 0.17 -0.22 -0.06 0.00 -0.84 0.00 0.00 61.79 60.84 1pmm h SER 346 Cb 0.14 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 1pmm h SER 346 CO -0.02 0.81 0.08 1.88 -1.14 0.00 0.00 176.83 178.44 1pmm h TYR 347 N 0.74 0.85 -0.66 3.45 0.05 -1.15 0.06 116.97 120.32 1pmm h TYR 347 Ca 0.17 -0.09 -0.03 0.00 0.05 0.00 0.00 58.73 58.82 1pmm h TYR 347 Cb 0.32 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 37.78 1pmm h TYR 347 CO 0.02 0.74 0.28 0.37 -1.05 0.00 0.00 178.16 178.52 1pmm h GLN 348 N 0.78 0.97 -0.26 4.88 4.15 -0.79 0.31 115.11 125.15 1pmm h GLN 348 Ca 0.16 -0.17 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 1pmm h GLN 348 Cb 0.36 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 1pmm h GLN 348 CO 0.01 0.80 -0.11 0.28 -1.93 0.00 0.00 178.83 177.87 1pmm h VAL 349 N 0.92 1.30 -0.53 2.39 2.07 -0.93 -1.34 116.25 120.12 1pmm h VAL 349 Ca 0.22 -1.18 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 1pmm h VAL 349 Cb 0.18 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1pmm h VAL 349 CO -0.02 0.37 0.28 0.00 0.02 0.00 0.00 177.57 178.22 1pmm h ALA 350 N 0.74 0.69 -0.68 1.67 0.00 -0.80 -1.13 119.26 119.74 1pmm h ALA 350 Ca 0.06 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1pmm h ALA 350 Cb 0.62 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1pmm h ALA 350 CO 0.04 0.22 0.13 0.00 0.00 0.00 0.00 179.25 179.63 1pmm h ALA 351 N 1.12 0.94 0.24 0.00 0.00 -0.91 -1.33 119.26 119.32 1pmm h ALA 351 Ca 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1pmm h ALA 351 Cb 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1pmm h ALA 351 CO -0.03 0.66 -0.11 -0.92 0.00 0.00 0.00 179.25 178.85 1pmm h TYR 352 N 1.04 -0.30 -0.79 0.00 3.20 -0.88 -1.75 116.97 117.50 1pmm h TYR 352 Ca 0.21 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.09 1pmm h TYR 352 Cb 0.42 0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 1pmm h TYR 352 CO 0.03 -0.12 0.51 -0.07 -1.64 0.00 0.00 178.16 176.87 1pmm h LEU 353 N -0.41 0.86 -0.33 2.82 3.38 -1.13 -0.33 115.31 120.17 1pmm h LEU 353 Ca -0.03 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1pmm h LEU 353 Cb 0.31 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1pmm h LEU 353 CO 0.05 0.60 0.17 0.00 0.09 0.00 0.00 178.44 179.35 1pmm h ALA 354 N 1.32 0.40 -0.52 1.53 0.00 -1.13 0.26 119.26 121.12 1pmm h ALA 354 Ca 0.31 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 1pmm h ALA 354 Cb -0.03 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1pmm h ALA 354 CO -0.10 -0.21 0.21 0.22 0.00 0.00 0.00 179.25 179.37 1pmm h ASP 355 N 0.34 0.71 -0.20 0.00 3.58 -0.82 -2.20 116.42 117.83 1pmm h ASP 355 Ca 0.14 -0.17 -0.14 0.00 0.42 0.00 0.00 57.03 57.27 1pmm h ASP 355 Cb 0.04 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 40.91 1pmm h ASP 355 CO -0.09 0.69 -0.44 -0.33 -2.88 0.00 0.00 179.24 176.19 1pmm h GLU 356 N 0.69 0.65 0.00 0.28 4.39 -0.75 -3.13 114.58 116.72 1pmm h GLU 356 Ca 0.17 -0.43 -0.04 0.00 0.34 0.00 0.00 59.36 59.40 1pmm h GLU 356 Cb 0.20 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1pmm h GLU 356 CO -0.01 1.05 -0.20 0.82 -1.16 0.00 0.00 179.01 179.51 1pmm h ILE 357 N 0.35 0.88 -0.38 3.13 2.04 -0.48 -2.38 117.51 120.66 1pmm h ILE 357 Ca 0.00 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 1pmm h ILE 357 Cb 1.05 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 1pmm h ILE 357 CO 0.10 0.20 0.10 0.00 0.00 0.00 0.00 178.15 178.54 1pmm h ALA 358 N 1.80 1.45 0.00 1.87 0.00 -1.34 -1.84 119.26 121.20 1pmm h ALA 358 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1pmm h ALA 358 Cb 0.43 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1pmm h ALA 358 CO 0.03 0.40 0.00 1.63 0.00 0.00 0.00 179.25 181.31 1pmm n LYS 359 N -4.34 0.03 0.01 0.00 5.02 -0.90 -3.57 118.16 114.42 1pmm n LYS 359 Ca 0.02 0.18 0.11 0.00 -2.02 0.00 0.00 58.31 56.60 1pmm n LYS 359 Cb 0.19 -1.55 -0.01 0.00 -0.02 0.00 0.00 35.03 33.63 1pmm n LYS 359 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1pmm n LEU 360 N -1.61 0.70 -3.81 -0.35 4.77 -0.69 -5.05 117.00 110.95 1pmm n LEU 360 Ca 0.05 -0.21 -0.02 0.00 -0.03 0.00 0.00 56.01 55.79 1pmm n LEU 360 Cb 0.25 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1pmm n LEU 360 CO 0.20 0.14 0.85 -0.83 -1.33 0.00 0.00 177.39 176.42 1pmm s GLY 361 N -3.33 -0.09 -1.48 -0.72 0.00 -1.23 -5.05 107.32 95.42 1pmm s GLY 361 Ca 0.06 -0.01 -0.13 0.00 0.00 0.00 0.00 44.72 44.64 1pmm s GLY 361 CO 0.82 1.60 2.32 -1.55 0.00 0.00 0.00 173.10 176.29 1pmm n PRO 362 N -0.62 3.01 -4.07 2.90 -0.04 -1.26 -4.86 135.00 130.07 1pmm n PRO 362 Ca -0.04 -2.59 -0.26 0.00 -0.04 0.00 0.00 63.50 60.57 1pmm n PRO 362 Cb 0.60 -3.20 -0.05 0.00 -0.04 0.00 0.00 33.50 30.81 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 2.91 3.19 -0.21 0.54 2.02 -1.26 -0.74 117.35 123.80 1pmm s TYR 363 Ca 0.50 -0.01 0.01 0.00 -0.37 0.00 0.00 57.07 57.20 1pmm s TYR 363 Cb 0.14 -1.52 0.04 0.00 -0.40 0.00 0.00 41.96 40.23 1pmm s TYR 363 CO -0.08 0.52 -0.12 -2.00 -1.57 0.00 0.00 175.55 172.30 1pmm s GLU 364 N -3.18 2.22 0.08 -0.62 2.12 0.45 -4.74 118.70 115.04 1pmm s GLU 364 Ca 0.31 -0.94 -0.27 0.00 0.36 0.00 0.00 54.97 54.43 1pmm s GLU 364 Cb -0.10 -2.53 -0.06 0.00 0.26 0.00 0.00 34.13 31.70 1pmm s GLU 364 CO 0.24 -0.42 0.86 -0.06 -0.54 0.00 0.00 175.26 175.34 1pmm s PHE 365 N 1.32 3.78 -0.20 5.30 0.40 -1.26 -1.81 117.98 125.51 1pmm s PHE 365 Ca -0.02 1.64 0.13 0.00 -0.60 0.00 0.00 56.93 58.08 1pmm s PHE 365 Cb -0.16 -2.93 -0.23 0.00 0.51 0.00 0.00 43.02 40.20 1pmm s PHE 365 CO -0.08 0.25 0.04 -0.89 0.70 0.00 0.00 175.22 175.23 1pmm n ILE 366 N 2.74 1.44 -3.79 0.64 5.41 0.14 -4.94 119.36 121.00 1pmm n ILE 366 Ca -0.00 -0.78 -0.13 0.00 1.00 0.00 0.00 62.75 62.84 1pmm n ILE 366 Cb 0.50 -0.77 -0.15 0.00 -0.71 0.00 0.00 39.64 38.51 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 3.75 1.11 -2.62 0.00 -2.24 -1.25 -1.40 114.28 111.63 1pmm n THR 368 Ca -0.21 -1.93 -0.13 0.00 -2.27 0.00 0.00 64.05 59.50 1pmm n THR 368 Cb 0.54 0.29 0.02 0.00 -2.10 0.00 0.00 70.33 69.08 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 -0.44 -0.04 3.63 3.38 0.00 -0.72 -4.00 105.19 107.00 1pmm n GLY 369 Ca 0.12 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 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 -5.11 4.12 0.52 1.61 0.52 -1.26 -4.50 118.95 114.84 1pmm s ARG 370 Ca 0.15 0.40 0.22 0.00 -0.52 0.00 0.00 55.73 55.97 1pmm s ARG 370 Cb -0.07 -3.62 1.33 0.00 0.52 0.00 0.00 34.95 33.12 1pmm s ARG 370 CO 0.18 -0.30 2.03 -1.35 0.02 0.00 0.00 175.30 175.89 1pmm h PRO 371 N 7.81 0.04 0.00 3.54 0.11 -1.91 -0.88 132.00 140.70 1pmm h PRO 371 Ca -0.30 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1pmm h PRO 371 Cb 1.14 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1pmm h PRO 371 CO 0.73 0.02 -0.14 -0.40 -0.21 0.00 0.00 178.00 178.01 1pmm n ASP 372 N -4.42 0.29 -0.02 -2.05 5.75 -1.26 -4.04 116.55 110.79 1pmm n ASP 372 Ca 0.07 0.35 0.01 0.00 -0.01 0.00 0.00 54.79 55.21 1pmm n ASP 372 Cb 0.47 -0.37 -0.08 0.00 -1.03 0.00 0.00 41.12 40.11 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 -1.69 1.17 -0.95 0.11 1.02 -0.42 -5.01 120.64 114.87 1pmm n GLU 373 Ca 0.06 -0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1pmm n GLU 373 Cb 0.36 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 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 2.11 -0.68 3.93 0.62 0.00 -0.68 -1.35 105.19 109.14 1pmm n GLY 374 Ca -0.07 -0.48 -0.26 0.00 0.00 0.00 0.00 46.02 45.21 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 -3.71 2.25 -1.21 -0.61 -4.36 -0.21 -4.39 121.20 108.96 1pmm s ILE 375 Ca 0.00 -0.27 -0.18 0.00 -0.26 0.00 0.00 60.65 59.93 1pmm s ILE 375 Cb 0.00 -2.98 -0.02 0.00 1.25 0.00 0.00 42.46 40.71 1pmm s ILE 375 CO 0.00 0.00 1.97 -2.65 0.24 0.00 0.00 174.94 174.50 1pmm n PRO 376 N -2.97 2.41 -4.12 0.37 -0.02 -1.26 -4.33 135.00 125.08 1pmm n PRO 376 Ca 0.09 -2.59 -0.08 0.00 -2.02 0.00 0.00 63.50 58.90 1pmm n PRO 376 Cb 0.60 -3.34 -0.10 0.00 -0.02 0.00 0.00 33.50 30.65 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 5.28 0.70 -0.15 3.55 0.00 -1.26 -1.77 121.76 128.10 1pmm s ALA 377 Ca 0.55 -1.29 0.02 0.00 0.00 0.00 0.00 51.96 51.24 1pmm s ALA 377 Cb 0.09 0.33 0.01 0.00 0.00 0.00 0.00 23.12 23.55 1pmm s ALA 377 CO 0.04 -0.35 -0.21 0.08 0.00 0.00 0.00 175.76 175.33 1pmm s VAL 378 N -3.85 2.01 -0.05 0.00 1.01 -0.23 -1.76 120.40 117.53 1pmm s VAL 378 Ca 0.11 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.17 1pmm s VAL 378 Cb 0.07 -1.80 0.02 0.00 0.00 0.00 0.00 36.38 34.68 1pmm s VAL 378 CO -0.07 0.54 -0.05 0.00 0.00 0.00 0.00 175.10 175.52 1pmm s PHE 380 N 1.01 0.21 0.20 0.00 -0.71 -0.69 0.24 117.98 118.23 1pmm s PHE 380 Ca -0.10 -0.57 -0.00 0.00 -1.04 0.00 0.00 56.93 55.23 1pmm s PHE 380 Cb -0.14 0.14 -0.04 0.00 -1.21 0.00 0.00 43.02 41.76 1pmm s PHE 380 CO -0.00 -0.83 0.10 -1.59 -1.34 0.00 0.00 175.22 171.56 1pmm s LYS 381 N -3.94 1.18 0.30 1.99 -2.85 -0.75 -0.83 119.74 114.84 1pmm s LYS 381 Ca 0.15 -1.61 -0.28 0.00 -1.00 0.00 0.00 55.97 53.23 1pmm s LYS 381 Cb 0.01 0.14 -0.09 0.00 -2.06 0.00 0.00 37.83 35.83 1pmm s LYS 381 CO 0.00 -0.34 1.00 -0.51 0.10 0.00 0.00 175.35 175.61 1pmm s LEU 382 N -3.17 4.47 0.37 2.77 1.43 -1.26 -0.41 118.68 122.88 1pmm s LEU 382 Ca 0.35 2.03 -0.27 0.00 -1.03 0.00 0.00 54.13 55.21 1pmm s LEU 382 Cb 0.07 -3.80 -0.11 0.00 0.03 0.00 0.00 46.19 42.38 1pmm s LEU 382 CO 0.10 -0.08 1.30 0.29 0.23 0.00 0.00 176.35 178.19 1pmm n LYS 383 N 0.94 2.11 -1.65 1.70 5.02 0.08 -4.72 118.16 121.65 1pmm n LYS 383 Ca 0.00 0.74 -0.46 0.00 -2.02 0.00 0.00 58.31 56.58 1pmm n LYS 383 Cb 0.48 -2.38 -0.03 0.00 -0.02 0.00 0.00 35.03 33.08 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 0.56 2.42 0.00 4.39 8.00 -1.26 -1.21 116.55 129.45 1pmm n ASP 384 Ca 0.05 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.69 1pmm n ASP 384 Cb 0.37 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 40.10 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 2.17 0.60 3.78 0.44 0.00 -1.26 -5.00 105.19 105.91 1pmm n GLY 385 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.37 3.97 -0.37 1.61 0.41 -0.35 -5.06 118.70 118.54 1pmm s GLU 386 Ca 0.00 -0.16 0.01 0.00 -0.41 0.00 0.00 54.97 54.41 1pmm s GLU 386 Cb 0.00 -3.35 0.12 0.00 -1.78 0.00 0.00 34.13 29.12 1pmm s GLU 386 CO 0.00 0.45 0.17 0.34 -0.49 0.00 0.00 175.26 175.72 1pmm s ASP 387 N -0.08 3.80 0.00 -0.19 2.15 -1.26 -4.77 116.67 116.32 1pmm s ASP 387 Ca 0.11 -2.12 0.11 0.00 0.43 0.00 0.00 52.55 51.08 1pmm s ASP 387 Cb -0.12 -0.92 0.66 0.00 -0.30 0.00 0.00 42.92 42.25 1pmm s ASP 387 CO 0.01 -0.34 1.28 -0.81 -0.17 0.00 0.00 175.17 175.13 1pmm n PRO 388 N 4.21 0.81 -0.25 4.34 -0.04 -1.26 -4.82 135.00 137.99 1pmm n PRO 388 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1pmm n PRO 388 Cb 0.38 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 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 0.44 0.84 3.48 0.55 0.00 -1.26 -4.96 105.19 104.28 1pmm n GLY 389 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.07 -0.41 0.43 1.61 -0.85 -1.26 -4.93 117.35 109.87 1pmm s TYR 390 Ca 0.00 0.14 0.07 0.00 -0.52 0.00 0.00 57.07 56.76 1pmm s TYR 390 Cb 0.00 0.53 -0.02 0.00 0.38 0.00 0.00 41.96 42.84 1pmm s TYR 390 CO 0.00 -0.89 0.33 0.95 -1.52 0.00 0.00 175.55 174.41 1pmm s THR 391 N -3.79 2.45 -0.18 -3.49 -4.23 -1.26 -5.00 115.64 100.14 1pmm s THR 391 Ca 0.03 -1.46 0.29 0.00 -1.18 0.00 0.00 61.69 59.38 1pmm s THR 391 Cb -0.01 -2.91 0.34 0.00 1.34 0.00 0.00 72.50 71.26 1pmm s THR 391 CO -0.09 0.00 1.85 -0.07 -0.54 0.00 0.00 174.62 175.77 1pmm h LEU 392 N 1.11 0.00 -0.36 4.79 3.38 -1.97 -2.70 115.31 119.57 1pmm h LEU 392 Ca -0.41 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 1pmm h LEU 392 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1pmm h LEU 392 CO 0.61 0.00 -0.14 1.88 0.09 0.00 0.00 178.44 180.88 1pmm h TYR 393 N 0.00 0.83 -0.58 1.13 0.05 -1.94 -0.50 116.97 115.97 1pmm h TYR 393 Ca 0.00 -0.20 -0.05 0.00 0.05 0.00 0.00 58.73 58.53 1pmm h TYR 393 Cb 0.57 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 1pmm h TYR 393 CO 0.00 0.91 0.15 -0.44 -1.05 0.00 0.00 178.16 177.73 1pmm h ASP 394 N 0.52 0.87 -0.48 3.88 3.32 -1.88 -1.63 116.42 121.02 1pmm h ASP 394 Ca 0.09 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.88 1pmm h ASP 394 Cb 0.67 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1pmm h ASP 394 CO 0.05 0.87 0.21 0.25 -1.72 0.00 0.00 179.24 178.89 1pmm h LEU 395 N 0.83 0.65 -0.57 1.55 5.85 -1.39 -1.69 115.31 120.54 1pmm h LEU 395 Ca 0.18 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.78 1pmm h LEU 395 Cb 0.33 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 1pmm h LEU 395 CO 0.00 0.63 0.34 -1.28 -0.34 0.00 0.00 178.44 177.79 1pmm h SER 396 N 0.63 0.56 -0.46 1.25 0.87 -0.84 -1.97 113.55 113.58 1pmm h SER 396 Ca 0.16 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.71 1pmm h SER 396 Cb 0.17 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 1pmm h SER 396 CO -0.02 0.39 0.22 -0.08 -0.53 0.00 0.00 176.83 176.81 1pmm h GLU 397 N 0.68 0.67 -0.34 2.24 4.81 -0.99 -2.29 114.58 119.35 1pmm h GLU 397 Ca 0.23 -0.10 -0.08 0.00 -0.13 0.00 0.00 59.36 59.28 1pmm h GLU 397 Cb 0.03 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 1pmm h GLU 397 CO -0.10 0.57 -0.13 0.00 -0.73 0.00 0.00 179.01 178.61 1pmm h ARG 398 N 0.60 0.60 -0.07 1.92 3.08 -1.07 -1.97 114.38 117.49 1pmm h ARG 398 Ca 0.16 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1pmm h ARG 398 Cb 0.12 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1pmm h ARG 398 CO -0.02 0.72 -0.25 -0.07 -1.07 0.00 0.00 179.97 179.28 1pmm h LEU 399 N 0.55 0.11 -2.10 3.04 3.38 -1.18 -1.65 115.31 117.48 1pmm h LEU 399 Ca 0.10 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1pmm h LEU 399 Cb 0.55 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1pmm h LEU 399 CO 0.03 0.37 -0.04 -0.09 0.09 0.00 0.00 178.44 178.81 1pmm h ARG 400 N 0.11 0.00 0.00 1.13 2.43 -0.77 -1.22 114.38 116.05 1pmm h ARG 400 Ca 0.02 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1pmm h ARG 400 Cb 0.51 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1pmm h ARG 400 CO 0.04 0.04 -0.03 -0.07 -1.51 0.00 0.00 179.97 178.44 1pmm h LEU 401 N 0.00 0.00 -2.58 3.80 3.38 -1.20 -1.38 115.31 117.33 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 0.03 0.00 0.54 0.09 0.00 0.00 178.44 179.10 1pmm n ARG 402 N -3.19 2.60 -0.09 1.13 5.12 -0.47 -4.95 116.66 116.80 1pmm n ARG 402 Ca -0.01 -2.41 0.00 0.00 -1.93 0.00 0.00 57.85 53.50 1pmm n ARG 402 Cb 0.21 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.01 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 1.42 0.68 3.75 -0.13 0.00 -0.52 -5.06 105.19 105.33 1pmm n GLY 403 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.33 3.93 -0.42 1.61 0.52 -1.13 -4.66 118.94 116.46 1pmm s TRP 404 Ca 0.00 1.89 -0.01 0.00 0.02 0.00 0.00 56.10 57.99 1pmm s TRP 404 Cb 0.00 -3.02 0.11 0.00 -1.15 0.00 0.00 33.47 29.41 1pmm s TRP 404 CO 0.00 0.32 0.20 -0.65 0.02 0.00 0.00 176.95 176.84 1pmm s GLN 405 N -1.16 1.96 -0.30 4.98 -0.21 -0.86 -3.24 119.66 120.82 1pmm s GLN 405 Ca 0.42 -1.93 0.04 0.00 0.02 0.00 0.00 55.36 53.90 1pmm s GLN 405 Cb -0.27 -3.52 0.08 0.00 1.00 0.00 0.00 33.01 30.30 1pmm s GLN 405 CO 0.33 -1.06 -0.02 0.08 -2.12 0.00 0.00 175.29 172.50 1pmm s VAL 406 N 0.93 2.23 0.40 1.09 1.01 -1.26 -1.10 120.40 123.71 1pmm s VAL 406 Ca 0.10 -2.03 -0.25 0.00 0.00 0.00 0.00 61.98 59.80 1pmm s VAL 406 Cb -0.22 -2.51 -0.08 0.00 0.00 0.00 0.00 36.38 33.57 1pmm s VAL 406 CO -0.05 -0.34 1.19 -2.16 0.00 0.00 0.00 175.10 173.74 1pmm s PRO 407 N 0.99 4.03 -0.06 2.72 0.04 -1.26 -4.65 135.00 136.81 1pmm s PRO 407 Ca 0.02 1.89 0.02 0.00 0.04 0.00 0.00 61.00 62.97 1pmm s PRO 407 Cb -0.19 -2.68 0.01 0.00 0.04 0.00 0.00 34.50 31.68 1pmm s PRO 407 CO -0.07 -0.36 -0.11 0.00 0.04 0.00 0.00 177.00 176.51 1pmm s ALA 408 N -1.39 1.11 0.24 8.56 0.00 -1.26 -2.16 121.76 126.87 1pmm s ALA 408 Ca 0.57 -0.34 -0.18 0.00 0.00 0.00 0.00 51.96 52.01 1pmm s ALA 408 Cb -0.32 -0.51 0.02 0.00 0.00 0.00 0.00 23.12 22.31 1pmm s ALA 408 CO 0.40 0.10 0.59 -0.59 0.00 0.00 0.00 175.76 176.26 1pmm s PHE 409 N 0.64 -0.03 0.14 0.00 -0.12 0.04 -4.94 117.98 113.70 1pmm s PHE 409 Ca -0.13 -0.36 -0.09 0.00 -0.05 0.00 0.00 56.93 56.30 1pmm s PHE 409 Cb -0.15 0.47 -0.06 0.00 -0.63 0.00 0.00 43.02 42.65 1pmm s PHE 409 CO 0.03 -1.06 0.45 0.95 -0.05 0.00 0.00 175.22 175.54 1pmm s THR 410 N -3.93 5.04 0.92 -4.49 -4.23 -1.26 -0.25 115.64 107.44 1pmm s THR 410 Ca 0.13 0.40 -0.14 0.00 -1.18 0.00 0.00 61.69 60.91 1pmm s THR 410 Cb -0.03 -3.64 0.15 0.00 1.34 0.00 0.00 72.50 70.32 1pmm s THR 410 CO 0.04 0.13 1.21 -0.76 -0.54 0.00 0.00 174.62 174.71 1pmm s LEU 411 N -2.32 2.32 0.00 4.79 1.43 -0.46 -4.95 118.68 119.50 1pmm s LEU 411 Ca 0.39 0.63 0.00 0.00 -1.03 0.00 0.00 54.13 54.12 1pmm s LEU 411 Cb -0.13 -2.87 0.00 0.00 0.03 0.00 0.00 46.19 43.22 1pmm s LEU 411 CO 0.21 -2.51 0.00 0.61 0.23 0.00 0.00 176.35 174.88 1pmm n GLY 412 N -3.04 3.34 7.00 -3.19 0.00 -1.26 -3.53 105.19 104.51 1pmm n GLY 412 Ca 0.11 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 3.12 1.05 -0.02 0.00 -1.26 -0.49 105.19 112.59 1pmm n GLY 413 Ca 0.00 0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.23 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 2.56 -0.63 1.61 1.02 0.21 -4.00 120.64 135.41 1pmm n GLU 414 Ca 0.00 -1.83 0.06 0.00 -0.02 0.00 0.00 57.16 55.38 1pmm n GLU 414 Cb 0.00 -1.57 0.16 0.00 -0.02 0.00 0.00 31.44 30.02 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 0.75 3.20 0.31 0.62 0.00 0.36 -4.41 120.51 121.33 1pmm n ALA 415 Ca 0.17 -2.98 0.19 0.00 0.00 0.00 0.00 53.44 50.81 1pmm n ALA 415 Cb 0.55 -0.41 0.99 0.00 0.00 0.00 0.00 19.45 20.57 1pmm n ALA 415 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1pmm h THR 416 N 1.86 0.15 -0.00 0.00 1.35 -1.58 -1.27 112.91 113.41 1pmm h THR 416 Ca -0.03 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.62 1pmm h THR 416 Cb 1.14 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 1pmm h THR 416 CO 0.01 0.02 -0.09 -0.90 -0.25 0.00 0.00 175.52 174.32 1pmm n ASP 417 N -3.25 0.26 -4.66 5.36 5.75 -1.26 -4.52 116.55 114.23 1pmm n ASP 417 Ca -0.02 -0.31 -0.39 0.00 -0.01 0.00 0.00 54.79 54.07 1pmm n ASP 417 Cb 0.15 -0.17 -0.07 0.00 -1.03 0.00 0.00 41.12 40.00 1pmm n ASP 417 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1pmm s ILE 418 N -2.59 5.16 -0.17 2.12 1.01 -0.48 -5.02 121.20 121.24 1pmm s ILE 418 Ca 0.26 0.77 -0.06 0.00 0.00 0.00 0.00 60.65 61.62 1pmm s ILE 418 Cb 0.20 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1pmm s ILE 418 CO 0.49 0.21 0.04 -0.69 0.00 0.00 0.00 174.94 174.99 1pmm s VAL 419 N 1.53 4.57 0.18 2.92 1.01 -1.26 -1.35 120.40 128.01 1pmm s VAL 419 Ca 0.20 -0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.13 1pmm s VAL 419 Cb -0.15 -3.04 -0.05 0.00 0.00 0.00 0.00 36.38 33.14 1pmm s VAL 419 CO 0.09 0.48 -0.12 0.68 0.00 0.00 0.00 175.10 176.22 1pmm s VAL 420 N 0.30 1.50 -0.02 2.92 -7.23 0.66 -4.35 120.40 114.17 1pmm s VAL 420 Ca 0.02 -2.15 0.07 0.00 -1.81 0.00 0.00 61.98 58.11 1pmm s VAL 420 Cb -0.13 -1.97 -0.02 0.00 0.56 0.00 0.00 36.38 34.82 1pmm s VAL 420 CO 0.01 -0.65 -0.24 -0.32 -0.31 0.00 0.00 175.10 173.58 1pmm s MET 421 N -3.69 2.04 -0.04 4.82 -2.45 -0.01 -0.78 119.30 119.18 1pmm s MET 421 Ca 0.20 -0.87 0.02 0.00 -1.25 0.00 0.00 55.69 53.80 1pmm s MET 421 Cb 0.01 -1.93 0.01 0.00 1.25 0.00 0.00 34.83 34.17 1pmm s MET 421 CO 0.04 0.50 -0.09 0.50 1.05 0.00 0.00 175.02 177.02 1pmm s ARG 422 N -0.50 1.19 -0.16 4.11 3.52 -0.92 -1.71 118.95 124.48 1pmm s ARG 422 Ca 0.07 -0.31 0.02 0.00 -0.13 0.00 0.00 55.73 55.38 1pmm s ARG 422 Cb -0.10 -1.07 0.01 0.00 -1.56 0.00 0.00 34.95 32.24 1pmm s ARG 422 CO -0.00 0.05 -0.21 0.42 -0.81 0.00 0.00 175.30 174.76 1pmm s ILE 423 N 0.47 2.10 -0.16 4.11 1.01 0.64 -4.07 121.20 125.31 1pmm s ILE 423 Ca -0.08 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 59.48 1pmm s ILE 423 Cb -0.12 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.44 1pmm s ILE 423 CO 0.01 0.54 0.29 -0.32 0.00 0.00 0.00 174.94 175.47 1pmm s MET 424 N 1.06 4.24 -0.60 2.79 1.75 -0.59 -1.06 119.30 126.89 1pmm s MET 424 Ca -0.01 0.10 -0.04 0.00 -1.25 0.00 0.00 55.69 54.48 1pmm s MET 424 Cb -0.14 -3.42 0.16 0.00 2.84 0.00 0.00 34.83 34.26 1pmm s MET 424 CO -0.07 0.25 0.43 0.00 -0.65 0.00 0.00 175.02 174.97 1pmm s ARG 426 N 0.25 2.29 0.26 0.00 0.52 -1.26 -4.71 118.95 116.31 1pmm s ARG 426 Ca 0.15 -1.41 -0.31 0.00 -0.52 0.00 0.00 55.73 53.64 1pmm s ARG 426 Cb -0.20 -2.60 -0.12 0.00 0.52 0.00 0.00 34.95 32.56 1pmm s ARG 426 CO -0.04 -0.86 1.65 0.50 0.02 0.00 0.00 175.30 176.58 1pmm s ARG 427 N -4.71 4.12 0.00 3.54 3.52 -1.26 -1.87 118.95 122.29 1pmm s ARG 427 Ca 0.61 2.60 0.00 0.00 -0.13 0.00 0.00 55.73 58.82 1pmm s ARG 427 Cb -0.07 -3.04 0.00 0.00 -1.56 0.00 0.00 34.95 30.28 1pmm s ARG 427 CO 0.39 -0.69 0.00 0.41 -0.81 0.00 0.00 175.30 174.60 1pmm n GLY 428 N 2.89 0.70 2.61 8.12 0.00 -1.26 -4.66 105.19 113.60 1pmm n GLY 428 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.92 3.67 -0.92 1.61 7.35 -0.78 -5.05 117.46 121.42 1pmm n PHE 429 Ca 0.00 -3.97 -0.30 0.00 -0.76 0.00 0.00 57.45 52.42 1pmm n PHE 429 Cb 0.00 -0.60 0.16 0.00 0.35 0.00 0.00 39.48 39.39 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 -2.86 0.98 0.22 -4.13 1.03 -1.26 -4.64 118.70 108.04 1pmm s GLU 430 Ca 0.42 1.15 -0.12 0.00 0.03 0.00 0.00 54.97 56.45 1pmm s GLU 430 Cb 0.18 -1.75 0.29 0.00 -0.80 0.00 0.00 34.13 32.05 1pmm s GLU 430 CO -0.04 -2.53 1.64 1.98 -1.33 0.00 0.00 175.26 174.98 1pmm h MET 431 N -1.77 0.05 -0.83 -4.83 1.85 -1.98 0.36 114.93 107.78 1pmm h MET 431 Ca -0.48 -0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 58.60 1pmm h MET 431 Cb 1.28 -0.01 -0.04 0.00 0.43 0.00 0.00 31.60 33.26 1pmm h MET 431 CO 0.49 0.03 0.49 0.22 -0.40 0.00 0.00 176.91 177.74 1pmm h ASP 432 N 0.05 1.00 -0.30 1.39 3.58 -1.99 0.01 116.42 120.15 1pmm h ASP 432 Ca 0.33 -0.06 -0.12 0.00 0.42 0.00 0.00 57.03 57.59 1pmm h ASP 432 Cb 0.53 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 1pmm h ASP 432 CO -0.62 0.77 -0.29 0.15 -2.88 0.00 0.00 179.24 176.37 1pmm h PHE 433 N 1.14 0.88 0.00 0.28 3.57 -1.59 -2.84 116.94 118.39 1pmm h PHE 433 Ca 0.30 -0.26 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 1pmm h PHE 433 Cb -0.03 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 1pmm h PHE 433 CO 0.01 1.02 -0.23 0.00 -2.23 0.00 0.00 178.31 176.88 1pmm h ALA 434 N 0.72 1.56 -0.05 2.41 0.00 -0.55 -1.57 119.26 121.78 1pmm h ALA 434 Ca 0.05 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 1pmm h ALA 434 Cb 0.87 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1pmm h ALA 434 CO 0.07 0.28 -0.36 1.49 0.00 0.00 0.00 179.25 180.74 1pmm h GLU 435 N 0.00 0.10 -0.49 0.00 4.57 -0.76 -1.63 114.58 116.37 1pmm h GLU 435 Ca -0.00 -0.04 -0.11 0.00 -1.18 0.00 0.00 59.36 58.03 1pmm h GLU 435 Cb 0.42 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 1pmm h GLU 435 CO 0.03 0.45 -0.12 -0.07 -1.18 0.00 0.00 179.01 178.12 1pmm h LEU 436 N 0.09 0.94 -0.71 1.64 3.38 -1.14 -1.40 115.31 118.10 1pmm h LEU 436 Ca 0.01 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 1pmm h LEU 436 Cb 0.68 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1pmm h LEU 436 CO 0.05 1.09 0.40 0.25 0.09 0.00 0.00 178.44 180.32 1pmm h LEU 437 N 0.79 0.88 -1.02 1.67 5.85 -1.27 -1.64 115.31 120.56 1pmm h LEU 437 Ca 0.12 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.77 1pmm h LEU 437 Cb 0.67 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 1pmm h LEU 437 CO 0.05 0.71 0.67 0.25 -0.34 0.00 0.00 178.44 179.77 1pmm h LEU 438 N 0.98 1.15 -0.64 2.25 5.85 -0.99 0.11 115.31 124.02 1pmm h LEU 438 Ca 0.25 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 1pmm h LEU 438 Cb 0.02 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.73 1pmm h LEU 438 CO -0.04 0.83 0.27 -0.33 -0.34 0.00 0.00 178.44 178.83 1pmm h GLU 439 N 1.36 0.94 -0.08 1.25 5.08 -0.55 -1.28 114.58 121.30 1pmm h GLU 439 Ca 0.37 -0.16 -0.12 0.00 -1.00 0.00 0.00 59.36 58.45 1pmm h GLU 439 Cb -0.16 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 28.92 1pmm h GLU 439 CO -0.08 0.79 -0.47 -0.44 -1.00 0.00 0.00 179.01 177.81 1pmm h ASP 440 N 0.89 0.21 -0.32 1.42 3.32 -0.66 -1.80 116.42 119.48 1pmm h ASP 440 Ca 0.21 -0.10 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 1pmm h ASP 440 Cb 0.18 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1pmm h ASP 440 CO -0.02 0.65 0.04 0.22 -1.72 0.00 0.00 179.24 178.42 1pmm h TYR 441 N 0.16 0.58 -0.52 4.55 5.03 -0.37 0.59 116.97 126.99 1pmm h TYR 441 Ca 0.01 -0.08 -0.02 0.00 2.58 0.00 0.00 58.73 61.21 1pmm h TYR 441 Cb 0.90 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 38.99 1pmm h TYR 441 CO 0.01 0.62 0.24 0.87 -1.32 0.00 0.00 178.16 178.59 1pmm h LYS 442 N 0.37 0.76 -0.61 1.82 1.57 -1.09 -2.05 116.57 117.33 1pmm h LYS 442 Ca 0.10 -0.12 -0.03 0.00 -1.87 0.00 0.00 60.65 58.73 1pmm h LYS 442 Cb 0.36 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.51 1pmm h LYS 442 CO 0.01 0.64 0.25 0.00 -0.57 0.00 0.00 179.45 179.77 1pmm h ALA 443 N 1.08 0.80 -0.61 3.86 0.00 -1.14 -1.43 119.26 121.82 1pmm h ALA 443 Ca 0.18 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1pmm h ALA 443 Cb 0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1pmm h ALA 443 CO -0.02 0.41 0.40 0.77 0.00 0.00 0.00 179.25 180.81 1pmm h SER 444 N 0.85 0.69 -0.28 0.00 0.02 -0.63 -0.55 113.55 113.65 1pmm h SER 444 Ca 0.20 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 1pmm h SER 444 Cb 0.20 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1pmm h SER 444 CO -0.02 0.49 0.08 -0.07 -1.14 0.00 0.00 176.83 176.17 1pmm h LEU 445 N 0.81 0.42 -0.80 5.07 3.38 -1.18 0.03 115.31 123.05 1pmm h LEU 445 Ca 0.23 -0.22 0.09 0.00 0.09 0.00 0.00 57.88 58.07 1pmm h LEU 445 Cb -0.07 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.49 1pmm h LEU 445 CO -0.06 0.53 0.45 0.50 0.09 0.00 0.00 178.44 179.96 1pmm h LYS 446 N 0.29 0.75 -0.01 1.13 1.63 -0.90 0.26 116.57 119.72 1pmm h LYS 446 Ca 0.09 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1pmm h LYS 446 Cb 0.27 -0.17 -0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1pmm h LYS 446 CO -0.00 0.49 0.00 -0.92 -3.45 0.00 0.00 179.45 175.57 1pmm h TYR 447 N 0.77 0.01 0.00 1.91 3.20 -0.81 -2.61 116.97 119.45 1pmm h TYR 447 Ca 0.38 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.25 1pmm h TYR 447 Cb 0.34 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.61 1pmm h TYR 447 CO -0.07 0.30 0.00 -0.07 -1.64 0.00 0.00 178.16 176.68 1pmm h LEU 448 N -0.28 0.00 0.20 2.82 3.38 -0.31 -2.42 115.31 118.69 1pmm h LEU 448 Ca 0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.68 1pmm h LEU 448 Cb 0.30 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.07 1pmm h LEU 448 CO 0.00 0.00 -1.35 -1.28 0.09 0.00 0.00 178.44 175.90 1pmm h SER 449 N 0.00 0.66 0.00 -0.43 0.87 -0.59 -3.28 113.55 110.78 1pmm h SER 449 Ca 0.00 -0.92 0.00 0.00 -1.23 0.00 0.00 61.79 59.64 1pmm h SER 449 Cb 0.05 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.79 1pmm h SER 449 CO 0.00 1.64 0.00 0.47 -0.53 0.00 0.00 176.83 178.41 1pmm n ASP 450 N -3.83 0.35 -4.01 6.23 8.00 -0.92 -4.80 116.55 117.58 1pmm n ASP 450 Ca -0.19 -1.97 -0.08 0.00 0.71 0.00 0.00 54.79 53.27 1pmm n ASP 450 Cb 1.00 -0.18 -0.10 0.00 -0.02 0.00 0.00 41.12 41.83 1pmm n ASP 450 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1pmm s HIS 451 N -1.64 0.34 -0.93 1.24 3.76 -1.20 -5.10 115.29 111.75 1pmm s HIS 451 Ca 0.00 -0.72 0.00 0.00 -0.15 0.00 0.00 55.06 54.19 1pmm s HIS 451 Cb 0.00 -0.25 0.00 0.00 1.11 0.00 0.00 32.58 33.44 1pmm s HIS 451 CO 0.00 -0.31 0.23 -2.30 -0.85 0.00 0.00 174.74 171.52