#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bed h TYR 24 N 0.00 0.69 -0.13 -1.77 3.20 -1.97 -2.23 116.97 114.76 2bed h TYR 24 Ca 0.00 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 2bed h TYR 24 Cb 0.00 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 2bed h TYR 24 CO 0.00 0.04 -0.41 0.66 -1.64 0.00 0.00 178.16 176.82 2bed h SER 25 N 0.49 0.31 1.12 -2.11 4.64 -1.95 -3.05 113.55 113.00 2bed h SER 25 Ca 0.52 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2bed h SER 25 Cb 0.89 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2bed h SER 25 CO -0.46 0.69 -0.18 0.18 -0.87 0.00 0.00 176.83 176.19 2bed n LEU 26 N -4.02 0.54 -4.70 5.97 7.99 -0.87 -4.87 117.00 117.03 2bed n LEU 26 Ca -0.01 0.42 -0.43 0.00 -0.01 0.00 0.00 56.01 55.97 2bed n LEU 26 Cb 0.49 -0.33 -0.03 0.00 -0.11 0.00 0.00 43.42 43.43 2bed n LEU 26 CO 0.42 -0.07 1.32 -1.14 -1.51 0.00 0.00 177.39 176.41 2bed n ARG 27 N -1.94 2.57 0.00 3.23 0.63 -1.00 -4.93 116.66 115.21 2bed n ARG 27 Ca 0.05 0.93 0.00 0.00 -0.92 0.00 0.00 57.85 57.91 2bed n ARG 27 Cb 0.40 -2.75 0.00 0.00 0.45 0.00 0.00 32.46 30.56 2bed n ARG 27 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 2bed n PRO 28 N 3.82 0.00 0.21 -0.14 -0.02 -1.26 -0.80 135.00 136.80 2bed n PRO 28 Ca 0.16 0.62 0.07 0.00 -2.02 0.00 0.00 63.50 62.34 2bed n PRO 28 Cb 0.33 -0.96 0.40 0.00 -0.02 0.00 0.00 33.50 33.25 2bed n PRO 28 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2bed h GLU 29 N 0.00 0.00 0.00 -0.52 9.09 -1.97 -1.92 114.58 119.26 2bed h GLU 29 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.41 2bed h GLU 29 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2bed h GLU 29 CO 0.00 0.00 -0.01 1.25 0.05 0.00 0.00 179.01 180.30 2bed h HIS 30 N 0.00 0.00 -0.91 2.06 2.76 -1.29 -2.17 115.15 115.60 2bed h HIS 30 Ca 0.00 0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.25 2bed h HIS 30 Cb 0.76 0.00 -0.06 0.00 1.55 0.00 0.00 27.41 29.66 2bed h HIS 30 CO 0.00 0.01 0.59 0.00 -1.30 0.00 0.00 177.93 177.23 2bed h ALA 31 N 1.99 1.57 -0.02 5.26 0.00 -1.51 -1.42 119.26 125.13 2bed h ALA 31 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2bed h ALA 31 Cb 0.20 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 2bed h ALA 31 CO 0.00 0.27 0.12 0.00 0.00 0.00 0.00 179.25 179.64 2bed h ARG 32 N 0.96 0.00 -1.48 0.00 3.08 -1.62 -2.02 114.38 113.30 2bed h ARG 32 Ca 0.41 0.00 -0.39 0.00 0.07 0.00 0.00 59.98 60.07 2bed h ARG 32 Cb 0.32 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 30.20 2bed h ARG 32 CO -0.17 0.00 0.49 0.39 -1.07 0.00 0.00 179.97 179.61 2bed n GLU 33 N -3.11 1.99 -4.05 0.04 -0.58 -0.53 -4.89 120.64 109.51 2bed n GLU 33 Ca -0.02 -1.90 -0.30 0.00 -0.42 0.00 0.00 57.16 54.52 2bed n GLU 33 Cb 0.19 -1.76 -0.06 0.00 -0.57 0.00 0.00 31.44 29.24 2bed n GLU 33 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 2bed s ARG 34 N -2.14 2.89 0.32 3.49 6.06 -0.76 -3.86 118.95 124.95 2bed s ARG 34 Ca 0.38 -0.69 -0.28 0.00 -2.50 0.00 0.00 55.73 52.64 2bed s ARG 34 Cb 0.29 -2.73 -0.13 0.00 0.06 0.00 0.00 34.95 32.44 2bed s ARG 34 CO -0.02 0.57 1.20 -0.11 -2.50 0.00 0.00 175.30 174.43 2bed n LEU 35 N 0.44 2.92 -3.95 -0.88 7.94 -1.26 -4.98 117.00 117.23 2bed n LEU 35 Ca -0.09 1.19 -0.30 0.00 -1.11 0.00 0.00 56.01 55.70 2bed n LEU 35 Cb 0.52 -1.41 -0.15 0.00 0.53 0.00 0.00 43.42 42.91 2bed n LEU 35 CO 0.44 -0.80 -0.27 -1.10 -1.11 0.00 0.00 177.39 174.55 2bed s GLN 36 N -1.68 1.58 0.00 1.96 -0.21 -1.26 -4.97 119.66 115.08 2bed s GLN 36 Ca 0.57 -2.08 0.17 0.00 0.02 0.00 0.00 55.36 54.04 2bed s GLN 36 Cb -0.62 -3.09 0.79 0.00 1.00 0.00 0.00 33.01 31.09 2bed s GLN 36 CO 0.61 -1.02 1.53 -0.40 -2.12 0.00 0.00 175.29 173.89 2bed n ASP 37 N 3.86 0.00 -1.41 5.90 5.75 -1.26 -4.86 116.55 124.52 2bed n ASP 37 Ca 0.04 0.28 -0.15 0.00 -0.01 0.00 0.00 54.79 54.94 2bed n ASP 37 Cb 0.38 -0.40 -0.04 0.00 -1.03 0.00 0.00 41.12 40.03 2bed n ASP 37 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2bed n ASP 38 N -1.40 -4.75 -3.43 -1.12 8.00 -1.26 -2.07 116.55 110.52 2bed n ASP 38 Ca 0.06 0.22 -0.25 0.00 0.71 0.00 0.00 54.79 55.53 2bed n ASP 38 Cb 0.17 -3.72 0.04 0.00 -0.02 0.00 0.00 41.12 37.58 2bed n ASP 38 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2bed n SER 39 N -0.66 -5.49 -3.36 -2.24 7.64 -1.26 -4.92 113.62 103.33 2bed n SER 39 Ca -0.17 -0.48 -0.26 0.00 1.01 0.00 0.00 58.87 58.98 2bed n SER 39 Cb 0.56 -4.40 -0.09 0.00 -1.01 0.00 0.00 64.21 59.26 2bed n SER 39 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2bed s VAL 40 N -3.20 0.23 0.08 0.44 1.01 -0.88 -5.13 120.40 112.95 2bed s VAL 40 Ca 0.47 -2.46 -0.22 0.00 0.00 0.00 0.00 61.98 59.78 2bed s VAL 40 Cb -0.22 -1.16 -0.07 0.00 0.00 0.00 0.00 36.38 34.93 2bed s VAL 40 CO 0.59 -1.14 0.65 -1.83 0.00 0.00 0.00 175.10 173.36 2bed s GLU 41 N 0.20 4.35 0.33 2.72 -1.05 -1.26 -4.96 118.70 119.03 2bed s GLU 41 Ca 0.31 0.88 0.03 0.00 -0.15 0.00 0.00 54.97 56.05 2bed s GLU 41 Cb 0.01 -3.28 -0.06 0.00 -0.44 0.00 0.00 34.13 30.37 2bed s GLU 41 CO -0.17 0.52 0.07 0.95 0.95 0.00 0.00 175.26 177.58 2bed s THR 42 N -0.80 1.03 0.41 1.83 -4.23 -1.26 -5.00 115.64 107.63 2bed s THR 42 Ca 0.32 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 59.03 2bed s THR 42 Cb -0.20 -2.72 0.41 0.00 1.34 0.00 0.00 72.50 71.33 2bed s THR 42 CO 0.21 0.00 1.78 0.58 -0.54 0.00 0.00 174.62 176.65 2bed h VAL 43 N 2.10 0.52 0.83 2.29 2.07 -1.99 -1.71 116.25 120.36 2bed h VAL 43 Ca -0.40 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 2bed h VAL 43 Cb 1.25 0.14 0.01 0.00 -1.52 0.00 0.00 31.29 31.16 2bed h VAL 43 CO 0.67 0.06 -0.40 0.74 0.02 0.00 0.00 177.57 178.66 2bed h THR 44 N 0.35 0.03 -0.87 2.57 2.02 -1.95 -2.17 112.91 112.89 2bed h THR 44 Ca 0.58 -0.16 0.06 0.00 0.77 0.00 0.00 66.41 67.66 2bed h THR 44 Cb 1.56 0.04 -0.06 0.00 -1.74 0.00 0.00 68.15 67.95 2bed h THR 44 CO -0.26 0.00 0.57 0.77 0.37 0.00 0.00 175.52 176.97 2bed h SER 45 N -1.28 0.86 0.78 4.18 4.64 -1.81 -0.70 113.55 120.21 2bed h SER 45 Ca -0.11 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.17 2bed h SER 45 Cb 0.86 -0.18 0.01 0.00 -0.31 0.00 0.00 62.40 62.78 2bed h SER 45 CO 0.19 0.55 -0.37 0.40 -0.87 0.00 0.00 176.83 176.73 2bed h ILE 46 N 0.98 0.24 -0.08 0.95 2.04 -1.32 0.13 117.51 120.44 2bed h ILE 46 Ca 0.37 -0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.20 2bed h ILE 46 Cb 0.20 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 2bed h ILE 46 CO -0.14 0.00 -0.07 -0.33 0.00 0.00 0.00 178.15 177.62 2bed h GLU 47 N -1.04 0.12 -0.29 2.37 4.39 -1.09 -0.94 114.58 118.10 2bed h GLU 47 Ca -0.11 -0.02 -0.11 0.00 0.34 0.00 0.00 59.36 59.46 2bed h GLU 47 Cb 0.80 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.42 2bed h GLU 47 CO 0.17 0.20 -0.26 0.37 -1.16 0.00 0.00 179.01 178.33 2bed h GLN 48 N 0.12 0.68 -0.62 2.33 5.75 -0.96 -2.79 115.11 119.62 2bed h GLN 48 Ca 0.03 -0.35 0.06 0.00 -0.15 0.00 0.00 58.65 58.24 2bed h GLN 48 Cb 0.20 0.01 -0.06 0.00 1.07 0.00 0.00 27.48 28.70 2bed h GLN 48 CO 0.01 0.96 0.32 0.00 -2.65 0.00 0.00 178.83 177.47 2bed h ALA 49 N 0.71 0.83 -0.17 3.38 0.00 0.43 -2.07 119.26 122.37 2bed h ALA 49 Ca 0.05 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2bed h ALA 49 Cb 0.82 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2bed h ALA 49 CO 0.07 -0.03 0.03 0.87 0.00 0.00 0.00 179.25 180.18 2bed h LYS 50 N 0.59 0.09 0.19 0.00 1.57 -1.13 -1.23 116.57 116.65 2bed h LYS 50 Ca 0.29 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.07 2bed h LYS 50 Cb 0.22 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 2bed h LYS 50 CO -0.20 0.06 -0.25 0.28 -0.57 0.00 0.00 179.45 178.77 2bed h VAL 51 N 0.09 0.46 -0.80 0.50 2.07 -1.16 -1.74 116.25 115.68 2bed h VAL 51 Ca 0.08 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.70 2bed h VAL 51 Cb 0.08 0.46 -0.07 0.00 -1.52 0.00 0.00 31.29 30.24 2bed h VAL 51 CO -0.11 0.00 0.44 -0.33 0.02 0.00 0.00 177.57 177.59 2bed h GLU 52 N -0.49 0.71 -0.18 1.57 5.08 -1.27 -0.32 114.58 119.68 2bed h GLU 52 Ca 0.01 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.38 2bed h GLU 52 Cb 0.48 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 2bed h GLU 52 CO -0.09 0.47 -0.26 1.49 -1.00 0.00 0.00 179.01 179.61 2bed h GLU 53 N 0.73 -0.29 -0.52 2.33 4.57 -0.73 0.21 114.58 120.88 2bed h GLU 53 Ca 0.39 0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.55 2bed h GLU 53 Cb 0.39 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.02 2bed h GLU 53 CO -0.26 -0.19 0.15 0.87 -1.18 0.00 0.00 179.01 178.40 2bed h LYS 54 N -0.30 0.82 -0.51 1.92 1.57 -0.43 -2.68 116.57 116.97 2bed h LYS 54 Ca 0.12 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2bed h LYS 54 Cb 0.48 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 2bed h LYS 54 CO -0.35 0.77 0.32 0.82 -0.57 0.00 0.00 179.45 180.44 2bed h ILE 55 N 0.73 1.10 -0.23 1.86 1.08 -0.58 -2.54 117.51 118.93 2bed h ILE 55 Ca 0.17 -0.22 0.05 0.00 -0.39 0.00 0.00 64.86 64.47 2bed h ILE 55 Cb 0.30 0.39 -0.05 0.00 -3.07 0.00 0.00 36.82 34.38 2bed h ILE 55 CO -0.00 0.12 -0.12 -0.61 -0.69 0.00 0.00 178.15 176.85 2bed h GLN 56 N 0.66 -0.09 -0.94 2.37 5.75 -0.43 0.16 115.11 122.58 2bed h GLN 56 Ca 0.19 0.01 0.24 0.00 -0.15 0.00 0.00 58.65 58.94 2bed h GLN 56 Cb -0.04 0.02 -0.06 0.00 1.07 0.00 0.00 27.48 28.47 2bed h GLN 56 CO -0.06 -0.06 0.64 0.93 -2.65 0.00 0.00 178.83 177.62 2bed h GLU 57 N -0.10 0.24 -0.06 1.69 5.08 -1.13 0.42 114.58 120.72 2bed h GLU 57 Ca 0.12 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 2bed h GLU 57 Cb 0.28 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 2bed h GLU 57 CO -0.29 0.16 -0.09 0.28 -1.00 0.00 0.00 179.01 178.07 2bed h VAL 58 N 0.25 1.40 -0.16 3.13 2.07 -0.34 -1.83 116.25 120.76 2bed h VAL 58 Ca 0.48 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2bed h VAL 58 Cb 1.46 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 33.37 2bed h VAL 58 CO -0.13 0.37 0.10 -0.26 0.02 0.00 0.00 177.57 177.67 2bed h PHE 59 N -0.31 0.21 0.00 1.57 0.05 0.58 -2.17 116.94 116.88 2bed h PHE 59 Ca 0.01 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.80 2bed h PHE 59 Cb 0.63 -0.07 0.00 0.00 2.00 0.00 0.00 35.95 38.51 2bed h PHE 59 CO 0.10 0.15 0.00 0.43 -0.18 0.00 0.00 178.31 178.82 2bed n SER 60 N -4.96 0.00 0.05 2.17 7.64 0.12 -2.91 113.62 115.73 2bed n SER 60 Ca -0.04 0.36 0.04 0.00 1.01 0.00 0.00 58.87 60.24 2bed n SER 60 Cb 0.04 -0.43 0.43 0.00 -1.01 0.00 0.00 64.21 63.24 2bed n SER 60 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2bed h SER 61 N 0.00 0.37 0.00 6.43 4.64 -0.64 -2.57 113.55 121.78 2bed h SER 61 Ca 0.00 -0.03 -0.16 0.00 -0.47 0.00 0.00 61.79 61.13 2bed h SER 61 Cb 0.18 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 62.19 2bed h SER 61 CO 0.00 0.33 -0.63 1.88 -0.87 0.00 0.00 176.83 177.54 2bed h TYR 62 N 0.42 0.63 0.00 4.77 -1.99 -1.70 -3.21 116.97 115.90 2bed h TYR 62 Ca 0.11 -0.35 -0.00 0.00 2.00 0.00 0.00 58.73 60.49 2bed h TYR 62 Cb 0.07 -0.07 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 2bed h TYR 62 CO 0.00 1.17 -0.00 1.63 -0.00 0.00 0.00 178.16 180.96 2bed n LYS 63 N -4.19 0.77 -3.86 4.88 5.02 -0.97 -4.46 118.16 115.35 2bed n LYS 63 Ca -0.10 -0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 55.86 2bed n LYS 63 Cb 0.69 -1.13 -0.12 0.00 -0.02 0.00 0.00 35.03 34.45 2bed n LYS 63 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2bed s PHE 64 N 0.49 3.38 0.00 2.13 5.36 -1.21 -4.91 117.98 123.22 2bed s PHE 64 Ca 0.01 -3.10 0.00 0.00 -0.96 0.00 0.00 56.93 52.88 2bed s PHE 64 Cb 0.00 -2.92 0.00 0.00 -0.34 0.00 0.00 43.02 39.76 2bed s PHE 64 CO 0.00 -0.72 0.00 0.09 -1.46 0.00 0.00 175.22 173.13 2bed n ASN 65 N 2.87 0.00 0.00 6.13 3.02 -1.26 -4.58 115.26 121.44 2bed n ASN 65 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2bed n ASN 65 Cb 0.34 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 2bed n ASN 65 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2bed n HIS 66 N -0.15 0.00 -3.51 3.10 8.25 -1.26 -5.18 115.22 116.47 2bed n HIS 66 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.24 2bed n HIS 66 Cb 0.00 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.14 2bed n HIS 66 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 2bed n LEU 67 N 0.00 0.00 -4.70 2.41 -0.00 -1.26 -5.11 117.00 108.34 2bed n LEU 67 Ca 0.00 -2.54 -0.42 0.00 -0.00 0.00 0.00 56.01 53.05 2bed n LEU 67 Cb 0.00 -0.19 -0.03 0.00 -0.00 0.00 0.00 43.42 43.20 2bed n LEU 67 CO 0.00 -0.62 0.85 -0.69 -0.00 0.00 0.00 177.39 176.93 2bed s VAL 68 N -2.48 4.36 -0.06 1.47 1.01 -1.26 -4.77 120.40 118.68 2bed s VAL 68 Ca 0.41 1.69 -0.31 0.00 0.00 0.00 0.00 61.98 63.77 2bed s VAL 68 Cb -0.03 -4.08 -0.09 0.00 0.00 0.00 0.00 36.38 32.17 2bed s VAL 68 CO 0.26 0.07 2.01 -0.81 0.00 0.00 0.00 175.10 176.64 2bed n PRO 69 N 4.46 2.47 -3.54 2.72 -0.04 -1.26 -4.94 135.00 134.87 2bed n PRO 69 Ca 0.09 0.87 -0.40 0.00 -0.04 0.00 0.00 63.50 64.02 2bed n PRO 69 Cb 0.48 -2.95 -0.05 0.00 -0.04 0.00 0.00 33.50 30.93 2bed n PRO 69 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2bed s ARG 70 N 4.82 3.33 -0.34 0.54 1.81 -1.26 -5.05 118.95 122.79 2bed s ARG 70 Ca 0.93 -2.90 -0.28 0.00 -1.72 0.00 0.00 55.73 51.76 2bed s ARG 70 Cb -0.49 -4.11 -0.01 0.00 -0.45 0.00 0.00 34.95 29.89 2bed s ARG 70 CO 0.43 -1.24 1.74 -0.51 -0.68 0.00 0.00 175.30 175.04 2bed s LEU 71 N -0.68 3.52 -0.05 2.53 1.02 -1.26 -4.94 118.68 118.81 2bed s LEU 71 Ca 0.23 1.23 0.03 0.00 0.02 0.00 0.00 54.13 55.65 2bed s LEU 71 Cb -0.12 -3.51 0.00 0.00 0.02 0.00 0.00 46.19 42.58 2bed s LEU 71 CO -0.08 -1.67 -0.15 -0.69 0.02 0.00 0.00 176.35 173.77 2bed s VAL 72 N 6.68 1.30 -0.43 -1.59 1.01 -1.26 -2.47 120.40 123.64 2bed s VAL 72 Ca 0.77 -0.62 -0.25 0.00 0.00 0.00 0.00 61.98 61.87 2bed s VAL 72 Cb -0.21 -1.14 0.02 0.00 0.00 0.00 0.00 36.38 35.05 2bed s VAL 72 CO 0.33 0.38 0.92 -0.22 0.00 0.00 0.00 175.10 176.52 2bed s LEU 73 N 0.26 4.00 -0.13 3.92 2.96 -1.26 -4.89 118.68 123.54 2bed s LEU 73 Ca -0.08 0.29 -0.01 0.00 -0.22 0.00 0.00 54.13 54.11 2bed s LEU 73 Cb -0.13 -3.21 -0.03 0.00 0.50 0.00 0.00 46.19 43.32 2bed s LEU 73 CO 0.03 -0.97 1.16 0.00 -1.32 0.00 0.00 176.35 175.25 2bed n GLN 74 N 7.01 0.46 -0.23 1.98 1.13 -1.26 -4.65 117.38 121.82 2bed n GLN 74 Ca 0.06 -0.47 -0.04 0.00 -1.94 0.00 0.00 57.00 54.61 2bed n GLN 74 Cb 0.48 -1.86 0.02 0.00 0.11 0.00 0.00 30.24 28.99 2bed n GLN 74 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2bed h ARG 75 N 6.54 -0.12 -0.49 -1.09 3.08 -1.96 -1.58 114.38 118.77 2bed h ARG 75 Ca 0.09 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.22 2bed h ARG 75 Cb 0.14 0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.16 2bed h ARG 75 CO 0.80 -0.08 0.13 0.93 -1.07 0.00 0.00 179.97 180.69 2bed h GLU 76 N -0.12 0.28 -0.39 0.04 4.39 -2.00 -0.65 114.58 116.13 2bed h GLU 76 Ca 0.26 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.85 2bed h GLU 76 Cb 0.55 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 2bed h GLU 76 CO -0.72 0.18 -0.14 0.87 -1.16 0.00 0.00 179.01 178.04 2bed h LYS 77 N 0.28 0.70 -0.06 2.33 6.56 -1.73 -2.58 116.57 122.08 2bed h LYS 77 Ca 0.24 -0.24 -0.10 0.00 -1.06 0.00 0.00 60.65 59.49 2bed h LYS 77 Cb 0.29 -0.06 -0.01 0.00 -0.57 0.00 0.00 32.23 31.88 2bed h LYS 77 CO -0.28 0.82 -0.42 0.45 -2.06 0.00 0.00 179.45 177.95 2bed h HIS 78 N 0.63 0.15 0.09 -1.35 3.86 -0.85 -2.41 115.15 115.27 2bed h HIS 78 Ca 0.10 -0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2bed h HIS 78 Cb 0.60 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.04 2bed h HIS 78 CO 0.03 0.53 -0.04 0.35 0.86 0.00 0.00 177.93 179.66 2bed h PHE 79 N 0.11 -0.11 -0.51 2.45 3.57 -0.92 -0.74 116.94 120.78 2bed h PHE 79 Ca 0.01 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 2bed h PHE 79 Cb 0.79 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.55 2bed h PHE 79 CO 0.01 0.05 0.00 0.45 -2.23 0.00 0.00 178.31 176.59 2bed h HIS 80 N -0.25 0.91 0.57 0.41 3.86 -1.42 0.63 115.15 119.86 2bed h HIS 80 Ca -0.01 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 59.05 2bed h HIS 80 Cb 0.21 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 2bed h HIS 80 CO -0.03 0.83 -0.50 -0.92 0.86 0.00 0.00 177.93 178.17 2bed h TYR 81 N 0.79 -1.38 0.00 2.45 3.20 -1.29 -1.94 116.97 118.80 2bed h TYR 81 Ca 0.15 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 2bed h TYR 81 Cb 0.47 0.53 -0.00 0.00 1.54 0.00 0.00 36.73 39.27 2bed h TYR 81 CO 0.03 -0.69 -0.08 -0.07 -1.64 0.00 0.00 178.16 175.71 2bed h LEU 82 N -1.05 0.00 0.30 2.82 3.38 -0.84 -2.64 115.31 117.28 2bed h LEU 82 Ca -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2bed h LEU 82 Cb 0.90 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 2bed h LEU 82 CO -0.03 0.08 -0.34 0.50 0.09 0.00 0.00 178.44 178.75 2bed h LYS 83 N 0.00 -0.63 -0.27 1.13 3.64 0.11 -2.81 116.57 117.75 2bed h LYS 83 Ca -0.00 0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 2bed h LYS 83 Cb 0.16 0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2bed h LYS 83 CO 0.01 -0.42 -0.26 0.00 -2.27 0.00 0.00 179.45 176.52 2bed h ARG 84 N -0.65 0.65 -1.15 1.90 3.08 -1.48 -3.20 114.38 113.54 2bed h ARG 84 Ca -0.04 -0.34 0.44 0.00 0.07 0.00 0.00 59.98 60.12 2bed h ARG 84 Cb 0.57 0.01 -0.16 0.00 0.08 0.00 0.00 29.97 30.47 2bed h ARG 84 CO -0.06 0.94 0.67 0.78 -1.07 0.00 0.00 179.97 181.23 2bed h GLY 85 N 0.38 1.93 2.00 0.04 0.00 -1.47 2.15 103.07 108.10 2bed h GLY 85 Ca 0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2bed h GLY 85 CO 0.06 -0.68 -0.07 -2.00 0.00 0.00 0.00 176.54 173.86 2bed h LEU 86 N 0.01 0.00 0.00 3.11 5.85 -1.49 -3.28 115.31 119.51 2bed h LEU 86 Ca 0.86 0.00 -0.39 0.00 0.84 0.00 0.00 57.88 59.19 2bed h LEU 86 Cb 2.47 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 43.44 2bed h LEU 86 CO -0.65 0.07 -2.39 0.54 -0.34 0.00 0.00 178.44 175.66 2bed n ARG 87 N -3.36 0.57 -3.80 1.25 3.00 0.71 -5.07 116.66 109.95 2bed n ARG 87 Ca -0.01 0.19 -0.11 0.00 -0.01 0.00 0.00 57.85 57.91 2bed n ARG 87 Cb 0.23 -1.44 -0.08 0.00 0.00 0.00 0.00 32.46 31.17 2bed n ARG 87 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 2bed s GLN 88 N -2.47 0.77 0.02 5.56 -2.07 0.05 -5.14 119.66 116.38 2bed s GLN 88 Ca -0.34 -0.60 0.03 0.00 -1.82 0.00 0.00 55.36 52.63 2bed s GLN 88 Cb 0.11 0.33 -0.02 0.00 -1.09 0.00 0.00 33.01 32.34 2bed s GLN 88 CO 0.50 -0.24 -0.09 -0.51 -1.32 0.00 0.00 175.29 173.63 2bed s LEU 89 N -2.17 2.13 0.98 2.60 1.43 -1.26 -4.05 118.68 118.34 2bed s LEU 89 Ca -0.04 -0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 52.60 2bed s LEU 89 Cb -0.00 -0.36 0.18 0.00 0.03 0.00 0.00 46.19 46.04 2bed s LEU 89 CO -0.04 -0.02 1.08 0.42 0.23 0.00 0.00 176.35 178.02 2bed s THR 90 N -0.72 2.35 -2.00 5.49 -4.23 -1.26 -4.81 115.64 110.46 2bed s THR 90 Ca -0.02 0.11 0.06 0.00 -1.18 0.00 0.00 61.69 60.67 2bed s THR 90 Cb -0.06 -2.44 0.18 0.00 1.34 0.00 0.00 72.50 71.52 2bed s THR 90 CO 0.00 -0.15 0.82 -0.90 -0.54 0.00 0.00 174.62 173.86 2bed n ASP 91 N -4.22 0.00 0.23 3.99 3.85 -1.26 -1.38 116.55 117.76 2bed n ASP 91 Ca 0.06 -0.21 0.07 0.00 -0.71 0.00 0.00 54.79 54.00 2bed n ASP 91 Cb 0.55 0.00 0.53 0.00 -1.35 0.00 0.00 41.12 40.85 2bed n ASP 91 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2bed h ALA 92 N 2.36 1.50 -0.63 2.12 0.00 -2.05 -2.44 119.26 120.13 2bed h ALA 92 Ca 0.00 -0.19 -0.31 0.00 0.00 0.00 0.00 54.91 54.41 2bed h ALA 92 Cb 0.00 -0.03 -0.19 0.00 0.00 0.00 0.00 17.79 17.57 2bed h ALA 92 CO 0.00 0.26 0.40 0.66 0.00 0.00 0.00 179.25 180.57 2bed n TYR 93 N -4.07 1.97 0.31 0.00 4.02 -0.48 -4.33 117.16 114.58 2bed n TYR 93 Ca -0.02 -1.31 0.15 0.00 -0.01 0.00 0.00 57.90 56.71 2bed n TYR 93 Cb 0.28 -0.68 0.56 0.00 -0.02 0.00 0.00 39.34 39.48 2bed n TYR 93 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 2bed h GLU 94 N 0.82 0.00 0.00 -0.72 5.08 -1.65 -2.54 114.58 115.57 2bed h GLU 94 Ca 0.39 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.70 2bed h GLU 94 Cb 2.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.41 2bed h GLU 94 CO 0.70 0.00 -0.23 0.00 -1.00 0.00 0.00 179.01 178.48 2bed n LEU 96 N -3.27 6.02 0.09 0.00 4.77 -0.96 -4.42 117.00 119.23 2bed n LEU 96 Ca 0.01 -3.14 0.10 0.00 -0.03 0.00 0.00 56.01 52.95 2bed n LEU 96 Cb 0.50 -0.75 0.43 0.00 -2.33 0.00 0.00 43.42 41.27 2bed n LEU 96 CO 0.34 0.80 0.80 -0.67 -1.33 0.00 0.00 177.39 177.34 2bed n ASP 97 N -0.18 0.44 -0.72 -1.43 2.03 -1.06 -1.55 116.55 114.08 2bed n ASP 97 Ca 0.41 0.62 0.07 0.00 0.52 0.00 0.00 54.79 56.40 2bed n ASP 97 Cb 1.38 -0.71 0.19 0.00 -0.72 0.00 0.00 41.12 41.26 2bed n ASP 97 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2bed n ALA 98 N -1.68 2.45 -2.62 -1.67 0.00 -1.26 -4.51 120.51 111.23 2bed n ALA 98 Ca 0.02 -1.54 -0.09 0.00 0.00 0.00 0.00 53.44 51.83 2bed n ALA 98 Cb 0.19 -0.52 0.04 0.00 0.00 0.00 0.00 19.45 19.15 2bed n ALA 98 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2bed n SER 99 N 0.15 2.42 0.03 0.00 7.64 -0.60 -3.88 113.62 119.38 2bed n SER 99 Ca 0.15 -2.65 -0.10 0.00 1.01 0.00 0.00 58.87 57.27 2bed n SER 99 Cb 0.58 -0.47 0.03 0.00 -1.01 0.00 0.00 64.21 63.35 2bed n SER 99 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2bed h ARG 100 N 2.63 0.49 -0.66 1.43 3.08 -1.14 -2.61 114.38 117.61 2bed h ARG 100 Ca 0.00 -0.37 0.09 0.00 0.07 0.00 0.00 59.98 59.77 2bed h ARG 100 Cb 1.26 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 31.34 2bed h ARG 100 CO 0.42 0.99 0.44 -1.35 -1.07 0.00 0.00 179.97 179.40 2bed h PRO 101 N 0.35 0.54 -0.36 0.04 0.11 -1.83 -1.02 132.00 129.83 2bed h PRO 101 Ca -0.02 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 2bed h PRO 101 Cb 1.24 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 2bed h PRO 101 CO 0.12 0.36 0.17 -1.49 -0.21 0.00 0.00 178.00 176.95 2bed h TRP 102 N 0.56 0.52 -0.86 0.65 4.06 -1.78 -1.30 115.95 117.80 2bed h TRP 102 Ca 0.30 -0.03 0.11 0.00 2.06 0.00 0.00 58.89 61.33 2bed h TRP 102 Cb 0.43 -0.16 -0.08 0.00 -1.00 0.00 0.00 29.16 28.35 2bed h TRP 102 CO -0.00 0.45 0.49 -0.07 -3.56 0.00 0.00 178.44 175.75 2bed h LEU 103 N 0.44 0.68 0.48 -4.49 3.38 -1.01 1.10 115.31 115.88 2bed h LEU 103 Ca 0.12 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 2bed h LEU 103 Cb 0.13 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2bed h LEU 103 CO -0.01 0.36 -0.29 0.00 0.09 0.00 0.00 178.44 178.59 2bed h TYR 105 N -0.71 -1.50 -0.54 0.00 3.20 -0.28 0.81 116.97 117.95 2bed h TYR 105 Ca -0.06 0.07 0.11 0.00 3.14 0.00 0.00 58.73 61.98 2bed h TYR 105 Cb 0.57 0.69 -0.10 0.00 1.54 0.00 0.00 36.73 39.42 2bed h TYR 105 CO -0.01 -0.46 -0.16 -1.49 -1.64 0.00 0.00 178.16 174.40 2bed h TRP 106 N -0.41 -0.38 -0.02 -3.82 6.55 0.12 0.26 115.95 118.26 2bed h TRP 106 Ca 0.05 0.05 -0.04 0.00 0.95 0.00 0.00 58.89 59.90 2bed h TRP 106 Cb 0.56 0.25 0.00 0.00 -0.86 0.00 0.00 29.16 29.11 2bed h TRP 106 CO -0.66 -0.26 -0.14 0.82 -1.05 0.00 0.00 178.44 177.14 2bed h ILE 107 N -0.03 1.52 0.00 1.49 2.04 -0.79 -2.36 117.51 119.39 2bed h ILE 107 Ca 0.26 -1.75 0.00 0.00 1.00 0.00 0.00 64.86 64.37 2bed h ILE 107 Cb 0.43 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 39.13 2bed h ILE 107 CO -0.57 0.47 0.00 -0.11 0.00 0.00 0.00 178.15 177.94 2bed n LEU 108 N -4.61 0.00 -0.03 1.44 7.94 0.28 -1.66 117.00 120.36 2bed n LEU 108 Ca -0.09 0.00 -0.02 0.00 -1.11 0.00 0.00 56.01 54.79 2bed n LEU 108 Cb 0.43 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.31 2bed n LEU 108 CO 0.37 0.00 -0.75 1.57 -1.11 0.00 0.00 177.39 177.47 2bed n HIS 109 N -0.91 0.00 -0.03 1.96 -0.00 0.06 -4.14 115.22 112.17 2bed n HIS 109 Ca 0.11 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.18 2bed n HIS 109 Cb 0.05 -0.38 0.03 0.00 -0.12 0.00 0.00 29.99 29.57 2bed n HIS 109 CO 0.00 0.00 0.00 0.77 0.46 0.00 0.00 176.34 177.57 2bed h SER 110 N 0.00 0.75 -0.68 0.26 0.02 -0.75 -1.63 113.55 111.52 2bed h SER 110 Ca -0.18 -0.38 -0.06 0.00 -0.84 0.00 0.00 61.79 60.32 2bed h SER 110 Cb 1.29 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.59 2bed h SER 110 CO 0.01 1.12 0.20 -0.07 -1.14 0.00 0.00 176.83 176.95 2bed h LEU 111 N 0.53 1.01 0.13 5.07 3.38 -1.65 -1.07 115.31 122.70 2bed h LEU 111 Ca 0.02 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.79 2bed h LEU 111 Cb 1.07 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.52 2bed h LEU 111 CO 0.10 0.96 -0.38 -0.08 0.09 0.00 0.00 178.44 179.14 2bed h GLU 112 N 1.01 -0.59 -0.29 1.13 4.81 -1.64 0.37 114.58 119.38 2bed h GLU 112 Ca 0.22 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.52 2bed h GLU 112 Cb 0.32 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 2bed h GLU 112 CO -0.00 -0.40 0.19 -0.07 -0.73 0.00 0.00 179.01 178.01 2bed h LEU 113 N -0.62 0.24 -0.02 1.64 3.38 -0.99 0.42 115.31 119.36 2bed h LEU 113 Ca 0.02 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2bed h LEU 113 Cb 0.64 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.34 2bed h LEU 113 CO -0.22 0.16 -0.01 0.18 0.09 0.00 0.00 178.44 178.65 2bed n LEU 114 N -4.49 0.04 -0.84 1.67 4.77 -0.43 -1.39 117.00 116.33 2bed n LEU 114 Ca 0.02 0.15 -0.11 0.00 -0.03 0.00 0.00 56.01 56.04 2bed n LEU 114 Cb 0.16 -0.16 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2bed n LEU 114 CO 0.35 0.01 -0.10 -0.67 -1.33 0.00 0.00 177.39 175.64 2bed n ASP 115 N -1.14 -4.41 -4.81 -1.43 2.03 0.15 -4.94 116.55 102.01 2bed n ASP 115 Ca 0.18 0.27 -0.33 0.00 0.52 0.00 0.00 54.79 55.43 2bed n ASP 115 Cb 0.19 -2.87 -0.02 0.00 -0.72 0.00 0.00 41.12 37.69 2bed n ASP 115 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2bed s GLU 116 N -2.88 3.73 0.23 -0.67 0.41 0.11 -4.98 118.70 114.65 2bed s GLU 116 Ca 0.00 1.19 -0.17 0.00 -0.41 0.00 0.00 54.97 55.57 2bed s GLU 116 Cb 0.00 -2.09 -0.08 0.00 -1.78 0.00 0.00 34.13 30.18 2bed s GLU 116 CO 0.00 -0.47 0.69 -1.25 -0.49 0.00 0.00 175.26 173.73 2bed s PRO 117 N -3.70 4.13 -0.88 0.39 0.04 -1.26 -4.41 135.00 129.30 2bed s PRO 117 Ca 0.63 0.73 -0.06 0.00 0.04 0.00 0.00 61.00 62.34 2bed s PRO 117 Cb -0.14 -2.78 0.22 0.00 0.04 0.00 0.00 34.50 31.85 2bed s PRO 117 CO 0.27 0.35 0.79 0.42 0.04 0.00 0.00 177.00 178.88 2bed s ILE 118 N -1.63 4.88 0.00 0.56 1.09 -1.26 -5.05 121.20 119.79 2bed s ILE 118 Ca 0.45 -3.32 -0.13 0.00 -1.10 0.00 0.00 60.65 56.55 2bed s ILE 118 Cb -0.15 -4.02 -0.06 0.00 -1.06 0.00 0.00 42.46 37.17 2bed s ILE 118 CO 0.20 -1.06 0.34 -2.65 -0.10 0.00 0.00 174.94 171.67 2bed n PRO 119 N 2.95 0.00 0.00 2.79 -0.02 -1.26 -4.60 135.00 134.86 2bed n PRO 119 Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 2bed n PRO 119 Cb 0.40 -0.48 0.00 0.00 -0.02 0.00 0.00 33.50 33.40 2bed n PRO 119 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2bed n GLN 120 N 0.48 0.00 -0.12 -0.52 6.02 -1.26 -1.89 117.38 120.10 2bed n GLN 120 Ca 0.06 0.25 -0.23 0.00 -0.01 0.00 0.00 57.00 57.07 2bed n GLN 120 Cb 0.03 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 29.69 2bed n GLN 120 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 2bed n ILE 121 N -1.25 1.52 -0.17 5.09 -0.00 -1.26 -3.85 119.36 119.44 2bed n ILE 121 Ca 0.00 -0.16 0.06 0.00 -0.00 0.00 0.00 62.75 62.65 2bed n ILE 121 Cb 0.00 -2.02 0.35 0.00 -0.00 0.00 0.00 39.64 37.97 2bed n ILE 121 CO 0.00 0.00 0.00 1.62 -0.00 0.00 0.00 176.55 178.17 2bed h VAL 122 N -1.00 1.04 0.29 1.39 3.04 -1.78 -2.25 116.25 116.98 2bed h VAL 122 Ca -0.46 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 64.97 2bed h VAL 122 Cb 1.36 0.21 -0.02 0.00 -2.01 0.00 0.00 31.29 30.83 2bed h VAL 122 CO -0.28 0.14 -0.31 0.00 -1.01 0.00 0.00 177.57 176.11 2bed h ALA 123 N 1.61 -0.64 -0.67 3.17 0.00 -1.56 0.94 119.26 122.11 2bed h ALA 123 Ca 0.30 -0.10 0.12 0.00 0.00 0.00 0.00 54.91 55.23 2bed h ALA 123 Cb 0.20 0.45 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 2bed h ALA 123 CO -0.09 -0.90 0.45 1.15 0.00 0.00 0.00 179.25 179.86 2bed h THR 124 N -0.64 0.85 0.48 0.00 2.02 -1.53 0.65 112.91 114.74 2bed h THR 124 Ca -0.01 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 2bed h THR 124 Cb 0.59 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 2bed h THR 124 CO -0.07 0.07 -0.23 0.44 0.37 0.00 0.00 175.52 176.10 2bed h ASP 125 N 0.40 -0.55 -0.62 4.18 3.32 -0.73 0.10 116.42 122.52 2bed h ASP 125 Ca 0.32 -0.07 0.13 0.00 0.02 0.00 0.00 57.03 57.42 2bed h ASP 125 Cb 0.69 0.14 -0.11 0.00 0.22 0.00 0.00 39.33 40.27 2bed h ASP 125 CO -0.09 -0.22 -0.09 0.58 -1.72 0.00 0.00 179.24 177.70 2bed h VAL 126 N -0.89 0.42 0.32 -1.35 2.07 0.20 0.31 116.25 117.32 2bed h VAL 126 Ca -0.07 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 2bed h VAL 126 Cb 0.59 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 2bed h VAL 126 CO 0.11 0.01 -0.29 0.00 0.02 0.00 0.00 177.57 177.42 2bed h GLN 128 N -0.63 1.04 0.34 0.00 4.20 0.14 -0.47 115.11 119.72 2bed h GLN 128 Ca -0.02 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 2bed h GLN 128 Cb 0.57 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2bed h GLN 128 CO -0.04 0.69 -0.16 0.35 -0.67 0.00 0.00 178.83 178.99 2bed h PHE 129 N 1.07 -0.42 -0.29 2.96 3.57 0.00 -2.10 116.94 121.73 2bed h PHE 129 Ca 0.42 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.99 2bed h PHE 129 Cb 0.22 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 2bed h PHE 129 CO -0.02 -0.25 0.21 -0.07 -2.23 0.00 0.00 178.31 175.96 2bed h LEU 130 N -0.48 0.00 -1.56 0.59 3.38 -0.47 0.39 115.31 117.17 2bed h LEU 130 Ca -0.05 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2bed h LEU 130 Cb 0.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2bed h LEU 130 CO 0.08 0.00 -0.23 -0.33 0.09 0.00 0.00 178.44 178.04 2bed h GLU 131 N 0.00 0.00 0.05 1.13 5.08 -0.42 -0.44 114.58 119.98 2bed h GLU 131 Ca 0.14 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.25 2bed h GLU 131 Cb 0.55 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.81 2bed h GLU 131 CO -0.00 0.23 -1.07 -0.07 -1.00 0.00 0.00 179.01 177.11 2bed h LEU 132 N 0.00 0.54 -0.74 1.33 3.38 0.08 -3.19 115.31 116.71 2bed h LEU 132 Ca -0.00 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.48 2bed h LEU 132 Cb 0.44 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2bed h LEU 132 CO 0.03 1.31 0.00 0.00 0.09 0.00 0.00 178.44 179.87 2bed s GLN 134 N -3.42 4.71 0.25 0.00 0.74 -0.25 0.94 119.66 122.63 2bed s GLN 134 Ca 0.04 1.67 -0.15 0.00 0.05 0.00 0.00 55.36 56.98 2bed s GLN 134 Cb 0.08 -3.24 -0.08 0.00 1.10 0.00 0.00 33.01 30.87 2bed s GLN 134 CO 0.58 0.29 0.66 0.45 -0.55 0.00 0.00 175.29 176.73 2bed s SER 135 N -0.83 6.81 0.00 6.67 0.15 0.21 -4.90 113.70 121.81 2bed s SER 135 Ca 0.44 1.20 0.07 0.00 0.70 0.00 0.00 55.95 58.35 2bed s SER 135 Cb -0.29 -2.34 0.40 0.00 -1.71 0.00 0.00 66.02 62.08 2bed s SER 135 CO 0.37 -0.08 1.09 -0.81 1.20 0.00 0.00 173.24 175.00 2bed n PRO 136 N 0.09 0.80 -0.47 5.44 -0.04 -1.26 -1.91 135.00 137.65 2bed n PRO 136 Ca 0.00 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.53 2bed n PRO 136 Cb 0.52 -1.13 0.17 0.00 -0.04 0.00 0.00 33.50 33.02 2bed n PRO 136 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2bed n ASP 137 N -0.63 1.82 -0.03 3.54 8.00 -1.26 -5.09 116.55 122.90 2bed n ASP 137 Ca 0.05 -3.44 0.00 0.00 0.71 0.00 0.00 54.79 52.11 2bed n ASP 137 Cb 0.02 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.65 2bed n ASP 137 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bed n GLY 138 N -1.08 -2.94 0.00 0.44 0.00 -0.80 -4.41 105.19 96.40 2bed n GLY 138 Ca 0.16 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.98 2bed n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bed n GLY 139 N -1.18 -0.79 3.28 -0.02 0.00 -1.26 -4.52 105.19 100.69 2bed n GLY 139 Ca 0.00 -1.70 -0.24 0.00 0.00 0.00 0.00 46.02 44.08 2bed n GLY 139 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bed s PHE 140 N -1.21 1.75 0.52 1.61 0.40 -1.26 -0.61 117.98 119.16 2bed s PHE 140 Ca 0.00 -0.42 0.07 0.00 -0.60 0.00 0.00 56.93 55.98 2bed s PHE 140 Cb 0.00 -0.96 0.05 0.00 0.51 0.00 0.00 43.02 42.61 2bed s PHE 140 CO 0.00 0.19 0.71 0.20 0.70 0.00 0.00 175.22 177.02 2bed s GLY 141 N -1.85 1.84 0.00 4.36 0.00 0.27 -0.84 107.32 111.10 2bed s GLY 141 Ca 0.06 -1.78 0.15 0.00 0.00 0.00 0.00 44.72 43.15 2bed s GLY 141 CO 0.04 -1.46 1.40 0.61 0.00 0.00 0.00 173.10 173.69 2bed n GLY 142 N -2.14 -0.76 0.00 0.20 0.00 -1.25 -4.65 105.19 96.59 2bed n GLY 142 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2bed n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bed n GLY 143 N -0.03 0.20 3.67 -0.02 0.00 -1.26 -1.02 105.19 106.73 2bed n GLY 143 Ca 0.07 -0.91 -0.60 0.00 0.00 0.00 0.00 46.02 44.59 2bed n GLY 143 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bed n PRO 144 N -0.14 0.67 -1.06 1.61 -0.02 -1.26 -1.59 135.00 133.21 2bed n PRO 144 Ca 0.00 0.24 -0.02 0.00 -2.02 0.00 0.00 63.50 61.70 2bed n PRO 144 Cb 0.00 -1.84 -0.01 0.00 -0.02 0.00 0.00 33.50 31.63 2bed n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bed n GLY 145 N 3.47 0.55 3.94 -1.23 0.00 -1.24 -4.99 105.19 105.69 2bed n GLY 145 Ca 0.25 -0.41 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 2bed n GLY 145 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bed s GLN 146 N -1.34 3.47 0.63 1.61 -0.21 -0.62 -5.07 119.66 118.14 2bed s GLN 146 Ca 0.00 -0.50 -0.18 0.00 0.02 0.00 0.00 55.36 54.70 2bed s GLN 146 Cb 0.00 -2.89 -0.02 0.00 1.00 0.00 0.00 33.01 31.10 2bed s GLN 146 CO 0.00 0.44 1.24 0.71 -2.12 0.00 0.00 175.29 175.57 2bed s TYR 147 N -1.85 2.22 0.37 0.91 4.12 -1.26 -4.13 117.35 117.72 2bed s TYR 147 Ca 0.36 1.51 -0.27 0.00 0.02 0.00 0.00 57.07 58.69 2bed s TYR 147 Cb -0.11 -3.57 -0.09 0.00 -1.52 0.00 0.00 41.96 36.67 2bed s TYR 147 CO 0.29 -2.56 1.26 -1.25 0.02 0.00 0.00 175.55 173.31 2bed s PRO 148 N -3.43 4.18 -0.10 -1.71 0.04 -1.26 -3.98 135.00 128.75 2bed s PRO 148 Ca 0.79 2.09 -0.05 0.00 0.04 0.00 0.00 61.00 63.87 2bed s PRO 148 Cb -0.33 -2.89 0.05 0.00 0.04 0.00 0.00 34.50 31.36 2bed s PRO 148 CO 0.37 -0.29 0.23 -1.58 0.04 0.00 0.00 177.00 175.78 2bed s HIS 149 N -1.24 -0.31 0.36 0.56 2.46 -0.02 -4.59 115.29 112.51 2bed s HIS 149 Ca 0.53 0.75 0.14 0.00 0.47 0.00 0.00 55.06 56.96 2bed s HIS 149 Cb -0.37 0.02 1.01 0.00 -0.13 0.00 0.00 32.58 33.11 2bed s HIS 149 CO 0.48 -0.23 1.74 -0.07 -2.47 0.00 0.00 174.74 174.19 2bed h LEU 150 N 7.28 0.55 0.27 8.88 3.38 -1.26 -0.14 115.31 134.27 2bed h LEU 150 Ca -0.39 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 2bed h LEU 150 Cb 1.15 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2bed h LEU 150 CO 0.37 0.07 -0.13 0.00 0.09 0.00 0.00 178.44 178.84 2bed h ALA 151 N 1.69 -0.37 -0.93 1.53 0.00 -1.93 0.39 119.26 119.64 2bed h ALA 151 Ca 0.64 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2bed h ALA 151 Cb 1.42 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.31 2bed h ALA 151 CO -0.41 -0.71 0.58 -1.35 0.00 0.00 0.00 179.25 177.37 2bed h PRO 152 N -0.37 1.24 -0.22 0.00 0.11 -1.63 -1.34 132.00 129.79 2bed h PRO 152 Ca -0.04 -0.10 0.03 0.00 0.11 0.00 0.00 66.00 66.01 2bed h PRO 152 Cb 0.28 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 31.10 2bed h PRO 152 CO 0.06 0.85 0.04 1.15 -0.21 0.00 0.00 178.00 179.89 2bed h THR 153 N 1.27 0.90 0.15 -1.15 2.02 -0.52 0.47 112.91 116.06 2bed h THR 153 Ca 0.34 -0.04 0.02 0.00 0.77 0.00 0.00 66.41 67.49 2bed h THR 153 Cb -0.09 0.76 -0.04 0.00 -1.74 0.00 0.00 68.15 67.04 2bed h THR 153 CO -0.07 0.02 -0.35 0.22 0.37 0.00 0.00 175.52 175.71 2bed h TYR 154 N 0.13 -0.97 -0.31 3.16 3.20 0.18 -1.21 116.97 121.15 2bed h TYR 154 Ca 0.10 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.05 2bed h TYR 154 Cb 0.10 0.41 -0.06 0.00 1.54 0.00 0.00 36.73 38.71 2bed h TYR 154 CO -0.15 -0.46 -0.09 0.00 -1.64 0.00 0.00 178.16 175.81 2bed h ALA 155 N -0.03 0.18 -0.20 1.82 0.00 -0.81 -1.96 119.26 118.26 2bed h ALA 155 Ca 0.02 0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.09 2bed h ALA 155 Cb 0.62 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 2bed h ALA 155 CO -0.19 -0.48 -0.02 0.00 0.00 0.00 0.00 179.25 178.56 2bed h ALA 156 N 1.27 0.16 -0.17 0.00 0.00 0.14 -1.72 119.26 118.94 2bed h ALA 156 Ca 0.15 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2bed h ALA 156 Cb 0.25 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2bed h ALA 156 CO -0.33 -0.45 0.11 0.28 0.00 0.00 0.00 179.25 178.86 2bed h VAL 157 N 0.04 1.05 -0.86 0.00 2.07 -0.85 -1.14 116.25 116.57 2bed h VAL 157 Ca 0.10 -0.10 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 2bed h VAL 157 Cb 0.13 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 2bed h VAL 157 CO -0.18 0.05 0.52 0.78 0.02 0.00 0.00 177.57 178.76 2bed h ASN 158 N 0.22 1.02 0.12 0.57 2.35 -1.26 -0.28 115.58 118.33 2bed h ASN 158 Ca 0.06 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2bed h ASN 158 Cb -0.02 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.08 2bed h ASN 158 CO -0.01 0.78 -0.25 0.00 -1.65 0.00 0.00 177.43 176.30 2bed h ALA 159 N 1.40 -0.83 -0.84 -0.83 0.00 -0.87 0.22 119.26 117.51 2bed h ALA 159 Ca 0.31 -0.07 0.21 0.00 0.00 0.00 0.00 54.91 55.36 2bed h ALA 159 Cb -0.06 0.60 -0.13 0.00 0.00 0.00 0.00 17.79 18.20 2bed h ALA 159 CO -0.06 -0.88 0.23 -0.07 0.00 0.00 0.00 179.25 178.48 2bed h LEU 160 N -0.40 0.04 -0.99 0.00 3.38 -0.89 0.16 115.31 116.61 2bed h LEU 160 Ca -0.01 0.18 -0.10 0.00 0.09 0.00 0.00 57.88 58.03 2bed h LEU 160 Cb 0.38 0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2bed h LEU 160 CO -0.10 -0.10 -0.44 0.00 0.09 0.00 0.00 178.44 177.89 2bed h ILE 162 N 0.12 1.23 0.00 0.00 2.04 0.23 0.11 117.51 121.23 2bed h ILE 162 Ca 0.01 -1.03 -0.07 0.00 1.00 0.00 0.00 64.86 64.77 2bed h ILE 162 Cb 0.82 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 2bed h ILE 162 CO 0.06 0.33 -0.33 0.40 0.00 0.00 0.00 178.15 178.62 2bed h ILE 163 N 0.38 0.65 -3.19 -0.67 2.04 -0.84 -3.47 117.51 112.40 2bed h ILE 163 Ca 0.07 -1.59 -0.02 0.00 1.00 0.00 0.00 64.86 64.32 2bed h ILE 163 Cb 0.51 2.07 -0.01 0.00 -0.74 0.00 0.00 36.82 38.66 2bed h ILE 163 CO 0.03 0.32 -0.02 0.61 0.00 0.00 0.00 178.15 179.09 2bed n GLY 164 N 0.70 -0.15 3.91 5.37 0.00 0.02 -4.94 105.19 110.10 2bed n GLY 164 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 2bed n GLY 164 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bed s THR 165 N -1.50 5.20 0.61 2.61 -4.23 -1.26 -4.93 115.64 112.13 2bed s THR 165 Ca 0.00 -0.18 0.31 0.00 -1.18 0.00 0.00 61.69 60.64 2bed s THR 165 Cb 0.00 -3.68 0.36 0.00 1.34 0.00 0.00 72.50 70.53 2bed s THR 165 CO 0.00 -0.06 2.11 -0.33 -0.54 0.00 0.00 174.62 175.80 2bed h GLU 166 N 2.44 0.00 0.58 3.99 3.07 -1.98 0.97 114.58 123.66 2bed h GLU 166 Ca -0.47 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.36 2bed h GLU 166 Cb 1.18 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 29.09 2bed h GLU 166 CO 0.71 0.00 -0.28 1.49 -1.40 0.00 0.00 179.01 179.53 2bed h GLU 167 N 0.00 -0.75 -0.14 2.33 4.81 -1.98 -1.01 114.58 117.84 2bed h GLU 167 Ca 0.07 0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.39 2bed h GLU 167 Cb 0.46 0.17 -0.07 0.00 0.63 0.00 0.00 28.75 29.95 2bed h GLU 167 CO -0.00 -0.44 -0.37 0.00 -0.73 0.00 0.00 179.01 177.46 2bed h ALA 168 N -0.67 -0.48 -0.59 2.92 0.00 -1.22 -1.94 119.26 117.28 2bed h ALA 168 Ca -0.08 0.01 0.12 0.00 0.00 0.00 0.00 54.91 54.96 2bed h ALA 168 Cb 0.65 0.71 -0.10 0.00 0.00 0.00 0.00 17.79 19.05 2bed h ALA 168 CO 0.13 -0.86 -0.05 1.88 0.00 0.00 0.00 179.25 180.35 2bed h TYR 169 N -0.44 -0.13 0.00 0.00 0.99 -1.01 0.71 116.97 117.09 2bed h TYR 169 Ca 0.09 0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.87 2bed h TYR 169 Cb 0.59 0.15 0.00 0.00 1.00 0.00 0.00 36.73 38.47 2bed h TYR 169 CO -0.45 -0.19 0.00 -0.91 -0.00 0.00 0.00 178.16 176.61 2bed h ASN 170 N 0.07 0.00 -0.58 3.88 4.21 -0.40 -1.99 115.58 120.77 2bed h ASN 170 Ca 0.30 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.75 2bed h ASN 170 Cb 0.47 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.65 2bed h ASN 170 CO -0.54 0.00 0.15 0.58 -1.29 0.00 0.00 177.43 176.34 2bed h VAL 171 N 0.00 1.25 -2.75 2.81 2.07 -0.47 -3.42 116.25 115.73 2bed h VAL 171 Ca 0.00 -0.87 -0.53 0.00 0.82 0.00 0.00 66.70 66.11 2bed h VAL 171 Cb 0.05 0.70 0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2bed h VAL 171 CO 0.00 0.33 0.95 -0.63 0.02 0.00 0.00 177.57 178.23 2bed s ILE 172 N -5.34 3.13 -1.18 4.57 1.01 -0.75 -4.95 121.20 117.70 2bed s ILE 172 Ca -0.13 0.61 -0.12 0.00 0.00 0.00 0.00 60.65 61.01 2bed s ILE 172 Cb 0.13 -3.39 0.21 0.00 0.01 0.00 0.00 42.46 39.41 2bed s ILE 172 CO 0.81 0.00 1.34 -3.20 0.00 0.00 0.00 174.94 173.89 2bed n ASN 173 N 5.37 5.33 -0.30 3.58 2.85 -1.26 -4.92 115.26 125.91 2bed n ASN 173 Ca 0.15 -3.00 -0.10 0.00 -0.11 0.00 0.00 54.58 51.52 2bed n ASN 173 Cb 0.41 -1.50 -0.06 0.00 1.24 0.00 0.00 39.78 39.86 2bed n ASN 173 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 2bed h ARG 174 N 6.94 -0.14 -1.00 1.20 3.08 -1.93 -0.89 114.38 121.63 2bed h ARG 174 Ca 0.27 0.01 0.16 0.00 0.07 0.00 0.00 59.98 60.50 2bed h ARG 174 Cb 0.87 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.85 2bed h ARG 174 CO 1.17 -0.09 0.62 1.05 -1.07 0.00 0.00 179.97 181.65 2bed h GLU 175 N -0.15 0.83 0.00 0.04 9.09 -1.97 -2.29 114.58 120.13 2bed h GLU 175 Ca 0.17 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 59.53 2bed h GLU 175 Cb 0.52 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 27.43 2bed h GLU 175 CO -0.81 0.55 -0.67 0.87 0.05 0.00 0.00 179.01 179.01 2bed h LYS 176 N 0.85 0.00 -0.59 1.06 1.57 -1.79 -3.12 116.57 114.55 2bed h LYS 176 Ca 0.55 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.24 2bed h LYS 176 Cb 0.74 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 2bed h LYS 176 CO -0.34 0.00 0.01 1.25 -0.57 0.00 0.00 179.45 179.81 2bed h LEU 177 N 0.00 0.99 -0.04 2.94 5.85 -0.63 0.42 115.31 124.84 2bed h LEU 177 Ca 0.00 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 2bed h LEU 177 Cb 0.79 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 2bed h LEU 177 CO 0.00 1.04 -0.05 0.25 -0.34 0.00 0.00 178.44 179.34 2bed h LEU 178 N 0.94 0.11 -1.63 2.25 6.46 -1.57 -1.58 115.31 120.30 2bed h LEU 178 Ca 0.17 -0.50 0.25 0.00 -0.12 0.00 0.00 57.88 57.69 2bed h LEU 178 Cb 0.53 -0.03 -0.07 0.00 -0.73 0.00 0.00 40.66 40.36 2bed h LEU 178 CO 0.03 0.59 0.66 -0.61 -0.62 0.00 0.00 178.44 178.49 2bed h GLN 179 N -0.36 0.26 0.08 1.25 4.15 -1.42 0.35 115.11 119.41 2bed h GLN 179 Ca 0.01 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.41 2bed h GLN 179 Cb 0.56 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.19 2bed h GLN 179 CO 0.01 0.17 -0.04 -0.92 -1.93 0.00 0.00 178.83 176.12 2bed h TYR 180 N 0.26 -0.10 -0.92 3.99 3.20 -0.51 -2.92 116.97 119.98 2bed h TYR 180 Ca 0.51 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.58 2bed h TYR 180 Cb 1.54 0.03 -0.11 0.00 1.54 0.00 0.00 36.73 39.73 2bed h TYR 180 CO -0.00 0.33 0.47 -0.07 -1.64 0.00 0.00 178.16 177.25 2bed h LEU 181 N -0.56 0.50 -0.86 2.82 3.38 0.05 0.17 115.31 120.81 2bed h LEU 181 Ca -0.01 0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.98 2bed h LEU 181 Cb 0.47 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2bed h LEU 181 CO 0.02 0.11 -0.36 1.88 0.09 0.00 0.00 178.44 180.18 2bed h TYR 182 N 0.54 0.47 0.00 1.13 0.99 -1.41 -2.07 116.97 116.62 2bed h TYR 182 Ca 0.55 -0.12 0.00 0.00 2.00 0.00 0.00 58.73 61.16 2bed h TYR 182 Cb 0.96 -0.11 0.00 0.00 1.00 0.00 0.00 36.73 38.58 2bed h TYR 182 CO -0.09 0.72 0.00 -1.13 -0.00 0.00 0.00 178.16 177.66 2bed n SER 183 N -4.06 0.23 -0.01 3.88 3.41 0.04 -2.40 113.62 114.71 2bed n SER 183 Ca -0.01 0.58 0.04 0.00 -0.26 0.00 0.00 58.87 59.22 2bed n SER 183 Cb 0.47 -0.62 -0.06 0.00 -0.26 0.00 0.00 64.21 63.73 2bed n SER 183 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2bed n LEU 184 N -1.78 0.00 -4.77 1.04 4.77 -1.07 -4.93 117.00 110.27 2bed n LEU 184 Ca 0.01 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.58 2bed n LEU 184 Cb 0.09 0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2bed n LEU 184 CO 0.09 0.01 1.02 -0.75 -1.33 0.00 0.00 177.39 176.43 2bed s LYS 185 N -2.54 4.29 0.21 3.23 2.36 -0.80 -1.55 119.74 124.93 2bed s LYS 185 Ca -0.03 2.30 0.07 0.00 -2.55 0.00 0.00 55.97 55.76 2bed s LYS 185 Cb 0.05 -3.05 -0.04 0.00 -1.05 0.00 0.00 37.83 33.75 2bed s LYS 185 CO 0.34 -0.27 0.09 -0.65 1.55 0.00 0.00 175.35 176.41 2bed s GLN 186 N -1.86 2.67 0.25 4.03 -1.52 0.23 -4.94 119.66 118.52 2bed s GLN 186 Ca 0.50 -1.07 -0.04 0.00 -1.95 0.00 0.00 55.36 52.80 2bed s GLN 186 Cb -0.41 -2.47 0.40 0.00 -0.22 0.00 0.00 33.01 30.31 2bed s GLN 186 CO 0.55 0.44 1.82 -1.35 -0.25 0.00 0.00 175.29 176.50 2bed h PRO 187 N 2.17 0.83 0.00 2.91 0.11 -1.96 -0.59 132.00 135.47 2bed h PRO 187 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2bed h PRO 187 Cb 1.22 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2bed h PRO 187 CO 0.61 0.55 0.00 -0.40 -0.21 0.00 0.00 178.00 178.55 2bed n ASP 188 N -4.70 0.00 0.00 -2.05 5.75 -1.26 -4.87 116.55 109.42 2bed n ASP 188 Ca 0.14 -1.18 0.00 0.00 -0.01 0.00 0.00 54.79 53.74 2bed n ASP 188 Cb 0.26 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.35 2bed n ASP 188 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bed n GLY 189 N 0.49 2.82 3.74 6.12 0.00 -0.23 -4.44 105.19 113.69 2bed n GLY 189 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2bed n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bed s SER 190 N 0.20 2.30 0.14 1.61 1.04 -1.26 -4.09 113.70 113.64 2bed s SER 190 Ca 0.00 0.67 0.06 0.00 0.48 0.00 0.00 55.95 57.17 2bed s SER 190 Cb 0.00 -0.99 -0.04 0.00 0.10 0.00 0.00 66.02 65.09 2bed s SER 190 CO 0.00 -3.27 -0.15 -0.36 0.98 0.00 0.00 173.24 170.44 2bed s PHE 191 N -3.30 1.51 0.39 5.02 0.40 -1.26 0.77 117.98 121.51 2bed s PHE 191 Ca 0.69 -0.56 -0.09 0.00 -0.60 0.00 0.00 56.93 56.37 2bed s PHE 191 Cb -0.10 -0.77 -0.06 0.00 0.51 0.00 0.00 43.02 42.60 2bed s PHE 191 CO 0.55 0.20 0.74 -0.51 0.70 0.00 0.00 175.22 176.90 2bed s LEU 192 N -2.67 3.85 0.27 -0.37 1.43 -0.60 -4.34 118.68 116.25 2bed s LEU 192 Ca 0.13 1.05 0.11 0.00 -1.03 0.00 0.00 54.13 54.39 2bed s LEU 192 Cb -0.04 -3.93 0.34 0.00 0.03 0.00 0.00 46.19 42.59 2bed s LEU 192 CO 0.04 -0.38 1.60 0.24 0.23 0.00 0.00 176.35 178.07 2bed h MET 193 N 1.24 0.00 -2.25 1.70 2.86 -1.31 -3.46 114.93 113.72 2bed h MET 193 Ca -0.47 0.00 0.18 0.00 -2.06 0.00 0.00 59.70 57.35 2bed h MET 193 Cb 1.19 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.75 2bed h MET 193 CO 0.64 0.63 0.52 -3.38 1.06 0.00 0.00 176.91 176.38 2bed s HIS 194 N -3.55 -0.15 0.01 -0.22 0.00 -1.26 -0.83 115.29 109.28 2bed s HIS 194 Ca -0.01 -0.11 -0.35 0.00 -3.00 0.00 0.00 55.06 51.59 2bed s HIS 194 Cb 0.12 0.62 -0.14 0.00 -4.00 0.00 0.00 32.58 29.18 2bed s HIS 194 CO 0.76 -0.73 1.65 0.28 -1.00 0.00 0.00 174.74 175.70 2bed n VAL 195 N -0.44 0.22 -1.56 -5.38 0.31 -1.26 -0.02 118.33 110.21 2bed n VAL 195 Ca -0.07 -0.04 -0.15 0.00 -0.01 0.00 0.00 64.34 64.07 2bed n VAL 195 Cb 0.61 -1.46 -0.06 0.00 -0.91 0.00 0.00 33.84 32.02 2bed n VAL 195 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2bed n GLY 196 N 3.66 1.32 1.25 2.92 0.00 -1.26 -4.99 105.19 108.09 2bed n GLY 196 Ca 0.20 -0.29 -0.07 0.00 0.00 0.00 0.00 46.02 45.87 2bed n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bed n GLY 197 N -1.08 2.21 3.94 -0.02 0.00 0.98 -5.11 105.19 106.11 2bed n GLY 197 Ca -0.16 -2.17 -0.28 0.00 0.00 0.00 0.00 46.02 43.41 2bed n GLY 197 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2bed s GLU 198 N -2.81 1.33 -0.05 1.61 1.03 -1.26 -4.67 118.70 113.88 2bed s GLU 198 Ca 0.17 -0.45 0.01 0.00 0.03 0.00 0.00 54.97 54.73 2bed s GLU 198 Cb -0.01 -2.02 0.02 0.00 -0.80 0.00 0.00 34.13 31.31 2bed s GLU 198 CO 0.11 -1.88 -0.06 0.08 -1.33 0.00 0.00 175.26 172.18 2bed s VAL 199 N -3.57 0.66 -0.05 1.83 1.01 -1.26 -0.94 120.40 118.09 2bed s VAL 199 Ca 0.68 -0.20 -0.31 0.00 0.00 0.00 0.00 61.98 62.16 2bed s VAL 199 Cb -0.06 -0.67 0.11 0.00 0.00 0.00 0.00 36.38 35.76 2bed s VAL 199 CO 0.49 0.25 1.07 1.51 0.00 0.00 0.00 175.10 178.42 2bed s ASP 200 N 0.87 -0.21 0.65 3.32 1.47 -1.26 -4.85 116.67 116.66 2bed s ASP 200 Ca -0.12 -0.08 0.14 0.00 1.18 0.00 0.00 52.55 53.68 2bed s ASP 200 Cb -0.15 0.28 0.79 0.00 -0.34 0.00 0.00 42.92 43.50 2bed s ASP 200 CO 0.01 -0.48 1.44 -0.37 0.68 0.00 0.00 175.17 176.44 2bed h VAL 201 N 2.00 0.00 -0.85 2.11 -1.51 -1.64 -0.85 116.25 115.51 2bed h VAL 201 Ca -0.19 0.00 0.10 0.00 -1.23 0.00 0.00 66.70 65.38 2bed h VAL 201 Cb 1.21 0.32 -0.06 0.00 -2.13 0.00 0.00 31.29 30.63 2bed h VAL 201 CO 0.27 0.00 0.55 0.03 -1.23 0.00 0.00 177.57 177.19 2bed h ARG 202 N 0.00 0.76 -0.43 5.19 3.08 -1.92 -2.05 114.38 119.01 2bed h ARG 202 Ca 0.00 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.92 2bed h ARG 202 Cb 1.33 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.20 2bed h ARG 202 CO 0.00 0.50 -0.08 0.66 -1.07 0.00 0.00 179.97 179.99 2bed h SER 203 N 0.78 0.82 -0.03 7.04 4.64 -1.46 -0.82 113.55 124.53 2bed h SER 203 Ca 0.40 -0.35 0.03 0.00 -0.47 0.00 0.00 61.79 61.40 2bed h SER 203 Cb 0.48 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.31 2bed h SER 203 CO -0.17 0.97 -0.21 0.00 -0.87 0.00 0.00 176.83 176.56 2bed h ALA 204 N 0.87 -0.24 -0.03 5.18 0.00 -1.54 0.18 119.26 123.68 2bed h ALA 204 Ca 0.11 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2bed h ALA 204 Cb 0.60 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2bed h ALA 204 CO 0.04 -0.69 -0.03 -0.92 0.00 0.00 0.00 179.25 177.64 2bed h TYR 205 N -0.32 -0.08 -0.61 0.00 3.20 -1.39 0.19 116.97 117.96 2bed h TYR 205 Ca 0.07 0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.98 2bed h TYR 205 Cb 0.41 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 2bed h TYR 205 CO -0.26 -0.05 0.37 0.00 -1.64 0.00 0.00 178.16 176.57 2bed h ALA 207 N 1.28 -1.14 -0.18 0.00 0.00 -0.36 -2.25 119.26 116.61 2bed h ALA 207 Ca 0.25 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.96 2bed h ALA 207 Cb 0.05 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2bed h ALA 207 CO -0.12 -1.08 0.16 0.00 0.00 0.00 0.00 179.25 178.22 2bed h ALA 208 N -1.22 1.95 -0.18 0.00 0.00 -0.48 0.13 119.26 119.46 2bed h ALA 208 Ca -0.12 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 2bed h ALA 208 Cb 0.88 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.69 2bed h ALA 208 CO 0.19 -0.26 -0.58 1.03 0.00 0.00 0.00 179.25 179.63 2bed h SER 209 N 0.00 0.82 0.10 0.00 0.87 -0.19 -2.86 113.55 112.29 2bed h SER 209 Ca 0.09 -0.60 -0.19 0.00 -1.23 0.00 0.00 61.79 59.86 2bed h SER 209 Cb 0.41 -0.24 0.01 0.00 -0.44 0.00 0.00 62.40 62.14 2bed h SER 209 CO -0.00 1.28 -0.91 -0.37 -0.53 0.00 0.00 176.83 176.29 2bed h VAL 210 N 0.41 1.36 -0.60 2.23 -1.51 -0.83 -3.12 116.25 114.21 2bed h VAL 210 Ca -0.02 -2.44 0.06 0.00 -1.23 0.00 0.00 66.70 63.06 2bed h VAL 210 Cb 1.21 3.01 -0.05 0.00 -2.13 0.00 0.00 31.29 33.32 2bed h VAL 210 CO 0.12 0.67 0.31 0.00 -1.23 0.00 0.00 177.57 177.44 2bed h ALA 211 N -0.01 0.78 0.34 5.19 0.00 -1.13 -1.19 119.26 123.25 2bed h ALA 211 Ca -0.19 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2bed h ALA 211 Cb 1.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.28 2bed h ALA 211 CO 0.07 -0.04 -0.16 0.66 0.00 0.00 0.00 179.25 179.78 2bed h SER 212 N 0.57 -0.39 -0.05 0.00 4.64 -1.65 0.51 113.55 117.19 2bed h SER 212 Ca 0.27 -0.15 0.03 0.00 -0.47 0.00 0.00 61.79 61.48 2bed h SER 212 Cb 0.20 0.10 -0.05 0.00 -0.31 0.00 0.00 62.40 62.34 2bed h SER 212 CO -0.19 -0.04 -0.22 -0.07 -0.87 0.00 0.00 176.83 175.44 2bed h LEU 213 N -0.76 -0.65 0.00 5.97 3.38 -1.46 -0.30 115.31 121.49 2bed h LEU 213 Ca -0.05 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2bed h LEU 213 Cb 0.51 0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2bed h LEU 213 CO 0.08 -0.28 0.00 0.35 0.09 0.00 0.00 178.44 178.68 2bed n THR 214 N -5.35 0.03 -3.46 0.22 -2.24 -0.46 -4.32 114.28 98.70 2bed n THR 214 Ca -0.04 0.01 -0.16 0.00 -2.27 0.00 0.00 64.05 61.58 2bed n THR 214 Cb 0.26 -0.66 0.01 0.00 -2.10 0.00 0.00 70.33 67.84 2bed n THR 214 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2bed n ASN 215 N -1.02 -6.19 -0.05 3.42 5.15 -0.12 -4.87 115.26 111.58 2bed n ASN 215 Ca 0.16 -0.62 0.01 0.00 -0.60 0.00 0.00 54.58 53.53 2bed n ASN 215 Cb 0.08 -3.63 0.01 0.00 -0.53 0.00 0.00 39.78 35.71 2bed n ASN 215 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 2bed n ILE 216 N -2.70 0.54 -1.95 -1.44 -5.35 0.00 -4.14 119.36 104.33 2bed n ILE 216 Ca -0.13 -0.57 -0.38 0.00 -0.27 0.00 0.00 62.75 61.40 2bed n ILE 216 Cb 0.59 0.66 -0.03 0.00 -1.74 0.00 0.00 39.64 39.12 2bed n ILE 216 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2bed s ILE 217 N -0.62 3.30 1.01 7.28 1.01 -1.24 -4.76 121.20 127.18 2bed s ILE 217 Ca 0.03 0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.70 2bed s ILE 217 Cb 0.02 -3.74 0.25 0.00 0.01 0.00 0.00 42.46 39.00 2bed s ILE 217 CO 0.00 -0.70 1.02 0.35 0.00 0.00 0.00 174.94 175.61 2bed n THR 218 N 7.38 0.00 0.15 2.92 -2.24 -1.26 -4.96 114.28 116.27 2bed n THR 218 Ca 0.24 -0.55 0.03 0.00 -2.27 0.00 0.00 64.05 61.50 2bed n THR 218 Cb 0.52 -1.32 0.14 0.00 -2.10 0.00 0.00 70.33 67.58 2bed n THR 218 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2bed h PRO 219 N 0.00 0.00 -0.18 -0.78 0.11 -2.01 -3.34 132.00 125.80 2bed h PRO 219 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2bed h PRO 219 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2bed h PRO 219 CO 0.24 0.48 0.00 -0.40 -0.21 0.00 0.00 178.00 178.12 2bed n ASP 220 N -3.35 2.37 0.22 -2.05 3.85 -1.26 -4.67 116.55 111.66 2bed n ASP 220 Ca 0.01 -1.78 -0.15 0.00 -0.71 0.00 0.00 54.79 52.16 2bed n ASP 220 Cb 0.66 -0.12 -0.08 0.00 -1.35 0.00 0.00 41.12 40.24 2bed n ASP 220 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 2bed h LEU 221 N 1.60 -0.58 -3.92 -2.12 5.85 -1.95 -3.00 115.31 111.19 2bed h LEU 221 Ca 0.00 0.04 -0.56 0.00 0.84 0.00 0.00 57.88 58.19 2bed h LEU 221 Cb 0.57 0.17 -0.29 0.00 0.37 0.00 0.00 40.66 41.48 2bed h LEU 221 CO 0.00 -0.36 0.59 0.49 -0.34 0.00 0.00 178.44 178.82 2bed n PHE 222 N -5.36 2.95 -2.40 1.25 3.01 -1.26 -4.96 117.46 110.68 2bed n PHE 222 Ca -0.10 -2.39 -0.43 0.00 1.01 0.00 0.00 57.45 55.54 2bed n PHE 222 Cb 0.27 -1.10 -0.02 0.00 -0.01 0.00 0.00 39.48 38.61 2bed n PHE 222 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2bed s GLU 223 N -3.56 4.18 0.00 -1.08 2.56 -1.14 -2.55 118.70 117.12 2bed s GLU 223 Ca 0.59 1.64 0.00 0.00 0.00 0.00 0.00 54.97 57.20 2bed s GLU 223 Cb 0.48 -3.80 0.00 0.00 2.00 0.00 0.00 34.13 32.82 2bed s GLU 223 CO 0.04 -0.78 0.00 0.41 -0.56 0.00 0.00 175.26 174.37 2bed n GLY 224 N 3.75 1.01 0.19 -1.50 0.00 -1.26 -4.58 105.19 102.80 2bed n GLY 224 Ca 0.14 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 2bed n GLY 224 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2bed h THR 225 N 0.00 1.33 -0.96 2.61 1.35 -1.64 -2.26 112.91 113.34 2bed h THR 225 Ca 0.00 -1.91 0.08 0.00 -0.55 0.00 0.00 66.41 64.03 2bed h THR 225 Cb 0.00 2.12 -0.07 0.00 -1.73 0.00 0.00 68.15 68.47 2bed h THR 225 CO 0.00 0.59 0.60 0.00 -0.25 0.00 0.00 175.52 176.46 2bed h ALA 226 N 0.50 1.37 -0.39 6.62 0.00 -1.91 0.22 119.26 125.66 2bed h ALA 226 Ca -0.05 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2bed h ALA 226 Cb 1.28 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2bed h ALA 226 CO 0.13 0.31 -0.17 0.93 0.00 0.00 0.00 179.25 180.45 2bed h GLU 227 N 1.05 0.81 0.05 0.00 3.07 -1.93 -1.42 114.58 116.21 2bed h GLU 227 Ca 0.44 -0.35 -0.00 0.00 -0.50 0.00 0.00 59.36 58.95 2bed h GLU 227 Cb 0.28 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 2bed h GLU 227 CO -0.21 0.98 -0.02 2.35 -1.40 0.00 0.00 179.01 180.70 2bed h TRP 228 N 0.62 -0.06 -0.60 4.33 7.01 -0.68 -2.34 115.95 124.22 2bed h TRP 228 Ca 0.09 -0.00 0.12 0.00 2.11 0.00 0.00 58.89 61.21 2bed h TRP 228 Cb 0.72 0.02 -0.10 0.00 -2.10 0.00 0.00 29.16 27.71 2bed h TRP 228 CO 0.06 0.10 0.01 0.82 -2.79 0.00 0.00 178.44 176.64 2bed h ILE 229 N -0.22 0.52 -0.63 2.65 2.04 -0.57 0.94 117.51 122.23 2bed h ILE 229 Ca -0.01 -0.04 0.12 0.00 1.00 0.00 0.00 64.86 65.93 2bed h ILE 229 Cb 0.19 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 2bed h ILE 229 CO 0.01 0.02 0.43 0.00 0.00 0.00 0.00 178.15 178.61 2bed h ALA 230 N 1.54 2.10 0.00 1.87 0.00 -0.87 0.72 119.26 124.63 2bed h ALA 230 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2bed h ALA 230 Cb 0.50 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2bed h ALA 230 CO -0.51 -0.25 0.00 0.54 0.00 0.00 0.00 179.25 179.03 2bed n ARG 231 N -4.46 0.74 0.11 0.00 1.74 0.32 -2.31 116.66 112.81 2bed n ARG 231 Ca 0.11 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.31 2bed n ARG 231 Cb 0.44 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.45 2bed n ARG 231 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bed s GLN 233 N -3.30 4.40 0.00 0.00 0.74 -0.98 -0.89 119.66 119.64 2bed s GLN 233 Ca 0.02 1.72 0.00 0.00 0.05 0.00 0.00 55.36 57.15 2bed s GLN 233 Cb 0.10 -3.45 0.00 0.00 1.10 0.00 0.00 33.01 30.76 2bed s GLN 233 CO 0.76 -0.34 0.00 0.27 -0.55 0.00 0.00 175.29 175.43 2bed n ASN 234 N 4.51 1.31 0.17 6.67 6.94 -0.81 -4.97 115.26 129.08 2bed n ASN 234 Ca 0.10 -0.18 0.12 0.00 -0.02 0.00 0.00 54.58 54.60 2bed n ASN 234 Cb 0.46 0.00 0.60 0.00 -2.36 0.00 0.00 39.78 38.48 2bed n ASN 234 CO 0.00 0.00 0.00 4.11 -1.03 0.00 0.00 177.26 180.34 2bed h TRP 235 N 0.12 0.00 0.00 -2.53 5.08 -1.95 -2.29 115.95 114.38 2bed h TRP 235 Ca 0.00 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 59.91 2bed h TRP 235 Cb 0.00 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.15 2bed h TRP 235 CO 0.00 0.00 -0.51 0.93 -1.28 0.00 0.00 178.44 177.58 2bed h GLU 236 N 0.00 0.00 0.00 0.12 5.08 -1.98 -3.47 114.58 114.33 2bed h GLU 236 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2bed h GLU 236 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2bed h GLU 236 CO 0.00 0.22 0.00 0.41 -1.00 0.00 0.00 179.01 178.64 2bed n GLY 237 N 1.19 2.56 1.82 -3.84 0.00 -0.86 -4.62 105.19 101.44 2bed n GLY 237 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 2bed n GLY 237 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bed n GLY 238 N -0.41 -0.22 3.52 -0.02 0.00 -1.26 -3.30 105.19 103.50 2bed n GLY 238 Ca 0.00 -1.85 -0.31 0.00 0.00 0.00 0.00 46.02 43.86 2bed n GLY 238 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bed s ILE 239 N -1.80 3.17 0.48 -0.61 1.01 -1.26 -1.93 121.20 120.26 2bed s ILE 239 Ca 0.33 -1.01 0.07 0.00 0.00 0.00 0.00 60.65 60.04 2bed s ILE 239 Cb -0.01 -2.36 0.02 0.00 0.01 0.00 0.00 42.46 40.11 2bed s ILE 239 CO 0.23 0.35 0.44 -0.83 0.00 0.00 0.00 174.94 175.13 2bed s GLY 240 N -1.45 2.17 0.15 6.18 0.00 -0.07 -0.97 107.32 113.33 2bed s GLY 240 Ca 0.16 -1.70 -0.15 0.00 0.00 0.00 0.00 44.72 43.03 2bed s GLY 240 CO 0.07 -1.79 1.76 -1.33 0.00 0.00 0.00 173.10 171.80 2bed h GLY 241 N 0.82 0.67 -3.33 0.20 0.00 -1.84 -3.44 103.07 96.14 2bed h GLY 241 Ca -0.38 -0.30 -0.12 0.00 0.00 0.00 0.00 47.33 46.52 2bed h GLY 241 CO 0.55 0.29 -0.67 -1.34 0.00 0.00 0.00 176.54 175.38 2bed s VAL 242 N -5.86 0.21 -0.02 4.60 -7.23 -1.26 -1.81 120.40 109.03 2bed s VAL 242 Ca -0.13 -1.73 -0.39 0.00 -1.81 0.00 0.00 61.98 57.92 2bed s VAL 242 Cb 0.11 -1.44 -0.18 0.00 0.56 0.00 0.00 36.38 35.43 2bed s VAL 242 CO 0.75 -0.95 1.30 -2.65 -0.31 0.00 0.00 175.10 173.23 2bed n PRO 243 N 0.19 0.65 0.00 4.82 -0.02 -1.26 -1.42 135.00 137.97 2bed n PRO 243 Ca -0.15 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 2bed n PRO 243 Cb 0.61 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 2bed n PRO 243 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bed n GLY 244 N 2.42 3.19 3.87 -1.23 0.00 -1.26 -5.03 105.19 107.15 2bed n GLY 244 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 2bed n GLY 244 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bed s MET 245 N -0.66 3.78 0.36 1.61 -1.94 -0.50 -5.04 119.30 116.91 2bed s MET 245 Ca 0.00 0.53 -0.26 0.00 -1.71 0.00 0.00 55.69 54.24 2bed s MET 245 Cb 0.00 -2.34 -0.12 0.00 2.01 0.00 0.00 34.83 34.37 2bed s MET 245 CO 0.00 -0.10 1.05 -1.91 -0.01 0.00 0.00 175.02 174.05 2bed n GLU 246 N -1.45 1.48 -2.16 2.03 2.13 -1.26 -4.15 120.64 117.27 2bed n GLU 246 Ca 0.03 0.53 -0.42 0.00 0.66 0.00 0.00 57.16 57.96 2bed n GLU 246 Cb 0.54 -2.01 -0.03 0.00 0.27 0.00 0.00 31.44 30.21 2bed n GLU 246 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2bed s ALA 247 N -1.17 3.57 -0.00 4.31 0.00 -1.26 -4.09 121.76 123.12 2bed s ALA 247 Ca 0.60 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.72 2bed s ALA 247 Cb -0.61 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.00 2bed s ALA 247 CO 0.59 -0.61 0.00 -1.58 0.00 0.00 0.00 175.76 174.17 2bed s HIS 248 N 0.45 0.04 0.20 0.00 2.46 -0.15 -4.66 115.29 113.64 2bed s HIS 248 Ca 0.60 0.01 -0.13 0.00 0.47 0.00 0.00 55.06 56.01 2bed s HIS 248 Cb -0.38 -0.07 0.22 0.00 -0.13 0.00 0.00 32.58 32.23 2bed s HIS 248 CO 0.36 -0.02 1.65 0.78 -2.47 0.00 0.00 174.74 175.04 2bed h GLY 249 N 6.33 0.49 0.55 1.59 0.00 -0.14 0.20 103.07 112.09 2bed h GLY 249 Ca -0.28 0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.25 2bed h GLY 249 CO 0.50 -0.20 0.02 -1.33 0.00 0.00 0.00 176.54 175.53 2bed h GLY 250 N 0.04 0.32 2.00 4.60 0.00 -1.87 -1.15 103.07 107.01 2bed h GLY 250 Ca 0.28 0.02 -0.13 0.00 0.00 0.00 0.00 47.33 47.50 2bed h GLY 250 CO -0.55 -0.05 -0.63 -0.97 0.00 0.00 0.00 176.54 174.33 2bed h TYR 251 N 0.11 0.00 -0.57 5.60 0.99 -1.72 -2.83 116.97 118.55 2bed h TYR 251 Ca 0.15 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.81 2bed h TYR 251 Cb 0.19 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 37.90 2bed h TYR 251 CO -0.21 0.63 0.08 1.15 -0.00 0.00 0.00 178.16 179.81 2bed h THR 252 N 0.00 1.25 0.73 -2.88 2.02 -0.00 0.10 112.91 114.13 2bed h THR 252 Ca -0.01 -0.97 -0.04 0.00 0.77 0.00 0.00 66.41 66.17 2bed h THR 252 Cb 1.20 0.72 0.01 0.00 -1.74 0.00 0.00 68.15 68.33 2bed h THR 252 CO 0.08 0.36 -0.35 0.15 0.37 0.00 0.00 175.52 176.13 2bed h PHE 253 N 0.88 -0.91 -1.05 3.16 3.57 -1.16 -1.48 116.94 119.95 2bed h PHE 253 Ca 0.18 -0.02 0.28 0.00 3.53 0.00 0.00 57.97 61.94 2bed h PHE 253 Cb 0.40 0.30 -0.11 0.00 2.79 0.00 0.00 35.95 39.33 2bed h PHE 253 CO 0.03 -0.55 0.65 0.00 -2.23 0.00 0.00 178.31 176.21 2bed h GLY 255 N 0.42 -0.44 0.67 0.00 0.00 -0.57 -2.02 103.07 101.13 2bed h GLY 255 Ca 0.64 0.16 0.03 0.00 0.00 0.00 0.00 47.33 48.17 2bed h GLY 255 CO -0.39 -0.16 -0.07 -2.00 0.00 0.00 0.00 176.54 173.92 2bed h LEU 256 N -0.55 -0.23 -0.64 3.11 5.85 -0.90 -1.81 115.31 120.15 2bed h LEU 256 Ca -0.04 0.05 0.11 0.00 0.84 0.00 0.00 57.88 58.84 2bed h LEU 256 Cb 0.32 0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.39 2bed h LEU 256 CO 0.07 -0.10 0.21 0.00 -0.34 0.00 0.00 178.44 178.28 2bed h ALA 257 N 1.04 0.82 -0.34 1.25 0.00 -0.86 1.00 119.26 122.17 2bed h ALA 257 Ca 0.07 0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.12 2bed h ALA 257 Cb 0.17 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2bed h ALA 257 CO -0.16 -0.24 0.13 0.00 0.00 0.00 0.00 179.25 178.98 2bed h ALA 258 N 1.47 0.40 -0.09 0.00 0.00 -0.82 -1.92 119.26 118.31 2bed h ALA 258 Ca 0.34 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.28 2bed h ALA 258 Cb 0.47 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2bed h ALA 258 CO -0.37 -0.26 0.05 -0.07 0.00 0.00 0.00 179.25 178.60 2bed h LEU 259 N 0.29 0.12 -1.18 0.00 3.38 -0.37 -0.76 115.31 116.78 2bed h LEU 259 Ca 0.15 -0.11 0.25 0.00 0.09 0.00 0.00 57.88 58.26 2bed h LEU 259 Cb 0.11 -0.03 -0.11 0.00 0.09 0.00 0.00 40.66 40.72 2bed h LEU 259 CO -0.14 0.20 0.63 0.58 0.09 0.00 0.00 178.44 179.80 2bed h VAL 260 N 0.03 0.55 -0.35 1.22 2.07 -0.53 1.25 116.25 120.49 2bed h VAL 260 Ca 0.03 -0.17 -0.13 0.00 0.82 0.00 0.00 66.70 67.25 2bed h VAL 260 Cb 0.11 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 29.87 2bed h VAL 260 CO -0.00 0.09 -0.30 0.40 0.02 0.00 0.00 177.57 177.78 2bed h ILE 261 N 0.51 1.29 -0.00 4.57 2.04 -0.82 -2.73 117.51 122.37 2bed h ILE 261 Ca 0.61 -1.46 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2bed h ILE 261 Cb 1.33 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 38.86 2bed h ILE 261 CO -0.38 0.48 -0.00 0.18 0.00 0.00 0.00 178.15 178.43 2bed n LEU 262 N -4.19 0.05 -3.25 1.44 4.77 0.30 -4.90 117.00 111.22 2bed n LEU 262 Ca -0.03 -0.01 -0.16 0.00 -0.03 0.00 0.00 56.01 55.78 2bed n LEU 262 Cb 0.49 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.65 2bed n LEU 262 CO 0.46 0.01 0.12 0.29 -1.33 0.00 0.00 177.39 176.93 2bed n LYS 263 N -0.97 -6.24 -1.66 3.23 5.02 0.35 -4.95 118.16 112.94 2bed n LYS 263 Ca 0.24 0.78 0.03 0.00 -2.02 0.00 0.00 58.31 57.33 2bed n LYS 263 Cb 0.12 -5.60 0.02 0.00 -0.02 0.00 0.00 35.03 29.55 2bed n LYS 263 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2bed n LYS 264 N -3.96 0.26 -0.34 1.97 4.76 -0.78 -4.90 118.16 115.16 2bed n LYS 264 Ca -0.24 -2.13 0.19 0.00 -2.87 0.00 0.00 58.31 53.27 2bed n LYS 264 Cb 0.64 -0.18 0.41 0.00 -1.84 0.00 0.00 35.03 34.06 2bed n LYS 264 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2bed h GLU 265 N 1.15 0.52 0.00 1.97 3.07 -1.92 0.24 114.58 119.62 2bed h GLU 265 Ca -0.25 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 2bed h GLU 265 Cb 1.77 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 29.56 2bed h GLU 265 CO 0.08 0.35 0.00 0.54 -1.40 0.00 0.00 179.01 178.57 2bed n ARG 266 N -4.87 0.12 0.00 2.33 3.00 -1.26 -1.47 116.66 114.50 2bed n ARG 266 Ca 0.27 0.13 0.12 0.00 -0.01 0.00 0.00 57.85 58.36 2bed n ARG 266 Cb 0.79 -1.50 0.54 0.00 0.00 0.00 0.00 32.46 32.29 2bed n ARG 266 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2bed n SER 267 N -1.15 0.00 -4.76 0.55 7.64 0.85 -4.77 113.62 111.98 2bed n SER 267 Ca 0.03 0.45 -0.22 0.00 1.01 0.00 0.00 58.87 60.14 2bed n SER 267 Cb 0.03 -0.48 -0.05 0.00 -1.01 0.00 0.00 64.21 62.70 2bed n SER 267 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2bed s LEU 268 N -2.96 3.57 -1.23 -3.43 1.43 -0.54 -4.84 118.68 110.68 2bed s LEU 268 Ca 0.13 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 52.69 2bed s LEU 268 Cb 0.16 -2.10 0.16 0.00 0.03 0.00 0.00 46.19 44.44 2bed s LEU 268 CO 0.45 -0.03 1.52 -3.20 0.23 0.00 0.00 176.35 175.32 2bed n ASN 269 N -1.08 5.17 -0.36 2.29 2.85 -1.26 -4.85 115.26 118.01 2bed n ASN 269 Ca -0.07 -2.98 0.31 0.00 -0.11 0.00 0.00 54.58 51.72 2bed n ASN 269 Cb 0.58 -1.58 0.63 0.00 1.24 0.00 0.00 39.78 40.65 2bed n ASN 269 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 2bed h LEU 270 N 9.83 0.24 -0.31 1.20 3.38 -1.93 -1.83 115.31 125.88 2bed h LEU 270 Ca 0.34 0.06 -0.09 0.00 0.09 0.00 0.00 57.88 58.29 2bed h LEU 270 Cb 0.84 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 2bed h LEU 270 CO 1.31 0.00 -0.14 0.11 0.09 0.00 0.00 178.44 179.81 2bed h LYS 271 N 0.19 0.64 -0.35 1.13 1.79 -1.98 -0.63 116.57 117.35 2bed h LYS 271 Ca 0.64 -0.28 -0.10 0.00 -2.18 0.00 0.00 60.65 58.74 2bed h LYS 271 Cb 2.06 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 32.68 2bed h LYS 271 CO -0.21 0.86 -0.19 0.66 -1.08 0.00 0.00 179.45 179.50 2bed h SER 272 N 0.40 0.66 -0.13 0.86 4.64 -1.68 -1.78 113.55 116.52 2bed h SER 272 Ca 0.07 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.17 2bed h SER 272 Cb 0.67 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 2bed h SER 272 CO 0.04 0.85 0.08 0.25 -0.87 0.00 0.00 176.83 177.19 2bed h LEU 273 N 0.59 0.16 -0.41 5.97 5.85 -1.31 0.18 115.31 126.33 2bed h LEU 273 Ca 0.09 -0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.80 2bed h LEU 273 Cb 0.65 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 2bed h LEU 273 CO 0.05 0.15 0.21 0.25 -0.34 0.00 0.00 178.44 178.76 2bed h LEU 274 N 0.15 0.32 -2.01 2.25 5.85 -0.92 0.10 115.31 121.05 2bed h LEU 274 Ca 0.05 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2bed h LEU 274 Cb 0.03 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 2bed h LEU 274 CO -0.01 0.23 -0.10 -0.61 -0.34 0.00 0.00 178.44 177.61 2bed h GLN 275 N 0.43 0.00 0.03 1.25 4.15 -1.02 -1.89 115.11 118.05 2bed h GLN 275 Ca 0.17 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.59 2bed h GLN 275 Cb 0.07 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.76 2bed h GLN 275 CO -0.11 0.10 -0.01 2.35 -1.93 0.00 0.00 178.83 179.22 2bed h TRP 276 N 0.00 -0.03 -0.58 3.99 7.01 0.71 -3.17 115.95 123.87 2bed h TRP 276 Ca -0.00 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.05 2bed h TRP 276 Cb 0.28 0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 27.30 2bed h TRP 276 CO 0.00 0.33 0.31 -0.24 -2.79 0.00 0.00 178.44 176.05 2bed h VAL 277 N -0.99 0.97 -0.61 2.65 3.04 -0.81 -1.65 116.25 118.85 2bed h VAL 277 Ca -0.00 -0.20 0.04 0.00 -1.01 0.00 0.00 66.70 65.52 2bed h VAL 277 Cb 0.38 0.32 -0.03 0.00 -2.01 0.00 0.00 31.29 29.94 2bed h VAL 277 CO 0.01 0.11 0.40 0.71 -1.01 0.00 0.00 177.57 177.79 2bed h THR 278 N 0.60 1.06 0.00 3.17 1.35 -1.50 0.76 112.91 118.34 2bed h THR 278 Ca 0.26 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.88 2bed h THR 278 Cb 0.15 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 66.88 2bed h THR 278 CO -0.16 0.13 0.00 0.28 -0.25 0.00 0.00 175.52 175.51 2bed h SER 279 N 0.69 0.00 0.82 5.36 0.02 -1.28 -3.05 113.55 116.11 2bed h SER 279 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2bed h SER 279 Cb 0.13 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2bed h SER 279 CO -0.07 0.00 0.00 0.03 -1.14 0.00 0.00 176.83 175.65 2bed h ARG 280 N 0.00 0.00 -6.40 3.45 2.47 -0.53 -3.43 114.38 109.94 2bed h ARG 280 Ca 0.00 0.00 -0.53 0.00 -1.26 0.00 0.00 59.98 58.19 2bed h ARG 280 Cb 0.51 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.80 2bed h ARG 280 CO 0.00 0.00 0.25 -1.14 0.56 0.00 0.00 179.97 179.64 2bed s GLN 281 N -3.51 4.57 -0.28 0.04 0.74 -1.16 -1.22 119.66 118.85 2bed s GLN 281 Ca 0.02 1.23 -0.29 0.00 0.05 0.00 0.00 55.36 56.37 2bed s GLN 281 Cb 0.09 -3.38 0.01 0.00 1.10 0.00 0.00 33.01 30.84 2bed s GLN 281 CO 0.46 0.23 1.04 -1.64 -0.55 0.00 0.00 175.29 174.83 2bed s MET 282 N 0.06 4.14 0.65 1.67 -1.94 0.17 -4.91 119.30 119.14 2bed s MET 282 Ca 0.42 1.16 0.41 0.00 -1.71 0.00 0.00 55.69 55.98 2bed s MET 282 Cb -0.21 -3.70 2.23 0.00 2.01 0.00 0.00 34.83 35.16 2bed s MET 282 CO 0.26 -0.78 2.26 0.07 -0.01 0.00 0.00 175.02 176.82 2bed h ARG 283 N 7.83 0.00 0.00 2.03 0.11 -1.90 0.90 114.38 123.35 2bed h ARG 283 Ca -0.20 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.87 2bed h ARG 283 Cb 1.06 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.14 2bed h ARG 283 CO 1.00 0.00 -0.67 0.34 0.10 0.00 0.00 179.97 180.74 2bed n PHE 284 N -3.00 0.00 -0.20 4.08 7.35 -1.25 -4.72 117.46 119.73 2bed n PHE 284 Ca -0.03 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.61 2bed n PHE 284 Cb 0.12 -0.32 0.05 0.00 0.35 0.00 0.00 39.48 39.69 2bed n PHE 284 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2bed h GLU 285 N -0.61 0.69 0.00 -4.13 3.07 -1.88 -3.47 114.58 108.25 2bed h GLU 285 Ca -0.02 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 2bed h GLU 285 Cb 0.65 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 2bed h GLU 285 CO -0.01 0.45 0.00 0.41 -1.40 0.00 0.00 179.01 178.46 2bed n GLY 286 N -1.26 1.84 2.33 -3.84 0.00 0.31 -4.52 105.19 100.04 2bed n GLY 286 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.92 2bed n GLY 286 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bed n GLY 287 N -0.07 0.26 3.91 -0.02 0.00 -1.26 -3.67 105.19 104.34 2bed n GLY 287 Ca 0.00 -1.94 -0.21 0.00 0.00 0.00 0.00 46.02 43.87 2bed n GLY 287 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bed s PHE 288 N -1.97 3.20 0.08 1.61 0.40 -1.26 0.46 117.98 120.50 2bed s PHE 288 Ca 0.41 -0.13 0.06 0.00 -0.60 0.00 0.00 56.93 56.68 2bed s PHE 288 Cb -0.02 -1.61 -0.04 0.00 0.51 0.00 0.00 43.02 41.86 2bed s PHE 288 CO 0.27 0.36 -0.09 1.14 0.70 0.00 0.00 175.22 177.60 2bed s GLN 289 N -3.97 2.23 0.31 0.44 -2.07 -0.36 -1.45 119.66 114.81 2bed s GLN 289 Ca 0.36 -0.95 0.26 0.00 -1.82 0.00 0.00 55.36 53.21 2bed s GLN 289 Cb -0.08 -2.35 0.94 0.00 -1.09 0.00 0.00 33.01 30.43 2bed s GLN 289 CO 0.28 0.53 1.77 0.78 -1.32 0.00 0.00 175.29 177.32 2bed h GLY 290 N 3.81 0.00 -4.37 2.60 0.00 -1.89 -3.45 103.07 99.78 2bed h GLY 290 Ca -0.49 0.00 0.08 0.00 0.00 0.00 0.00 47.33 46.93 2bed h GLY 290 CO 0.53 0.00 0.54 1.09 0.00 0.00 0.00 176.54 178.70 2bed s ARG 291 N -3.31 0.61 0.08 4.80 1.70 -1.26 0.60 118.95 122.17 2bed s ARG 291 Ca 0.06 0.12 -0.36 0.00 -0.47 0.00 0.00 55.73 55.08 2bed s ARG 291 Cb 0.10 0.29 -0.18 0.00 -0.57 0.00 0.00 34.95 34.59 2bed s ARG 291 CO 0.50 -0.19 1.13 0.00 -1.08 0.00 0.00 175.30 175.65 2bed n ASN 293 N 1.98 -3.98 -4.26 0.00 3.02 -1.26 -5.01 115.26 105.75 2bed n ASN 293 Ca 0.18 -0.65 -0.21 0.00 -0.03 0.00 0.00 54.58 53.87 2bed n ASN 293 Cb 0.17 -4.71 -0.10 0.00 -0.61 0.00 0.00 39.78 34.53 2bed n ASN 293 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2bed s LYS 294 N -6.03 1.67 0.64 3.52 2.47 -0.71 -5.00 119.74 116.29 2bed s LYS 294 Ca 0.33 -1.95 -0.07 0.00 -1.56 0.00 0.00 55.97 52.72 2bed s LYS 294 Cb -0.15 -0.55 0.03 0.00 -1.46 0.00 0.00 37.83 35.69 2bed s LYS 294 CO 0.76 -0.33 0.96 -0.51 0.16 0.00 0.00 175.35 176.39 2bed s LEU 295 N -3.47 3.05 0.90 5.43 1.43 -1.26 -4.89 118.68 119.87 2bed s LEU 295 Ca 0.33 0.66 -0.11 0.00 -1.03 0.00 0.00 54.13 53.98 2bed s LEU 295 Cb 0.06 -3.42 0.13 0.00 0.03 0.00 0.00 46.19 42.99 2bed s LEU 295 CO 0.15 -1.28 1.09 -0.69 0.23 0.00 0.00 176.35 175.85 2bed s VAL 296 N -3.12 2.66 -0.30 -1.59 1.01 -1.26 -4.17 120.40 113.63 2bed s VAL 296 Ca 0.57 0.21 -0.16 0.00 0.00 0.00 0.00 61.98 62.60 2bed s VAL 296 Cb -0.11 -2.62 0.17 0.00 0.00 0.00 0.00 36.38 33.83 2bed s VAL 296 CO 0.46 -0.28 1.08 -0.62 0.00 0.00 0.00 175.10 175.74 2bed s ASP 297 N -3.28 -0.38 0.30 3.32 -1.08 -0.53 -4.88 116.67 110.14 2bed s ASP 297 Ca 0.64 0.56 0.06 0.00 -0.52 0.00 0.00 52.55 53.28 2bed s ASP 297 Cb -0.19 1.33 0.77 0.00 -1.46 0.00 0.00 42.92 43.37 2bed s ASP 297 CO 0.57 -0.08 1.73 1.23 0.52 0.00 0.00 175.17 179.14 2bed h GLY 298 N 6.65 1.69 2.00 2.66 0.00 -1.17 -1.55 103.07 113.34 2bed h GLY 298 Ca -0.20 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 2bed h GLY 298 CO 0.13 -0.21 -0.13 0.00 0.00 0.00 0.00 176.54 176.33 2bed n TYR 300 N -4.26 0.00 0.29 0.00 0.53 -0.58 -1.83 117.16 111.32 2bed n TYR 300 Ca -0.03 0.00 0.19 0.00 -1.02 0.00 0.00 57.90 57.04 2bed n TYR 300 Cb 0.21 -0.19 0.85 0.00 -1.03 0.00 0.00 39.34 39.18 2bed n TYR 300 CO 0.00 0.00 0.00 0.77 -1.02 0.00 0.00 176.86 176.61 2bed h SER 301 N 0.00 0.00 0.00 7.72 0.02 -1.36 -1.33 113.55 118.60 2bed h SER 301 Ca 0.00 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.69 2bed h SER 301 Cb 0.09 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.59 2bed h SER 301 CO 0.00 0.01 -1.97 0.33 -1.14 0.00 0.00 176.83 174.07 2bed n PHE 302 N -3.13 0.00 -0.05 3.45 7.35 -0.76 -3.79 117.46 120.54 2bed n PHE 302 Ca -0.01 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.56 2bed n PHE 302 Cb 0.23 -0.66 -0.07 0.00 0.35 0.00 0.00 39.48 39.33 2bed n PHE 302 CO 0.00 0.00 0.00 -1.49 -0.76 0.00 0.00 176.76 174.51 2bed h TRP 303 N 0.00 0.30 0.04 -5.13 -0.00 -1.51 -1.17 115.95 108.48 2bed h TRP 303 Ca -0.38 -0.08 -0.00 0.00 -0.00 0.00 0.00 58.89 58.43 2bed h TRP 303 Cb 1.63 -0.07 0.00 0.00 -0.00 0.00 0.00 29.16 30.72 2bed h TRP 303 CO 0.02 0.61 -0.02 1.96 -0.00 0.00 0.00 178.44 181.01 2bed h GLN 304 N -0.09 -0.05 -0.65 0.49 1.08 -1.49 -3.35 115.11 111.05 2bed h GLN 304 Ca 0.03 0.00 0.19 0.00 -1.45 0.00 0.00 58.65 57.42 2bed h GLN 304 Cb 0.53 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.95 2bed h GLN 304 CO 0.02 -0.03 0.49 0.00 -0.95 0.00 0.00 178.83 178.36 2bed h ALA 305 N -1.55 2.57 0.00 3.87 0.00 -1.63 -0.62 119.26 121.91 2bed h ALA 305 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2bed h ALA 305 Cb 0.04 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2bed h ALA 305 CO 0.01 -0.82 -0.12 0.78 0.00 0.00 0.00 179.25 179.10 2bed h GLY 306 N 0.00 0.00 1.98 0.00 0.00 -1.35 -2.51 103.07 101.19 2bed h GLY 306 Ca 0.31 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.61 2bed h GLY 306 CO -0.00 0.00 -0.13 1.41 0.00 0.00 0.00 176.54 177.82 2bed h LEU 307 N 0.00 0.02 -0.13 3.11 3.38 -1.24 -3.09 115.31 117.36 2bed h LEU 307 Ca -0.00 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bed h LEU 307 Cb 0.28 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2bed h LEU 307 CO 0.02 0.15 0.07 -0.07 0.09 0.00 0.00 178.44 178.70 2bed h LEU 308 N 0.02 0.16 -1.48 1.67 3.38 -1.61 0.24 115.31 117.69 2bed h LEU 308 Ca 0.00 -0.07 0.06 0.00 0.09 0.00 0.00 57.88 57.96 2bed h LEU 308 Cb 0.24 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2bed h LEU 308 CO 0.02 0.19 0.42 -0.65 0.09 0.00 0.00 178.44 178.50 2bed h PRO 309 N 0.12 0.62 -0.22 1.13 0.11 -1.71 -0.32 132.00 131.74 2bed h PRO 309 Ca 0.05 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.02 2bed h PRO 309 Cb 0.06 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.03 2bed h PRO 309 CO -0.01 0.41 -0.26 -0.07 -0.21 0.00 0.00 178.00 177.87 2bed h LEU 310 N 0.64 0.61 -0.89 2.35 3.38 -1.33 -3.01 115.31 117.06 2bed h LEU 310 Ca 0.27 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2bed h LEU 310 Cb 0.25 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2bed h LEU 310 CO -0.08 0.98 0.00 -0.07 0.09 0.00 0.00 178.44 179.35 2bed h LEU 311 N 0.25 0.00 -0.11 1.67 3.38 -0.11 -2.40 115.31 118.00 2bed h LEU 311 Ca 0.03 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 2bed h LEU 311 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2bed h LEU 311 CO 0.06 0.00 -0.27 -0.74 0.09 0.00 0.00 178.44 177.58 2bed h HIS 312 N 0.00 0.49 0.70 1.13 2.76 -0.97 -1.66 115.15 117.60 2bed h HIS 312 Ca 0.00 -0.19 -0.03 0.00 -2.20 0.00 0.00 60.37 57.95 2bed h HIS 312 Cb 0.60 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.47 2bed h HIS 312 CO 0.00 0.89 -0.48 0.00 -1.30 0.00 0.00 177.93 177.04 2bed h ARG 313 N -0.04 -1.08 -0.39 5.26 3.08 -1.37 -0.17 114.38 119.67 2bed h ARG 313 Ca -0.00 0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.17 2bed h ARG 313 Cb 0.88 0.25 -0.08 0.00 0.08 0.00 0.00 29.97 31.09 2bed h ARG 313 CO 0.06 -0.72 -0.56 0.00 -1.07 0.00 0.00 179.97 177.68 2bed h ALA 314 N -1.15 -0.80 0.21 0.04 0.00 -1.47 0.29 119.26 116.39 2bed h ALA 314 Ca -0.09 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2bed h ALA 314 Cb 0.91 1.12 -0.03 0.00 0.00 0.00 0.00 17.79 19.79 2bed h ALA 314 CO 0.07 -1.06 -0.32 -0.07 0.00 0.00 0.00 179.25 177.87 2bed h LEU 315 N -0.41 -0.90 -1.47 0.00 3.38 -1.31 -2.48 115.31 112.13 2bed h LEU 315 Ca 0.07 0.09 0.17 0.00 0.09 0.00 0.00 57.88 58.30 2bed h LEU 315 Cb 0.60 0.32 -0.06 0.00 0.09 0.00 0.00 40.66 41.61 2bed h LEU 315 CO -0.58 -0.43 0.56 -0.74 0.09 0.00 0.00 178.44 177.34 2bed h HIS 316 N -0.60 0.60 0.00 1.13 2.76 -0.44 0.39 115.15 118.99 2bed h HIS 316 Ca 0.01 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 2bed h HIS 316 Cb 0.59 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.36 2bed h HIS 316 CO -0.24 0.20 0.00 0.00 -1.30 0.00 0.00 177.93 176.59 2bed n ALA 317 N -2.49 1.65 -1.03 5.26 0.00 0.98 -0.13 120.51 124.75 2bed n ALA 317 Ca 0.17 -0.05 0.06 0.00 0.00 0.00 0.00 53.44 53.62 2bed n ALA 317 Cb 0.58 -1.19 0.28 0.00 0.00 0.00 0.00 19.45 19.13 2bed n ALA 317 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2bed n GLN 318 N -1.35 3.24 -3.92 0.00 6.02 0.14 -4.95 117.38 116.57 2bed n GLN 318 Ca 0.05 -2.95 -0.31 0.00 -0.01 0.00 0.00 57.00 53.77 2bed n GLN 318 Cb 0.10 -1.95 0.01 0.00 1.02 0.00 0.00 30.24 29.42 2bed n GLN 318 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2bed n GLY 319 N -0.35 -0.49 3.66 1.08 0.00 0.82 -4.86 105.19 105.05 2bed n GLY 319 Ca 0.25 0.17 -0.42 0.00 0.00 0.00 0.00 46.02 46.02 2bed n GLY 319 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bed s ASP 320 N -3.22 6.65 0.24 1.61 3.68 -1.18 -4.88 116.67 119.58 2bed s ASP 320 Ca 0.66 2.23 0.26 0.00 2.13 0.00 0.00 52.55 57.82 2bed s ASP 320 Cb -0.34 -2.53 0.80 0.00 -1.45 0.00 0.00 42.92 39.39 2bed s ASP 320 CO 0.81 -0.94 1.76 1.55 0.13 0.00 0.00 175.17 178.48 2bed h PRO 321 N 9.61 0.00 0.00 4.34 0.13 -1.93 -3.32 132.00 140.83 2bed h PRO 321 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2bed h PRO 321 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2bed h PRO 321 CO 0.95 0.00 -0.47 0.00 -0.23 0.00 0.00 178.00 178.25 2bed n ALA 322 N -1.82 3.45 -1.58 -0.56 0.00 -1.26 -4.94 120.51 113.80 2bed n ALA 322 Ca 0.05 -0.33 -0.36 0.00 0.00 0.00 0.00 53.44 52.79 2bed n ALA 322 Cb 0.41 -1.14 0.08 0.00 0.00 0.00 0.00 19.45 18.80 2bed n ALA 322 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2bed n LEU 323 N -1.51 5.23 -4.81 0.00 4.77 -1.25 -4.98 117.00 114.44 2bed n LEU 323 Ca 0.06 0.77 -0.36 0.00 -0.03 0.00 0.00 56.01 56.44 2bed n LEU 323 Cb 0.34 -1.51 -0.06 0.00 -2.33 0.00 0.00 43.42 39.85 2bed n LEU 323 CO 0.35 -1.33 0.48 -0.55 -1.33 0.00 0.00 177.39 175.00 2bed s SER 324 N -1.51 7.11 -0.04 -1.43 0.15 -1.26 -4.99 113.70 111.73 2bed s SER 324 Ca 0.80 1.52 0.07 0.00 0.70 0.00 0.00 55.95 59.03 2bed s SER 324 Cb -0.37 -2.46 0.28 0.00 -1.71 0.00 0.00 66.02 61.77 2bed s SER 324 CO 0.44 -0.00 1.10 0.23 1.20 0.00 0.00 173.24 176.20 2bed n MET 325 N 0.64 2.07 0.00 5.44 0.00 -1.26 -4.54 117.12 119.47 2bed n MET 325 Ca -0.01 -1.11 0.00 0.00 0.00 0.00 0.00 57.70 56.58 2bed n MET 325 Cb 0.51 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.23 2bed n MET 325 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 2bed n SER 326 N 0.29 0.00 -4.34 7.83 3.41 -1.26 -4.79 113.62 114.75 2bed n SER 326 Ca 0.10 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.50 2bed n SER 326 Cb 0.42 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.27 2bed n SER 326 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2bed s HIS 327 N -0.82 1.80 0.69 7.33 3.76 -1.26 -4.62 115.29 122.16 2bed s HIS 327 Ca 0.00 -0.49 -0.11 0.00 -0.15 0.00 0.00 55.06 54.31 2bed s HIS 327 Cb 0.00 -0.87 0.01 0.00 1.11 0.00 0.00 32.58 32.82 2bed s HIS 327 CO 0.00 0.35 1.07 -1.58 -0.85 0.00 0.00 174.74 173.73 2bed s TRP 328 N -2.34 3.35 -1.13 1.40 0.23 -1.26 -4.69 118.94 114.49 2bed s TRP 328 Ca 0.18 1.03 -0.07 0.00 -2.03 0.00 0.00 56.10 55.21 2bed s TRP 328 Cb -0.04 -3.00 -0.03 0.00 0.03 0.00 0.00 33.47 30.42 2bed s TRP 328 CO 0.07 -1.09 2.87 -1.33 0.96 0.00 0.00 176.95 178.42 2bed n MET 329 N -2.94 3.57 -3.58 4.98 2.81 -1.26 -4.78 117.12 115.92 2bed n MET 329 Ca 0.07 -2.43 -0.10 0.00 -1.81 0.00 0.00 57.70 53.42 2bed n MET 329 Cb 0.57 -2.54 -0.02 0.00 -0.71 0.00 0.00 33.22 30.51 2bed n MET 329 CO 0.00 0.00 0.00 -0.59 1.51 0.00 0.00 175.97 176.89 2bed s PHE 330 N 0.46 -0.37 -1.27 2.03 -0.12 -1.26 -4.84 117.98 112.61 2bed s PHE 330 Ca 0.63 0.08 -0.19 0.00 -0.05 0.00 0.00 56.93 57.40 2bed s PHE 330 Cb 0.23 0.55 0.02 0.00 -0.63 0.00 0.00 43.02 43.19 2bed s PHE 330 CO -0.08 -0.94 1.84 1.58 -0.05 0.00 0.00 175.22 177.57 2bed n HIS 331 N -0.38 4.02 -0.43 3.49 -0.00 -1.26 -4.81 115.22 115.84 2bed n HIS 331 Ca -0.13 -2.51 0.38 0.00 -0.00 0.00 0.00 57.72 55.46 2bed n HIS 331 Cb 0.63 -2.59 0.65 0.00 -0.00 0.00 0.00 29.99 28.68 2bed n HIS 331 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.34 178.30 2bed h GLN 332 N 7.90 0.02 0.30 1.57 4.20 -1.88 -0.77 115.11 126.45 2bed h GLN 332 Ca 0.41 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.10 2bed h GLN 332 Cb 0.85 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.63 2bed h GLN 332 CO 1.47 0.01 -0.15 0.37 -0.67 0.00 0.00 178.83 179.87 2bed h GLN 333 N 0.02 -0.39 -0.97 1.46 4.15 -1.87 -2.58 115.11 114.92 2bed h GLN 333 Ca 0.87 0.03 0.17 0.00 0.77 0.00 0.00 58.65 60.48 2bed h GLN 333 Cb 2.65 0.09 -0.09 0.00 0.21 0.00 0.00 27.48 30.34 2bed h GLN 333 CO -0.54 -0.09 0.61 0.00 -1.93 0.00 0.00 178.83 176.88 2bed h ALA 334 N -0.13 1.75 -0.57 3.38 0.00 -1.47 0.60 119.26 122.82 2bed h ALA 334 Ca -0.04 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2bed h ALA 334 Cb 0.48 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2bed h ALA 334 CO 0.07 -0.06 -0.04 1.25 0.00 0.00 0.00 179.25 180.47 2bed h LEU 335 N 0.75 1.01 -0.79 0.00 5.85 -1.44 -0.97 115.31 119.72 2bed h LEU 335 Ca 0.52 -0.30 -0.13 0.00 0.84 0.00 0.00 57.88 58.81 2bed h LEU 335 Cb 0.81 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 2bed h LEU 335 CO -0.29 1.08 -0.55 1.56 -0.34 0.00 0.00 178.44 179.90 2bed h GLN 336 N 0.93 0.16 -0.19 1.25 4.20 -0.55 -1.79 115.11 119.12 2bed h GLN 336 Ca 0.16 -0.10 -0.16 0.00 0.06 0.00 0.00 58.65 58.61 2bed h GLN 336 Cb 0.59 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.38 2bed h GLN 336 CO 0.04 0.67 -0.51 0.93 -0.67 0.00 0.00 178.83 179.28 2bed h GLU 337 N 0.12 0.68 -0.02 1.46 5.08 -0.85 -0.67 114.58 120.38 2bed h GLU 337 Ca -0.00 -0.48 0.02 0.00 -1.00 0.00 0.00 59.36 57.90 2bed h GLU 337 Cb 1.01 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 2bed h GLU 337 CO 0.08 1.10 -0.10 -0.92 -1.00 0.00 0.00 179.01 178.17 2bed h TYR 338 N 0.38 -0.26 0.78 4.33 3.20 -1.08 0.43 116.97 124.76 2bed h TYR 338 Ca -0.01 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 2bed h TYR 338 Cb 1.13 0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.52 2bed h TYR 338 CO 0.09 -0.16 -0.44 0.82 -1.64 0.00 0.00 178.16 176.83 2bed h ILE 339 N -0.16 0.00 -0.07 1.81 2.04 -1.29 0.21 117.51 120.04 2bed h ILE 339 Ca 0.05 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.94 2bed h ILE 339 Cb 0.22 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.27 2bed h ILE 339 CO -0.12 0.00 -0.15 -0.07 0.00 0.00 0.00 178.15 177.81 2bed h LEU 340 N -1.14 -0.44 0.08 1.44 3.38 -1.08 0.31 115.31 117.87 2bed h LEU 340 Ca -0.11 0.08 -0.25 0.00 0.09 0.00 0.00 57.88 57.69 2bed h LEU 340 Cb 0.90 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 2bed h LEU 340 CO 0.13 -0.20 -1.16 0.24 0.09 0.00 0.00 178.44 177.54 2bed h MET 341 N -0.21 0.20 0.00 1.13 2.86 -0.97 -3.41 114.93 114.53 2bed h MET 341 Ca 0.07 -0.33 -0.17 0.00 -2.06 0.00 0.00 59.70 57.22 2bed h MET 341 Cb 0.31 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.06 2bed h MET 341 CO -0.20 1.15 -1.85 0.00 1.06 0.00 0.00 176.91 177.07 2bed s GLN 344 N -3.77 0.11 -0.06 0.00 0.74 -1.25 -2.39 119.66 113.04 2bed s GLN 344 Ca 0.54 0.63 -0.24 0.00 0.05 0.00 0.00 55.36 56.34 2bed s GLN 344 Cb 0.44 -0.14 -0.04 0.00 1.10 0.00 0.00 33.01 34.38 2bed s GLN 344 CO -0.15 -0.27 0.74 0.00 -0.55 0.00 0.00 175.29 175.05 2bed h PRO 346 N 6.78 -0.12 -0.00 0.00 0.11 -2.01 0.55 132.00 137.31 2bed h PRO 346 Ca -0.41 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2bed h PRO 346 Cb 1.20 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2bed h PRO 346 CO 0.75 -0.08 0.00 0.00 -0.21 0.00 0.00 178.00 178.47 2bed h ALA 347 N 1.13 1.52 0.00 -0.75 0.00 -1.96 -3.48 119.26 115.72 2bed h ALA 347 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2bed h ALA 347 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2bed h ALA 347 CO -0.74 -0.01 0.00 0.41 0.00 0.00 0.00 179.25 178.91 2bed n GLY 348 N -1.32 3.79 0.08 0.00 0.00 0.19 -4.77 105.19 103.17 2bed n GLY 348 Ca -0.03 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.27 2bed n GLY 348 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bed n GLY 349 N -1.59 -2.89 2.91 -0.02 0.00 -1.26 -4.44 105.19 97.90 2bed n GLY 349 Ca 0.00 -1.26 -0.16 0.00 0.00 0.00 0.00 46.02 44.60 2bed n GLY 349 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bed n LEU 350 N -1.48 0.00 -3.83 0.99 7.99 -1.26 -1.35 117.00 118.06 2bed n LEU 350 Ca 0.00 -1.71 -0.06 0.00 -0.01 0.00 0.00 56.01 54.23 2bed n LEU 350 Cb 0.02 -0.41 -0.01 0.00 -0.11 0.00 0.00 43.42 42.91 2bed n LEU 350 CO 0.00 -0.77 0.55 -1.48 -1.51 0.00 0.00 177.39 174.17 2bed s LEU 351 N 0.00 -0.19 0.00 2.23 0.05 -1.01 -3.63 118.68 116.13 2bed s LEU 351 Ca 0.48 -0.65 0.00 0.00 0.05 0.00 0.00 54.13 54.01 2bed s LEU 351 Cb -0.03 2.60 0.00 0.00 -2.05 0.00 0.00 46.19 46.70 2bed s LEU 351 CO 0.31 -1.29 0.54 -0.67 -0.55 0.00 0.00 176.35 174.70 2bed n ASP 352 N -0.64 0.00 -3.55 1.48 -0.08 -1.26 -4.21 116.55 108.28 2bed n ASP 352 Ca -0.05 0.54 -0.14 0.00 -1.51 0.00 0.00 54.79 53.63 2bed n ASP 352 Cb 0.60 -0.04 -0.06 0.00 2.34 0.00 0.00 41.12 43.95 2bed n ASP 352 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 2bed s LYS 353 N -1.18 1.71 0.35 -0.67 -2.85 -1.26 -0.87 119.74 114.96 2bed s LYS 353 Ca 0.00 -1.69 -0.29 0.00 -1.00 0.00 0.00 55.97 53.00 2bed s LYS 353 Cb 0.00 0.40 -0.11 0.00 -2.06 0.00 0.00 37.83 36.07 2bed s LYS 353 CO 0.00 -0.68 1.39 -1.25 0.10 0.00 0.00 175.35 174.91 2bed s PRO 354 N -3.46 4.25 0.00 1.78 0.04 -1.22 -2.30 135.00 134.09 2bed s PRO 354 Ca 0.32 2.37 0.00 0.00 0.04 0.00 0.00 61.00 63.73 2bed s PRO 354 Cb 0.01 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.52 2bed s PRO 354 CO 0.18 -0.35 0.00 0.41 0.04 0.00 0.00 177.00 177.28 2bed n GLY 355 N 0.74 2.74 3.89 0.56 0.00 -1.26 -5.05 105.19 106.81 2bed n GLY 355 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 2bed n GLY 355 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bed s LYS 356 N -0.18 3.04 0.61 1.61 -0.14 -0.97 -5.07 119.74 118.63 2bed s LYS 356 Ca 0.00 0.43 -0.06 0.00 -1.36 0.00 0.00 55.97 54.99 2bed s LYS 356 Cb 0.00 -2.09 0.02 0.00 -1.68 0.00 0.00 37.83 34.08 2bed s LYS 356 CO 0.00 -0.86 0.92 -1.12 -0.76 0.00 0.00 175.35 173.53 2bed s SER 357 N -4.31 5.41 0.34 2.83 0.01 -1.26 -4.88 113.70 111.84 2bed s SER 357 Ca 0.56 0.62 -0.07 0.00 1.31 0.00 0.00 55.95 58.37 2bed s SER 357 Cb -0.11 -1.54 -0.06 0.00 0.21 0.00 0.00 66.02 64.53 2bed s SER 357 CO 0.51 -1.18 0.64 0.00 0.41 0.00 0.00 173.24 173.62 2bed s ARG 358 N -5.03 3.68 -0.03 12.44 1.70 -1.26 -4.45 118.95 126.01 2bed s ARG 358 Ca 0.55 0.18 -0.29 0.00 -0.47 0.00 0.00 55.73 55.71 2bed s ARG 358 Cb -0.11 -2.54 0.10 0.00 -0.57 0.00 0.00 34.95 31.83 2bed s ARG 358 CO 0.45 0.11 0.82 0.16 -1.08 0.00 0.00 175.30 175.75 2bed s ASP 359 N -3.20 -0.47 0.57 -2.89 1.47 -1.24 -5.04 116.67 105.88 2bed s ASP 359 Ca 0.47 0.26 0.27 0.00 1.18 0.00 0.00 52.55 54.73 2bed s ASP 359 Cb -0.11 0.43 1.72 0.00 -0.34 0.00 0.00 42.92 44.62 2bed s ASP 359 CO 0.31 -0.61 2.23 -0.26 0.68 0.00 0.00 175.17 177.52 2bed h PHE 360 N 2.36 0.00 0.88 2.11 -1.00 -1.98 -1.65 116.94 117.65 2bed h PHE 360 Ca -0.24 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.49 2bed h PHE 360 Cb 1.21 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.78 2bed h PHE 360 CO 0.29 0.01 -0.42 -0.92 -1.61 0.00 0.00 178.31 175.65 2bed h TYR 361 N 0.00 -1.09 -0.10 -0.55 3.20 -1.95 0.72 116.97 117.20 2bed h TYR 361 Ca -0.00 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.78 2bed h TYR 361 Cb 0.02 0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 2bed h TYR 361 CO 0.00 -0.67 -0.23 0.45 -1.64 0.00 0.00 178.16 176.07 2bed h HIS 362 N -1.27 0.18 -0.40 -3.82 3.86 -1.79 -0.59 115.15 111.31 2bed h HIS 362 Ca -0.12 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.04 2bed h HIS 362 Cb 0.91 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 29.31 2bed h HIS 362 CO -0.00 0.39 0.16 1.15 0.86 0.00 0.00 177.93 180.48 2bed h THR 363 N 0.15 1.20 -0.71 2.45 2.02 -1.22 0.76 112.91 117.57 2bed h THR 363 Ca 0.03 -0.63 -0.06 0.00 0.77 0.00 0.00 66.41 66.52 2bed h THR 363 Cb 0.49 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 2bed h THR 363 CO 0.03 0.23 0.22 0.00 0.37 0.00 0.00 175.52 176.37 2bed n TYR 365 N -4.26 0.67 0.12 0.00 4.02 -0.29 -2.66 117.16 114.77 2bed n TYR 365 Ca 0.06 0.22 -0.01 0.00 -0.01 0.00 0.00 57.90 58.16 2bed n TYR 365 Cb 0.23 -0.99 0.23 0.00 -0.02 0.00 0.00 39.34 38.79 2bed n TYR 365 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2bed h LEU 367 N 0.11 -0.17 -0.72 0.00 3.38 -1.66 -0.27 115.31 115.99 2bed h LEU 367 Ca 0.00 -0.37 0.15 0.00 0.09 0.00 0.00 57.88 57.75 2bed h LEU 367 Cb 0.88 0.04 -0.10 0.00 0.09 0.00 0.00 40.66 41.57 2bed h LEU 367 CO 0.07 0.38 0.22 0.28 0.09 0.00 0.00 178.44 179.48 2bed h SER 368 N -0.83 0.11 0.43 -0.43 0.02 -1.49 0.11 113.55 111.46 2bed h SER 368 Ca -0.02 0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2bed h SER 368 Cb 0.53 0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.22 2bed h SER 368 CO 0.03 0.02 -0.24 1.23 -1.14 0.00 0.00 176.83 176.74 2bed h GLY 369 N 0.33 -0.65 -0.46 -3.77 0.00 -1.08 -2.07 103.07 95.36 2bed h GLY 369 Ca 0.40 0.26 0.15 0.00 0.00 0.00 0.00 47.33 48.14 2bed h GLY 369 CO -0.45 -0.24 -0.18 -2.00 0.00 0.00 0.00 176.54 173.67 2bed h LEU 370 N -0.62 -0.67 -0.11 3.11 5.85 0.80 -0.83 115.31 122.84 2bed h LEU 370 Ca -0.05 0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.93 2bed h LEU 370 Cb 0.50 0.45 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 2bed h LEU 370 CO 0.07 -0.24 -0.16 -1.28 -0.34 0.00 0.00 178.44 176.49 2bed h SER 371 N 0.00 -0.48 -0.77 1.25 0.87 -0.59 -2.02 113.55 111.82 2bed h SER 371 Ca 0.35 0.09 0.08 0.00 -1.23 0.00 0.00 61.79 61.08 2bed h SER 371 Cb 0.54 0.22 -0.07 0.00 -0.44 0.00 0.00 62.40 62.66 2bed h SER 371 CO -0.75 -0.20 0.44 0.40 -0.53 0.00 0.00 176.83 176.18 2bed h ILE 372 N -0.20 0.93 0.00 2.23 2.04 -0.47 -0.03 117.51 122.01 2bed h ILE 372 Ca 0.09 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.69 2bed h ILE 372 Cb 0.33 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 2bed h ILE 372 CO -0.23 0.14 0.00 0.00 0.00 0.00 0.00 178.15 178.06 2bed h ALA 373 N 1.42 1.00 -0.01 1.87 0.00 -0.81 -3.01 119.26 119.71 2bed h ALA 373 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2bed h ALA 373 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2bed h ALA 373 CO -0.22 0.00 -0.52 0.00 0.00 0.00 0.00 179.25 178.50 2bed n GLN 374 N -2.60 1.87 -4.25 0.00 10.64 -0.58 -4.63 117.38 117.84 2bed n GLN 374 Ca 0.02 -0.39 -0.31 0.00 -1.83 0.00 0.00 57.00 54.49 2bed n GLN 374 Cb 0.29 -1.24 -0.16 0.00 -0.86 0.00 0.00 30.24 28.26 2bed n GLN 374 CO 0.00 0.00 0.00 -1.01 -1.83 0.00 0.00 177.06 174.22 2bed s HIS 375 N -2.16 2.31 -0.03 2.61 3.76 -0.13 -0.66 115.29 121.00 2bed s HIS 375 Ca 0.09 -1.25 0.05 0.00 -0.15 0.00 0.00 55.06 53.81 2bed s HIS 375 Cb 0.12 -1.65 -0.03 0.00 1.11 0.00 0.00 32.58 32.14 2bed s HIS 375 CO 0.51 -0.64 -0.18 0.12 -0.85 0.00 0.00 174.74 173.71 2bed s PHE 376 N 1.22 2.59 0.23 1.40 5.36 -0.96 -4.77 117.98 123.05 2bed s PHE 376 Ca 0.00 -0.24 0.00 0.00 -0.96 0.00 0.00 56.93 55.74 2bed s PHE 376 Cb -0.14 -1.58 -0.04 0.00 -0.34 0.00 0.00 43.02 40.92 2bed s PHE 376 CO -0.08 0.14 0.12 0.20 -1.46 0.00 0.00 175.22 174.15 2bed s GLY 377 N -0.80 1.59 0.00 13.12 0.00 -1.26 -2.77 107.32 117.20 2bed s GLY 377 Ca 0.12 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 43.06 2bed s GLY 377 CO 0.01 -1.48 0.00 -1.26 0.00 0.00 0.00 173.10 170.36 2bed n SER 378 N -0.38 0.00 0.00 1.64 2.88 -1.08 -4.94 113.62 111.74 2bed n SER 378 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2bed n SER 378 Cb 0.66 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 2bed n SER 378 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2bed n GLY 379 N 0.00 2.24 0.28 0.46 0.00 -1.26 -2.76 105.19 104.16 2bed n GLY 379 Ca 0.00 -0.39 0.17 0.00 0.00 0.00 0.00 46.02 45.80 2bed n GLY 379 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bed h ALA 380 N -0.26 1.05 -2.44 4.61 0.00 -2.02 -3.44 119.26 116.76 2bed h ALA 380 Ca 0.00 -0.04 -0.54 0.00 0.00 0.00 0.00 54.91 54.33 2bed h ALA 380 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2bed h ALA 380 CO 0.00 0.05 0.69 -1.64 0.00 0.00 0.00 179.25 178.36 2bed s MET 381 N -3.86 4.36 -0.17 0.00 1.00 -1.11 -5.02 119.30 114.49 2bed s MET 381 Ca -0.01 1.87 -0.04 0.00 0.00 0.00 0.00 55.69 57.51 2bed s MET 381 Cb 0.11 -3.42 0.08 0.00 0.00 0.00 0.00 34.83 31.59 2bed s MET 381 CO 0.53 -0.41 0.18 -0.51 0.00 0.00 0.00 175.02 174.81 2bed s LEU 382 N 1.63 -0.02 -0.20 -0.03 2.01 -1.26 -2.65 118.68 118.17 2bed s LEU 382 Ca 0.61 -0.18 -0.04 0.00 0.01 0.00 0.00 54.13 54.52 2bed s LEU 382 Cb -0.31 0.24 0.08 0.00 0.01 0.00 0.00 46.19 46.21 2bed s LEU 382 CO 0.27 -0.31 0.14 -2.28 1.01 0.00 0.00 176.35 175.18 2bed s HIS 383 N 2.28 0.04 0.16 0.29 2.46 -1.11 -5.01 115.29 114.40 2bed s HIS 383 Ca 0.05 -0.21 -0.05 0.00 0.47 0.00 0.00 55.06 55.33 2bed s HIS 383 Cb -0.15 -0.61 -0.06 0.00 -0.13 0.00 0.00 32.58 31.64 2bed s HIS 383 CO -0.10 -0.59 0.40 -0.51 -2.47 0.00 0.00 174.74 171.46 2bed s ASP 384 N 2.20 6.49 -0.25 9.88 -0.00 -1.26 -2.27 116.67 131.45 2bed s ASP 384 Ca 0.05 0.60 -0.02 0.00 -0.00 0.00 0.00 52.55 53.17 2bed s ASP 384 Cb -0.16 -2.09 0.08 0.00 -0.00 0.00 0.00 42.92 40.75 2bed s ASP 384 CO -0.14 0.02 0.06 -0.69 -0.00 0.00 0.00 175.17 174.43 2bed s VAL 385 N -1.71 0.64 -0.25 -1.27 1.01 0.16 -4.98 120.40 114.00 2bed s VAL 385 Ca 0.41 -0.92 -0.06 0.00 0.00 0.00 0.00 61.98 61.41 2bed s VAL 385 Cb -0.12 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 2bed s VAL 385 CO 0.25 -0.44 0.04 -0.69 0.00 0.00 0.00 175.10 174.27 2bed s VAL 386 N 1.77 4.06 0.11 2.92 1.01 -1.26 -4.15 120.40 124.87 2bed s VAL 386 Ca 0.04 -0.29 -0.22 0.00 0.00 0.00 0.00 61.98 61.52 2bed s VAL 386 Cb -0.17 -2.91 -0.07 0.00 0.00 0.00 0.00 36.38 33.23 2bed s VAL 386 CO -0.17 0.34 0.65 -0.04 0.00 0.00 0.00 175.10 175.87 2bed s MET 387 N 1.58 4.34 2.34 2.72 -1.94 -1.26 -4.89 119.30 122.18 2bed s MET 387 Ca 0.06 0.90 0.00 0.00 -1.71 0.00 0.00 55.69 54.94 2bed s MET 387 Cb -0.15 -3.25 0.00 0.00 2.01 0.00 0.00 34.83 33.44 2bed s MET 387 CO 0.02 0.62 0.00 0.41 -0.01 0.00 0.00 175.02 176.05 2bed n GLY 388 N 1.67 -1.05 3.66 -0.03 0.00 -1.26 -4.80 105.19 103.38 2bed n GLY 388 Ca -0.09 -1.22 -0.46 0.00 0.00 0.00 0.00 46.02 44.25 2bed n GLY 388 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2bed n VAL 389 N 0.00 0.40 0.12 1.61 3.14 -1.03 -4.83 118.33 117.73 2bed n VAL 389 Ca 0.00 -0.10 0.06 0.00 -2.96 0.00 0.00 64.34 61.34 2bed n VAL 389 Cb 0.00 -1.45 0.33 0.00 -1.06 0.00 0.00 33.84 31.66 2bed n VAL 389 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 2bed n PRO 390 N 2.77 0.08 0.00 1.45 -0.04 -1.26 -0.73 135.00 137.27 2bed n PRO 390 Ca 0.15 0.54 0.08 0.00 -0.04 0.00 0.00 63.50 64.23 2bed n PRO 390 Cb 0.29 -1.91 0.49 0.00 -0.04 0.00 0.00 33.50 32.33 2bed n PRO 390 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2bed n GLU 391 N -1.93 0.72 -0.14 0.54 4.71 -1.26 -3.12 120.64 120.17 2bed n GLU 391 Ca -0.01 0.00 0.03 0.00 -0.01 0.00 0.00 57.16 57.17 2bed n GLU 391 Cb 0.16 -1.36 0.09 0.00 -1.01 0.00 0.00 31.44 29.33 2bed n GLU 391 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2bed n ASN 392 N -0.86 1.41 -4.69 1.62 5.03 0.09 -4.86 115.26 113.00 2bed n ASN 392 Ca 0.12 -2.08 -0.40 0.00 0.87 0.00 0.00 54.58 53.10 2bed n ASN 392 Cb 0.06 -0.27 -0.05 0.00 -1.02 0.00 0.00 39.78 38.50 2bed n ASN 392 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2bed s VAL 393 N -1.65 5.04 0.23 2.41 0.11 -1.18 -4.92 120.40 120.44 2bed s VAL 393 Ca 0.13 1.31 0.07 0.00 -2.93 0.00 0.00 61.98 60.55 2bed s VAL 393 Cb 0.08 -3.99 -0.04 0.00 -1.53 0.00 0.00 36.38 30.90 2bed s VAL 393 CO 0.07 0.18 0.19 -0.76 -3.33 0.00 0.00 175.10 171.46 2bed s LEU 394 N 1.33 3.84 0.76 2.54 1.43 -1.26 -4.99 118.68 122.34 2bed s LEU 394 Ca 0.33 -0.21 -0.14 0.00 -1.03 0.00 0.00 54.13 53.08 2bed s LEU 394 Cb -0.17 -2.39 0.06 0.00 0.03 0.00 0.00 46.19 43.72 2bed s LEU 394 CO 0.14 -0.02 1.22 -1.10 0.23 0.00 0.00 176.35 176.81 2bed s GLN 395 N -3.71 1.92 0.55 1.70 -1.52 -0.48 -4.96 119.66 113.15 2bed s GLN 395 Ca 0.33 1.79 -0.17 0.00 -1.95 0.00 0.00 55.36 55.36 2bed s GLN 395 Cb -0.08 -1.80 -0.06 0.00 -0.22 0.00 0.00 33.01 30.84 2bed s GLN 395 CO 0.25 -2.01 1.02 -1.25 -0.25 0.00 0.00 175.29 173.05 2bed s PRO 396 N -3.98 3.64 0.01 2.91 0.04 -1.26 -4.82 135.00 131.54 2bed s PRO 396 Ca 0.74 1.11 0.07 0.00 0.04 0.00 0.00 61.00 62.96 2bed s PRO 396 Cb -0.30 -2.08 -0.02 0.00 0.04 0.00 0.00 34.50 32.14 2bed s PRO 396 CO 0.48 -0.53 -0.21 -0.08 0.04 0.00 0.00 177.00 176.69 2bed s THR 397 N -2.49 1.65 -0.19 1.26 -1.32 -1.26 -4.31 115.64 108.98 2bed s THR 397 Ca 0.62 -1.03 -0.29 0.00 -1.21 0.00 0.00 61.69 59.78 2bed s THR 397 Cb -0.13 -1.40 -0.01 0.00 -1.51 0.00 0.00 72.50 69.45 2bed s THR 397 CO 0.33 0.34 1.28 -2.28 -2.21 0.00 0.00 174.62 172.08 2bed s HIS 398 N -0.63 2.80 -2.00 9.09 2.46 0.28 -4.83 115.29 122.45 2bed s HIS 398 Ca 0.08 0.97 0.01 0.00 0.47 0.00 0.00 55.06 56.58 2bed s HIS 398 Cb -0.08 -3.60 0.05 0.00 -0.13 0.00 0.00 32.58 28.82 2bed s HIS 398 CO 0.00 -1.73 0.27 -0.35 -2.47 0.00 0.00 174.74 170.47 2bed n PRO 399 N 6.78 0.17 -0.04 2.88 -0.04 -1.26 0.80 135.00 144.29 2bed n PRO 399 Ca 0.14 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.52 2bed n PRO 399 Cb 0.45 -1.08 -0.03 0.00 -0.04 0.00 0.00 33.50 32.80 2bed n PRO 399 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2bed n VAL 400 N -0.58 0.43 0.49 0.52 0.31 -1.26 -4.71 118.33 113.52 2bed n VAL 400 Ca 0.01 -0.11 0.11 0.00 -0.01 0.00 0.00 64.34 64.34 2bed n VAL 400 Cb 0.00 -1.57 -0.04 0.00 -0.91 0.00 0.00 33.84 31.32 2bed n VAL 400 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2bed n TYR 401 N -3.32 0.21 -3.65 3.52 4.02 -1.20 -4.99 117.16 111.76 2bed n TYR 401 Ca -0.15 0.06 -0.24 0.00 -0.01 0.00 0.00 57.90 57.55 2bed n TYR 401 Cb 0.61 -0.41 0.07 0.00 -0.02 0.00 0.00 39.34 39.59 2bed n TYR 401 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2bed n ASN 402 N -1.99 -5.33 -2.83 7.72 5.15 0.24 -5.00 115.26 113.22 2bed n ASN 402 Ca 0.01 -0.61 -0.14 0.00 -0.60 0.00 0.00 54.58 53.23 2bed n ASN 402 Cb 0.45 -4.77 -0.04 0.00 -0.53 0.00 0.00 39.78 34.89 2bed n ASN 402 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 2bed n ILE 403 N -4.81 0.00 -2.07 -1.44 -5.35 -1.24 -4.80 119.36 99.65 2bed n ILE 403 Ca -0.03 -1.36 -0.41 0.00 -0.27 0.00 0.00 62.75 60.67 2bed n ILE 403 Cb 0.57 0.49 -0.03 0.00 -1.74 0.00 0.00 39.64 38.94 2bed n ILE 403 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2bed s GLY 404 N -2.43 2.27 0.25 3.28 0.00 -1.26 1.00 107.32 110.42 2bed s GLY 404 Ca 0.12 1.26 -0.05 0.00 0.00 0.00 0.00 44.72 46.05 2bed s GLY 404 CO 0.09 2.26 1.66 -2.55 0.00 0.00 0.00 173.10 174.56 2bed h PRO 405 N 5.38 0.18 -0.38 2.90 0.11 -1.88 0.38 132.00 138.69 2bed h PRO 405 Ca -0.45 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.58 2bed h PRO 405 Cb 1.21 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2bed h PRO 405 CO 0.79 0.12 -0.04 0.38 -0.21 0.00 0.00 178.00 179.04 2bed h ASP 406 N 0.19 0.59 -0.30 -2.05 2.03 -1.93 -0.30 116.42 114.65 2bed h ASP 406 Ca 0.42 -0.14 -0.04 0.00 -0.73 0.00 0.00 57.03 56.55 2bed h ASP 406 Cb 0.75 -0.16 -0.01 0.00 -0.83 0.00 0.00 39.33 39.08 2bed h ASP 406 CO -0.58 0.69 0.03 0.11 -1.03 0.00 0.00 179.24 178.46 2bed h LYS 407 N 0.58 0.51 0.68 4.15 1.79 -0.74 0.74 116.57 124.28 2bed h LYS 407 Ca 0.11 -0.15 -0.03 0.00 -2.18 0.00 0.00 60.65 58.41 2bed h LYS 407 Cb 0.43 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.02 2bed h LYS 407 CO 0.02 0.63 -0.47 0.28 -1.08 0.00 0.00 179.45 178.83 2bed h VAL 408 N 0.32 0.07 -0.42 0.50 2.07 -0.25 -0.55 116.25 117.98 2bed h VAL 408 Ca 0.09 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.70 2bed h VAL 408 Cb 0.38 0.07 -0.08 0.00 -1.52 0.00 0.00 31.29 30.13 2bed h VAL 408 CO 0.01 0.00 -0.14 0.40 0.02 0.00 0.00 177.57 177.86 2bed h ILE 409 N -1.10 0.51 -0.26 4.57 2.04 -1.03 0.93 117.51 123.18 2bed h ILE 409 Ca -0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.78 2bed h ILE 409 Cb 0.90 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 2bed h ILE 409 CO 0.06 0.00 0.17 -0.61 0.00 0.00 0.00 178.15 177.77 2bed h GLN 410 N -0.04 0.33 0.04 2.37 4.15 -0.74 -1.27 115.11 119.96 2bed h GLN 410 Ca 0.21 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.60 2bed h GLN 410 Cb 0.36 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.97 2bed h GLN 410 CO -0.46 0.22 -0.02 0.00 -1.93 0.00 0.00 178.83 176.64 2bed h ALA 411 N 1.10 -0.06 0.41 3.38 0.00 -0.69 -1.68 119.26 121.72 2bed h ALA 411 Ca 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2bed h ALA 411 Cb -0.04 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2bed h ALA 411 CO -0.02 -0.45 -0.39 1.79 0.00 0.00 0.00 179.25 180.17 2bed h THR 412 N -0.23 0.00 -1.00 0.00 1.35 -0.74 -0.91 112.91 111.38 2bed h THR 412 Ca -0.01 0.00 0.20 0.00 -0.55 0.00 0.00 66.41 66.05 2bed h THR 412 Cb 0.21 0.00 -0.11 0.00 -1.73 0.00 0.00 68.15 66.52 2bed h THR 412 CO 0.01 0.00 0.61 0.71 -0.25 0.00 0.00 175.52 176.60 2bed h THR 413 N -0.80 0.69 -0.21 6.82 1.35 -1.27 -1.50 112.91 118.01 2bed h THR 413 Ca -0.05 -0.25 -0.01 0.00 -0.55 0.00 0.00 66.41 65.55 2bed h THR 413 Cb 0.69 -0.10 -0.01 0.00 -1.73 0.00 0.00 68.15 67.00 2bed h THR 413 CO -0.04 0.13 0.08 -0.74 -0.25 0.00 0.00 175.52 174.71 2bed h HIS 414 N 0.73 0.32 0.00 4.73 6.17 -0.86 -2.91 115.15 123.33 2bed h HIS 414 Ca 0.58 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.63 2bed h HIS 414 Cb 0.94 -0.09 0.00 0.00 2.52 0.00 0.00 27.41 30.78 2bed h HIS 414 CO -0.00 0.36 0.00 0.74 0.71 0.00 0.00 177.93 179.73 2bed h PHE 415 N 0.18 0.00 0.00 5.26 -1.00 -0.21 -2.48 116.94 118.69 2bed h PHE 415 Ca 0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.85 2bed h PHE 415 Cb 0.18 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.74 2bed h PHE 415 CO -0.01 0.00 0.00 1.28 -1.61 0.00 0.00 178.31 177.97 2bed n LEU 416 N -3.01 0.00 0.21 1.54 4.32 -0.70 -1.67 117.00 117.69 2bed n LEU 416 Ca 0.01 0.41 0.08 0.00 -0.02 0.00 0.00 56.01 56.49 2bed n LEU 416 Cb 0.33 -0.41 0.44 0.00 -1.62 0.00 0.00 43.42 42.16 2bed n LEU 416 CO 0.28 -0.09 0.77 1.56 -1.22 0.00 0.00 177.39 178.68 2bed h GLN 417 N 0.00 0.00 -6.31 3.23 4.20 -1.44 -3.42 115.11 111.36 2bed h GLN 417 Ca 0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 2bed h GLN 417 Cb 0.31 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 2bed h GLN 417 CO 0.00 0.28 -0.28 0.15 -0.67 0.00 0.00 178.83 178.31 2bed s LYS 418 N -3.73 3.54 0.00 1.46 3.01 -0.67 -5.10 119.74 118.26 2bed s LYS 418 Ca -0.00 -0.28 -0.07 0.00 -1.01 0.00 0.00 55.97 54.60 2bed s LYS 418 Cb 0.11 -2.78 -0.05 0.00 -1.01 0.00 0.00 37.83 34.10 2bed s LYS 418 CO 0.65 0.33 0.28 -1.25 0.51 0.00 0.00 175.35 175.88 2bed s PRO 419 N -3.50 3.61 0.26 -1.68 0.04 -1.26 -4.97 135.00 127.49 2bed s PRO 419 Ca 0.40 -0.03 -0.31 0.00 0.04 0.00 0.00 61.00 61.10 2bed s PRO 419 Cb -0.11 -3.09 -0.13 0.00 0.04 0.00 0.00 34.50 31.22 2bed s PRO 419 CO 0.30 0.65 1.48 0.28 0.04 0.00 0.00 177.00 179.76 2bed n VAL 420 N 1.20 1.00 -1.26 -0.36 0.31 -1.26 -4.64 118.33 113.32 2bed n VAL 420 Ca -0.12 -0.25 -0.11 0.00 -0.01 0.00 0.00 64.34 63.85 2bed n VAL 420 Cb 0.53 -1.68 -0.11 0.00 -0.91 0.00 0.00 33.84 31.67 2bed n VAL 420 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2bed n PRO 421 N 2.05 0.02 -0.93 5.55 -0.02 -1.26 -4.81 135.00 135.60 2bed n PRO 421 Ca 0.10 -0.08 -0.31 0.00 -2.02 0.00 0.00 63.50 61.20 2bed n PRO 421 Cb 0.34 -1.16 0.14 0.00 -0.02 0.00 0.00 33.50 32.79 2bed n PRO 421 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2bed s GLY 422 N 0.56 1.68 0.00 -1.23 0.00 -1.26 -5.04 107.32 102.04 2bed s GLY 422 Ca 0.66 0.46 0.00 0.00 0.00 0.00 0.00 44.72 45.84 2bed s GLY 422 CO 0.27 0.85 0.38 0.69 0.00 0.00 0.00 173.10 175.29