#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t3d h GLU 4 N 0.53 0.63 -0.19 0.00 3.07 -2.06 -2.76 114.58 113.80 1t3d h GLU 4 Ca 0.46 -0.68 -0.09 0.00 -0.50 0.00 0.00 59.36 58.56 1t3d h GLU 4 Cb 0.97 0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 29.06 1t3d h GLU 4 CO -0.20 1.27 -0.25 0.93 -1.40 0.00 0.00 179.01 179.36 1t3d h GLU 5 N 0.27 0.36 -0.37 2.33 5.08 -1.82 -2.02 114.58 118.40 1t3d h GLU 5 Ca -0.12 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1t3d h GLU 5 Cb 1.60 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.81 1t3d h GLU 5 CO 0.18 0.59 0.18 1.25 -1.00 0.00 0.00 179.01 180.22 1t3d h LEU 6 N 0.32 0.48 -1.71 1.33 6.46 -0.88 -1.99 115.31 119.32 1t3d h LEU 6 Ca 0.05 -0.12 -0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1t3d h LEU 6 Cb 0.62 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.42 1t3d h LEU 6 CO 0.04 0.47 -0.14 -0.08 -0.62 0.00 0.00 178.44 178.11 1t3d h GLU 7 N 0.46 0.00 0.18 1.25 4.57 -1.18 -2.19 114.58 117.68 1t3d h GLU 7 Ca 0.13 0.00 -0.31 0.00 -1.18 0.00 0.00 59.36 58.00 1t3d h GLU 7 Cb 0.11 0.00 0.03 0.00 -0.16 0.00 0.00 28.75 28.73 1t3d h GLU 7 CO -0.02 0.14 -1.32 0.97 -1.18 0.00 0.00 179.01 177.60 1t3d h ILE 8 N 0.00 1.30 -0.66 2.32 6.09 -0.71 -1.88 117.51 123.97 1t3d h ILE 8 Ca -0.00 -2.57 -0.08 0.00 -1.37 0.00 0.00 64.86 60.84 1t3d h ILE 8 Cb 0.45 2.89 -0.03 0.00 0.47 0.00 0.00 36.82 40.60 1t3d h ILE 8 CO 0.02 0.77 0.10 1.62 -3.07 0.00 0.00 178.15 177.59 1t3d h VAL 9 N 0.17 1.26 -0.82 2.19 3.04 -1.21 -0.83 116.25 120.06 1t3d h VAL 9 Ca -0.22 -1.04 -0.03 0.00 -1.01 0.00 0.00 66.70 64.41 1t3d h VAL 9 Cb 2.01 0.66 -0.04 0.00 -2.01 0.00 0.00 31.29 31.91 1t3d h VAL 9 CO 0.25 0.39 0.40 -0.25 -1.01 0.00 0.00 177.57 177.35 1t3d h TRP 10 N 1.01 1.17 -0.40 3.17 2.91 -1.46 -1.41 115.95 120.94 1t3d h TRP 10 Ca 0.20 -0.05 -0.13 0.00 1.13 0.00 0.00 58.89 60.04 1t3d h TRP 10 Cb 0.44 -0.36 -0.01 0.00 -0.51 0.00 0.00 29.16 28.72 1t3d h TRP 10 CO 0.03 0.84 -0.26 -0.91 -1.03 0.00 0.00 178.44 177.11 1t3d h ASN 11 N 1.16 0.87 -0.83 2.65 -0.26 -0.87 -1.47 115.58 116.83 1t3d h ASN 11 Ca 0.28 -0.34 -0.04 0.00 -0.56 0.00 0.00 56.30 55.65 1t3d h ASN 11 Cb 0.10 -0.24 -0.04 0.00 -1.06 0.00 0.00 38.32 37.08 1t3d h ASN 11 CO -0.04 1.08 0.37 0.78 -1.06 0.00 0.00 177.43 178.57 1t3d h ASN 12 N 0.72 1.11 -0.41 5.81 -0.26 -0.92 -0.86 115.58 120.77 1t3d h ASN 12 Ca 0.09 -0.15 -0.01 0.00 -0.56 0.00 0.00 56.30 55.67 1t3d h ASN 12 Cb 0.81 -0.29 -0.02 0.00 -1.06 0.00 0.00 38.32 37.76 1t3d h ASN 12 CO 0.07 0.95 0.23 0.40 -1.06 0.00 0.00 177.43 178.02 1t3d h ILE 13 N 1.19 1.15 -0.23 2.81 2.04 -0.91 -1.38 117.51 122.19 1t3d h ILE 13 Ca 0.28 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1t3d h ILE 13 Cb 0.16 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1t3d h ILE 13 CO -0.03 0.16 0.12 0.11 0.00 0.00 0.00 178.15 178.51 1t3d h LYS 14 N 0.53 0.32 -0.66 2.37 1.57 -1.07 -0.94 116.57 118.71 1t3d h LYS 14 Ca 0.14 -0.04 0.09 0.00 -1.87 0.00 0.00 60.65 58.97 1t3d h LYS 14 Cb 0.05 -0.06 -0.07 0.00 0.08 0.00 0.00 32.23 32.24 1t3d h LYS 14 CO -0.02 0.31 0.31 0.00 -0.57 0.00 0.00 179.45 179.48 1t3d h ALA 15 N 0.99 0.88 -0.59 3.86 0.00 -1.09 -1.75 119.26 121.57 1t3d h ALA 15 Ca 0.08 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1t3d h ALA 15 Cb 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1t3d h ALA 15 CO -0.01 -0.09 0.05 0.93 0.00 0.00 0.00 179.25 180.13 1t3d h GLU 16 N 0.54 0.99 -0.72 0.00 5.08 -0.84 -3.05 114.58 116.58 1t3d h GLU 16 Ca 0.32 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1t3d h GLU 16 Cb 0.33 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 1t3d h GLU 16 CO -0.26 0.94 0.47 0.00 -1.00 0.00 0.00 179.01 179.16 1t3d h ALA 17 N 1.12 0.92 -0.13 3.43 0.00 -0.31 -1.44 119.26 122.86 1t3d h ALA 17 Ca 0.18 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.07 1t3d h ALA 17 Cb 0.47 -0.29 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 1t3d h ALA 17 CO 0.02 0.35 -0.41 0.00 0.00 0.00 0.00 179.25 179.21 1t3d h ARG 18 N 0.98 -0.46 -0.72 0.00 3.08 -1.32 -1.39 114.38 114.55 1t3d h ARG 18 Ca 0.26 0.03 0.14 0.00 0.07 0.00 0.00 59.98 60.49 1t3d h ARG 18 Cb -0.10 0.11 -0.14 0.00 0.08 0.00 0.00 29.97 29.92 1t3d h ARG 18 CO -0.06 -0.31 -0.18 1.15 -1.07 0.00 0.00 179.97 179.51 1t3d h THR 19 N -0.48 0.28 -0.50 2.04 2.02 -1.40 -3.08 112.91 111.78 1t3d h THR 19 Ca 0.08 -0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 1t3d h THR 19 Cb 0.62 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1t3d h THR 19 CO -0.39 0.00 0.19 -0.07 0.37 0.00 0.00 175.52 175.62 1t3d h LEU 20 N 0.00 0.70 -0.69 2.58 3.38 -0.23 -1.77 115.31 119.28 1t3d h LEU 20 Ca 0.35 -0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.23 1t3d h LEU 20 Cb 0.53 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.02 1t3d h LEU 20 CO -0.74 0.69 0.33 0.00 0.09 0.00 0.00 178.44 178.81 1t3d h ALA 21 N 1.04 0.94 0.00 1.53 0.00 -1.27 -0.36 119.26 121.13 1t3d h ALA 21 Ca 0.17 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1t3d h ALA 21 Cb 0.21 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1t3d h ALA 21 CO -0.01 -0.07 -0.12 -0.44 0.00 0.00 0.00 179.25 178.61 1t3d h ASP 22 N 0.57 0.00 0.58 0.00 3.32 -1.40 -3.13 116.42 116.36 1t3d h ASP 22 Ca 0.34 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 57.11 1t3d h ASP 22 Cb 0.36 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.90 1t3d h ASP 22 CO -0.27 0.12 -1.42 0.00 -1.72 0.00 0.00 179.24 175.95 1t3d s GLU 24 N -2.64 0.71 0.00 0.00 2.56 -0.60 -5.10 118.70 113.63 1t3d s GLU 24 Ca -0.06 -1.42 0.00 0.00 0.00 0.00 0.00 54.97 53.49 1t3d s GLU 24 Cb 0.08 -1.57 0.00 0.00 2.00 0.00 0.00 34.13 34.64 1t3d s GLU 24 CO 0.85 -1.17 0.27 -0.35 -0.56 0.00 0.00 175.26 174.29 1t3d n PRO 25 N 4.05 0.00 0.00 4.30 -0.04 -1.24 -2.25 135.00 139.81 1t3d n PRO 25 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1t3d n PRO 25 Cb 0.37 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1t3d n PRO 25 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1t3d n LEU 27 N 2.48 0.00 -0.10 1.53 4.77 -1.26 -4.63 117.00 119.79 1t3d n LEU 27 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 1t3d n LEU 27 Cb 0.00 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1t3d n LEU 27 CO 0.13 0.00 0.92 0.00 -1.33 0.00 0.00 177.39 177.12 1t3d h ALA 28 N 0.00 0.39 0.00 -1.18 0.00 -1.71 0.34 119.26 117.10 1t3d h ALA 28 Ca 0.00 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1t3d h ALA 28 Cb 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1t3d h ALA 28 CO 0.00 -0.30 -0.27 0.77 0.00 0.00 0.00 179.25 179.46 1t3d h SER 29 N 0.24 0.00 -0.00 0.00 0.02 -1.91 -0.81 113.55 111.09 1t3d h SER 29 Ca 0.16 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1t3d h SER 29 Cb 0.15 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 1t3d h SER 29 CO -0.18 0.27 0.00 0.15 -1.14 0.00 0.00 176.83 175.93 1t3d h PHE 30 N 0.00 0.00 -0.57 3.45 3.04 -1.55 0.05 116.94 121.36 1t3d h PHE 30 Ca -0.00 -0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.95 1t3d h PHE 30 Cb 0.49 -0.00 -0.03 0.00 2.56 0.00 0.00 35.95 38.97 1t3d h PHE 30 CO 0.00 0.23 0.35 1.88 -2.02 0.00 0.00 178.31 178.75 1t3d h TYR 31 N -0.23 0.74 0.02 0.41 0.99 -0.66 -0.59 116.97 117.65 1t3d h TYR 31 Ca 0.00 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 1t3d h TYR 31 Cb 0.23 -0.24 0.00 0.00 1.00 0.00 0.00 36.73 37.72 1t3d h TYR 31 CO 0.00 0.49 -0.01 1.25 -0.00 0.00 0.00 178.16 179.89 1t3d h HIS 32 N 0.78 -0.03 -0.31 4.88 2.76 -0.93 -0.92 115.15 121.39 1t3d h HIS 32 Ca 0.21 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.36 1t3d h HIS 32 Cb -0.04 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 28.92 1t3d h HIS 32 CO 0.00 0.28 0.14 0.00 -1.30 0.00 0.00 177.93 177.05 1t3d h ALA 33 N 0.64 0.40 -0.03 5.26 0.00 -0.74 -2.04 119.26 122.75 1t3d h ALA 33 Ca -0.00 -0.10 -0.25 0.00 0.00 0.00 0.00 54.91 54.56 1t3d h ALA 33 Cb 0.31 -0.12 0.02 0.00 0.00 0.00 0.00 17.79 18.00 1t3d h ALA 33 CO 0.00 -0.04 -0.95 1.79 0.00 0.00 0.00 179.25 180.05 1t3d h THR 34 N 0.36 1.29 0.00 0.00 1.35 -1.15 -3.43 112.91 111.33 1t3d h THR 34 Ca 0.10 -2.17 0.00 0.00 -0.55 0.00 0.00 66.41 63.80 1t3d h THR 34 Cb 0.13 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 1t3d h THR 34 CO -0.01 0.67 -0.11 0.18 -0.25 0.00 0.00 175.52 176.00 1t3d n LEU 35 N -3.90 1.10 0.25 3.87 4.77 -0.39 -4.62 117.00 118.07 1t3d n LEU 35 Ca -0.10 0.15 0.08 0.00 -0.03 0.00 0.00 56.01 56.11 1t3d n LEU 35 Cb 0.84 -0.36 0.63 0.00 -2.33 0.00 0.00 43.42 42.20 1t3d n LEU 35 CO 0.55 -0.68 1.00 -0.07 -1.33 0.00 0.00 177.39 176.85 1t3d h LEU 36 N -0.11 0.00 -0.03 2.23 3.38 -1.31 -1.84 115.31 117.64 1t3d h LEU 36 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1t3d h LEU 36 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1t3d h LEU 36 CO 0.00 0.09 -0.11 0.29 0.09 0.00 0.00 178.44 178.79 1t3d n LYS 37 N -4.26 0.13 -3.98 1.13 5.02 -0.78 -4.85 118.16 110.57 1t3d n LYS 37 Ca -0.03 -0.03 -0.33 0.00 -2.02 0.00 0.00 58.31 55.91 1t3d n LYS 37 Cb 0.17 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.62 1t3d n LYS 37 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1t3d s HIS 38 N -2.89 3.43 -0.83 2.13 3.76 -0.69 -5.01 115.29 115.19 1t3d s HIS 38 Ca 0.17 0.27 0.18 0.00 -0.15 0.00 0.00 55.06 55.53 1t3d s HIS 38 Cb 0.19 -1.77 -0.21 0.00 1.11 0.00 0.00 32.58 31.90 1t3d s HIS 38 CO 0.55 0.60 0.77 0.39 -0.85 0.00 0.00 174.74 176.19 1t3d n GLU 39 N 0.85 0.85 -3.88 1.40 -0.58 -1.26 -5.00 120.64 113.02 1t3d n GLU 39 Ca -0.10 -0.01 -0.09 0.00 -0.42 0.00 0.00 57.16 56.53 1t3d n GLU 39 Cb 0.52 -1.38 -0.05 0.00 -0.57 0.00 0.00 31.44 29.96 1t3d n GLU 39 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1t3d s ASN 40 N -2.84 -0.12 0.20 1.62 2.20 -1.26 -5.07 114.94 109.68 1t3d s ASN 40 Ca 0.06 -0.73 -0.09 0.00 -0.94 0.00 0.00 52.86 51.16 1t3d s ASN 40 Cb 0.14 0.54 0.13 0.00 -2.00 0.00 0.00 41.25 40.05 1t3d s ASN 40 CO 0.76 -1.03 1.76 0.25 -2.94 0.00 0.00 177.10 175.90 1t3d h LEU 41 N 2.32 1.01 -0.60 3.54 5.85 -1.94 -2.80 115.31 122.70 1t3d h LEU 41 Ca -0.29 -0.18 0.11 0.00 0.84 0.00 0.00 57.88 58.37 1t3d h LEU 41 Cb 1.25 -0.26 -0.09 0.00 0.37 0.00 0.00 40.66 41.93 1t3d h LEU 41 CO 0.40 0.92 0.12 1.23 -0.34 0.00 0.00 178.44 180.77 1t3d h GLY 42 N 1.05 0.75 1.20 3.75 0.00 -1.97 0.36 103.07 108.22 1t3d h GLY 42 Ca 0.24 -0.02 -0.08 0.00 0.00 0.00 0.00 47.33 47.47 1t3d h GLY 42 CO -0.02 -0.12 0.02 1.76 0.00 0.00 0.00 176.54 178.18 1t3d h SER 43 N 0.25 0.94 -0.56 0.19 0.02 -1.96 -1.22 113.55 111.22 1t3d h SER 43 Ca 0.31 -0.24 -0.09 0.00 -0.84 0.00 0.00 61.79 60.93 1t3d h SER 43 Cb 0.47 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 1t3d h SER 43 CO -0.41 0.98 0.01 0.00 -1.14 0.00 0.00 176.83 176.28 1t3d h ALA 44 N 1.12 0.75 -0.25 3.77 0.00 -1.02 -2.25 119.26 121.38 1t3d h ALA 44 Ca 0.17 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1t3d h ALA 44 Cb 0.50 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1t3d h ALA 44 CO 0.02 0.56 0.10 -0.07 0.00 0.00 0.00 179.25 179.87 1t3d h LEU 45 N 0.86 0.34 -1.23 0.00 3.38 -0.23 -2.86 115.31 115.57 1t3d h LEU 45 Ca 0.16 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1t3d h LEU 45 Cb 0.52 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1t3d h LEU 45 CO 0.03 0.40 0.12 0.77 0.09 0.00 0.00 178.44 179.84 1t3d h SER 46 N 0.25 0.59 0.00 -0.43 4.64 -1.22 -1.23 113.55 116.16 1t3d h SER 46 Ca 0.08 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1t3d h SER 46 Cb 0.16 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1t3d h SER 46 CO -0.01 0.59 0.00 0.00 -0.87 0.00 0.00 176.83 176.54 1t3d n TYR 47 N -4.32 0.00 0.00 4.77 9.36 -0.85 -1.80 117.16 124.32 1t3d n TYR 47 Ca 0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.25 1t3d n TYR 47 Cb 0.19 -0.01 0.00 0.00 -0.63 0.00 0.00 39.34 38.90 1t3d n TYR 47 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1t3d n LEU 49 N 0.10 0.00 -0.15 2.98 4.77 -0.47 -2.03 117.00 122.20 1t3d n LEU 49 Ca 0.00 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.96 1t3d n LEU 49 Cb 0.02 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.17 1t3d n LEU 49 CO 0.00 0.00 0.86 0.00 -1.33 0.00 0.00 177.39 176.92 1t3d h ALA 50 N 0.00 0.48 0.00 -1.18 0.00 -1.59 -1.49 119.26 115.48 1t3d h ALA 50 Ca 0.00 0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 1t3d h ALA 50 Cb 0.00 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1t3d h ALA 50 CO 0.00 -0.37 -0.70 -0.91 0.00 0.00 0.00 179.25 177.27 1t3d h ASN 51 N 0.14 0.00 0.22 0.00 2.35 -1.66 -2.43 115.58 114.21 1t3d h ASN 51 Ca 0.25 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 55.67 1t3d h ASN 51 Cb 0.36 0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.76 1t3d h ASN 51 CO -0.39 0.70 -1.47 0.11 -1.65 0.00 0.00 177.43 174.73 1t3d h LYS 52 N 0.00 0.47 -0.12 0.81 1.79 -1.75 -3.34 116.57 114.44 1t3d h LYS 52 Ca -0.01 -0.81 -0.19 0.00 -2.18 0.00 0.00 60.65 57.46 1t3d h LYS 52 Cb 1.24 0.30 -0.00 0.00 -1.58 0.00 0.00 32.23 32.19 1t3d h LYS 52 CO 0.09 1.39 -0.71 -0.07 -1.08 0.00 0.00 179.45 179.07 1t3d h LEU 53 N 0.06 0.62 -3.14 2.94 4.07 -1.39 -3.48 115.31 114.99 1t3d h LEU 53 Ca -0.27 -0.39 -0.22 0.00 0.08 0.00 0.00 57.88 57.08 1t3d h LEU 53 Cb 2.08 -0.18 0.05 0.00 1.08 0.00 0.00 40.66 43.69 1t3d h LEU 53 CO 0.23 1.14 -0.29 -0.24 -1.08 0.00 0.00 178.44 178.20 1t3d n SER 54 N -3.88 -0.85 -3.79 -0.43 2.88 -0.91 -5.02 113.62 101.61 1t3d n SER 54 Ca -0.05 0.31 -0.05 0.00 -1.33 0.00 0.00 58.87 57.76 1t3d n SER 54 Cb 0.70 -0.31 -0.02 0.00 -0.75 0.00 0.00 64.21 63.83 1t3d n SER 54 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1t3d s SER 55 N -0.35 -0.21 0.22 -3.46 1.04 -1.26 -4.97 113.70 104.72 1t3d s SER 55 Ca 0.21 -0.49 -0.09 0.00 0.48 0.00 0.00 55.95 56.06 1t3d s SER 55 Cb -0.25 0.58 0.20 0.00 0.10 0.00 0.00 66.02 66.65 1t3d s SER 55 CO 0.21 -1.08 1.90 -0.65 0.98 0.00 0.00 173.24 174.60 1t3d h PRO 56 N 2.00 1.11 0.00 4.02 0.11 -2.06 -2.90 132.00 134.28 1t3d h PRO 56 Ca -0.22 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1t3d h PRO 56 Cb 1.24 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1t3d h PRO 56 CO 0.25 0.73 0.01 -0.89 -0.21 0.00 0.00 178.00 177.89 1t3d n ILE 57 N -4.50 0.16 -4.00 4.15 5.41 -1.26 -5.13 119.36 114.20 1t3d n ILE 57 Ca 0.09 0.05 -0.08 0.00 1.00 0.00 0.00 62.75 63.81 1t3d n ILE 57 Cb 0.02 -1.05 -0.10 0.00 -0.71 0.00 0.00 39.64 37.80 1t3d n ILE 57 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1t3d s PRO 59 N -1.89 0.54 0.22 0.38 0.04 -1.10 -5.15 135.00 128.05 1t3d s PRO 59 Ca 0.00 -0.90 -0.08 0.00 0.04 0.00 0.00 61.00 60.06 1t3d s PRO 59 Cb 0.00 0.20 0.29 0.00 0.04 0.00 0.00 34.50 35.03 1t3d s PRO 59 CO 0.00 -0.11 1.79 0.00 0.04 0.00 0.00 177.00 178.72 1t3d h ALA 60 N 3.67 0.94 -0.81 8.56 0.00 -1.86 -0.14 119.26 129.62 1t3d h ALA 60 Ca -0.33 0.04 0.09 0.00 0.00 0.00 0.00 54.91 54.71 1t3d h ALA 60 Cb 1.17 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.82 1t3d h ALA 60 CO 0.54 -0.01 0.46 0.97 0.00 0.00 0.00 179.25 181.21 1t3d h ILE 61 N 0.63 0.91 0.00 0.00 2.10 -2.00 0.06 117.51 119.21 1t3d h ILE 61 Ca 0.33 -0.27 -0.00 0.00 1.08 0.00 0.00 64.86 66.00 1t3d h ILE 61 Cb 0.29 0.07 0.00 0.00 -1.09 0.00 0.00 36.82 36.09 1t3d h ILE 61 CO -0.23 0.14 -0.00 0.00 -1.08 0.00 0.00 178.15 176.98 1t3d h ALA 62 N 1.45 -0.00 -0.74 0.18 0.00 -1.50 -3.20 119.26 115.45 1t3d h ALA 62 Ca 0.39 -0.20 0.11 0.00 0.00 0.00 0.00 54.91 55.22 1t3d h ALA 62 Cb 0.35 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.06 1t3d h ALA 62 CO -0.24 -0.30 0.35 0.82 0.00 0.00 0.00 179.25 179.87 1t3d h ILE 63 N -0.40 0.78 -0.83 0.00 2.04 -1.05 -2.41 117.51 115.64 1t3d h ILE 63 Ca -0.00 -0.19 0.04 0.00 1.00 0.00 0.00 64.86 65.71 1t3d h ILE 63 Cb 0.39 0.17 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 1t3d h ILE 63 CO 0.00 0.10 0.55 -0.09 0.00 0.00 0.00 178.15 178.71 1t3d h ARG 64 N 0.56 0.97 -0.37 2.37 2.43 -1.00 0.31 114.38 119.65 1t3d h ARG 64 Ca 0.38 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.46 1t3d h ARG 64 Cb 0.48 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1t3d h ARG 64 CO -0.32 0.64 0.11 0.93 -1.51 0.00 0.00 179.97 179.83 1t3d h GLU 65 N 1.00 0.58 -0.14 0.20 5.08 -1.43 0.16 114.58 120.04 1t3d h GLU 65 Ca 0.34 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.59 1t3d h GLU 65 Cb 0.08 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1t3d h GLU 65 CO -0.10 0.60 0.00 0.28 -1.00 0.00 0.00 179.01 178.79 1t3d h VAL 66 N 0.45 0.91 -0.43 3.13 2.07 -1.12 -0.78 116.25 120.49 1t3d h VAL 66 Ca 0.12 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.67 1t3d h VAL 66 Cb 0.27 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 1t3d h VAL 66 CO -0.00 0.01 0.17 0.58 0.02 0.00 0.00 177.57 178.34 1t3d h VAL 67 N 0.05 0.89 -0.37 2.57 2.07 -0.69 -0.28 116.25 120.49 1t3d h VAL 67 Ca 0.06 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.38 1t3d h VAL 67 Cb 0.07 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1t3d h VAL 67 CO -0.11 0.06 -0.12 -0.33 0.02 0.00 0.00 177.57 177.10 1t3d h GLU 68 N 0.34 0.64 -0.54 1.57 4.39 -0.49 -1.25 114.58 119.24 1t3d h GLU 68 Ca 0.20 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1t3d h GLU 68 Cb 0.17 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 1t3d h GLU 68 CO -0.19 0.74 0.29 1.49 -1.16 0.00 0.00 179.01 180.19 1t3d h GLU 69 N 0.59 0.76 -0.22 2.33 4.81 -0.46 -1.15 114.58 121.23 1t3d h GLU 69 Ca 0.10 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1t3d h GLU 69 Cb 0.54 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.75 1t3d h GLU 69 CO 0.03 0.59 0.08 0.00 -0.73 0.00 0.00 179.01 178.98 1t3d h ALA 70 N 1.13 0.25 -0.10 2.92 0.00 -0.36 -2.26 119.26 120.84 1t3d h ALA 70 Ca 0.19 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1t3d h ALA 70 Cb 0.05 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1t3d h ALA 70 CO -0.03 -0.34 -0.33 1.88 0.00 0.00 0.00 179.25 180.43 1t3d h TYR 71 N 0.18 0.22 -0.56 0.00 0.99 -1.15 -0.88 116.97 115.78 1t3d h TYR 71 Ca 0.10 -0.05 -0.04 0.00 2.00 0.00 0.00 58.73 60.74 1t3d h TYR 71 Cb 0.06 -0.05 -0.02 0.00 1.00 0.00 0.00 36.73 37.72 1t3d h TYR 71 CO -0.12 0.51 0.18 0.00 -0.00 0.00 0.00 178.16 178.73 1t3d h ALA 72 N 1.49 0.73 0.00 3.88 0.00 -1.03 -2.29 119.26 122.05 1t3d h ALA 72 Ca 0.02 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 1t3d h ALA 72 Cb 0.67 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1t3d h ALA 72 CO 0.05 0.39 -0.61 0.00 0.00 0.00 0.00 179.25 179.07 1t3d h ALA 73 N 1.05 0.91 -1.46 0.00 0.00 -0.95 -3.38 119.26 115.42 1t3d h ALA 73 Ca 0.18 -0.56 -0.44 0.00 0.00 0.00 0.00 54.91 54.09 1t3d h ALA 73 Cb 0.27 -0.10 -0.30 0.00 0.00 0.00 0.00 17.79 17.66 1t3d h ALA 73 CO -0.01 0.77 -0.87 -3.47 0.00 0.00 0.00 179.25 175.68 1t3d n ASP 74 N -3.70 -1.10 0.12 0.00 2.03 -0.38 -4.97 116.55 108.55 1t3d n ASP 74 Ca -0.01 -2.81 0.08 0.00 0.52 0.00 0.00 54.79 52.57 1t3d n ASP 74 Cb 0.63 0.25 0.43 0.00 -0.72 0.00 0.00 41.12 41.72 1t3d n ASP 74 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1t3d n PRO 75 N 1.89 0.11 -0.09 -0.67 -0.04 -0.86 -4.45 135.00 130.88 1t3d n PRO 75 Ca 0.19 0.58 -0.01 0.00 -0.04 0.00 0.00 63.50 64.22 1t3d n PRO 75 Cb 0.55 -1.83 -0.01 0.00 -0.04 0.00 0.00 33.50 32.17 1t3d n PRO 75 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1t3d n GLU 76 N -2.06 0.17 0.00 0.54 -0.58 -1.26 -3.29 120.64 114.16 1t3d n GLU 76 Ca -0.01 -0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 1t3d n GLU 76 Cb 0.05 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 29.40 1t3d n GLU 76 CO 0.00 0.00 0.00 -0.89 -0.48 0.00 0.00 177.13 175.76 1t3d n ILE 78 N 2.62 0.00 -0.16 -3.67 5.41 -1.26 -0.71 119.36 121.58 1t3d n ILE 78 Ca 0.03 0.00 -0.04 0.00 1.00 0.00 0.00 62.75 63.74 1t3d n ILE 78 Cb 0.08 0.00 0.15 0.00 -0.71 0.00 0.00 39.64 39.16 1t3d n ILE 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1t3d h ALA 79 N 0.00 1.13 -0.56 -1.39 0.00 -1.94 -1.70 119.26 114.80 1t3d h ALA 79 Ca 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.69 1t3d h ALA 79 Cb 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1t3d h ALA 79 CO 0.00 0.58 0.37 0.77 0.00 0.00 0.00 179.25 180.97 1t3d h SER 80 N 0.87 0.64 -0.87 0.00 0.02 -1.24 -1.85 113.55 111.11 1t3d h SER 80 Ca 0.19 -0.02 0.09 0.00 -0.84 0.00 0.00 61.79 61.21 1t3d h SER 80 Cb 0.34 -0.16 -0.07 0.00 0.14 0.00 0.00 62.40 62.65 1t3d h SER 80 CO 0.00 0.46 0.52 0.00 -1.14 0.00 0.00 176.83 176.67 1t3d h ALA 81 N 1.21 1.24 -0.80 3.77 0.00 -1.71 0.12 119.26 123.08 1t3d h ALA 81 Ca 0.21 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 1t3d h ALA 81 Cb -0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 1t3d h ALA 81 CO -0.05 0.17 0.32 0.00 0.00 0.00 0.00 179.25 179.69 1t3d h ALA 82 N 1.46 1.05 -0.30 0.00 0.00 -0.69 -0.09 119.26 120.68 1t3d h ALA 82 Ca 0.41 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 1t3d h ALA 82 Cb 0.33 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1t3d h ALA 82 CO -0.23 0.67 -0.38 0.00 0.00 0.00 0.00 179.25 179.31 1t3d h ASP 84 N 0.58 0.94 -0.05 0.00 3.32 -0.66 0.44 116.42 120.99 1t3d h ASP 84 Ca 0.05 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1t3d h ASP 84 Cb 0.92 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.22 1t3d h ASP 84 CO 0.08 0.79 0.04 0.40 -1.72 0.00 0.00 179.24 178.82 1t3d h ILE 85 N 1.03 1.02 -0.95 0.35 2.04 -0.77 -2.08 117.51 118.15 1t3d h ILE 85 Ca 0.26 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.09 1t3d h ILE 85 Cb 0.07 0.94 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 1t3d h ILE 85 CO -0.04 0.02 0.61 1.56 0.00 0.00 0.00 178.15 180.30 1t3d h GLN 86 N 0.07 1.26 -0.49 2.37 1.08 -1.12 -2.18 115.11 116.11 1t3d h GLN 86 Ca 0.02 -0.09 0.04 0.00 -1.45 0.00 0.00 58.65 57.17 1t3d h GLN 86 Cb -0.01 -0.28 -0.04 0.00 -0.05 0.00 0.00 27.48 27.11 1t3d h GLN 86 CO -0.00 0.85 0.25 0.00 -0.95 0.00 0.00 178.83 178.98 1t3d h ALA 87 N 1.34 0.62 -0.39 3.87 0.00 -0.59 -0.11 119.26 123.98 1t3d h ALA 87 Ca 0.35 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1t3d h ALA 87 Cb -0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1t3d h ALA 87 CO -0.07 -0.08 0.17 0.28 0.00 0.00 0.00 179.25 179.54 1t3d h VAL 88 N 0.50 1.18 -0.60 0.00 2.07 -1.14 -0.11 116.25 118.15 1t3d h VAL 88 Ca 0.21 -0.55 -0.05 0.00 0.82 0.00 0.00 66.70 67.12 1t3d h VAL 88 Cb 0.10 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1t3d h VAL 88 CO -0.13 0.20 0.17 -0.09 0.02 0.00 0.00 177.57 177.74 1t3d h ARG 89 N 0.49 0.95 0.11 1.57 2.43 -1.05 -0.72 114.38 118.16 1t3d h ARG 89 Ca 0.13 -0.21 -0.28 0.00 -0.81 0.00 0.00 59.98 58.81 1t3d h ARG 89 Cb 0.16 -0.13 0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1t3d h ARG 89 CO -0.01 0.86 -1.20 1.79 -1.51 0.00 0.00 179.97 179.89 1t3d h THR 90 N 0.87 1.35 0.00 0.20 1.35 -0.93 -3.38 112.91 112.37 1t3d h THR 90 Ca 0.19 -2.59 -0.21 0.00 -0.55 0.00 0.00 66.41 63.26 1t3d h THR 90 Cb 0.31 2.71 -0.03 0.00 -1.73 0.00 0.00 68.15 69.41 1t3d h THR 90 CO -0.00 0.78 -1.36 0.03 -0.25 0.00 0.00 175.52 174.71 1t3d h ARG 91 N 0.22 0.00 -4.59 4.72 3.08 -0.98 -3.44 114.38 113.39 1t3d h ARG 91 Ca -0.16 0.00 -0.70 0.00 0.07 0.00 0.00 59.98 59.19 1t3d h ARG 91 Cb 1.88 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 31.71 1t3d h ARG 91 CO 0.22 0.45 -0.47 0.34 -1.07 0.00 0.00 179.97 179.44 1t3d s ASP 92 N -6.06 5.97 0.23 7.04 2.15 -0.28 -4.97 116.67 120.74 1t3d s ASP 92 Ca -0.02 -0.79 0.23 0.00 0.43 0.00 0.00 52.55 52.40 1t3d s ASP 92 Cb 0.08 -2.11 0.93 0.00 -0.30 0.00 0.00 42.92 41.52 1t3d s ASP 92 CO 0.81 -0.37 1.71 -0.81 -0.17 0.00 0.00 175.17 176.34 1t3d n PRO 93 N 5.10 0.19 0.00 4.34 -0.04 -1.26 -1.85 135.00 141.47 1t3d n PRO 93 Ca -0.12 0.37 0.09 0.00 -0.04 0.00 0.00 63.50 63.81 1t3d n PRO 93 Cb 0.47 -1.83 0.42 0.00 -0.04 0.00 0.00 33.50 32.53 1t3d n PRO 93 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1t3d n ALA 94 N -1.75 1.90 -4.01 0.55 0.00 -1.26 -4.65 120.51 111.29 1t3d n ALA 94 Ca 0.03 -0.07 -0.33 0.00 0.00 0.00 0.00 53.44 53.07 1t3d n ALA 94 Cb 0.26 -1.32 -0.15 0.00 0.00 0.00 0.00 19.45 18.24 1t3d n ALA 94 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1t3d s VAL 95 N -3.00 2.28 -0.35 0.00 1.01 -0.77 -4.98 120.40 114.60 1t3d s VAL 95 Ca 0.10 -1.27 0.10 0.00 0.00 0.00 0.00 61.98 60.91 1t3d s VAL 95 Cb 0.13 -2.17 0.26 0.00 0.00 0.00 0.00 36.38 34.60 1t3d s VAL 95 CO 0.36 0.22 1.20 -0.90 0.00 0.00 0.00 175.10 175.97 1t3d n ASP 96 N 4.55 2.75 -4.05 3.32 3.85 -1.26 -4.65 116.55 121.05 1t3d n ASP 96 Ca -0.17 -2.42 -0.15 0.00 -0.71 0.00 0.00 54.79 51.34 1t3d n ASP 96 Cb 0.46 -0.27 -0.12 0.00 -1.35 0.00 0.00 41.12 39.84 1t3d n ASP 96 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1t3d s LYS 97 N -1.74 0.56 0.36 0.11 1.02 -1.26 -5.03 119.74 113.75 1t3d s LYS 97 Ca 0.22 -0.63 0.08 0.00 0.02 0.00 0.00 55.97 55.65 1t3d s LYS 97 Cb 0.16 -0.42 0.68 0.00 -0.52 0.00 0.00 37.83 37.73 1t3d s LYS 97 CO 0.07 0.09 1.87 1.88 -0.92 0.00 0.00 175.35 178.34 1t3d h TYR 98 N 4.89 0.34 -0.00 3.18 0.05 -1.92 -3.20 116.97 120.31 1t3d h TYR 98 Ca -0.34 -0.05 -0.14 0.00 0.05 0.00 0.00 58.73 58.25 1t3d h TYR 98 Cb 1.20 -0.09 -0.02 0.00 1.01 0.00 0.00 36.73 38.82 1t3d h TYR 98 CO 0.58 0.46 -0.67 0.66 -1.05 0.00 0.00 178.16 178.14 1t3d h SER 99 N 0.30 0.03 -0.41 3.88 4.64 -1.90 -3.37 113.55 116.72 1t3d h SER 99 Ca 0.06 -0.02 0.07 0.00 -0.47 0.00 0.00 61.79 61.43 1t3d h SER 99 Cb 0.44 -0.01 -0.06 0.00 -0.31 0.00 0.00 62.40 62.46 1t3d h SER 99 CO 0.03 0.69 0.04 0.74 -0.87 0.00 0.00 176.83 177.46 1t3d h THR 100 N 0.02 0.74 -0.52 2.95 2.02 -1.98 0.97 112.91 117.10 1t3d h THR 100 Ca -0.01 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 67.12 1t3d h THR 100 Cb 1.19 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 68.14 1t3d h THR 100 CO 0.09 0.03 0.35 -0.65 0.37 0.00 0.00 175.52 175.70 1t3d h PRO 101 N 0.16 0.68 -0.86 6.66 0.11 -1.79 0.13 132.00 137.09 1t3d h PRO 101 Ca 0.20 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 1t3d h PRO 101 Cb 0.27 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.18 1t3d h PRO 101 CO -0.30 0.45 0.46 1.25 -0.21 0.00 0.00 178.00 179.65 1t3d h LEU 102 N 0.70 1.08 0.13 2.35 5.85 -1.62 -2.91 115.31 120.90 1t3d h LEU 102 Ca 0.19 -0.11 -0.25 0.00 0.84 0.00 0.00 57.88 58.56 1t3d h LEU 102 Cb -0.08 -0.28 0.03 0.00 0.37 0.00 0.00 40.66 40.71 1t3d h LEU 102 CO -0.04 0.88 -1.04 -0.07 -0.34 0.00 0.00 178.44 177.82 1t3d h LEU 103 N 1.20 0.69 0.00 2.25 3.38 -0.61 -3.45 115.31 118.77 1t3d h LEU 103 Ca 0.30 -0.87 0.00 0.00 0.09 0.00 0.00 57.88 57.40 1t3d h LEU 103 Cb 0.05 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1t3d h LEU 103 CO -0.05 1.50 -0.55 -1.22 0.09 0.00 0.00 178.44 178.21 1t3d n TYR 104 N -3.96 0.00 -3.00 1.13 4.01 0.42 -5.05 117.16 110.72 1t3d n TYR 104 Ca -0.14 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.18 1t3d n TYR 104 Cb 0.90 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.88 1t3d n TYR 104 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1t3d s LEU 105 N -2.34 4.27 0.50 7.72 1.43 -1.10 -4.92 118.68 124.24 1t3d s LEU 105 Ca 0.00 -0.04 0.15 0.00 -1.03 0.00 0.00 54.13 53.21 1t3d s LEU 105 Cb 0.00 -2.93 1.22 0.00 0.03 0.00 0.00 46.19 44.52 1t3d s LEU 105 CO 0.00 -0.84 2.12 0.07 0.23 0.00 0.00 176.35 177.94 1t3d h LYS 106 N 8.84 0.08 -0.44 1.70 2.10 -1.88 -1.58 116.57 125.38 1t3d h LYS 106 Ca -0.25 -0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.31 1t3d h LYS 106 Cb 1.09 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 32.39 1t3d h LYS 106 CO 0.93 0.05 -0.08 0.78 -2.00 0.00 0.00 179.45 179.14 1t3d h GLY 107 N 0.08 0.90 0.92 0.07 0.00 -1.82 0.86 103.07 104.09 1t3d h GLY 107 Ca 0.04 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.64 1t3d h GLY 107 CO -0.01 0.66 0.12 -2.75 0.00 0.00 0.00 176.54 174.56 1t3d h PHE 108 N 0.67 0.39 -0.88 5.60 3.57 -1.56 -1.05 116.94 123.69 1t3d h PHE 108 Ca 0.12 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.64 1t3d h PHE 108 Cb 0.60 -0.12 -0.06 0.00 2.79 0.00 0.00 35.95 39.17 1t3d h PHE 108 CO 0.05 0.38 0.56 0.45 -2.23 0.00 0.00 178.31 177.52 1t3d h HIS 109 N 0.28 1.04 -0.41 0.41 3.86 -1.16 -1.09 115.15 118.08 1t3d h HIS 109 Ca 0.09 0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 59.18 1t3d h HIS 109 Cb 0.15 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.27 1t3d h HIS 109 CO -0.01 0.57 -0.33 0.00 0.86 0.00 0.00 177.93 179.02 1t3d h ALA 110 N 1.38 0.60 -0.43 2.45 0.00 -0.61 -0.58 119.26 122.06 1t3d h ALA 110 Ca 0.36 -0.44 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1t3d h ALA 110 Cb 0.07 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1t3d h ALA 110 CO -0.14 0.67 0.21 1.25 0.00 0.00 0.00 179.25 181.24 1t3d h LEU 111 N 0.78 0.29 -0.72 0.00 5.85 -0.91 0.61 115.31 121.21 1t3d h LEU 111 Ca 0.08 0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.69 1t3d h LEU 111 Cb 0.92 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 1t3d h LEU 111 CO 0.09 0.21 -0.62 1.56 -0.34 0.00 0.00 178.44 179.33 1t3d h GLN 112 N 0.42 0.00 -0.64 1.25 1.08 -0.92 -2.22 115.11 114.09 1t3d h GLN 112 Ca 0.19 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.36 1t3d h GLN 112 Cb 0.11 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.51 1t3d h GLN 112 CO -0.14 0.62 0.28 0.00 -0.95 0.00 0.00 178.83 178.64 1t3d h ALA 113 N 1.38 0.83 -0.79 3.87 0.00 -0.68 -2.55 119.26 121.31 1t3d h ALA 113 Ca -0.01 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1t3d h ALA 113 Cb 1.13 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 1t3d h ALA 113 CO 0.08 0.42 0.50 -0.92 0.00 0.00 0.00 179.25 179.32 1t3d h TYR 114 N 0.89 0.93 -0.97 0.00 3.20 -0.42 -1.80 116.97 118.80 1t3d h TYR 114 Ca 0.22 0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.15 1t3d h TYR 114 Cb 0.16 -0.30 -0.06 0.00 1.54 0.00 0.00 36.73 38.07 1t3d h TYR 114 CO 0.01 0.52 0.63 0.00 -1.64 0.00 0.00 178.16 177.68 1t3d h ARG 115 N 0.96 1.18 0.05 1.82 3.08 -1.00 0.27 114.38 120.74 1t3d h ARG 115 Ca 0.32 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.30 1t3d h ARG 115 Cb 0.04 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 29.83 1t3d h ARG 115 CO -0.12 0.78 -0.03 0.82 -1.07 0.00 0.00 179.97 180.35 1t3d h ILE 116 N 1.22 1.08 -0.94 2.04 1.08 -1.28 -1.57 117.51 119.14 1t3d h ILE 116 Ca 0.39 -0.45 0.06 0.00 -0.39 0.00 0.00 64.86 64.46 1t3d h ILE 116 Cb 0.01 1.38 -0.06 0.00 -3.07 0.00 0.00 36.82 35.09 1t3d h ILE 116 CO -0.13 0.11 0.61 1.23 -0.69 0.00 0.00 178.15 179.29 1t3d h GLY 117 N -0.27 1.38 1.02 5.37 0.00 -0.77 -0.46 103.07 109.35 1t3d h GLY 117 Ca -0.01 -0.44 -0.05 0.00 0.00 0.00 0.00 47.33 46.83 1t3d h GLY 117 CO 0.01 0.34 0.23 0.84 0.00 0.00 0.00 176.54 177.96 1t3d h HIS 118 N 1.11 1.05 -0.44 5.60 -0.00 -0.35 0.88 115.15 122.99 1t3d h HIS 118 Ca 0.40 -0.10 -0.05 0.00 -0.00 0.00 0.00 60.37 60.62 1t3d h HIS 118 Cb 0.14 -0.31 -0.02 0.00 -0.00 0.00 0.00 27.41 27.23 1t3d h HIS 118 CO -0.00 0.84 0.10 2.35 -0.00 0.00 0.00 177.93 181.22 1t3d h TRP 119 N 0.96 0.75 -0.55 5.26 7.01 -0.95 -1.54 115.95 126.89 1t3d h TRP 119 Ca 0.22 -0.09 -0.01 0.00 2.11 0.00 0.00 58.89 61.11 1t3d h TRP 119 Cb 0.27 -0.21 -0.03 0.00 -2.10 0.00 0.00 29.16 27.09 1t3d h TRP 119 CO 0.02 0.70 0.30 -0.07 -2.79 0.00 0.00 178.44 176.60 1t3d h LEU 120 N 0.59 0.69 -0.63 0.65 3.38 -0.85 -2.16 115.31 116.98 1t3d h LEU 120 Ca 0.14 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1t3d h LEU 120 Cb 0.33 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1t3d h LEU 120 CO 0.00 0.59 0.38 -0.25 0.09 0.00 0.00 178.44 179.25 1t3d h TRP 121 N 0.74 0.72 0.00 1.13 2.91 -0.53 -0.37 115.95 120.55 1t3d h TRP 121 Ca 0.19 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.20 1t3d h TRP 121 Cb 0.05 -0.23 -0.00 0.00 -0.51 0.00 0.00 29.16 28.46 1t3d h TRP 121 CO -0.01 0.41 -0.15 -0.91 -1.03 0.00 0.00 178.44 176.74 1t3d h ASN 122 N 0.75 0.00 0.34 2.65 2.35 -0.99 -1.83 115.58 118.86 1t3d h ASN 122 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1t3d h ASN 122 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.40 1t3d h ASN 122 CO -0.11 0.15 -0.05 0.00 -1.65 0.00 0.00 177.43 175.77 1t3d n GLN 123 N -3.29 0.71 -0.40 0.81 1.13 -0.84 -4.92 117.38 110.58 1t3d n GLN 123 Ca 0.00 -0.16 0.00 0.00 -1.94 0.00 0.00 57.00 54.91 1t3d n GLN 123 Cb 0.40 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.26 1t3d n GLN 123 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1t3d n GLY 124 N 1.23 0.73 2.98 1.08 0.00 -0.69 -4.99 105.19 105.52 1t3d n GLY 124 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1t3d n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t3d n ARG 125 N -2.00 3.91 0.09 1.61 1.74 -0.20 -4.74 116.66 117.07 1t3d n ARG 125 Ca 0.00 -3.95 -0.14 0.00 -0.77 0.00 0.00 57.85 52.99 1t3d n ARG 125 Cb 0.00 -2.77 -0.12 0.00 -1.02 0.00 0.00 32.46 28.55 1t3d n ARG 125 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1t3d h ARG 126 N 5.77 0.23 -0.55 5.56 3.08 -1.84 -2.43 114.38 124.19 1t3d h ARG 126 Ca 0.31 -0.36 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 1t3d h ARG 126 Cb 0.65 0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.80 1t3d h ARG 126 CO 1.47 1.15 0.34 0.00 -1.07 0.00 0.00 179.97 181.86 1t3d h ALA 127 N 0.70 0.70 -0.25 0.04 0.00 -1.96 -0.65 119.26 117.83 1t3d h ALA 127 Ca -0.10 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.58 1t3d h ALA 127 Cb 1.87 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.44 1t3d h ALA 127 CO 0.18 0.17 -0.51 1.25 0.00 0.00 0.00 179.25 180.34 1t3d h LEU 128 N 0.74 0.79 -0.96 0.00 5.85 -1.97 -1.77 115.31 117.99 1t3d h LEU 128 Ca 0.20 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1t3d h LEU 128 Cb -0.03 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.74 1t3d h LEU 128 CO -0.04 1.16 0.43 0.00 -0.34 0.00 0.00 178.44 179.64 1t3d h ALA 129 N 0.86 1.20 -0.08 1.25 0.00 -1.08 -1.77 119.26 119.65 1t3d h ALA 129 Ca 0.02 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 54.58 1t3d h ALA 129 Cb 1.08 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1t3d h ALA 129 CO 0.11 0.63 -0.83 0.82 0.00 0.00 0.00 179.25 179.98 1t3d h ILE 130 N 1.16 1.34 -0.20 0.00 1.08 -1.02 -1.58 117.51 118.29 1t3d h ILE 130 Ca 0.29 -2.17 0.02 0.00 -0.39 0.00 0.00 64.86 62.61 1t3d h ILE 130 Cb 0.07 2.17 -0.02 0.00 -3.07 0.00 0.00 36.82 35.96 1t3d h ILE 130 CO -0.04 0.66 0.06 0.15 -0.69 0.00 0.00 178.15 178.30 1t3d h PHE 131 N 0.36 0.12 -0.44 1.37 3.57 -1.15 -2.71 116.94 118.06 1t3d h PHE 131 Ca -0.06 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.32 1t3d h PHE 131 Cb 1.44 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 40.15 1t3d h PHE 131 CO 0.07 0.06 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.89 1t3d h LEU 132 N 0.16 0.98 -0.53 0.59 3.38 -1.27 -0.62 115.31 117.99 1t3d h LEU 132 Ca 0.09 -0.41 0.11 0.00 0.09 0.00 0.00 57.88 57.75 1t3d h LEU 132 Cb 0.06 -0.27 -0.10 0.00 0.09 0.00 0.00 40.66 40.44 1t3d h LEU 132 CO -0.09 1.17 -0.15 -0.61 0.09 0.00 0.00 178.44 178.85 1t3d h GLN 133 N 0.78 -0.02 0.02 1.13 4.15 -1.26 0.59 115.11 120.51 1t3d h GLN 133 Ca 0.10 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.31 1t3d h GLN 133 Cb 0.82 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.49 1t3d h GLN 133 CO 0.07 -0.01 -0.95 -0.91 -1.93 0.00 0.00 178.83 175.10 1t3d h ASN 134 N -0.02 0.16 -0.56 -0.69 4.21 -1.14 -1.99 115.58 115.55 1t3d h ASN 134 Ca 0.26 -0.14 -0.06 0.00 1.21 0.00 0.00 56.30 57.56 1t3d h ASN 134 Cb 0.41 -0.05 -0.03 0.00 -1.12 0.00 0.00 38.32 37.53 1t3d h ASN 134 CO -0.56 1.02 0.14 -0.61 -1.29 0.00 0.00 177.43 176.13 1t3d h GLN 135 N 0.05 0.95 -0.05 0.81 5.75 -0.89 -1.90 115.11 119.82 1t3d h GLN 135 Ca -0.04 -0.21 -0.11 0.00 -0.15 0.00 0.00 58.65 58.14 1t3d h GLN 135 Cb 1.64 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 30.04 1t3d h GLN 135 CO 0.14 0.85 -0.47 0.28 -2.65 0.00 0.00 178.83 176.98 1t3d h VAL 136 N 0.90 1.34 -0.31 2.39 2.07 -0.68 -1.23 116.25 120.72 1t3d h VAL 136 Ca 0.19 -1.64 -0.06 0.00 0.82 0.00 0.00 66.70 66.01 1t3d h VAL 136 Cb 0.34 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1t3d h VAL 136 CO 0.00 0.48 -0.04 -1.28 0.02 0.00 0.00 177.57 176.75 1t3d h SER 137 N 0.10 0.58 -0.44 0.57 0.87 -0.97 -0.51 113.55 113.75 1t3d h SER 137 Ca 0.00 -0.34 -0.10 0.00 -1.23 0.00 0.00 61.79 60.12 1t3d h SER 137 Cb 0.87 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 1t3d h SER 137 CO 0.07 0.78 -0.12 0.58 -0.53 0.00 0.00 176.83 177.60 1t3d h VAL 138 N 0.36 1.27 0.14 2.23 2.07 -1.23 -0.84 116.25 120.26 1t3d h VAL 138 Ca 0.08 -1.24 -0.23 0.00 0.82 0.00 0.00 66.70 66.13 1t3d h VAL 138 Cb 0.51 1.16 0.01 0.00 -1.52 0.00 0.00 31.29 31.45 1t3d h VAL 138 CO 0.02 0.42 -1.10 0.74 0.02 0.00 0.00 177.57 177.68 1t3d h THR 139 N 0.69 1.31 -0.01 2.57 2.02 -1.18 -3.38 112.91 114.94 1t3d h THR 139 Ca 0.11 -2.50 0.00 0.00 0.77 0.00 0.00 66.41 64.79 1t3d h THR 139 Cb 0.67 3.01 0.00 0.00 -1.74 0.00 0.00 68.15 70.08 1t3d h THR 139 CO 0.05 0.72 -0.12 0.49 0.37 0.00 0.00 175.52 177.03 1t3d n PHE 140 N -4.01 0.00 -2.20 3.16 0.99 -0.22 -5.01 117.46 110.17 1t3d n PHE 140 Ca -0.18 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.11 1t3d n PHE 140 Cb 0.88 0.00 -0.01 0.00 -1.00 0.00 0.00 39.48 39.34 1t3d n PHE 140 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1t3d n GLN 141 N -0.22 -1.21 -4.75 -1.08 3.00 -0.32 -4.63 117.38 108.17 1t3d n GLN 141 Ca 0.03 0.78 -0.30 0.00 -0.01 0.00 0.00 57.00 57.49 1t3d n GLN 141 Cb 0.14 -5.11 -0.17 0.00 0.00 0.00 0.00 30.24 25.11 1t3d n GLN 141 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1t3d s VAL 142 N -2.75 1.81 -0.40 5.09 1.01 -1.23 -1.19 120.40 122.74 1t3d s VAL 142 Ca 0.00 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.17 1t3d s VAL 142 Cb 0.00 -1.60 0.11 0.00 0.00 0.00 0.00 36.38 34.89 1t3d s VAL 142 CO 0.00 0.50 0.13 -0.62 0.00 0.00 0.00 175.10 175.11 1t3d s ASP 143 N 0.72 4.70 -0.19 3.32 3.68 -0.07 -2.67 116.67 126.17 1t3d s ASP 143 Ca -0.11 -2.40 -0.01 0.00 2.13 0.00 0.00 52.55 52.16 1t3d s ASP 143 Cb -0.16 -1.66 0.01 0.00 -1.45 0.00 0.00 42.92 39.66 1t3d s ASP 143 CO 0.02 -0.35 -0.14 -0.63 0.13 0.00 0.00 175.17 174.19 1t3d s ILE 144 N 0.57 2.59 0.25 4.11 1.01 -1.26 -0.65 121.20 127.82 1t3d s ILE 144 Ca 0.13 -0.77 -0.30 0.00 0.00 0.00 0.00 60.65 59.71 1t3d s ILE 144 Cb -0.21 -2.12 -0.10 0.00 0.01 0.00 0.00 42.46 40.04 1t3d s ILE 144 CO -0.05 0.50 1.34 -2.28 0.00 0.00 0.00 174.94 174.45 1t3d s HIS 145 N 1.24 3.15 0.51 3.97 5.65 0.20 -4.79 115.29 125.21 1t3d s HIS 145 Ca 0.03 1.22 0.35 0.00 0.25 0.00 0.00 55.06 56.91 1t3d s HIS 145 Cb -0.14 -3.68 1.89 0.00 -1.18 0.00 0.00 32.58 29.47 1t3d s HIS 145 CO -0.07 -2.07 2.21 -1.00 -0.65 0.00 0.00 174.74 173.16 1t3d h PRO 146 N 4.77 0.00 0.00 2.88 0.13 -1.90 -2.25 132.00 135.64 1t3d h PRO 146 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1t3d h PRO 146 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1t3d h PRO 146 CO 0.74 0.03 0.00 0.00 -0.23 0.00 0.00 178.00 178.55 1t3d n ALA 147 N -2.19 2.15 -1.57 -0.56 0.00 -1.26 -4.07 120.51 113.00 1t3d n ALA 147 Ca -0.02 -0.07 -0.37 0.00 0.00 0.00 0.00 53.44 52.99 1t3d n ALA 147 Cb 0.15 -1.42 0.07 0.00 0.00 0.00 0.00 19.45 18.26 1t3d n ALA 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t3d n ALA 148 N -1.56 0.51 -3.69 0.00 0.00 -0.85 -4.77 120.51 110.16 1t3d n ALA 148 Ca 0.06 -0.07 -0.35 0.00 0.00 0.00 0.00 53.44 53.08 1t3d n ALA 148 Cb 0.31 -2.22 -0.14 0.00 0.00 0.00 0.00 19.45 17.40 1t3d n ALA 148 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1t3d s LYS 149 N -3.28 2.40 -0.07 0.00 1.02 -0.87 -4.99 119.74 113.96 1t3d s LYS 149 Ca 0.79 -1.29 0.03 0.00 0.02 0.00 0.00 55.97 55.52 1t3d s LYS 149 Cb -0.37 -3.16 0.01 0.00 -0.52 0.00 0.00 37.83 33.79 1t3d s LYS 149 CO 0.45 -0.62 -0.15 0.42 -0.92 0.00 0.00 175.35 174.53 1t3d s ILE 150 N 1.23 1.31 0.00 2.17 1.01 -1.26 -0.71 121.20 124.95 1t3d s ILE 150 Ca -0.05 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 60.01 1t3d s ILE 150 Cb -0.20 -1.17 0.00 0.00 0.01 0.00 0.00 42.46 41.10 1t3d s ILE 150 CO -0.02 0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.93 1t3d n GLY 151 N 3.68 1.03 3.41 6.18 0.00 0.68 -4.97 105.19 115.19 1t3d n GLY 151 Ca -0.22 -1.51 -0.20 0.00 0.00 0.00 0.00 46.02 44.10 1t3d n GLY 151 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1t3d s ARG 152 N 0.52 1.59 -1.02 1.61 1.70 -1.26 -4.73 118.95 117.35 1t3d s ARG 152 Ca 0.00 -1.88 -0.01 0.00 -0.47 0.00 0.00 55.73 53.37 1t3d s ARG 152 Cb 0.00 -0.69 0.00 0.00 -0.57 0.00 0.00 34.95 33.70 1t3d s ARG 152 CO 0.00 -0.23 0.19 0.41 -1.08 0.00 0.00 175.30 174.60 1t3d n GLY 153 N -0.63 -0.11 0.00 3.88 0.00 -1.26 -1.08 105.19 106.00 1t3d n GLY 153 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1t3d n GLY 153 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1t3d n ILE 154 N -4.02 0.00 -2.69 -0.61 2.08 -1.26 -3.14 119.36 109.73 1t3d n ILE 154 Ca -0.11 0.00 -0.03 0.00 0.56 0.00 0.00 62.75 63.17 1t3d n ILE 154 Cb 0.59 -1.04 0.03 0.00 -0.75 0.00 0.00 39.64 38.47 1t3d n ILE 154 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 1t3d s LEU 156 N 0.00 -0.35 0.13 1.39 1.43 -1.26 -4.67 118.68 115.35 1t3d s LEU 156 Ca 0.00 -0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 52.40 1t3d s LEU 156 Cb 0.00 0.46 -0.07 0.00 0.03 0.00 0.00 46.19 46.62 1t3d s LEU 156 CO 0.00 -0.02 1.10 -0.62 0.23 0.00 0.00 176.35 177.05 1t3d s ASP 157 N 1.07 7.25 0.00 2.29 2.15 -0.59 -4.06 116.67 124.79 1t3d s ASP 157 Ca 0.23 2.02 0.00 0.00 0.43 0.00 0.00 52.55 55.23 1t3d s ASP 157 Cb 0.11 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 1t3d s ASP 157 CO -0.11 -0.27 0.00 1.41 -0.17 0.00 0.00 175.17 176.04 1t3d n HIS 158 N 2.86 0.00 0.00 -5.34 8.25 -1.26 -2.66 115.22 117.07 1t3d n HIS 158 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 1t3d n HIS 158 Cb 0.47 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.58 1t3d n HIS 158 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1t3d n ALA 159 N 0.00 0.00 -1.73 -1.41 0.00 -1.26 -4.63 120.51 111.49 1t3d n ALA 159 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1t3d n ALA 159 Cb 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.42 1t3d n ALA 159 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1t3d n THR 160 N -1.95 0.45 -1.00 0.00 5.66 -1.26 -2.12 114.28 114.06 1t3d n THR 160 Ca 0.00 -0.11 0.00 0.00 -3.05 0.00 0.00 64.05 60.89 1t3d n THR 160 Cb 0.00 -1.98 0.00 0.00 -1.55 0.00 0.00 70.33 66.80 1t3d n THR 160 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1t3d n GLY 161 N 3.18 0.65 3.74 1.09 0.00 -0.33 -1.00 105.19 112.51 1t3d n GLY 161 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1t3d n GLY 161 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1t3d s ILE 162 N -2.64 3.26 -0.06 -0.61 1.01 -0.90 -4.21 121.20 117.05 1t3d s ILE 162 Ca 0.00 1.02 0.02 0.00 0.00 0.00 0.00 60.65 61.69 1t3d s ILE 162 Cb 0.00 -3.65 0.02 0.00 0.01 0.00 0.00 42.46 38.83 1t3d s ILE 162 CO 0.00 0.15 -0.10 -0.69 0.00 0.00 0.00 174.94 174.30 1t3d s VAL 163 N 0.19 0.94 -0.09 2.92 1.01 -0.70 -0.89 120.40 123.78 1t3d s VAL 163 Ca 0.57 -0.37 -0.02 0.00 0.00 0.00 0.00 61.98 62.16 1t3d s VAL 163 Cb -0.36 -0.89 0.03 0.00 0.00 0.00 0.00 36.38 35.17 1t3d s VAL 163 CO 0.37 0.31 0.02 -0.69 0.00 0.00 0.00 175.10 175.11 1t3d s VAL 164 N 0.72 0.32 0.49 2.92 1.01 0.17 -0.23 120.40 125.81 1t3d s VAL 164 Ca -0.14 0.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.85 1t3d s VAL 164 Cb -0.15 -0.57 0.10 0.00 0.00 0.00 0.00 36.38 35.76 1t3d s VAL 164 CO 0.03 0.15 0.67 0.61 0.00 0.00 0.00 175.10 176.56 1t3d n GLY 165 N 5.16 0.15 0.38 4.51 0.00 -0.83 -0.63 105.19 113.92 1t3d n GLY 165 Ca -0.07 -1.92 -0.00 0.00 0.00 0.00 0.00 46.02 44.03 1t3d n GLY 165 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1t3d h GLU 166 N 0.00 1.26 -0.40 1.61 4.81 -1.90 -2.73 114.58 117.23 1t3d h GLU 166 Ca -0.22 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1t3d h GLU 166 Cb 0.75 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1t3d h GLU 166 CO 0.21 0.83 0.00 0.25 -0.73 0.00 0.00 179.01 179.57 1t3d n THR 167 N -4.42 2.21 -1.84 0.32 -2.24 -1.26 -2.82 114.28 104.24 1t3d n THR 167 Ca 0.13 -1.58 -0.32 0.00 -2.27 0.00 0.00 64.05 60.01 1t3d n THR 167 Cb 0.07 -0.13 0.03 0.00 -2.10 0.00 0.00 70.33 68.19 1t3d n THR 167 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1t3d s ALA 168 N -2.49 2.71 -0.01 6.98 0.00 -1.03 -4.52 121.76 123.40 1t3d s ALA 168 Ca 0.44 0.26 0.01 0.00 0.00 0.00 0.00 51.96 52.67 1t3d s ALA 168 Cb 0.34 -3.21 0.01 0.00 0.00 0.00 0.00 23.12 20.26 1t3d s ALA 168 CO 0.13 -0.99 -0.03 0.08 0.00 0.00 0.00 175.76 174.96 1t3d s VAL 169 N -2.71 0.27 -0.09 0.00 1.01 -0.90 -2.05 120.40 115.93 1t3d s VAL 169 Ca 0.61 -0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.50 1t3d s VAL 169 Cb -0.15 -0.27 0.02 0.00 0.00 0.00 0.00 36.38 35.98 1t3d s VAL 169 CO 0.45 0.11 -0.06 -0.63 0.00 0.00 0.00 175.10 174.96 1t3d s ILE 170 N 0.27 0.81 0.89 2.22 1.01 0.11 -0.47 121.20 126.03 1t3d s ILE 170 Ca -0.03 -0.19 -0.09 0.00 0.00 0.00 0.00 60.65 60.34 1t3d s ILE 170 Cb -0.06 -0.85 0.19 0.00 0.01 0.00 0.00 42.46 41.76 1t3d s ILE 170 CO -0.01 0.32 1.21 -1.61 0.00 0.00 0.00 174.94 174.86 1t3d s GLU 171 N 1.50 0.84 0.82 2.79 2.02 0.30 -0.23 118.70 126.75 1t3d s GLU 171 Ca -0.00 -0.86 -0.13 0.00 0.02 0.00 0.00 54.97 54.00 1t3d s GLU 171 Cb -0.13 -2.05 0.09 0.00 0.10 0.00 0.00 34.13 32.14 1t3d s GLU 171 CO -0.05 -2.16 1.19 -0.80 0.02 0.00 0.00 175.26 173.47 1t3d s ASN 172 N -4.90 3.55 -1.26 -0.19 0.01 -1.26 -3.97 114.94 106.92 1t3d s ASN 172 Ca 0.73 2.32 -0.02 0.00 -0.71 0.00 0.00 52.86 55.17 1t3d s ASN 172 Cb -0.03 -2.58 0.01 0.00 0.41 0.00 0.00 41.25 39.05 1t3d s ASN 172 CO 0.50 -2.69 0.99 0.47 -1.51 0.00 0.00 177.10 174.86 1t3d n ASP 173 N -3.42 -2.90 -4.54 -1.22 8.00 -0.24 -3.28 116.55 108.96 1t3d n ASP 173 Ca 0.13 -0.64 -0.33 0.00 0.71 0.00 0.00 54.79 54.65 1t3d n ASP 173 Cb 0.51 -4.90 -0.12 0.00 -0.02 0.00 0.00 41.12 36.59 1t3d n ASP 173 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1t3d s VAL 174 N -3.40 3.47 -0.17 2.53 1.01 -1.21 -2.09 120.40 120.54 1t3d s VAL 174 Ca 0.15 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1t3d s VAL 174 Cb -0.07 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.93 1t3d s VAL 174 CO 0.75 0.59 -0.20 -0.44 0.00 0.00 0.00 175.10 175.80 1t3d s SER 175 N -0.69 3.10 -0.04 3.32 0.01 -0.85 -4.24 113.70 114.31 1t3d s SER 175 Ca 0.11 -0.63 0.04 0.00 1.31 0.00 0.00 55.95 56.77 1t3d s SER 175 Cb -0.11 -1.46 -0.00 0.00 0.21 0.00 0.00 66.02 64.66 1t3d s SER 175 CO 0.01 0.01 -0.15 -0.63 0.41 0.00 0.00 173.24 172.89 1t3d s ILE 176 N 1.21 1.26 0.55 1.44 1.01 -1.26 -0.32 121.20 125.09 1t3d s ILE 176 Ca 0.03 -0.63 0.08 0.00 0.00 0.00 0.00 60.65 60.13 1t3d s ILE 176 Cb -0.13 -1.09 0.06 0.00 0.01 0.00 0.00 42.46 41.31 1t3d s ILE 176 CO -0.11 0.37 0.65 -0.76 0.00 0.00 0.00 174.94 175.09 1t3d s LEU 177 N 0.02 3.04 0.46 2.97 1.02 -0.94 -1.55 118.68 123.70 1t3d s LEU 177 Ca -0.02 -0.93 -0.23 0.00 0.02 0.00 0.00 54.13 52.97 1t3d s LEU 177 Cb -0.10 -1.59 -0.10 0.00 0.02 0.00 0.00 46.19 44.41 1t3d s LEU 177 CO 0.01 -1.21 0.87 0.00 0.02 0.00 0.00 176.35 176.05 1t3d n GLN 178 N -2.05 1.05 -1.88 1.70 0.00 -1.09 -3.25 117.38 111.87 1t3d n GLN 178 Ca 0.10 0.38 -0.14 0.00 0.00 0.00 0.00 57.00 57.34 1t3d n GLN 178 Cb 0.62 -1.92 -0.03 0.00 0.00 0.00 0.00 30.24 28.91 1t3d n GLN 178 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1t3d n SER 179 N 0.48 -4.52 -4.72 2.61 7.64 -0.17 -1.08 113.62 113.86 1t3d n SER 179 Ca 0.11 0.15 -0.40 0.00 1.01 0.00 0.00 58.87 59.74 1t3d n SER 179 Cb 0.41 -3.49 -0.05 0.00 -1.01 0.00 0.00 64.21 60.07 1t3d n SER 179 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1t3d s VAL 180 N -2.63 5.06 -0.16 0.44 1.01 -1.20 -3.31 120.40 119.61 1t3d s VAL 180 Ca 0.00 1.42 -0.03 0.00 0.00 0.00 0.00 61.98 63.36 1t3d s VAL 180 Cb 0.00 -4.03 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 1t3d s VAL 180 CO 0.00 0.26 -0.05 -0.89 0.00 0.00 0.00 175.10 174.41 1t3d s THR 181 N 0.79 3.69 -0.66 3.92 2.01 -0.32 -1.72 115.64 123.34 1t3d s THR 181 Ca 0.37 -0.43 -0.06 0.00 0.31 0.00 0.00 61.69 61.88 1t3d s THR 181 Cb -0.18 -2.61 0.17 0.00 0.01 0.00 0.00 72.50 69.89 1t3d s THR 181 CO 0.18 0.49 0.51 -0.76 -0.69 0.00 0.00 174.62 174.34 1t3d s LEU 182 N 0.53 5.64 0.30 4.42 1.43 0.68 -1.09 118.68 130.59 1t3d s LEU 182 Ca -0.04 -2.75 0.09 0.00 -1.03 0.00 0.00 54.13 50.40 1t3d s LEU 182 Cb -0.15 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1t3d s LEU 182 CO 0.03 -0.44 0.09 -0.83 0.23 0.00 0.00 176.35 175.42 1t3d s GLY 183 N 1.19 1.78 0.74 -3.19 0.00 -0.01 -1.97 107.32 105.85 1t3d s GLY 183 Ca 0.16 -1.72 -0.04 0.00 0.00 0.00 0.00 44.72 43.13 1t3d s GLY 183 CO -0.05 -1.72 1.02 -0.32 0.00 0.00 0.00 173.10 172.04 1t3d s GLY 184 N -3.77 1.76 -0.01 0.20 0.00 -1.26 -1.02 107.32 103.22 1t3d s GLY 184 Ca 0.35 -1.49 -0.07 0.00 0.00 0.00 0.00 44.72 43.51 1t3d s GLY 184 CO 0.22 -0.95 0.14 -1.08 0.00 0.00 0.00 173.10 171.43 1t3d s THR 185 N -3.23 0.07 0.00 0.90 -1.32 -1.23 -4.39 115.64 106.44 1t3d s THR 185 Ca 0.66 -0.55 0.00 0.00 -1.21 0.00 0.00 61.69 60.59 1t3d s THR 185 Cb -0.06 -0.39 0.00 0.00 -1.51 0.00 0.00 72.50 70.54 1t3d s THR 185 CO 0.45 -0.30 0.00 0.61 -2.21 0.00 0.00 174.62 173.17 1t3d n GLY 186 N 1.78 -1.12 0.48 6.08 0.00 -1.26 -4.76 105.19 106.39 1t3d n GLY 186 Ca -0.21 -1.63 0.05 0.00 0.00 0.00 0.00 46.02 44.23 1t3d n GLY 186 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1t3d n LYS 187 N -1.29 1.97 -4.06 1.61 2.85 -1.26 -5.00 118.16 112.99 1t3d n LYS 187 Ca 0.00 -1.64 -0.31 0.00 -1.05 0.00 0.00 58.31 55.30 1t3d n LYS 187 Cb 0.00 -1.21 -0.06 0.00 -0.65 0.00 0.00 35.03 33.11 1t3d n LYS 187 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1t3d s SER 188 N -0.92 5.67 1.21 -5.58 0.01 -1.26 -5.12 113.70 107.71 1t3d s SER 188 Ca 0.16 0.08 -0.17 0.00 1.31 0.00 0.00 55.95 57.33 1t3d s SER 188 Cb 0.09 -1.59 0.24 0.00 0.21 0.00 0.00 66.02 64.97 1t3d s SER 188 CO 0.13 0.21 0.56 0.61 0.41 0.00 0.00 173.24 175.16 1t3d n GLY 189 N 0.73 -2.67 0.00 3.44 0.00 -1.26 -4.95 105.19 100.48 1t3d n GLY 189 Ca -0.10 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1t3d n GLY 189 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t3d n GLY 190 N 1.73 2.41 3.65 -0.02 0.00 -1.26 -4.97 105.19 106.73 1t3d n GLY 190 Ca 0.04 -1.98 -0.50 0.00 0.00 0.00 0.00 46.02 43.58 1t3d n GLY 190 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1t3d n ASP 191 N 0.00 3.11 -0.11 1.61 2.03 -1.26 -4.78 116.55 117.15 1t3d n ASP 191 Ca 0.00 0.86 0.00 0.00 0.52 0.00 0.00 54.79 56.17 1t3d n ASP 191 Cb 0.00 -1.33 0.00 0.00 -0.72 0.00 0.00 41.12 39.07 1t3d n ASP 191 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1t3d n ARG 192 N 6.83 0.00 -4.36 -0.67 1.85 -1.26 -4.63 116.66 114.41 1t3d n ARG 192 Ca 0.26 -0.12 -0.20 0.00 -1.00 0.00 0.00 57.85 56.79 1t3d n ARG 192 Cb 0.27 -0.10 -0.10 0.00 -1.05 0.00 0.00 32.46 31.48 1t3d n ARG 192 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1t3d s HIS 193 N 0.00 1.82 0.82 2.89 3.76 -1.24 -3.17 115.29 120.17 1t3d s HIS 193 Ca 0.00 -0.52 -0.13 0.00 -0.15 0.00 0.00 55.06 54.27 1t3d s HIS 193 Cb 0.00 -0.84 0.09 0.00 1.11 0.00 0.00 32.58 32.94 1t3d s HIS 193 CO 0.00 0.41 1.19 -2.14 -0.85 0.00 0.00 174.74 173.35 1t3d s PRO 194 N -3.47 1.55 -0.27 8.40 0.02 -0.59 -3.98 135.00 136.66 1t3d s PRO 194 Ca 0.22 1.69 0.02 0.00 0.02 0.00 0.00 61.00 62.95 1t3d s PRO 194 Cb -0.02 -1.77 0.07 0.00 0.02 0.00 0.00 34.50 32.79 1t3d s PRO 194 CO 0.08 -2.27 -0.04 0.15 -0.33 0.00 0.00 177.00 174.59 1t3d s LYS 195 N -4.27 1.74 -0.25 5.54 3.01 -0.11 -2.13 119.74 123.27 1t3d s LYS 195 Ca 0.71 -1.28 -0.07 0.00 -1.01 0.00 0.00 55.97 54.32 1t3d s LYS 195 Cb -0.27 -2.76 -0.03 0.00 -1.01 0.00 0.00 37.83 33.76 1t3d s LYS 195 CO 0.52 -0.68 0.07 0.42 0.51 0.00 0.00 175.35 176.20 1t3d s ILE 196 N 1.22 4.31 0.62 2.17 -1.09 0.38 -1.07 121.20 127.73 1t3d s ILE 196 Ca -0.03 -0.19 -0.00 0.00 -2.23 0.00 0.00 60.65 58.20 1t3d s ILE 196 Cb -0.19 -3.03 0.06 0.00 -1.58 0.00 0.00 42.46 37.72 1t3d s ILE 196 CO -0.07 0.32 0.86 -0.13 -1.23 0.00 0.00 174.94 174.69 1t3d s ARG 197 N 1.61 2.27 0.32 2.79 1.81 -0.59 -0.54 118.95 126.62 1t3d s ARG 197 Ca 0.06 -0.80 -0.29 0.00 -1.72 0.00 0.00 55.73 52.98 1t3d s ARG 197 Cb -0.15 -2.40 -0.12 0.00 -0.45 0.00 0.00 34.95 31.82 1t3d s ARG 197 CO 0.04 -0.98 1.43 -1.91 -0.68 0.00 0.00 175.30 173.20 1t3d n GLU 198 N -2.55 2.38 -0.01 3.54 2.13 -1.26 -2.83 120.64 122.03 1t3d n GLU 198 Ca 0.10 0.84 0.00 0.00 0.66 0.00 0.00 57.16 58.76 1t3d n GLU 198 Cb 0.60 -2.52 0.00 0.00 0.27 0.00 0.00 31.44 29.79 1t3d n GLU 198 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1t3d n GLY 199 N 1.31 1.38 0.00 8.31 0.00 -0.89 -1.33 105.19 113.98 1t3d n GLY 199 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1t3d n GLY 199 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1t3d n VAL 200 N -2.00 0.00 0.00 1.61 0.31 -1.13 -1.28 118.33 115.84 1t3d n VAL 200 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1t3d n VAL 200 Cb 0.00 -0.95 0.00 0.00 -0.91 0.00 0.00 33.84 31.98 1t3d n VAL 200 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1t3d n ILE 202 N -2.15 0.00 -0.99 2.52 5.41 0.57 -2.01 119.36 122.71 1t3d n ILE 202 Ca 0.00 0.00 -0.31 0.00 1.00 0.00 0.00 62.75 63.44 1t3d n ILE 202 Cb 0.00 0.00 0.14 0.00 -0.71 0.00 0.00 39.64 39.07 1t3d n ILE 202 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1t3d s GLY 203 N 0.00 1.66 0.27 7.39 0.00 0.08 -2.21 107.32 114.51 1t3d s GLY 203 Ca 0.00 0.30 -0.31 0.00 0.00 0.00 0.00 44.72 44.72 1t3d s GLY 203 CO 0.00 0.72 1.49 0.00 0.00 0.00 0.00 173.10 175.32 1t3d n ALA 204 N -3.95 1.79 -0.64 3.20 0.00 -1.26 -2.29 120.51 117.37 1t3d n ALA 204 Ca 0.09 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1t3d n ALA 204 Cb 0.53 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1t3d n ALA 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t3d n GLY 205 N 2.13 1.71 3.77 0.00 0.00 -0.24 -0.89 105.19 111.67 1t3d n GLY 205 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1t3d n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3d s ALA 206 N -3.61 3.60 -0.14 4.61 0.00 -0.97 -4.26 121.76 120.99 1t3d s ALA 206 Ca 0.00 1.55 -0.00 0.00 0.00 0.00 0.00 51.96 53.51 1t3d s ALA 206 Cb 0.00 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 1t3d s ALA 206 CO 0.00 -1.02 -0.14 0.15 0.00 0.00 0.00 175.76 174.76 1t3d s LYS 207 N -1.80 3.33 -0.15 0.00 3.01 0.10 -1.18 119.74 123.04 1t3d s LYS 207 Ca 0.54 -0.71 0.00 0.00 -1.01 0.00 0.00 55.97 54.80 1t3d s LYS 207 Cb -0.46 -2.64 0.03 0.00 -1.01 0.00 0.00 37.83 33.75 1t3d s LYS 207 CO 0.60 0.14 -0.13 0.42 0.51 0.00 0.00 175.35 176.88 1t3d s ILE 208 N 0.53 1.56 -0.00 2.17 1.01 -0.25 0.04 121.20 126.26 1t3d s ILE 208 Ca -0.09 -0.67 0.07 0.00 0.00 0.00 0.00 60.65 59.96 1t3d s ILE 208 Cb -0.16 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.81 1t3d s ILE 208 CO 0.04 0.42 -0.21 -0.76 0.00 0.00 0.00 174.94 174.43 1t3d s LEU 209 N 1.49 2.06 0.00 2.97 1.43 -0.64 -0.83 118.68 125.16 1t3d s LEU 209 Ca 0.04 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1t3d s LEU 209 Cb -0.13 -1.06 0.00 0.00 0.03 0.00 0.00 46.19 45.03 1t3d s LEU 209 CO -0.10 0.24 0.00 0.61 0.23 0.00 0.00 176.35 177.33 1t3d n GLY 210 N 2.44 -0.44 3.22 -3.19 0.00 -0.19 -4.66 105.19 102.37 1t3d n GLY 210 Ca -0.16 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.66 1t3d n GLY 210 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1t3d n ASN 211 N -0.88 4.71 -4.34 1.61 5.15 -1.20 -1.54 115.26 118.77 1t3d n ASN 211 Ca 0.00 -2.93 -0.20 0.00 -0.60 0.00 0.00 54.58 50.84 1t3d n ASN 211 Cb 0.00 -1.65 -0.11 0.00 -0.53 0.00 0.00 39.78 37.49 1t3d n ASN 211 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1t3d s ILE 212 N 2.92 1.80 -0.02 -1.44 -4.36 -1.26 -4.93 121.20 113.91 1t3d s ILE 212 Ca 0.48 -2.04 -0.15 0.00 -0.26 0.00 0.00 60.65 58.68 1t3d s ILE 212 Cb 0.06 -1.92 -0.05 0.00 1.25 0.00 0.00 42.46 41.80 1t3d s ILE 212 CO 0.01 -0.43 0.41 -1.61 0.24 0.00 0.00 174.94 173.56 1t3d s GLU 213 N -3.13 3.98 -0.33 0.37 0.41 -1.26 -0.93 118.70 117.81 1t3d s GLU 213 Ca 0.19 0.40 0.02 0.00 -0.41 0.00 0.00 54.97 55.16 1t3d s GLU 213 Cb -0.04 -3.26 0.08 0.00 -1.78 0.00 0.00 34.13 29.14 1t3d s GLU 213 CO 0.07 0.61 0.03 0.08 -0.49 0.00 0.00 175.26 175.56 1t3d s VAL 214 N -0.80 2.53 0.99 2.63 1.01 -0.23 -0.99 120.40 125.54 1t3d s VAL 214 Ca 0.24 -1.99 -0.12 0.00 0.00 0.00 0.00 61.98 60.11 1t3d s VAL 214 Cb -0.16 -2.69 0.18 0.00 0.00 0.00 0.00 36.38 33.71 1t3d s VAL 214 CO 0.13 -0.41 1.09 -0.83 0.00 0.00 0.00 175.10 175.08 1t3d s GLY 215 N 1.16 1.58 0.52 4.51 0.00 -0.13 -1.55 107.32 113.41 1t3d s GLY 215 Ca 0.03 -0.27 -0.23 0.00 0.00 0.00 0.00 44.72 44.25 1t3d s GLY 215 CO -0.06 0.32 1.39 0.54 0.00 0.00 0.00 173.10 175.29 1t3d n ARG 216 N -4.16 1.88 -0.83 2.90 1.74 -1.26 -1.76 116.66 115.17 1t3d n ARG 216 Ca 0.05 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 57.82 1t3d n ARG 216 Cb 0.57 -2.60 0.00 0.00 -1.02 0.00 0.00 32.46 29.41 1t3d n ARG 216 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1t3d n GLY 217 N 0.69 0.28 3.78 -0.13 0.00 -0.44 -0.13 105.19 109.24 1t3d n GLY 217 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1t3d n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3d s ALA 218 N -1.76 2.49 -0.19 4.61 0.00 -0.72 -3.85 121.76 122.34 1t3d s ALA 218 Ca 0.00 0.39 0.01 0.00 0.00 0.00 0.00 51.96 52.37 1t3d s ALA 218 Cb 0.00 -3.27 0.03 0.00 0.00 0.00 0.00 23.12 19.87 1t3d s ALA 218 CO 0.00 -1.31 -0.17 0.21 0.00 0.00 0.00 175.76 174.48 1t3d s LYS 219 N -4.41 2.74 -0.44 0.00 2.20 0.12 -4.22 119.74 115.72 1t3d s LYS 219 Ca 0.64 -0.90 -0.16 0.00 -0.36 0.00 0.00 55.97 55.19 1t3d s LYS 219 Cb -0.18 -2.58 0.04 0.00 -1.51 0.00 0.00 37.83 33.60 1t3d s LYS 219 CO 0.46 -0.29 0.41 0.42 -0.36 0.00 0.00 175.35 175.99 1t3d s ILE 220 N 1.28 5.15 0.60 5.43 -1.09 -1.26 -0.97 121.20 130.33 1t3d s ILE 220 Ca 0.02 -0.66 -0.19 0.00 -2.23 0.00 0.00 60.65 57.60 1t3d s ILE 220 Cb -0.14 -4.07 -0.05 0.00 -1.58 0.00 0.00 42.46 36.62 1t3d s ILE 220 CO -0.11 -0.48 1.03 0.61 -1.23 0.00 0.00 174.94 174.75 1t3d n GLY 221 N 5.16 -0.15 3.70 6.18 0.00 -0.22 -0.74 105.19 119.11 1t3d n GLY 221 Ca -0.10 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1t3d n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3d n ALA 222 N -1.67 1.26 -1.00 4.61 0.00 -1.26 -2.72 120.51 119.72 1t3d n ALA 222 Ca 0.14 0.34 -0.00 0.00 0.00 0.00 0.00 53.44 53.91 1t3d n ALA 222 Cb 0.47 -2.25 -0.00 0.00 0.00 0.00 0.00 19.45 17.67 1t3d n ALA 222 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t3d n GLY 223 N 0.79 0.36 3.82 0.00 0.00 -0.07 -4.83 105.19 105.26 1t3d n GLY 223 Ca 0.05 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1t3d n GLY 223 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1t3d s SER 224 N -2.02 6.20 -0.25 1.61 0.01 -1.10 -4.72 113.70 113.43 1t3d s SER 224 Ca 0.00 1.75 0.03 0.00 1.31 0.00 0.00 55.95 59.03 1t3d s SER 224 Cb 0.00 -2.53 0.06 0.00 0.21 0.00 0.00 66.02 63.76 1t3d s SER 224 CO 0.00 -0.88 -0.10 -0.69 0.41 0.00 0.00 173.24 171.98 1t3d s VAL 225 N -2.42 2.05 -0.32 3.43 1.01 -0.65 -0.73 120.40 122.78 1t3d s VAL 225 Ca 0.63 -1.54 -0.09 0.00 0.00 0.00 0.00 61.98 60.98 1t3d s VAL 225 Cb -0.14 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.07 1t3d s VAL 225 CO 0.31 -0.02 0.14 -0.69 0.00 0.00 0.00 175.10 174.84 1t3d s VAL 226 N 1.16 4.36 -0.22 2.92 1.01 0.11 0.11 120.40 129.85 1t3d s VAL 226 Ca -0.08 -0.61 0.07 0.00 0.00 0.00 0.00 61.98 61.36 1t3d s VAL 226 Cb -0.20 -3.28 -0.08 0.00 0.00 0.00 0.00 36.38 32.83 1t3d s VAL 226 CO -0.05 0.01 0.24 0.18 0.00 0.00 0.00 175.10 175.48 1t3d n LEU 227 N 4.94 0.22 -4.25 3.92 4.77 -1.26 -1.62 117.00 123.72 1t3d n LEU 227 Ca -0.14 -0.35 -0.18 0.00 -0.03 0.00 0.00 56.01 55.31 1t3d n LEU 227 Cb 0.48 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 1t3d n LEU 227 CO 0.33 0.05 -0.45 -1.10 -1.33 0.00 0.00 177.39 174.90 1t3d s GLN 228 N -1.87 1.05 0.32 3.23 -0.21 -1.26 -4.95 119.66 115.97 1t3d s GLN 228 Ca 0.01 -1.26 -0.28 0.00 0.02 0.00 0.00 55.36 53.85 1t3d s GLN 228 Cb 0.05 -0.93 -0.13 0.00 1.00 0.00 0.00 33.01 32.99 1t3d s GLN 228 CO 0.27 0.18 1.13 -2.30 -2.12 0.00 0.00 175.29 172.45 1t3d n PRO 229 N 0.48 1.70 -3.80 2.91 -0.02 -1.26 -4.89 135.00 130.12 1t3d n PRO 229 Ca -0.15 0.60 -0.36 0.00 -2.02 0.00 0.00 63.50 61.56 1t3d n PRO 229 Cb 0.57 -2.07 -0.13 0.00 -0.02 0.00 0.00 33.50 31.85 1t3d n PRO 229 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1t3d s VAL 230 N -1.09 4.18 0.73 -1.45 1.01 -0.16 -4.97 120.40 118.65 1t3d s VAL 230 Ca 0.57 -0.22 -0.14 0.00 0.00 0.00 0.00 61.98 62.20 1t3d s VAL 230 Cb -0.63 -2.94 0.04 0.00 0.00 0.00 0.00 36.38 32.84 1t3d s VAL 230 CO 0.61 0.36 1.15 -2.84 0.00 0.00 0.00 175.10 174.38 1t3d s PRO 231 N 1.53 2.29 0.47 2.72 0.02 -1.26 -0.95 135.00 139.82 1t3d s PRO 231 Ca 0.06 1.53 -0.22 0.00 0.02 0.00 0.00 61.00 62.39 1t3d s PRO 231 Cb -0.15 -1.87 -0.10 0.00 0.02 0.00 0.00 34.50 32.40 1t3d s PRO 231 CO 0.03 -1.67 0.83 -2.30 -0.33 0.00 0.00 177.00 173.55 1t3d n PRO 232 N -2.85 0.97 -3.85 5.54 -0.02 -1.26 -3.06 135.00 130.46 1t3d n PRO 232 Ca 0.12 0.36 -0.29 0.00 -2.02 0.00 0.00 63.50 61.66 1t3d n PRO 232 Cb 0.51 -1.89 0.03 0.00 -0.02 0.00 0.00 33.50 32.13 1t3d n PRO 232 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1t3d n HIS 233 N -0.96 -2.33 -4.34 6.00 8.25 0.81 -4.83 115.22 117.81 1t3d n HIS 233 Ca 0.11 0.89 -0.22 0.00 -0.26 0.00 0.00 57.72 58.24 1t3d n HIS 233 Cb 0.42 -4.04 -0.11 0.00 1.12 0.00 0.00 29.99 27.38 1t3d n HIS 233 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1t3d s THR 234 N -3.28 1.87 -0.22 1.59 2.01 -1.17 -4.21 115.64 112.22 1t3d s THR 234 Ca 0.65 -1.97 -0.03 0.00 0.31 0.00 0.00 61.69 60.65 1t3d s THR 234 Cb -0.32 -1.90 -0.00 0.00 0.01 0.00 0.00 72.50 70.29 1t3d s THR 234 CO 0.80 -0.33 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.45 1t3d s THR 235 N -2.12 3.24 -0.08 -0.82 2.01 -0.74 0.11 115.64 117.24 1t3d s THR 235 Ca 0.17 -0.58 -0.00 0.00 0.31 0.00 0.00 61.69 61.59 1t3d s THR 235 Cb -0.05 -2.49 -0.03 0.00 0.01 0.00 0.00 72.50 69.94 1t3d s THR 235 CO 0.07 0.41 -0.04 0.00 -0.69 0.00 0.00 174.62 174.37 1t3d s ALA 236 N 1.45 3.10 -0.03 7.40 0.00 -0.15 -0.68 121.76 132.85 1t3d s ALA 236 Ca 0.05 -0.86 -0.30 0.00 0.00 0.00 0.00 51.96 50.86 1t3d s ALA 236 Cb -0.14 -1.33 0.07 0.00 0.00 0.00 0.00 23.12 21.72 1t3d s ALA 236 CO -0.04 0.57 0.66 0.00 0.00 0.00 0.00 175.76 176.95 1t3d s ALA 237 N -0.82 -1.72 0.00 0.00 0.00 -0.92 -1.06 121.76 117.24 1t3d s ALA 237 Ca 0.12 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.29 1t3d s ALA 237 Cb -0.11 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.09 1t3d s ALA 237 CO 0.02 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.78 1t3d n GLY 238 N 0.80 1.46 2.86 0.00 0.00 -1.26 -2.10 105.19 106.95 1t3d n GLY 238 Ca -0.19 -2.18 -0.30 0.00 0.00 0.00 0.00 46.02 43.35 1t3d n GLY 238 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t3d s VAL 239 N -1.50 1.37 0.85 1.61 1.01 -1.26 -1.63 120.40 120.84 1t3d s VAL 239 Ca 0.00 -1.55 -0.12 0.00 0.00 0.00 0.00 61.98 60.31 1t3d s VAL 239 Cb 0.00 -1.92 0.10 0.00 0.00 0.00 0.00 36.38 34.56 1t3d s VAL 239 CO 0.00 -0.49 1.12 -2.16 0.00 0.00 0.00 175.10 173.56 1t3d s PRO 240 N 1.39 1.67 0.32 2.72 0.04 -1.26 -5.00 135.00 134.88 1t3d s PRO 240 Ca 0.06 0.46 -0.28 0.00 0.04 0.00 0.00 61.00 61.29 1t3d s PRO 240 Cb -0.18 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.38 1t3d s PRO 240 CO -0.15 -1.87 1.08 0.00 0.04 0.00 0.00 177.00 176.10 1t3d s ALA 241 N -3.23 3.30 0.14 8.56 0.00 0.12 -4.83 121.76 125.81 1t3d s ALA 241 Ca 0.62 0.84 0.04 0.00 0.00 0.00 0.00 51.96 53.46 1t3d s ALA 241 Cb -0.14 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 1t3d s ALA 241 CO 0.54 -0.19 -0.10 -0.98 0.00 0.00 0.00 175.76 175.03 1t3d s ARG 242 N -1.80 1.02 0.10 0.00 1.70 -0.89 -4.84 118.95 114.24 1t3d s ARG 242 Ca 0.49 -1.42 -0.31 0.00 -0.47 0.00 0.00 55.73 54.02 1t3d s ARG 242 Cb -0.29 -0.56 -0.08 0.00 -0.57 0.00 0.00 34.95 33.45 1t3d s ARG 242 CO 0.37 0.06 1.55 0.42 -1.08 0.00 0.00 175.30 176.62 1t3d s ILE 243 N -3.34 3.03 0.00 4.99 -1.09 -1.26 -2.17 121.20 121.37 1t3d s ILE 243 Ca 0.15 0.62 0.00 0.00 -2.23 0.00 0.00 60.65 59.20 1t3d s ILE 243 Cb 0.03 -3.40 0.00 0.00 -1.58 0.00 0.00 42.46 37.51 1t3d s ILE 243 CO -0.00 0.02 0.43 1.33 -1.23 0.00 0.00 174.94 175.49 1t3d n VAL 244 N 4.35 0.04 -3.41 2.92 0.24 0.14 -4.97 118.33 117.64 1t3d n VAL 244 Ca 0.14 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 1t3d n VAL 244 Cb 0.41 1.17 0.00 0.00 -1.47 0.00 0.00 33.84 33.95 1t3d n VAL 244 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1t3d n GLY 245 N -0.02 -1.19 2.90 7.63 0.00 -1.22 -4.19 105.19 109.10 1t3d n GLY 245 Ca 0.00 -0.95 -0.14 0.00 0.00 0.00 0.00 46.02 44.93 1t3d n GLY 245 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t3d s LYS 246 N -0.83 0.18 0.72 1.61 -2.85 -1.23 -1.79 119.74 115.55 1t3d s LYS 246 Ca 0.00 -0.07 -0.16 0.00 -1.00 0.00 0.00 55.97 54.74 1t3d s LYS 246 Cb 0.00 -0.18 0.03 0.00 -2.06 0.00 0.00 37.83 35.62 1t3d s LYS 246 CO 0.00 0.04 1.23 -2.14 0.10 0.00 0.00 175.35 174.58 1t3d s PRO 247 N -0.01 2.18 0.00 1.78 0.02 -1.21 -4.82 135.00 132.94 1t3d s PRO 247 Ca 0.00 1.85 0.13 0.00 0.02 0.00 0.00 61.00 63.01 1t3d s PRO 247 Cb -0.01 -1.83 0.78 0.00 0.02 0.00 0.00 34.50 33.46 1t3d s PRO 247 CO -0.00 -1.82 1.42 -0.25 -0.33 0.00 0.00 177.00 176.01 1t3d n ASP 248 N -2.56 0.00 -3.90 2.53 8.00 -1.26 -4.82 116.55 114.54 1t3d n ASP 248 Ca 0.14 -1.36 -0.10 0.00 0.71 0.00 0.00 54.79 54.18 1t3d n ASP 248 Cb 0.50 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.50 1t3d n ASP 248 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1t3d s SER 249 N -1.52 0.11 0.44 -2.24 1.04 -1.26 -5.04 113.70 105.23 1t3d s SER 249 Ca 0.20 -0.40 0.12 0.00 0.48 0.00 0.00 55.95 56.35 1t3d s SER 249 Cb 0.09 0.22 0.97 0.00 0.10 0.00 0.00 66.02 67.40 1t3d s SER 249 CO 0.15 -0.45 2.01 -0.78 0.98 0.00 0.00 173.24 175.16 1t3d h ASP 250 N 3.92 0.15 -2.63 7.02 1.82 -1.91 -3.35 116.42 121.43 1t3d h ASP 250 Ca -0.32 -0.02 -0.60 0.00 -0.39 0.00 0.00 57.03 55.71 1t3d h ASP 250 Cb 1.19 -0.04 -0.39 0.00 0.68 0.00 0.00 39.33 40.77 1t3d h ASP 250 CO 0.46 0.23 -0.87 -0.54 -1.61 0.00 0.00 179.24 176.92 1t3d s LYS 251 N -4.90 1.17 0.59 0.28 1.02 -1.26 -4.04 119.74 112.60 1t3d s LYS 251 Ca -0.05 -2.22 0.28 0.00 0.02 0.00 0.00 55.97 54.00 1t3d s LYS 251 Cb 0.16 -1.85 1.63 0.00 -0.52 0.00 0.00 37.83 37.26 1t3d s LYS 251 CO 0.71 -1.33 2.09 -1.35 -0.92 0.00 0.00 175.35 174.55 1t3d h PRO 252 N 5.87 0.00 -1.85 -1.68 0.11 -1.65 -3.32 132.00 129.49 1t3d h PRO 252 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1t3d h PRO 252 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1t3d h PRO 252 CO 0.43 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.09 1t3d n SER 253 N -3.84 0.00 0.00 -2.05 3.41 -0.40 -4.49 113.62 106.25 1t3d n SER 253 Ca 0.02 -0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 1t3d n SER 253 Cb 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 1t3d n SER 253 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1t3d n ASP 255 N 1.08 0.00 0.00 4.04 8.00 -1.25 -4.66 116.55 123.76 1t3d n ASP 255 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1t3d n ASP 255 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1t3d n ASP 255 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1t3d n ASP 257 N 0.00 0.00 -0.09 -2.24 2.03 -1.26 -5.14 116.55 109.85 1t3d n ASP 257 Ca 0.00 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.44 1t3d n ASP 257 Cb 0.00 0.00 0.39 0.00 -0.72 0.00 0.00 41.12 40.79 1t3d n ASP 257 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1t3d n GLN 258 N 0.00 0.35 -1.81 -0.67 1.13 -1.26 -4.89 117.38 110.24 1t3d n GLN 258 Ca 0.00 -0.18 -0.41 0.00 -1.94 0.00 0.00 57.00 54.47 1t3d n GLN 258 Cb 0.00 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 28.84 1t3d n GLN 258 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 1t3d s HIS 259 N -2.77 2.70 -0.32 1.08 3.76 -1.26 -4.70 115.29 113.78 1t3d s HIS 259 Ca 0.18 0.97 0.17 0.00 -0.15 0.00 0.00 55.06 56.23 1t3d s HIS 259 Cb 0.19 -4.03 0.47 0.00 1.11 0.00 0.00 32.58 30.31 1t3d s HIS 259 CO 0.59 -3.27 1.03 1.97 -0.85 0.00 0.00 174.74 174.22 1t3d n PHE 260 N 1.43 1.57 0.27 1.40 1.16 -1.26 -4.51 117.46 117.53 1t3d n PHE 260 Ca 0.05 -2.61 0.18 0.00 -1.87 0.00 0.00 57.45 53.19 1t3d n PHE 260 Cb 0.38 -0.30 0.92 0.00 -1.61 0.00 0.00 39.48 38.87 1t3d n PHE 260 CO 0.00 0.00 0.00 -2.95 -1.87 0.00 0.00 176.76 171.94 1t3d h ASN 261 N 2.78 0.00 0.00 5.98 -1.07 -1.94 -3.48 115.58 117.86 1t3d h ASN 261 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.34 1t3d h ASN 261 Cb 1.20 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.45 1t3d h ASN 261 CO 0.47 0.00 0.00 0.61 0.07 0.00 0.00 177.43 178.58