#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dpm h LEU 34 N 0.00 -0.19 -1.57 2.46 5.85 -1.99 0.10 115.31 119.98 3dpm h LEU 34 Ca 0.00 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 3dpm h LEU 34 Cb 0.00 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3dpm h LEU 34 CO 0.00 -0.06 0.01 1.62 -0.34 0.00 0.00 178.44 179.68 3dpm h VAL 35 N 0.07 1.12 -0.08 1.05 3.04 -1.91 -1.95 116.25 117.59 3dpm h VAL 35 Ca 0.17 -0.46 -0.08 0.00 -1.01 0.00 0.00 66.70 65.33 3dpm h VAL 35 Cb 0.25 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 30.49 3dpm h VAL 35 CO -0.31 0.15 -0.24 0.00 -1.01 0.00 0.00 177.57 176.16 3dpm h LYS 37 N -0.17 0.62 -0.53 0.00 1.57 -0.56 -0.61 116.57 116.89 3dpm h LYS 37 Ca -0.01 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3dpm h LYS 37 Cb 0.86 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 3dpm h LYS 37 CO 0.05 0.41 0.25 -0.91 -0.57 0.00 0.00 179.45 178.68 3dpm h ASN 38 N 0.64 0.70 -0.42 0.86 2.35 -1.37 -0.61 115.58 117.72 3dpm h ASN 38 Ca 0.31 -0.14 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 3dpm h ASN 38 Cb 0.25 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 3dpm h ASN 38 CO -0.21 0.64 -0.02 0.00 -1.65 0.00 0.00 177.43 176.19 3dpm h ALA 39 N 1.09 1.04 -0.42 -0.83 0.00 -0.79 0.13 119.26 119.47 3dpm h ALA 39 Ca 0.18 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 3dpm h ALA 39 Cb 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3dpm h ALA 39 CO -0.02 0.60 -0.08 -0.07 0.00 0.00 0.00 179.25 179.67 3dpm h LEU 40 N 0.78 0.79 -0.51 0.00 3.38 -0.87 0.28 115.31 119.16 3dpm h LEU 40 Ca 0.15 -0.35 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 3dpm h LEU 40 Cb 0.50 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 3dpm h LEU 40 CO 0.02 0.96 0.11 -0.61 0.09 0.00 0.00 178.44 179.01 3dpm h GLN 41 N 0.62 0.83 0.00 1.13 -0.00 -0.78 -0.75 115.11 116.16 3dpm h GLN 41 Ca 0.11 -0.21 -0.13 0.00 -0.00 0.00 0.00 58.65 58.42 3dpm h GLN 41 Cb 0.60 -0.10 -0.02 0.00 0.00 0.00 0.00 27.48 27.96 3dpm h GLN 41 CO 0.04 0.80 -0.64 -0.44 0.00 0.00 0.00 178.83 178.59 3dpm h ASP 42 N 0.71 0.00 -0.46 -0.69 3.32 -0.62 -2.61 116.42 116.07 3dpm h ASP 42 Ca 0.16 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.13 3dpm h ASP 42 Cb 0.36 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 3dpm h ASP 42 CO 0.00 0.64 -0.01 0.25 -1.72 0.00 0.00 179.24 178.40 3dpm h LEU 43 N 0.00 0.80 -1.64 1.55 6.46 -0.20 -1.67 115.31 120.62 3dpm h LEU 43 Ca -0.01 -0.32 -0.03 0.00 -0.12 0.00 0.00 57.88 57.41 3dpm h LEU 43 Cb 1.16 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.87 3dpm h LEU 43 CO 0.08 0.92 -0.12 0.77 -0.62 0.00 0.00 178.44 179.47 3dpm h SER 44 N 0.66 0.07 0.23 1.25 4.64 -0.93 0.16 113.55 119.63 3dpm h SER 44 Ca 0.13 -0.01 -0.21 0.00 -0.47 0.00 0.00 61.79 61.23 3dpm h SER 44 Cb 0.52 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 3dpm h SER 44 CO 0.03 0.20 -0.83 0.15 -0.87 0.00 0.00 176.83 175.51 3dpm h PHE 45 N 0.07 0.65 -0.45 4.77 3.57 -1.06 -1.92 116.94 122.57 3dpm h PHE 45 Ca 0.02 -0.32 -0.05 0.00 3.53 0.00 0.00 57.97 61.14 3dpm h PHE 45 Cb 0.27 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 3dpm h PHE 45 CO 0.00 1.11 0.07 -0.07 -2.23 0.00 0.00 178.31 177.19 3dpm h LEU 46 N 0.29 0.72 -0.81 0.59 3.38 -0.45 -1.45 115.31 117.58 3dpm h LEU 46 Ca -0.06 -0.26 0.07 0.00 0.09 0.00 0.00 57.88 57.73 3dpm h LEU 46 Cb 1.44 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.93 3dpm h LEU 46 CO 0.15 0.80 0.48 -0.08 0.09 0.00 0.00 178.44 179.88 3dpm h GLU 47 N 0.61 0.82 -0.57 1.13 4.81 -0.94 -1.96 114.58 118.49 3dpm h GLU 47 Ca 0.14 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.21 3dpm h GLU 47 Cb 0.38 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3dpm h GLU 47 CO 0.01 0.54 -0.07 1.25 -0.73 0.00 0.00 179.01 180.01 3dpm h HIS 48 N 0.85 1.17 -0.32 0.92 2.76 -1.04 -2.86 115.15 116.63 3dpm h HIS 48 Ca 0.37 -0.23 0.03 0.00 -2.20 0.00 0.00 60.37 58.34 3dpm h HIS 48 Cb 0.25 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 28.90 3dpm h HIS 48 CO -0.05 1.06 0.22 -0.07 -1.30 0.00 0.00 177.93 177.79 3dpm h LEU 49 N 0.95 0.29 -0.32 0.26 3.38 -0.52 -0.58 115.31 118.76 3dpm h LEU 49 Ca 0.15 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3dpm h LEU 49 Cb 0.65 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3dpm h LEU 49 CO 0.04 0.20 0.00 -0.07 0.09 0.00 0.00 178.44 178.70 3dpm h LEU 50 N 0.33 0.00 -0.50 1.67 3.38 -1.22 -2.41 115.31 116.57 3dpm h LEU 50 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3dpm h LEU 50 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3dpm h LEU 50 CO -0.03 0.00 -0.53 0.00 0.09 0.00 0.00 178.44 177.97 3dpm n GLN 51 N -2.31 0.67 -0.04 1.13 1.13 -0.25 -4.15 117.38 113.55 3dpm n GLN 51 Ca 0.04 -0.50 -0.08 0.00 -1.94 0.00 0.00 57.00 54.53 3dpm n GLN 51 Cb 0.35 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.18 3dpm n GLN 51 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3dpm n VAL 52 N -0.73 0.48 -1.59 5.09 0.31 -1.07 -4.90 118.33 115.92 3dpm n VAL 52 Ca 0.08 -0.15 0.05 0.00 -0.01 0.00 0.00 64.34 64.32 3dpm n VAL 52 Cb 0.39 -1.24 0.09 0.00 -0.91 0.00 0.00 33.84 32.16 3dpm n VAL 52 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3dpm n LYS 53 N -3.10 0.73 -3.38 5.55 4.76 -0.92 -4.94 118.16 116.86 3dpm n LYS 53 Ca -0.16 -2.02 -0.45 0.00 -2.87 0.00 0.00 58.31 52.81 3dpm n LYS 53 Cb 0.64 -1.01 -0.05 0.00 -1.84 0.00 0.00 35.03 32.77 3dpm n LYS 53 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3dpm s TYR 54 N -1.60 3.50 0.31 2.13 5.04 -1.25 -4.28 117.35 121.20 3dpm s TYR 54 Ca 0.21 -1.77 0.02 0.00 -2.44 0.00 0.00 57.07 53.09 3dpm s TYR 54 Cb 0.20 -3.72 0.59 0.00 0.35 0.00 0.00 41.96 39.38 3dpm s TYR 54 CO -0.01 -0.99 1.90 0.00 -1.34 0.00 0.00 175.55 175.11 3dpm h ALA 55 N 8.23 1.58 -0.23 3.97 0.00 -1.44 -2.67 119.26 128.69 3dpm h ALA 55 Ca -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3dpm h ALA 55 Cb 1.06 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3dpm h ALA 55 CO 0.87 0.26 0.01 -0.35 0.00 0.00 0.00 179.25 180.04 3dpm n PRO 56 N -4.51 2.51 0.13 0.00 -0.04 -1.26 -4.41 135.00 127.41 3dpm n PRO 56 Ca 0.14 -1.24 -0.14 0.00 -0.04 0.00 0.00 63.50 62.22 3dpm n PRO 56 Cb 0.26 -1.79 -0.07 0.00 -0.04 0.00 0.00 33.50 31.86 3dpm n PRO 56 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3dpm h LYS 57 N 1.54 -0.58 -0.88 0.54 3.64 -1.82 0.41 116.57 119.41 3dpm h LYS 57 Ca 0.01 0.04 0.14 0.00 -1.27 0.00 0.00 60.65 59.57 3dpm h LYS 57 Cb 1.11 0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 32.99 3dpm h LYS 57 CO 0.20 -0.39 0.57 1.15 -2.27 0.00 0.00 179.45 178.72 3dpm h THR 58 N -0.60 0.84 -0.28 1.00 2.02 -1.86 -1.24 112.91 112.80 3dpm h THR 58 Ca 0.02 -0.24 -0.17 0.00 0.77 0.00 0.00 66.41 66.80 3dpm h THR 58 Cb 0.62 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 3dpm h THR 58 CO -0.19 0.13 -0.50 -0.25 0.37 0.00 0.00 175.52 175.07 3dpm h TRP 59 N 0.69 0.98 -0.01 3.16 2.91 -1.62 -2.86 115.95 119.21 3dpm h TRP 59 Ca 0.44 -0.33 -0.10 0.00 1.13 0.00 0.00 58.89 60.03 3dpm h TRP 59 Cb 0.71 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 29.15 3dpm h TRP 59 CO -0.00 1.13 -0.45 0.87 -1.03 0.00 0.00 178.44 178.95 3dpm h LYS 60 N 0.62 0.02 -0.29 2.65 1.79 0.15 0.29 116.57 121.79 3dpm h LYS 60 Ca 0.02 -0.01 -0.18 0.00 -2.18 0.00 0.00 60.65 58.31 3dpm h LYS 60 Cb 1.09 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.73 3dpm h LYS 60 CO 0.11 0.47 -0.51 0.93 -1.08 0.00 0.00 179.45 179.36 3dpm h GLU 61 N 0.01 0.84 0.10 3.15 5.08 -1.20 -2.18 114.58 120.37 3dpm h GLU 61 Ca -0.00 -0.51 -0.35 0.00 -1.00 0.00 0.00 59.36 57.50 3dpm h GLU 61 Cb 0.81 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 3dpm h GLU 61 CO 0.06 1.14 -1.93 1.04 -1.00 0.00 0.00 179.01 178.32 3dpm n GLN 62 N -4.01 0.73 0.08 2.33 6.02 -1.09 -1.89 117.38 119.55 3dpm n GLN 62 Ca -0.04 0.27 -0.16 0.00 -0.01 0.00 0.00 57.00 57.06 3dpm n GLN 62 Cb 0.61 -1.73 -0.14 0.00 1.02 0.00 0.00 30.24 30.00 3dpm n GLN 62 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 3dpm h TYR 63 N 0.06 0.48 0.00 1.08 3.20 -1.08 -3.36 116.97 117.34 3dpm h TYR 63 Ca -0.39 -0.35 0.00 0.00 3.14 0.00 0.00 58.73 61.13 3dpm h TYR 63 Cb 2.03 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 40.28 3dpm h TYR 63 CO 0.06 1.33 -1.14 1.28 -1.64 0.00 0.00 178.16 178.06 3dpm n LEU 64 N -3.49 0.63 -0.81 2.82 4.77 -0.87 -4.96 117.00 115.08 3dpm n LEU 64 Ca -0.13 -0.36 -0.10 0.00 -0.03 0.00 0.00 56.01 55.39 3dpm n LEU 64 Cb 1.04 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 42.09 3dpm n LEU 64 CO 0.52 0.16 -0.10 0.61 -1.33 0.00 0.00 177.39 177.25 3dpm n GLY 65 N 1.43 1.03 3.78 -0.72 0.00 -0.79 -4.97 105.19 104.94 3dpm n GLY 65 Ca 0.02 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 3dpm n GLY 65 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3dpm s TRP 66 N -2.39 3.18 -0.10 1.61 -0.00 -0.90 -4.97 118.94 115.38 3dpm s TRP 66 Ca 0.00 1.61 -0.02 0.00 -0.00 0.00 0.00 56.10 57.70 3dpm s TRP 66 Cb 0.00 -3.21 0.04 0.00 -0.00 0.00 0.00 33.47 30.29 3dpm s TRP 66 CO 0.00 -0.87 0.02 0.34 -0.00 0.00 0.00 176.95 176.44 3dpm s ASP 67 N -1.44 1.89 0.02 5.86 2.15 -1.26 -4.09 116.67 119.80 3dpm s ASP 67 Ca 0.58 -0.26 -0.09 0.00 0.43 0.00 0.00 52.55 53.21 3dpm s ASP 67 Cb -0.25 -0.45 -0.04 0.00 -0.30 0.00 0.00 42.92 41.88 3dpm s ASP 67 CO 0.31 -0.23 1.14 0.25 -0.17 0.00 0.00 175.17 176.47 3dpm h LEU 68 N 8.32 -0.39 -1.50 -1.34 5.85 -1.99 -1.47 115.31 122.79 3dpm h LEU 68 Ca -0.18 0.04 0.21 0.00 0.84 0.00 0.00 57.88 58.79 3dpm h LEU 68 Cb 1.12 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 42.22 3dpm h LEU 68 CO 0.27 -0.16 0.61 0.58 -0.34 0.00 0.00 178.44 179.40 3dpm h VAL 69 N -0.23 0.65 -0.03 1.05 2.07 -1.98 0.23 116.25 118.00 3dpm h VAL 69 Ca -0.01 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3dpm h VAL 69 Cb 0.21 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 3dpm h VAL 69 CO -0.04 0.07 -0.02 -0.61 0.02 0.00 0.00 177.57 176.99 3dpm h GLN 70 N 0.40 0.07 -0.71 1.57 4.15 -1.94 -1.51 115.11 117.13 3dpm h GLN 70 Ca 0.49 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.85 3dpm h GLN 70 Cb 1.23 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.89 3dpm h GLN 70 CO -0.19 0.46 0.34 0.77 -1.93 0.00 0.00 178.83 178.29 3dpm h SER 71 N -0.32 0.92 0.31 -0.69 0.02 -0.48 -1.53 113.55 111.78 3dpm h SER 71 Ca 0.01 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.82 3dpm h SER 71 Cb 0.44 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 3dpm h SER 71 CO 0.00 0.80 -0.27 -1.28 -1.14 0.00 0.00 176.83 174.94 3dpm h SER 72 N 0.99 -0.72 -0.51 3.07 0.87 -0.95 -0.43 113.55 115.87 3dpm h SER 72 Ca 0.24 0.06 0.09 0.00 -1.23 0.00 0.00 61.79 60.95 3dpm h SER 72 Cb 0.12 0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.29 3dpm h SER 72 CO -0.03 -0.40 0.35 0.58 -0.53 0.00 0.00 176.83 176.79 3dpm h VAL 73 N -0.60 0.89 -0.32 2.23 2.07 -1.08 0.11 116.25 119.55 3dpm h VAL 73 Ca -0.02 -0.10 -0.16 0.00 0.82 0.00 0.00 66.70 67.24 3dpm h VAL 73 Cb 0.54 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 30.87 3dpm h VAL 73 CO -0.03 0.05 -0.41 -1.28 0.02 0.00 0.00 177.57 175.92 3dpm h SER 74 N 0.30 0.92 -0.35 0.57 0.87 -0.57 -2.33 113.55 112.96 3dpm h SER 74 Ca 0.23 -0.49 -0.05 0.00 -1.23 0.00 0.00 61.79 60.25 3dpm h SER 74 Cb 0.53 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 3dpm h SER 74 CO -0.05 1.23 0.03 0.00 -0.53 0.00 0.00 176.83 177.51 3dpm h ALA 75 N 0.72 0.47 -0.81 6.23 0.00 0.57 -2.51 119.26 123.93 3dpm h ALA 75 Ca 0.04 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 54.83 3dpm h ALA 75 Cb 1.01 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 3dpm h ALA 75 CO 0.10 0.20 0.53 1.96 0.00 0.00 0.00 179.25 182.03 3dpm h GLN 76 N 0.42 0.70 -0.12 0.00 4.20 -1.01 -1.77 115.11 117.53 3dpm h GLN 76 Ca 0.10 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 3dpm h GLN 76 Cb 0.40 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 3dpm h GLN 76 CO 0.01 0.47 -0.00 1.96 -0.67 0.00 0.00 178.83 180.60 3dpm h GLN 77 N 0.73 0.21 -0.88 1.46 7.50 -1.10 -1.50 115.11 121.52 3dpm h GLN 77 Ca 0.38 -0.07 0.05 0.00 0.50 0.00 0.00 58.65 59.51 3dpm h GLN 77 Cb 0.49 -0.02 -0.05 0.00 0.05 0.00 0.00 27.48 27.95 3dpm h GLN 77 CO -0.15 0.46 0.58 0.87 -1.50 0.00 0.00 178.83 179.09 3dpm h LYS 78 N -0.06 1.01 0.22 1.46 1.57 -0.94 0.20 116.57 120.03 3dpm h LYS 78 Ca 0.03 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3dpm h LYS 78 Cb 0.36 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3dpm h LYS 78 CO 0.01 0.67 -0.10 -0.07 -0.57 0.00 0.00 179.45 179.38 3dpm h LEU 79 N 1.04 -0.25 -0.75 2.94 3.38 -1.24 -3.10 115.31 117.33 3dpm h LEU 79 Ca 0.37 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 3dpm h LEU 79 Cb 0.13 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3dpm h LEU 79 CO -0.13 0.14 0.07 0.03 0.09 0.00 0.00 178.44 178.65 3dpm h ARG 80 N -0.68 1.02 0.00 1.13 3.08 -1.08 -2.70 114.38 115.15 3dpm h ARG 80 Ca -0.03 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.74 3dpm h ARG 80 Cb 0.48 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.41 3dpm h ARG 80 CO 0.05 0.96 0.00 -2.37 -1.07 0.00 0.00 179.97 177.54 3dpm n THR 81 N -4.21 0.70 -3.09 2.04 5.66 0.69 -4.78 114.28 111.28 3dpm n THR 81 Ca 0.04 0.17 -0.39 0.00 -3.05 0.00 0.00 64.05 60.82 3dpm n THR 81 Cb 0.30 -0.93 -0.05 0.00 -1.55 0.00 0.00 70.33 68.10 3dpm n THR 81 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3dpm s GLN 82 N -2.69 4.41 -0.48 1.09 -1.52 -1.02 -5.01 119.66 114.44 3dpm s GLN 82 Ca 0.12 0.93 -0.28 0.00 -1.95 0.00 0.00 55.36 54.18 3dpm s GLN 82 Cb 0.10 -3.33 -0.00 0.00 -0.22 0.00 0.00 33.01 29.56 3dpm s GLN 82 CO 0.24 0.38 1.59 -1.21 -0.25 0.00 0.00 175.29 176.04 3dpm s GLU 83 N -0.34 3.25 -0.82 2.91 2.02 -1.26 -4.15 118.70 120.31 3dpm s GLU 83 Ca 0.35 0.83 -0.01 0.00 0.02 0.00 0.00 54.97 56.16 3dpm s GLU 83 Cb -0.20 -4.17 0.00 0.00 0.10 0.00 0.00 34.13 29.87 3dpm s GLU 83 CO 0.21 -1.98 0.60 0.09 0.02 0.00 0.00 175.26 174.21 3dpm n ASN 84 N 10.15 -4.85 -4.74 -0.19 5.03 -1.26 -4.87 115.26 114.53 3dpm n ASN 84 Ca 0.17 -0.96 -0.37 0.00 0.87 0.00 0.00 54.58 54.29 3dpm n ASN 84 Cb 0.49 -1.65 0.06 0.00 -1.02 0.00 0.00 39.78 37.65 3dpm n ASN 84 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 3dpm s PRO 85 N -4.90 2.77 0.45 3.52 0.04 -1.26 -5.06 135.00 130.56 3dpm s PRO 85 Ca 0.01 2.07 0.03 0.00 0.04 0.00 0.00 61.00 63.15 3dpm s PRO 85 Cb -0.00 -1.96 0.01 0.00 0.04 0.00 0.00 34.50 32.59 3dpm s PRO 85 CO 0.90 -1.43 0.64 -1.54 0.04 0.00 0.00 177.00 175.61 3dpm s SER 86 N -1.32 5.67 0.14 6.66 1.04 -1.26 -4.76 113.70 119.88 3dpm s SER 86 Ca 0.79 -0.03 -0.15 0.00 0.48 0.00 0.00 55.95 57.04 3dpm s SER 86 Cb -0.37 -1.13 0.02 0.00 0.10 0.00 0.00 66.02 64.64 3dpm s SER 86 CO 0.40 -0.78 1.71 0.74 0.98 0.00 0.00 173.24 176.30 3dpm h THR 87 N 0.45 1.19 -0.06 2.02 2.02 -1.96 -2.70 112.91 113.87 3dpm h THR 87 Ca -0.44 -0.55 -0.07 0.00 0.77 0.00 0.00 66.41 66.12 3dpm h THR 87 Cb 1.27 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 3dpm h THR 87 CO 0.53 0.21 -0.27 0.77 0.37 0.00 0.00 175.52 177.13 3dpm h SER 88 N 0.57 0.10 0.03 4.18 4.64 -1.95 -0.70 113.55 120.42 3dpm h SER 88 Ca 0.15 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3dpm h SER 88 Cb 0.14 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3dpm h SER 88 CO -0.02 0.38 -0.01 0.15 -0.87 0.00 0.00 176.83 176.46 3dpm h PHE 89 N 0.10 -0.03 -0.90 4.77 3.57 -1.90 0.25 116.94 122.78 3dpm h PHE 89 Ca 0.01 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.53 3dpm h PHE 89 Cb 0.53 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 3dpm h PHE 89 CO 0.00 0.08 0.60 0.00 -2.23 0.00 0.00 178.31 176.76 3dpm h GLN 91 N 1.21 1.23 -0.71 0.00 4.20 -0.68 -1.56 115.11 118.80 3dpm h GLN 91 Ca 0.33 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.95 3dpm h GLN 91 Cb -0.13 -0.27 -0.03 0.00 0.30 0.00 0.00 27.48 27.35 3dpm h GLN 91 CO -0.08 0.82 0.39 1.96 -0.67 0.00 0.00 178.83 181.25 3dpm h GLN 92 N 1.26 0.99 -0.66 1.46 4.20 -0.10 -1.43 115.11 120.82 3dpm h GLN 92 Ca 0.34 -0.12 -0.08 0.00 0.06 0.00 0.00 58.65 58.85 3dpm h GLN 92 Cb -0.13 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.43 3dpm h GLN 92 CO -0.07 0.74 0.10 0.28 -0.67 0.00 0.00 178.83 179.21 3dpm h VAL 93 N 0.97 1.26 -0.08 -0.54 2.07 -0.86 -0.42 116.25 118.65 3dpm h VAL 93 Ca 0.25 -1.05 -0.10 0.00 0.82 0.00 0.00 66.70 66.61 3dpm h VAL 93 Cb 0.04 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 3dpm h VAL 93 CO -0.04 0.39 -0.43 -0.07 0.02 0.00 0.00 177.57 177.44 3dpm h LEU 94 N 1.03 0.18 -0.47 2.57 3.38 -1.01 -0.94 115.31 120.04 3dpm h LEU 94 Ca 0.20 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.92 3dpm h LEU 94 Cb 0.45 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3dpm h LEU 94 CO 0.01 0.59 -0.63 0.00 0.09 0.00 0.00 178.44 178.51 3dpm h ALA 95 N 1.42 0.65 -0.35 1.53 0.00 -0.96 -2.26 119.26 119.29 3dpm h ALA 95 Ca 0.01 -0.55 -0.14 0.00 0.00 0.00 0.00 54.91 54.23 3dpm h ALA 95 Cb 0.82 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3dpm h ALA 95 CO 0.06 0.72 -0.34 -0.44 0.00 0.00 0.00 179.25 179.25 3dpm h ASP 96 N 0.36 0.82 0.38 0.00 5.19 -0.78 0.12 116.42 122.51 3dpm h ASP 96 Ca -0.01 -0.35 -0.01 0.00 -0.62 0.00 0.00 57.03 56.04 3dpm h ASP 96 Cb 1.19 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 40.46 3dpm h ASP 96 CO 0.11 1.09 -0.26 0.15 -3.12 0.00 0.00 179.24 177.21 3dpm h PHE 97 N 0.65 -0.69 -0.21 4.55 3.57 -1.03 -0.93 116.94 122.85 3dpm h PHE 97 Ca 0.07 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.53 3dpm h PHE 97 Cb 0.89 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.87 3dpm h PHE 97 CO 0.05 -0.40 -0.01 0.82 -2.23 0.00 0.00 178.31 176.54 3dpm h ILE 98 N -0.63 1.14 0.00 1.41 1.08 -1.33 -1.24 117.51 117.93 3dpm h ILE 98 Ca -0.04 -0.54 -0.02 0.00 -0.39 0.00 0.00 64.86 63.87 3dpm h ILE 98 Cb 0.53 1.00 -0.00 0.00 -3.07 0.00 0.00 36.82 35.28 3dpm h ILE 98 CO 0.02 0.18 -0.10 1.23 -0.69 0.00 0.00 178.15 178.80 3dpm h GLY 99 N 0.61 0.00 2.00 5.37 0.00 -0.20 -2.49 103.07 108.36 3dpm h GLY 99 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 3dpm h GLY 99 CO 0.01 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.22 3dpm h GLY 100 N 1.60 0.00 2.00 4.60 0.00 0.08 -1.25 103.07 110.10 3dpm h GLY 100 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3dpm h GLY 100 CO 0.01 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.59 3dpm n LEU 101 N -2.68 0.71 -3.86 3.11 4.77 -0.94 -4.36 117.00 113.75 3dpm n LEU 101 Ca -0.00 0.67 -0.24 0.00 -0.03 0.00 0.00 56.01 56.40 3dpm n LEU 101 Cb 0.16 -0.56 -0.00 0.00 -2.33 0.00 0.00 43.42 40.69 3dpm n LEU 101 CO 0.19 -0.54 -0.18 -3.20 -1.33 0.00 0.00 177.39 172.33 3dpm n ASN 102 N -2.27 -0.84 -3.92 -1.43 4.05 -0.47 -4.97 115.26 105.41 3dpm n ASN 102 Ca 0.02 -0.95 -0.26 0.00 0.45 0.00 0.00 54.58 53.84 3dpm n ASN 102 Cb 0.25 -3.37 -0.17 0.00 1.23 0.00 0.00 39.78 37.72 3dpm n ASN 102 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 3dpm s ASP 103 N -4.32 2.10 0.58 1.20 -1.08 -1.26 -4.89 116.67 109.01 3dpm s ASP 103 Ca 0.03 -0.30 0.37 0.00 -0.52 0.00 0.00 52.55 52.13 3dpm s ASP 103 Cb -0.01 -0.83 1.68 0.00 -1.46 0.00 0.00 42.92 42.30 3dpm s ASP 103 CO 0.86 -0.10 2.10 -0.26 0.52 0.00 0.00 175.17 178.29 3dpm h PHE 104 N 8.01 0.00 0.00 -5.34 -1.00 -1.93 -2.33 116.94 114.35 3dpm h PHE 104 Ca -0.30 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.48 3dpm h PHE 104 Cb 1.14 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.70 3dpm h PHE 104 CO 0.48 0.00 -0.86 0.72 -1.61 0.00 0.00 178.31 177.03 3dpm n HIS 105 N -3.08 0.24 -3.38 -0.55 8.25 -1.26 -4.82 115.22 110.62 3dpm n HIS 105 Ca -0.00 0.07 -0.41 0.00 -0.26 0.00 0.00 57.72 57.12 3dpm n HIS 105 Cb 0.24 -0.40 -0.09 0.00 1.12 0.00 0.00 29.99 30.85 3dpm n HIS 105 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dpm s ALA 106 N -3.14 3.50 0.35 -1.41 0.00 -0.88 -4.04 121.76 116.15 3dpm s ALA 106 Ca 0.06 -1.12 -0.14 0.00 0.00 0.00 0.00 51.96 50.76 3dpm s ALA 106 Cb 0.15 -2.83 0.04 0.00 0.00 0.00 0.00 23.12 20.47 3dpm s ALA 106 CO 0.77 -1.03 0.70 0.20 0.00 0.00 0.00 175.76 176.41 3dpm s GLY 107 N 1.73 0.52 -0.05 0.00 0.00 -0.93 -4.74 107.32 103.84 3dpm s GLY 107 Ca 0.13 -0.83 -0.02 0.00 0.00 0.00 0.00 44.72 44.00 3dpm s GLY 107 CO 0.12 -0.42 0.09 0.14 0.00 0.00 0.00 173.10 173.03 3dpm s VAL 108 N -2.78 -0.11 0.14 1.40 1.01 -1.26 -1.61 120.40 117.19 3dpm s VAL 108 Ca 0.18 0.29 0.05 0.00 0.00 0.00 0.00 61.98 62.50 3dpm s VAL 108 Cb -0.04 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 3dpm s VAL 108 CO 0.12 0.12 0.11 0.42 0.00 0.00 0.00 175.10 175.87 3dpm s THR 109 N 1.63 4.44 0.12 3.92 -4.23 0.22 -4.60 115.64 117.14 3dpm s THR 109 Ca -0.03 -1.00 0.08 0.00 -1.18 0.00 0.00 61.69 59.56 3dpm s THR 109 Cb -0.12 -3.22 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 3dpm s THR 109 CO -0.04 -0.03 -0.20 -0.36 -0.54 0.00 0.00 174.62 173.45 3dpm s PHE 110 N -1.62 1.75 -1.20 3.99 0.40 0.19 -0.55 117.98 120.93 3dpm s PHE 110 Ca 0.30 -0.44 -0.19 0.00 -0.60 0.00 0.00 56.93 56.00 3dpm s PHE 110 Cb -0.11 -0.94 -0.02 0.00 0.51 0.00 0.00 43.02 42.46 3dpm s PHE 110 CO 0.22 0.23 1.91 1.19 0.70 0.00 0.00 175.22 179.48 3dpm n PHE 111 N 0.87 3.41 -3.76 0.36 3.01 -0.21 -4.48 117.46 116.64 3dpm n PHE 111 Ca -0.18 -2.25 -0.13 0.00 1.01 0.00 0.00 57.45 55.90 3dpm n PHE 111 Cb 0.55 -2.47 -0.10 0.00 -0.01 0.00 0.00 39.48 37.44 3dpm n PHE 111 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dpm s ALA 112 N 6.36 -0.80 -0.50 4.37 0.00 -1.26 -4.92 121.76 125.00 3dpm s ALA 112 Ca 0.58 0.82 0.09 0.00 0.00 0.00 0.00 51.96 53.45 3dpm s ALA 112 Cb 0.06 -0.43 -0.09 0.00 0.00 0.00 0.00 23.12 22.66 3dpm s ALA 112 CO 0.08 -0.17 0.43 0.44 0.00 0.00 0.00 175.76 176.53 3dpm n ILE 113 N 2.63 0.00 -1.67 0.00 -5.35 -1.26 -3.72 119.36 110.00 3dpm n ILE 113 Ca -0.14 -0.30 -0.42 0.00 -0.27 0.00 0.00 62.75 61.61 3dpm n ILE 113 Cb 0.57 1.02 -0.00 0.00 -1.74 0.00 0.00 39.64 39.49 3dpm n ILE 113 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 3dpm n GLU 114 N -1.08 1.83 -3.55 6.28 2.13 -1.26 -4.87 120.64 120.13 3dpm n GLU 114 Ca 0.02 0.65 -0.09 0.00 0.66 0.00 0.00 57.16 58.40 3dpm n GLU 114 Cb 0.15 -2.21 -0.03 0.00 0.27 0.00 0.00 31.44 29.62 3dpm n GLU 114 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 3dpm s SER 115 N -0.46 -0.34 0.03 4.31 1.04 -0.53 -1.93 113.70 115.82 3dpm s SER 115 Ca 0.58 0.18 0.02 0.00 0.48 0.00 0.00 55.95 57.21 3dpm s SER 115 Cb -0.58 0.32 -0.02 0.00 0.10 0.00 0.00 66.02 65.84 3dpm s SER 115 CO 0.60 -0.44 -0.06 0.00 0.98 0.00 0.00 173.24 174.32 3dpm s ALA 116 N -2.12 0.44 -0.03 5.32 0.00 -0.43 0.06 121.76 125.00 3dpm s ALA 116 Ca 0.03 -0.58 -0.14 0.00 0.00 0.00 0.00 51.96 51.27 3dpm s ALA 116 Cb -0.01 0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.16 3dpm s ALA 116 CO -0.04 -0.01 0.30 -0.47 0.00 0.00 0.00 175.76 175.54 3dpm s TYR 117 N -1.05 -0.20 -0.08 0.00 5.04 -0.43 -1.36 117.35 119.27 3dpm s TYR 117 Ca -0.08 0.36 0.02 0.00 -2.44 0.00 0.00 57.07 54.93 3dpm s TYR 117 Cb -0.08 0.09 0.02 0.00 0.35 0.00 0.00 41.96 42.34 3dpm s TYR 117 CO 0.00 -0.34 -0.12 -0.51 -1.34 0.00 0.00 175.55 173.24 3dpm s LEU 118 N -1.04 1.59 -0.19 6.97 1.43 -0.49 -0.92 118.68 126.02 3dpm s LEU 118 Ca -0.11 -0.32 -0.02 0.00 -1.03 0.00 0.00 54.13 52.65 3dpm s LEU 118 Cb -0.05 -0.87 -0.06 0.00 0.03 0.00 0.00 46.19 45.23 3dpm s LEU 118 CO 0.03 0.01 1.55 -0.81 0.23 0.00 0.00 176.35 177.36 3dpm n PRO 119 N 4.04 0.84 -4.03 1.29 -0.04 -1.26 -4.84 135.00 131.01 3dpm n PRO 119 Ca -0.21 -0.59 -0.09 0.00 -0.04 0.00 0.00 63.50 62.57 3dpm n PRO 119 Cb 0.51 -1.88 -0.11 0.00 -0.04 0.00 0.00 33.50 31.98 3dpm n PRO 119 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3dpm s TYR 120 N 3.01 0.42 -0.03 0.54 1.51 -1.26 -1.62 117.35 119.92 3dpm s TYR 120 Ca 0.22 -0.66 0.03 0.00 -1.01 0.00 0.00 57.07 55.65 3dpm s TYR 120 Cb 0.09 -0.29 0.00 0.00 -0.11 0.00 0.00 41.96 41.65 3dpm s TYR 120 CO -0.01 -0.21 -0.12 0.99 -1.11 0.00 0.00 175.55 175.10 3dpm s THR 121 N -2.10 0.99 0.11 -0.71 2.01 -0.45 -4.89 115.64 110.60 3dpm s THR 121 Ca -0.08 -0.47 0.07 0.00 0.31 0.00 0.00 61.69 61.52 3dpm s THR 121 Cb -0.05 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 3dpm s THR 121 CO -0.03 0.30 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.33 3dpm s VAL 122 N 0.18 1.58 -0.04 3.82 1.01 -1.26 -1.84 120.40 123.84 3dpm s VAL 122 Ca -0.04 -1.57 0.02 0.00 0.00 0.00 0.00 61.98 60.39 3dpm s VAL 122 Cb -0.10 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.79 3dpm s VAL 122 CO 0.01 -0.16 -0.09 -1.58 0.00 0.00 0.00 175.10 173.28 3dpm s GLN 123 N -2.07 1.16 -0.11 2.72 0.74 -0.83 -4.92 119.66 116.34 3dpm s GLN 123 Ca 0.06 -0.30 -0.16 0.00 0.05 0.00 0.00 55.36 55.01 3dpm s GLN 123 Cb -0.09 -1.04 -0.05 0.00 1.10 0.00 0.00 33.01 32.93 3dpm s GLN 123 CO 0.04 0.06 0.42 0.21 -0.55 0.00 0.00 175.29 175.46 3dpm s LYS 124 N 0.46 4.25 0.75 1.67 2.20 -1.26 -2.39 119.74 125.41 3dpm s LYS 124 Ca -0.08 0.35 -0.07 0.00 -0.36 0.00 0.00 55.97 55.81 3dpm s LYS 124 Cb -0.12 -3.40 0.09 0.00 -1.51 0.00 0.00 37.83 32.90 3dpm s LYS 124 CO 0.01 0.27 1.06 -1.54 -0.36 0.00 0.00 175.35 174.80 3dpm s SER 125 N 0.28 4.45 0.40 1.43 1.04 -0.41 -4.90 113.70 115.99 3dpm s SER 125 Ca 0.23 0.29 0.16 0.00 0.48 0.00 0.00 55.95 57.11 3dpm s SER 125 Cb -0.15 -0.79 0.84 0.00 0.10 0.00 0.00 66.02 66.01 3dpm s SER 125 CO 0.09 -1.83 1.85 0.77 0.98 0.00 0.00 173.24 175.10 3dpm h SER 126 N -0.76 0.00 0.00 7.02 4.64 -1.64 -2.64 113.55 120.17 3dpm h SER 126 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 3dpm h SER 126 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3dpm h SER 126 CO 0.53 0.33 0.00 -0.90 -0.87 0.00 0.00 176.83 175.92 3dpm n ASP 127 N -3.92 0.00 0.00 4.97 3.85 -1.26 -4.89 116.55 115.29 3dpm n ASP 127 Ca -0.02 -1.01 0.00 0.00 -0.71 0.00 0.00 54.79 53.06 3dpm n ASP 127 Cb 0.40 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.17 3dpm n ASP 127 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dpm n GLY 128 N 0.92 1.23 3.46 6.12 0.00 -0.99 -5.10 105.19 110.83 3dpm n GLY 128 Ca 0.22 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 3dpm n GLY 128 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dpm s ARG 129 N -2.34 2.11 -0.25 1.61 0.52 -1.26 -4.93 118.95 114.42 3dpm s ARG 129 Ca 0.00 -0.96 -0.06 0.00 -0.52 0.00 0.00 55.73 54.20 3dpm s ARG 129 Cb 0.00 -2.21 -0.01 0.00 0.52 0.00 0.00 34.95 33.25 3dpm s ARG 129 CO 0.00 0.55 0.02 -0.06 0.02 0.00 0.00 175.30 175.83 3dpm s PHE 130 N -0.92 3.04 -0.04 -0.53 0.40 -1.26 -1.29 117.98 117.38 3dpm s PHE 130 Ca 0.15 -0.80 0.06 0.00 -0.60 0.00 0.00 56.93 55.74 3dpm s PHE 130 Cb -0.11 -2.18 -0.02 0.00 0.51 0.00 0.00 43.02 41.23 3dpm s PHE 130 CO 0.05 -0.50 -0.21 0.71 0.70 0.00 0.00 175.22 175.97 3dpm s TYR 131 N 1.52 2.50 0.31 0.36 1.51 -1.01 0.62 117.35 123.16 3dpm s TYR 131 Ca 0.05 -0.38 -0.29 0.00 -1.01 0.00 0.00 57.07 55.44 3dpm s TYR 131 Cb -0.15 -1.57 -0.10 0.00 -0.11 0.00 0.00 41.96 40.03 3dpm s TYR 131 CO 0.00 0.02 1.34 -0.06 -1.11 0.00 0.00 175.55 175.74 3dpm s PHE 132 N -0.57 3.03 0.00 2.71 0.40 -0.63 -1.97 117.98 120.96 3dpm s PHE 132 Ca 0.08 1.33 0.00 0.00 -0.60 0.00 0.00 56.93 57.74 3dpm s PHE 132 Cb -0.11 -3.72 0.00 0.00 0.51 0.00 0.00 43.02 39.70 3dpm s PHE 132 CO 0.00 -2.05 0.00 1.33 0.70 0.00 0.00 175.22 175.20 3dpm n VAL 133 N 1.14 0.00 -3.67 -0.44 0.24 -0.77 -1.54 118.33 113.30 3dpm n VAL 133 Ca 0.01 -0.34 -0.12 0.00 -2.04 0.00 0.00 64.34 61.85 3dpm n VAL 133 Cb 0.41 0.96 -0.08 0.00 -1.47 0.00 0.00 33.84 33.66 3dpm n VAL 133 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3dpm s ASP 134 N -0.76 -0.64 -0.26 -1.34 -1.08 -1.20 -4.98 116.67 106.41 3dpm s ASP 134 Ca 0.00 1.19 -0.01 0.00 -0.52 0.00 0.00 52.55 53.21 3dpm s ASP 134 Cb 0.00 1.18 0.08 0.00 -1.46 0.00 0.00 42.92 42.72 3dpm s ASP 134 CO 0.00 -0.21 0.05 -0.63 0.52 0.00 0.00 175.17 174.90 3dpm s ILE 135 N 0.59 0.90 -0.06 4.11 1.01 -1.26 -1.35 121.20 125.14 3dpm s ILE 135 Ca -0.02 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 59.53 3dpm s ILE 135 Cb -0.05 -1.49 0.06 0.00 0.01 0.00 0.00 42.46 40.99 3dpm s ILE 135 CO -0.03 -0.41 1.48 0.23 0.00 0.00 0.00 174.94 176.20 3dpm n MET 136 N 4.87 1.16 -4.19 2.79 2.81 -0.64 -4.85 117.12 119.07 3dpm n MET 136 Ca -0.06 -0.34 -0.15 0.00 -1.81 0.00 0.00 57.70 55.34 3dpm n MET 136 Cb 0.44 -1.13 -0.07 0.00 -0.71 0.00 0.00 33.22 31.75 3dpm n MET 136 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 3dpm s THR 137 N -0.43 0.00 1.05 2.03 -1.32 -1.26 -4.93 115.64 110.78 3dpm s THR 137 Ca 0.07 -1.85 -0.13 0.00 -1.21 0.00 0.00 61.69 58.57 3dpm s THR 137 Cb 0.05 -2.51 0.17 0.00 -1.51 0.00 0.00 72.50 68.70 3dpm s THR 137 CO 0.01 0.00 0.79 2.22 -2.21 0.00 0.00 174.62 175.43 3dpm n PHE 138 N -0.50 -0.64 -0.51 9.09 1.16 -1.26 -4.70 117.46 120.10 3dpm n PHE 138 Ca 0.04 0.14 -0.43 0.00 -1.87 0.00 0.00 57.45 55.32 3dpm n PHE 138 Cb 0.63 -1.79 -0.11 0.00 -1.61 0.00 0.00 39.48 36.60 3dpm n PHE 138 CO 0.00 0.00 0.00 0.43 -1.87 0.00 0.00 176.76 175.32 3dpm n SER 139 N -3.59 0.92 -3.00 5.98 7.64 -1.26 -4.86 113.62 115.45 3dpm n SER 139 Ca 0.06 -2.43 -0.15 0.00 1.01 0.00 0.00 58.87 57.37 3dpm n SER 139 Cb 0.55 -0.48 0.12 0.00 -1.01 0.00 0.00 64.21 63.38 3dpm n SER 139 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3dpm n SER 140 N 8.76 -0.88 0.26 6.43 2.88 -1.26 -4.88 113.62 124.93 3dpm n SER 140 Ca 0.45 -1.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.15 3dpm n SER 140 Cb 0.41 -0.51 0.89 0.00 -0.75 0.00 0.00 64.21 64.26 3dpm n SER 140 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 3dpm h GLU 141 N 0.00 0.00 -6.15 -1.46 5.08 -1.99 -3.41 114.58 106.64 3dpm h GLU 141 Ca -0.21 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.59 3dpm h GLU 141 Cb 0.62 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 3dpm h GLU 141 CO 0.14 0.00 0.06 0.42 -1.00 0.00 0.00 179.01 178.63 3dpm s ILE 142 N -4.60 4.86 0.23 3.13 1.09 -1.26 -5.07 121.20 119.58 3dpm s ILE 142 Ca -0.05 1.41 0.08 0.00 -1.10 0.00 0.00 60.65 60.99 3dpm s ILE 142 Cb 0.15 -4.01 -0.05 0.00 -1.06 0.00 0.00 42.46 37.49 3dpm s ILE 142 CO 0.54 0.38 -0.14 -0.13 -0.10 0.00 0.00 174.94 175.48 3dpm s ARG 143 N -0.01 1.44 0.32 2.79 0.52 -1.26 -4.96 118.95 117.79 3dpm s ARG 143 Ca 0.34 -1.66 -0.29 0.00 -0.52 0.00 0.00 55.73 53.60 3dpm s ARG 143 Cb -0.19 -1.27 -0.10 0.00 0.52 0.00 0.00 34.95 33.91 3dpm s ARG 143 CO 0.19 0.19 1.38 0.08 0.02 0.00 0.00 175.30 177.16 3dpm s VAL 144 N -2.88 2.56 0.00 3.52 1.01 -1.26 -2.11 120.40 121.24 3dpm s VAL 144 Ca 0.25 0.54 0.00 0.00 0.00 0.00 0.00 61.98 62.77 3dpm s VAL 144 Cb -0.01 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 33.03 3dpm s VAL 144 CO 0.09 0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.92 3dpm n GLY 145 N 1.08 2.73 3.70 4.51 0.00 -0.59 -4.99 105.19 111.62 3dpm n GLY 145 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 3dpm n GLY 145 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dpm n ASP 146 N 0.00 1.66 -4.79 1.61 10.43 -0.90 -4.69 116.55 119.87 3dpm n ASP 146 Ca 0.00 0.80 -0.36 0.00 2.57 0.00 0.00 54.79 57.80 3dpm n ASP 146 Cb 0.00 -1.51 -0.07 0.00 1.84 0.00 0.00 41.12 41.38 3dpm n ASP 146 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 3dpm s GLU 147 N -3.27 3.90 -0.30 -1.24 2.12 -0.47 -1.60 118.70 117.84 3dpm s GLU 147 Ca 0.81 -0.14 -0.19 0.00 0.36 0.00 0.00 54.97 55.81 3dpm s GLU 147 Cb -0.38 -3.32 -0.01 0.00 0.26 0.00 0.00 34.13 30.67 3dpm s GLU 147 CO 0.42 0.49 0.57 -1.17 -0.54 0.00 0.00 175.26 175.04 3dpm s LEU 148 N -0.22 4.15 -0.26 2.70 2.96 0.20 -0.58 118.68 127.64 3dpm s LEU 148 Ca 0.12 0.38 -0.07 0.00 -0.22 0.00 0.00 54.13 54.34 3dpm s LEU 148 Cb -0.12 -2.72 -0.16 0.00 0.50 0.00 0.00 46.19 43.70 3dpm s LEU 148 CO 0.01 -0.41 -0.22 0.18 -1.32 0.00 0.00 176.35 174.60 3dpm n LEU 149 N 5.74 2.45 -4.10 -0.68 4.77 0.15 -4.44 117.00 120.88 3dpm n LEU 149 Ca -0.03 0.12 -0.09 0.00 -0.03 0.00 0.00 56.01 55.98 3dpm n LEU 149 Cb 0.49 -0.89 -0.09 0.00 -2.33 0.00 0.00 43.42 40.60 3dpm n LEU 149 CO 0.44 0.74 -0.25 -1.61 -1.33 0.00 0.00 177.39 175.37 3dpm s GLU 150 N -2.51 0.92 -0.04 3.23 2.02 -0.94 -2.34 118.70 119.04 3dpm s GLU 150 Ca -0.35 -1.36 -0.01 0.00 0.02 0.00 0.00 54.97 53.27 3dpm s GLU 150 Cb 0.11 0.26 0.03 0.00 0.10 0.00 0.00 34.13 34.63 3dpm s GLU 150 CO 0.56 -0.27 0.03 0.08 0.02 0.00 0.00 175.26 175.68 3dpm s VAL 151 N -4.02 0.07 -1.46 2.63 1.01 0.21 -1.72 120.40 117.12 3dpm s VAL 151 Ca 0.21 0.24 -0.10 0.00 0.00 0.00 0.00 61.98 62.32 3dpm s VAL 151 Cb 0.07 -0.24 0.06 0.00 0.00 0.00 0.00 36.38 36.26 3dpm s VAL 151 CO -0.00 0.17 0.82 -0.67 0.00 0.00 0.00 175.10 175.41 3dpm n ASP 152 N 4.74 -5.10 0.00 3.32 -0.08 0.50 -1.58 116.55 118.34 3dpm n ASP 152 Ca -0.15 -0.55 0.00 0.00 -1.51 0.00 0.00 54.79 52.58 3dpm n ASP 152 Cb 0.50 -4.10 0.00 0.00 2.34 0.00 0.00 41.12 39.86 3dpm n ASP 152 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3dpm n GLY 153 N -1.58 2.84 3.77 0.27 0.00 -1.26 -4.96 105.19 104.27 3dpm n GLY 153 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 3dpm n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dpm s ALA 154 N -2.21 3.55 0.58 4.61 0.00 -0.62 -5.06 121.76 122.61 3dpm s ALA 154 Ca 0.00 -0.96 -0.20 0.00 0.00 0.00 0.00 51.96 50.80 3dpm s ALA 154 Cb 0.00 -1.48 -0.04 0.00 0.00 0.00 0.00 23.12 21.61 3dpm s ALA 154 CO 0.00 0.72 1.26 -1.25 0.00 0.00 0.00 175.76 176.49 3dpm s PRO 155 N -2.10 3.00 0.22 0.00 0.04 -1.26 -0.62 135.00 134.28 3dpm s PRO 155 Ca 0.26 1.98 -0.12 0.00 0.04 0.00 0.00 61.00 63.16 3dpm s PRO 155 Cb -0.12 -2.04 0.28 0.00 0.04 0.00 0.00 34.50 32.65 3dpm s PRO 155 CO 0.18 -1.22 1.63 0.28 0.04 0.00 0.00 177.00 177.91 3dpm h VAL 156 N 1.05 0.36 -0.70 -0.36 2.07 -1.78 -1.71 116.25 115.19 3dpm h VAL 156 Ca -0.51 -0.01 0.10 0.00 0.82 0.00 0.00 66.70 67.11 3dpm h VAL 156 Cb 1.30 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 31.33 3dpm h VAL 156 CO 0.56 0.00 0.31 1.56 0.02 0.00 0.00 177.57 180.03 3dpm h GLN 157 N 0.02 0.51 -0.02 1.57 7.50 -1.90 -0.73 115.11 122.05 3dpm h GLN 157 Ca 0.33 -0.03 -0.11 0.00 0.50 0.00 0.00 58.65 59.34 3dpm h GLN 157 Cb 0.51 -0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.91 3dpm h GLN 157 CO -0.66 0.34 -0.49 -0.44 -1.50 0.00 0.00 178.83 176.08 3dpm h ASP 158 N 0.52 0.06 -0.37 1.46 3.32 -1.69 -1.89 116.42 117.84 3dpm h ASP 158 Ca 0.35 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 57.25 3dpm h ASP 158 Cb 0.43 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3dpm h ASP 158 CO -0.31 0.54 -0.22 0.58 -1.72 0.00 0.00 179.24 178.11 3dpm h VAL 159 N 0.05 1.27 -0.48 -1.35 2.07 -0.74 -2.93 116.25 114.13 3dpm h VAL 159 Ca -0.00 -1.36 -0.08 0.00 0.82 0.00 0.00 66.70 66.08 3dpm h VAL 159 Cb 0.88 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 3dpm h VAL 159 CO 0.07 0.46 0.01 -0.07 0.02 0.00 0.00 177.57 178.06 3dpm h LEU 160 N 0.76 0.83 -1.61 2.57 3.38 -0.86 -2.85 115.31 117.53 3dpm h LEU 160 Ca 0.10 -0.30 0.13 0.00 0.09 0.00 0.00 57.88 57.90 3dpm h LEU 160 Cb 0.77 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 3dpm h LEU 160 CO 0.06 0.93 0.47 0.00 0.09 0.00 0.00 178.44 179.99 3dpm h ALA 161 N 0.93 2.09 0.00 1.53 0.00 -1.19 0.48 119.26 123.10 3dpm h ALA 161 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3dpm h ALA 161 Cb 0.50 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3dpm h ALA 161 CO 0.02 -0.27 0.00 1.79 0.00 0.00 0.00 179.25 180.79 3dpm h THR 162 N 0.41 0.00 0.00 0.00 1.35 -1.33 -2.52 112.91 110.82 3dpm h THR 162 Ca 0.34 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 66.00 3dpm h THR 162 Cb 0.76 0.93 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 3dpm h THR 162 CO -0.10 0.00 -1.28 0.18 -0.25 0.00 0.00 175.52 174.07 3dpm n LEU 163 N -2.43 0.72 -4.69 3.87 4.77 0.16 -4.99 117.00 114.42 3dpm n LEU 163 Ca 0.01 -0.36 -0.31 0.00 -0.03 0.00 0.00 56.01 55.32 3dpm n LEU 163 Cb 0.18 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.42 3dpm n LEU 163 CO 0.18 0.18 0.67 -0.31 -1.33 0.00 0.00 177.39 176.78 3dpm s TYR 164 N -3.14 1.96 0.52 -1.77 2.02 -0.93 -4.95 117.35 111.05 3dpm s TYR 164 Ca 0.04 1.60 -0.03 0.00 -0.37 0.00 0.00 57.07 58.30 3dpm s TYR 164 Cb 0.15 -3.21 -0.00 0.00 -0.40 0.00 0.00 41.96 38.50 3dpm s TYR 164 CO 0.88 -2.57 0.80 0.20 -1.57 0.00 0.00 175.55 173.29 3dpm s GLY 165 N -2.96 1.58 0.24 0.71 0.00 -1.26 -4.97 107.32 100.65 3dpm s GLY 165 Ca 0.65 -0.82 -0.14 0.00 0.00 0.00 0.00 44.72 44.40 3dpm s GLY 165 CO 0.58 -0.60 1.57 1.76 0.00 0.00 0.00 173.10 176.41 3dpm h SER 166 N 0.10 -1.14 -1.14 1.64 0.02 -1.84 -1.42 113.55 109.77 3dpm h SER 166 Ca -0.46 0.28 -0.69 0.00 -0.84 0.00 0.00 61.79 60.09 3dpm h SER 166 Cb 1.25 0.65 -0.29 0.00 0.14 0.00 0.00 62.40 64.14 3dpm h SER 166 CO 0.59 -0.30 0.82 0.59 -1.14 0.00 0.00 176.83 177.40 3dpm n ASN 167 N -5.51 7.55 -4.66 3.07 5.03 -1.26 -5.00 115.26 114.47 3dpm n ASN 167 Ca 0.11 -3.79 -0.45 0.00 0.87 0.00 0.00 54.58 51.31 3dpm n ASN 167 Cb 0.42 -0.96 -0.03 0.00 -1.02 0.00 0.00 39.78 38.19 3dpm n ASN 167 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 3dpm n HIS 168 N -0.85 2.03 -0.37 3.10 -0.00 -0.54 -4.89 115.22 113.70 3dpm n HIS 168 Ca 0.61 0.47 0.05 0.00 0.46 0.00 0.00 57.72 59.31 3dpm n HIS 168 Cb 0.61 -2.43 0.14 0.00 -0.12 0.00 0.00 29.99 28.19 3dpm n HIS 168 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 3dpm n LYS 169 N 2.04 2.79 -0.90 1.57 5.02 -1.26 -4.99 118.16 122.43 3dpm n LYS 169 Ca 0.12 -2.13 0.00 0.00 -2.02 0.00 0.00 58.31 54.29 3dpm n LYS 169 Cb 0.30 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 3dpm n LYS 169 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dpm n GLY 170 N -0.07 0.85 3.70 0.72 0.00 -1.26 -5.01 105.19 104.12 3dpm n GLY 170 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 3dpm n GLY 170 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dpm s THR 171 N -3.47 2.17 0.27 2.61 -4.23 -1.26 -4.88 115.64 106.85 3dpm s THR 171 Ca 0.00 0.07 0.04 0.00 -1.18 0.00 0.00 61.69 60.62 3dpm s THR 171 Cb 0.00 -2.40 0.02 0.00 1.34 0.00 0.00 72.50 71.45 3dpm s THR 171 CO 0.00 -0.06 1.65 0.00 -0.54 0.00 0.00 174.62 175.67 3dpm h ALA 172 N -1.07 1.00 -0.33 3.99 0.00 -1.96 -2.71 119.26 118.18 3dpm h ALA 172 Ca -0.45 -0.44 0.03 0.00 0.00 0.00 0.00 54.91 54.05 3dpm h ALA 172 Cb 1.28 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 3dpm h ALA 172 CO 0.46 0.62 0.15 0.00 0.00 0.00 0.00 179.25 180.48 3dpm h ALA 173 N 1.27 0.40 -0.47 0.00 0.00 -1.90 0.23 119.26 118.79 3dpm h ALA 173 Ca 0.02 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 3dpm h ALA 173 Cb 0.88 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 3dpm h ALA 173 CO 0.07 -0.23 0.12 0.93 0.00 0.00 0.00 179.25 180.15 3dpm h GLU 174 N 0.32 0.70 0.00 0.00 5.08 -1.86 -0.92 114.58 117.91 3dpm h GLU 174 Ca 0.14 -0.13 -0.19 0.00 -1.00 0.00 0.00 59.36 58.18 3dpm h GLU 174 Cb 0.07 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 3dpm h GLU 174 CO -0.11 0.63 -0.92 0.93 -1.00 0.00 0.00 179.01 178.54 3dpm h GLU 175 N 0.69 0.01 -0.04 2.33 5.08 -1.11 -2.52 114.58 119.03 3dpm h GLU 175 Ca 0.16 -0.02 -0.21 0.00 -1.00 0.00 0.00 59.36 58.29 3dpm h GLU 175 Cb 0.24 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3dpm h GLU 175 CO -0.00 0.92 -0.86 0.77 -1.00 0.00 0.00 179.01 178.84 3dpm h SER 176 N 0.00 0.55 -0.51 1.42 0.02 -0.27 -1.44 113.55 113.33 3dpm h SER 176 Ca -0.01 -0.40 -0.04 0.00 -0.84 0.00 0.00 61.79 60.50 3dpm h SER 176 Cb 1.62 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.97 3dpm h SER 176 CO 0.12 1.18 0.19 0.00 -1.14 0.00 0.00 176.83 177.18 3dpm h ALA 177 N 0.79 1.29 -0.15 3.77 0.00 -1.11 -0.77 119.26 123.10 3dpm h ALA 177 Ca -0.06 -0.17 -0.22 0.00 0.00 0.00 0.00 54.91 54.47 3dpm h ALA 177 Cb 1.47 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 19.04 3dpm h ALA 177 CO 0.15 0.51 -0.75 0.00 0.00 0.00 0.00 179.25 179.16 3dpm h ALA 178 N 1.41 0.29 -0.42 0.00 0.00 -1.38 -3.07 119.26 116.08 3dpm h ALA 178 Ca 0.19 -0.59 0.02 0.00 0.00 0.00 0.00 54.91 54.53 3dpm h ALA 178 Cb 0.21 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3dpm h ALA 178 CO -0.01 0.64 0.28 1.25 0.00 0.00 0.00 179.25 181.41 3dpm h LEU 179 N 0.49 0.43 -2.12 0.00 6.46 -0.73 -0.11 115.31 119.73 3dpm h LEU 179 Ca -0.05 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.70 3dpm h LEU 179 Cb 1.38 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 41.21 3dpm h LEU 179 CO 0.15 0.30 0.00 0.03 -0.62 0.00 0.00 178.44 178.31 3dpm h ARG 180 N 0.50 0.00 -0.02 1.25 2.47 -1.06 -2.15 114.38 115.38 3dpm h ARG 180 Ca 0.17 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.89 3dpm h ARG 180 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.37 3dpm h ARG 180 CO -0.04 0.00 -0.30 0.25 0.56 0.00 0.00 179.97 180.44 3dpm n THR 181 N -3.01 0.00 -0.22 2.04 -2.24 -0.09 -4.37 114.28 106.40 3dpm n THR 181 Ca -0.01 -0.35 0.02 0.00 -2.27 0.00 0.00 64.05 61.44 3dpm n THR 181 Cb 0.18 1.27 0.12 0.00 -2.10 0.00 0.00 70.33 69.81 3dpm n THR 181 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3dpm h LEU 182 N 2.58 -0.20 -3.21 3.22 6.46 -1.00 -2.00 115.31 121.15 3dpm h LEU 182 Ca 0.00 0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.91 3dpm h LEU 182 Cb 0.70 0.26 0.00 0.00 -0.73 0.00 0.00 40.66 40.88 3dpm h LEU 182 CO 0.00 -0.10 0.00 0.49 -0.62 0.00 0.00 178.44 178.21 3dpm n PHE 183 N -5.25 1.08 -3.37 1.25 0.99 -1.26 -4.84 117.46 106.05 3dpm n PHE 183 Ca 0.10 -0.75 -0.17 0.00 -0.00 0.00 0.00 57.45 56.64 3dpm n PHE 183 Cb 0.39 -0.28 -0.08 0.00 -1.00 0.00 0.00 39.48 38.51 3dpm n PHE 183 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3dpm s SER 184 N -1.47 1.33 -0.19 4.37 0.15 -0.75 -1.40 113.70 115.74 3dpm s SER 184 Ca 0.41 -1.18 -0.06 0.00 0.70 0.00 0.00 55.95 55.82 3dpm s SER 184 Cb 0.31 0.57 -0.03 0.00 -1.71 0.00 0.00 66.02 65.15 3dpm s SER 184 CO 0.13 -0.32 0.03 -0.13 1.20 0.00 0.00 173.24 174.15 3dpm s ARG 185 N 1.87 3.77 -0.08 5.44 1.81 -0.47 -4.58 118.95 126.71 3dpm s ARG 185 Ca 0.13 -0.45 0.01 0.00 -1.72 0.00 0.00 55.73 53.71 3dpm s ARG 185 Cb -0.15 -3.15 0.02 0.00 -0.45 0.00 0.00 34.95 31.23 3dpm s ARG 185 CO -0.17 0.11 -0.09 -1.64 -0.68 0.00 0.00 175.30 172.83 3dpm s MET 186 N 0.78 1.51 0.55 3.54 -1.94 -1.26 -1.31 119.30 121.16 3dpm s MET 186 Ca 0.02 -0.31 0.34 0.00 -1.71 0.00 0.00 55.69 54.03 3dpm s MET 186 Cb -0.14 -1.40 1.42 0.00 2.01 0.00 0.00 34.83 36.72 3dpm s MET 186 CO 0.02 -0.10 2.00 0.00 -0.01 0.00 0.00 175.02 176.93 3dpm h ALA 187 N 7.48 1.01 0.00 3.03 0.00 -1.54 -1.12 119.26 128.12 3dpm h ALA 187 Ca -0.31 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3dpm h ALA 187 Cb 1.16 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3dpm h ALA 187 CO 0.44 0.03 0.00 0.66 0.00 0.00 0.00 179.25 180.38 3dpm h SER 188 N 0.00 0.00 -0.23 0.00 4.64 -1.75 -1.33 113.55 114.88 3dpm h SER 188 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dpm h SER 188 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 3dpm h SER 188 CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 3dpm n LEU 189 N -2.33 2.72 -0.00 5.97 4.77 -0.49 0.55 117.00 128.18 3dpm n LEU 189 Ca 0.01 -2.14 -0.00 0.00 -0.03 0.00 0.00 56.01 53.85 3dpm n LEU 189 Cb 0.19 -0.20 -0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3dpm n LEU 189 CO 0.18 0.66 -0.00 0.61 -1.33 0.00 0.00 177.39 177.51 3dpm n GLY 190 N 0.05 0.44 3.87 -0.72 0.00 -0.50 -4.93 105.19 103.40 3dpm n GLY 190 Ca 0.09 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 3dpm n GLY 190 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dpm s HIS 191 N -2.00 3.52 -0.09 1.61 3.76 -0.81 -4.33 115.29 116.94 3dpm s HIS 191 Ca 0.00 1.18 -0.24 0.00 -0.15 0.00 0.00 55.06 55.85 3dpm s HIS 191 Cb 0.00 -2.58 -0.03 0.00 1.11 0.00 0.00 32.58 31.08 3dpm s HIS 191 CO 0.00 -0.34 0.74 0.15 -0.85 0.00 0.00 174.74 174.44 3dpm s LYS 192 N -4.36 4.40 -0.28 1.40 1.02 -1.26 -4.12 119.74 116.54 3dpm s LYS 192 Ca 0.54 0.93 -0.15 0.00 0.02 0.00 0.00 55.97 57.30 3dpm s LYS 192 Cb -0.10 -3.49 -0.03 0.00 -0.52 0.00 0.00 37.83 33.69 3dpm s LYS 192 CO 0.39 -0.05 0.40 0.08 -0.92 0.00 0.00 175.35 175.24 3dpm s VAL 193 N 1.20 5.15 0.66 3.17 1.01 -1.26 -4.83 120.40 125.49 3dpm s VAL 193 Ca 0.38 0.55 -0.05 0.00 0.00 0.00 0.00 61.98 62.86 3dpm s VAL 193 Cb -0.18 -3.74 0.05 0.00 0.00 0.00 0.00 36.38 32.51 3dpm s VAL 193 CO 0.17 0.11 0.95 -2.16 0.00 0.00 0.00 175.10 174.16 3dpm s PRO 194 N 2.12 2.37 0.31 2.72 0.04 -1.26 -5.01 135.00 136.29 3dpm s PRO 194 Ca 0.16 -0.33 -0.13 0.00 0.04 0.00 0.00 61.00 60.73 3dpm s PRO 194 Cb -0.16 -2.25 0.02 0.00 0.04 0.00 0.00 34.50 32.15 3dpm s PRO 194 CO 0.10 -1.06 0.62 -1.54 0.04 0.00 0.00 177.00 175.16 3dpm s SER 195 N -4.47 0.09 0.00 6.66 1.04 -1.26 -4.66 113.70 111.10 3dpm s SER 195 Ca 0.59 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.99 3dpm s SER 195 Cb -0.11 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.72 3dpm s SER 195 CO 0.43 -1.37 0.00 0.61 0.98 0.00 0.00 173.24 173.89 3dpm n GLY 196 N -0.48 -1.91 3.88 7.32 0.00 -1.26 -4.89 105.19 107.85 3dpm n GLY 196 Ca -0.04 -1.43 -0.30 0.00 0.00 0.00 0.00 46.02 44.26 3dpm n GLY 196 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dpm s ARG 197 N 0.00 3.60 0.19 1.61 0.52 -1.26 -1.90 118.95 121.71 3dpm s ARG 197 Ca 0.00 0.58 -0.11 0.00 -0.52 0.00 0.00 55.73 55.68 3dpm s ARG 197 Cb 0.00 -2.18 -0.00 0.00 0.52 0.00 0.00 34.95 33.29 3dpm s ARG 197 CO 0.00 -0.43 0.36 -0.08 0.02 0.00 0.00 175.30 175.17 3dpm s THR 198 N -3.00 0.04 -0.17 0.02 -1.32 0.23 -4.93 115.64 106.51 3dpm s THR 198 Ca 0.53 -1.29 0.00 0.00 -1.21 0.00 0.00 61.69 59.72 3dpm s THR 198 Cb -0.11 -1.88 0.01 0.00 -1.51 0.00 0.00 72.50 69.01 3dpm s THR 198 CO 0.50 -0.20 -0.16 -0.89 -2.21 0.00 0.00 174.62 171.66 3dpm s THR 199 N -3.96 2.51 -0.23 5.08 2.01 -1.26 -0.85 115.64 118.93 3dpm s THR 199 Ca 0.17 -0.81 -0.08 0.00 0.31 0.00 0.00 61.69 61.29 3dpm s THR 199 Cb 0.02 -2.07 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 3dpm s THR 199 CO 0.02 0.51 0.09 -0.76 -0.69 0.00 0.00 174.62 173.79 3dpm s LEU 200 N 1.09 3.65 -0.25 4.42 1.43 -0.30 -0.37 118.68 128.35 3dpm s LEU 200 Ca -0.00 -0.09 -0.12 0.00 -1.03 0.00 0.00 54.13 52.89 3dpm s LEU 200 Cb -0.14 -1.97 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 3dpm s LEU 200 CO -0.05 0.03 0.24 -0.75 0.23 0.00 0.00 176.35 176.04 3dpm s LYS 201 N 1.27 4.06 0.35 1.70 2.20 -0.70 -0.10 119.74 128.52 3dpm s LYS 201 Ca 0.05 -0.16 0.05 0.00 -0.36 0.00 0.00 55.97 55.56 3dpm s LYS 201 Cb -0.14 -3.58 -0.07 0.00 -1.51 0.00 0.00 37.83 32.53 3dpm s LYS 201 CO 0.04 -0.05 0.04 0.96 -0.36 0.00 0.00 175.35 175.98 3dpm s ILE 202 N 1.38 1.48 -0.08 5.43 -0.00 -0.31 0.33 121.20 129.43 3dpm s ILE 202 Ca 0.10 -2.00 0.02 0.00 -0.00 0.00 0.00 60.65 58.77 3dpm s ILE 202 Cb -0.15 -2.86 0.02 0.00 -0.00 0.00 0.00 42.46 39.47 3dpm s ILE 202 CO 0.07 -0.01 -0.11 -0.60 -0.00 0.00 0.00 174.94 174.29 3dpm s ARG 203 N -3.82 1.71 0.66 0.37 3.52 0.26 -1.57 118.95 120.07 3dpm s ARG 203 Ca 0.36 -0.39 -0.14 0.00 -0.13 0.00 0.00 55.73 55.43 3dpm s ARG 203 Cb 0.09 -1.50 -0.00 0.00 -1.56 0.00 0.00 34.95 31.98 3dpm s ARG 203 CO 0.16 -0.05 1.08 1.03 -0.81 0.00 0.00 175.30 176.71 3dpm s ARG 204 N 0.95 2.93 0.52 5.12 1.81 0.15 -1.37 118.95 129.07 3dpm s ARG 204 Ca -0.09 1.23 0.17 0.00 -1.72 0.00 0.00 55.73 55.31 3dpm s ARG 204 Cb -0.15 -1.98 1.27 0.00 -0.45 0.00 0.00 34.95 33.64 3dpm s ARG 204 CO 0.00 -1.12 2.13 -1.00 -0.68 0.00 0.00 175.30 174.63 3dpm h PRO 205 N -0.09 0.02 -0.84 3.54 0.13 -1.88 -2.00 132.00 130.88 3dpm h PRO 205 Ca -0.46 -0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 3dpm h PRO 205 Cb 1.23 -0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.28 3dpm h PRO 205 CO 0.55 0.01 0.16 1.19 -0.23 0.00 0.00 178.00 179.68 3dpm n PHE 206 N -4.52 1.53 0.00 1.56 3.01 -1.26 -4.92 117.46 112.86 3dpm n PHE 206 Ca -0.01 -0.79 0.00 0.00 1.01 0.00 0.00 57.45 57.66 3dpm n PHE 206 Cb 0.15 -0.48 0.00 0.00 -0.01 0.00 0.00 39.48 39.14 3dpm n PHE 206 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dpm n GLY 207 N 0.04 3.31 3.71 1.37 0.00 -0.75 -5.06 105.19 107.82 3dpm n GLY 207 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 3dpm n GLY 207 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dpm s THR 208 N -2.90 3.68 -0.18 2.61 2.01 -1.26 -4.74 115.64 114.86 3dpm s THR 208 Ca 0.00 1.18 -0.05 0.00 0.31 0.00 0.00 61.69 63.13 3dpm s THR 208 Cb 0.00 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 3dpm s THR 208 CO 0.00 0.08 0.01 0.28 -0.69 0.00 0.00 174.62 174.29 3dpm s THR 209 N 1.30 4.18 0.07 -0.82 -1.32 -1.26 0.32 115.64 118.12 3dpm s THR 209 Ca 0.62 -0.25 0.06 0.00 -1.21 0.00 0.00 61.69 60.91 3dpm s THR 209 Cb -0.33 -2.87 -0.03 0.00 -1.51 0.00 0.00 72.50 67.76 3dpm s THR 209 CO 0.29 0.46 -0.16 -0.13 -2.21 0.00 0.00 174.62 172.87 3dpm s ARG 210 N 0.60 0.95 -0.28 7.08 1.81 -0.61 -5.00 118.95 123.51 3dpm s ARG 210 Ca -0.00 -0.97 -0.10 0.00 -1.72 0.00 0.00 55.73 52.94 3dpm s ARG 210 Cb -0.14 -1.03 -0.03 0.00 -0.45 0.00 0.00 34.95 33.29 3dpm s ARG 210 CO 0.02 0.24 0.16 -1.21 -0.68 0.00 0.00 175.30 173.83 3dpm s GLU 211 N -1.63 3.73 -0.23 3.54 2.02 -1.26 -1.16 118.70 123.71 3dpm s GLU 211 Ca 0.01 -0.46 -0.06 0.00 0.02 0.00 0.00 54.97 54.49 3dpm s GLU 211 Cb -0.09 -3.57 -0.02 0.00 0.10 0.00 0.00 34.13 30.55 3dpm s GLU 211 CO 0.03 -0.25 0.01 0.08 0.02 0.00 0.00 175.26 175.15 3dpm s VAL 212 N 1.69 3.89 -0.02 2.63 1.01 0.86 -4.94 120.40 125.52 3dpm s VAL 212 Ca 0.06 -0.32 -0.27 0.00 0.00 0.00 0.00 61.98 61.46 3dpm s VAL 212 Cb -0.16 -2.79 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 3dpm s VAL 212 CO 0.08 0.39 0.85 -0.13 0.00 0.00 0.00 175.10 176.29 3dpm s ARG 213 N 1.43 4.51 0.31 2.72 3.00 -1.26 -1.15 118.95 128.50 3dpm s ARG 213 Ca 0.05 1.17 0.03 0.00 0.00 0.00 0.00 55.73 56.97 3dpm s ARG 213 Cb -0.15 -3.45 -0.05 0.00 0.00 0.00 0.00 34.95 31.31 3dpm s ARG 213 CO 0.01 0.02 0.11 0.14 0.00 0.00 0.00 175.30 175.58 3dpm s VAL 214 N 0.84 0.66 -0.03 3.52 -7.23 -0.03 -4.96 120.40 113.17 3dpm s VAL 214 Ca 0.45 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.65 3dpm s VAL 214 Cb -0.20 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.14 3dpm s VAL 214 CO 0.23 0.00 -0.13 -0.75 -0.31 0.00 0.00 175.10 174.15 3dpm s LYS 215 N -3.90 1.33 0.16 4.82 2.20 -1.26 -0.60 119.74 122.49 3dpm s LYS 215 Ca 0.35 -0.44 -0.30 0.00 -0.36 0.00 0.00 55.97 55.21 3dpm s LYS 215 Cb 0.07 -1.20 -0.08 0.00 -1.51 0.00 0.00 37.83 35.11 3dpm s LYS 215 CO 0.15 0.17 1.28 -1.58 -0.36 0.00 0.00 175.35 175.01 3dpm s TRP 216 N 0.13 3.33 -0.54 4.03 0.52 -0.80 -4.92 118.94 120.68 3dpm s TRP 216 Ca -0.03 1.23 -0.28 0.00 0.02 0.00 0.00 56.10 57.03 3dpm s TRP 216 Cb -0.10 -3.55 0.01 0.00 -1.15 0.00 0.00 33.47 28.69 3dpm s TRP 216 CO 0.01 -1.72 1.42 1.03 0.02 0.00 0.00 176.95 177.71 3dpm s ARG 217 N 0.30 3.32 -0.16 4.98 3.00 -0.10 -4.68 118.95 125.61 3dpm s ARG 217 Ca 0.58 0.52 -0.03 0.00 0.00 0.00 0.00 55.73 56.80 3dpm s ARG 217 Cb -0.34 -4.12 -0.02 0.00 0.00 0.00 0.00 34.95 30.46 3dpm s ARG 217 CO 0.35 -1.91 -0.05 -0.47 0.00 0.00 0.00 175.30 173.22 3dpm s TYR 218 N 6.05 2.99 -0.30 -0.53 5.04 -1.26 -1.31 117.35 128.02 3dpm s TYR 218 Ca 0.54 -0.38 -0.06 0.00 -2.44 0.00 0.00 57.07 54.73 3dpm s TYR 218 Cb -0.11 -1.95 0.02 0.00 0.35 0.00 0.00 41.96 40.27 3dpm s TYR 218 CO 0.26 -0.09 0.06 0.08 -1.34 0.00 0.00 175.55 174.52 3dpm s VAL 219 N 0.42 3.67 0.92 3.14 1.01 0.11 -5.00 120.40 124.68 3dpm s VAL 219 Ca -0.05 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 3dpm s VAL 219 Cb -0.14 -2.96 0.15 0.00 0.00 0.00 0.00 36.38 33.42 3dpm s VAL 219 CO 0.03 0.01 1.09 -2.16 0.00 0.00 0.00 175.10 174.08 3dpm s PRO 220 N 1.43 1.01 0.29 2.72 0.04 -1.26 -1.46 135.00 137.76 3dpm s PRO 220 Ca 0.00 1.03 -0.29 0.00 0.04 0.00 0.00 61.00 61.78 3dpm s PRO 220 Cb -0.18 -1.76 -0.10 0.00 0.04 0.00 0.00 34.50 32.50 3dpm s PRO 220 CO 0.01 -2.47 1.09 -2.00 0.04 0.00 0.00 177.00 173.67 3dpm s GLU 221 N -4.80 4.62 -0.01 4.56 2.56 -1.26 -4.15 118.70 120.22 3dpm s GLU 221 Ca 0.65 1.78 0.11 0.00 0.00 0.00 0.00 54.97 57.51 3dpm s GLU 221 Cb -0.20 -3.16 -0.17 0.00 2.00 0.00 0.00 34.13 32.61 3dpm s GLU 221 CO 0.58 0.20 0.29 0.41 -0.56 0.00 0.00 175.26 176.18 3dpm n GLY 222 N 1.15 -0.44 3.44 -1.50 0.00 -1.26 -4.88 105.19 101.70 3dpm n GLY 222 Ca -0.01 -0.28 -0.44 0.00 0.00 0.00 0.00 46.02 45.30 3dpm n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dpm s VAL 223 N -2.66 4.79 0.22 1.61 1.01 -1.26 -5.02 120.40 119.09 3dpm s VAL 223 Ca -0.03 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.16 3dpm s VAL 223 Cb 0.07 -4.37 -0.16 0.00 0.00 0.00 0.00 36.38 31.93 3dpm s VAL 223 CO 0.47 -0.92 0.90 0.61 0.00 0.00 0.00 175.10 176.16 3dpm n GLY 224 N 5.19 -0.64 3.65 4.51 0.00 -1.26 -4.86 105.19 111.78 3dpm n GLY 224 Ca -0.06 0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.94 3dpm n GLY 224 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dpm s ASP 225 N -0.53 6.64 0.58 1.61 -1.08 -1.26 -4.89 116.67 117.74 3dpm s ASP 225 Ca 0.65 1.97 0.28 0.00 -0.52 0.00 0.00 52.55 54.93 3dpm s ASP 225 Cb -0.84 -2.53 1.65 0.00 -1.46 0.00 0.00 42.92 39.74 3dpm s ASP 225 CO 0.57 -0.98 2.14 0.25 0.52 0.00 0.00 175.17 177.66 3dpm h LEU 226 N 10.53 0.00 -1.12 -1.34 5.85 -1.94 -1.69 115.31 125.60 3dpm h LEU 226 Ca -0.35 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.28 3dpm h LEU 226 Cb 1.16 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 3dpm h LEU 226 CO 0.97 0.00 -0.33 0.00 -0.34 0.00 0.00 178.44 178.74 3dpm h ALA 227 N 1.85 1.26 0.00 1.25 0.00 -1.90 0.35 119.26 122.06 3dpm h ALA 227 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3dpm h ALA 227 Cb 0.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3dpm h ALA 227 CO -0.00 0.51 0.00 1.15 0.00 0.00 0.00 179.25 180.91 3dpm h THR 228 N 0.17 0.00 0.00 0.00 2.02 -1.69 -3.23 112.91 110.19 3dpm h THR 228 Ca 0.02 -0.53 -0.14 0.00 0.77 0.00 0.00 66.41 66.53 3dpm h THR 228 Cb 0.67 1.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 3dpm h THR 228 CO 0.05 0.00 -1.99 -0.38 0.37 0.00 0.00 175.52 173.57 3dpm n ILE 229 N -2.46 0.53 -0.32 3.11 5.41 -0.72 -4.70 119.36 120.21 3dpm n ILE 229 Ca 0.04 -0.56 -0.07 0.00 1.00 0.00 0.00 62.75 63.17 3dpm n ILE 229 Cb 0.40 -0.21 -0.03 0.00 -0.71 0.00 0.00 39.64 39.09 3dpm n ILE 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3dpm h ALA 230 N 1.29 -0.25 -0.52 -1.39 0.00 -0.36 -1.73 119.26 116.30 3dpm h ALA 230 Ca -0.21 0.16 0.15 0.00 0.00 0.00 0.00 54.91 55.01 3dpm h ALA 230 Cb 1.39 1.10 -0.02 0.00 0.00 0.00 0.00 17.79 20.26 3dpm h ALA 230 CO 0.01 -0.81 0.46 -1.00 0.00 0.00 0.00 179.25 177.91 3dpm h PRO 231 N -0.10 0.00 -0.55 0.00 0.13 -1.84 -1.84 132.00 127.81 3dpm h PRO 231 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 3dpm h PRO 231 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 3dpm h PRO 231 CO -0.85 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 175.79 3dpm n SER 232 N -3.97 3.46 -4.67 1.44 3.41 -0.66 -4.96 113.62 107.67 3dpm n SER 232 Ca 0.10 -2.00 -0.42 0.00 -0.26 0.00 0.00 58.87 56.29 3dpm n SER 232 Cb 0.67 -0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 64.23 3dpm n SER 232 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3dpm s ILE 233 N -1.01 3.81 0.15 -1.33 1.01 -0.69 -4.98 121.20 118.16 3dpm s ILE 233 Ca 0.37 1.08 -0.09 0.00 0.00 0.00 0.00 60.65 62.00 3dpm s ILE 233 Cb 0.19 -3.69 -0.06 0.00 0.01 0.00 0.00 42.46 38.90 3dpm s ILE 233 CO 0.25 -0.06 0.47 -0.13 0.00 0.00 0.00 174.94 175.47 3dpm s ARG 234 N 3.26 3.78 0.53 2.79 0.52 -1.26 -5.07 118.95 123.50 3dpm s ARG 234 Ca 0.65 0.20 -0.20 0.00 -0.52 0.00 0.00 55.73 55.86 3dpm s ARG 234 Cb -0.29 -2.84 -0.06 0.00 0.52 0.00 0.00 34.95 32.27 3dpm s ARG 234 CO 0.24 0.45 1.14 0.00 0.02 0.00 0.00 175.30 177.15 3dpm s ALA 235 N -1.60 2.74 0.18 2.13 0.00 -1.26 -4.94 121.76 119.01 3dpm s ALA 235 Ca 0.40 0.85 -0.32 0.00 0.00 0.00 0.00 51.96 52.90 3dpm s ALA 235 Cb -0.13 -3.37 -0.11 0.00 0.00 0.00 0.00 23.12 19.51 3dpm s ALA 235 CO 0.21 -0.76 1.70 -1.25 0.00 0.00 0.00 175.76 175.65 3dpm s PRO 236 N -3.17 4.15 -0.05 0.00 0.04 -1.26 -5.01 135.00 129.70 3dpm s PRO 236 Ca 0.71 2.54 0.04 0.00 0.04 0.00 0.00 61.00 64.33 3dpm s PRO 236 Cb -0.25 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.12 3dpm s PRO 236 CO 0.29 -0.73 -0.15 -0.65 0.04 0.00 0.00 177.00 175.79 3dpm s GLN 237 N 1.40 1.71 0.46 4.56 -1.52 -1.26 -5.14 119.66 119.86 3dpm s GLN 237 Ca 0.74 -0.54 -0.21 0.00 -1.95 0.00 0.00 55.36 53.40 3dpm s GLN 237 Cb -0.48 -1.47 -0.09 0.00 -0.22 0.00 0.00 33.01 30.75 3dpm s GLN 237 CO 0.32 0.18 1.02 -0.51 -0.25 0.00 0.00 175.29 176.05 3dpm s LEU 238 N 0.19 3.91 0.00 2.90 1.43 -1.26 -5.30 118.68 120.56 3dpm s LEU 238 Ca -0.06 1.89 0.00 0.00 -1.03 0.00 0.00 54.13 54.93 3dpm s LEU 238 Cb -0.12 -4.50 0.00 0.00 0.03 0.00 0.00 46.19 41.60 3dpm s LEU 238 CO 0.03 -0.64 0.00 0.00 0.23 0.00 0.00 176.35 175.97 3dpm n GLN 239 N -0.75 0.00 0.00 1.70 10.64 -1.26 -5.33 117.38 122.38 3dpm n GLN 239 Ca 0.08 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.25 3dpm n GLN 239 Cb 0.52 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.90 3dpm n GLN 239 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3dpm n GLY 284 N 0.15 -1.95 0.41 2.61 0.00 0.77 -5.37 105.19 101.81 3dpm n GLY 284 Ca 0.00 -1.77 0.12 0.00 0.00 0.00 0.00 46.02 44.37 3dpm n GLY 284 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3dpm n TYR 285 N -0.02 0.00 -2.37 1.61 4.02 -1.26 -3.09 117.16 116.05 3dpm n TYR 285 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.54 3dpm n TYR 285 Cb 0.00 -0.03 -0.01 0.00 -0.02 0.00 0.00 39.34 39.27 3dpm n TYR 285 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 3dpm s ASN 286 N -2.51 5.99 0.18 7.72 0.02 -1.26 -4.96 114.94 120.12 3dpm s ASN 286 Ca 0.20 2.06 -0.31 0.00 -1.02 0.00 0.00 52.86 53.78 3dpm s ASN 286 Cb 0.18 -2.57 -0.10 0.00 0.02 0.00 0.00 41.25 38.78 3dpm s ASN 286 CO 0.57 -1.03 1.52 -0.63 0.02 0.00 0.00 177.10 177.55 3dpm s ILE 287 N -1.89 2.69 0.00 0.60 -1.09 -1.26 -1.78 121.20 118.47 3dpm s ILE 287 Ca 0.70 0.51 0.00 0.00 -2.23 0.00 0.00 60.65 59.63 3dpm s ILE 287 Cb -0.20 -3.33 0.00 0.00 -1.58 0.00 0.00 42.46 37.35 3dpm s ILE 287 CO 0.24 0.05 0.00 0.61 -1.23 0.00 0.00 174.94 174.61 3dpm n GLY 288 N 3.39 0.77 3.73 6.18 0.00 0.11 -4.88 105.19 114.49 3dpm n GLY 288 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3dpm n GLY 288 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dpm s SER 289 N -2.64 6.46 0.08 1.61 0.15 -0.73 -4.66 113.70 113.96 3dpm s SER 289 Ca 0.00 2.82 -0.26 0.00 0.70 0.00 0.00 55.95 59.20 3dpm s SER 289 Cb 0.00 -2.61 -0.16 0.00 -1.71 0.00 0.00 66.02 61.54 3dpm s SER 289 CO 0.00 -0.89 1.70 0.74 1.20 0.00 0.00 173.24 175.99 3dpm h THR 290 N 3.69 0.75 0.00 6.45 2.02 -1.91 -3.25 112.91 120.66 3dpm h THR 290 Ca -0.45 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 66.59 3dpm h THR 290 Cb 1.21 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 68.35 3dpm h THR 290 CO 0.87 0.00 -0.67 0.44 0.37 0.00 0.00 175.52 176.53 3dpm h ASP 291 N -0.32 0.00 -0.36 4.18 3.45 -1.92 -3.42 116.42 118.02 3dpm h ASP 291 Ca -0.03 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.43 3dpm h ASP 291 Cb 0.25 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 3dpm h ASP 291 CO 0.04 0.67 0.00 0.61 -1.57 0.00 0.00 179.24 178.99 3dpm n GLY 292 N 1.16 -1.25 0.00 2.75 0.00 -1.23 -4.57 105.19 102.05 3dpm n GLY 292 Ca 0.01 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.77 3dpm n GLY 292 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3dpm n PHE 293 N -0.03 0.00 -3.26 1.61 1.16 -1.18 0.27 117.46 116.03 3dpm n PHE 293 Ca 0.00 -0.26 -0.38 0.00 -1.87 0.00 0.00 57.45 54.94 3dpm n PHE 293 Cb 0.00 -0.03 -0.06 0.00 -1.61 0.00 0.00 39.48 37.79 3dpm n PHE 293 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3dpm s LEU 294 N -0.51 4.37 0.37 5.98 1.43 -1.26 -5.01 118.68 124.04 3dpm s LEU 294 Ca 0.00 1.03 -0.12 0.00 -1.03 0.00 0.00 54.13 54.00 3dpm s LEU 294 Cb 0.00 -2.82 -0.07 0.00 0.03 0.00 0.00 46.19 43.32 3dpm s LEU 294 CO 0.00 0.08 0.76 -2.16 0.23 0.00 0.00 176.35 175.25 3dpm s PRO 295 N 0.06 3.87 0.52 1.29 0.04 -1.26 -5.01 135.00 134.51 3dpm s PRO 295 Ca 0.29 0.55 -0.18 0.00 0.04 0.00 0.00 61.00 61.70 3dpm s PRO 295 Cb -0.17 -2.40 -0.13 0.00 0.04 0.00 0.00 34.50 31.84 3dpm s PRO 295 CO 0.15 0.04 0.09 1.33 0.04 0.00 0.00 177.00 178.64 3dpm n VAL 296 N -0.92 0.73 1.39 -0.36 0.24 -1.26 -4.88 118.33 113.27 3dpm n VAL 296 Ca 0.03 -0.50 0.14 0.00 -2.04 0.00 0.00 64.34 61.96 3dpm n VAL 296 Cb 0.54 -0.22 0.46 0.00 -1.47 0.00 0.00 33.84 33.15 3dpm n VAL 296 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 3dpm n ILE 297 N -1.55 0.00 -0.23 1.34 -0.00 -1.26 -4.98 119.36 112.68 3dpm n ILE 297 Ca 0.09 -0.21 0.00 0.00 -0.00 0.00 0.00 62.75 62.63 3dpm n ILE 297 Cb 0.47 0.48 0.00 0.00 -0.00 0.00 0.00 39.64 40.59 3dpm n ILE 297 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3dpm n GLY 298 N 1.24 -1.09 3.69 3.28 0.00 -1.26 -4.95 105.19 106.09 3dpm n GLY 298 Ca 0.16 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 3dpm n GLY 298 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dpm s PRO 299 N -1.85 4.14 -0.36 1.61 0.04 -1.26 -4.86 135.00 132.46 3dpm s PRO 299 Ca 0.00 2.59 -0.29 0.00 0.04 0.00 0.00 61.00 63.34 3dpm s PRO 299 Cb 0.00 -3.62 -0.00 0.00 0.04 0.00 0.00 34.50 30.92 3dpm s PRO 299 CO 0.00 -0.85 1.54 0.08 0.04 0.00 0.00 177.00 177.82 3dpm s VAL 300 N 2.81 3.77 -0.12 -0.36 1.01 -1.26 -3.72 120.40 122.53 3dpm s VAL 300 Ca 0.81 0.80 0.17 0.00 0.00 0.00 0.00 61.98 63.76 3dpm s VAL 300 Cb -0.46 -3.97 -0.19 0.00 0.00 0.00 0.00 36.38 31.77 3dpm s VAL 300 CO 0.36 -0.58 0.63 2.30 0.00 0.00 0.00 175.10 177.82 3dpm n ILE 301 N 7.04 1.10 -3.97 2.22 -5.35 -0.42 -4.95 119.36 115.02 3dpm n ILE 301 Ca 0.19 -0.70 -0.09 0.00 -0.27 0.00 0.00 62.75 61.88 3dpm n ILE 301 Cb 0.47 -0.61 -0.10 0.00 -1.74 0.00 0.00 39.64 37.67 3dpm n ILE 301 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 3dpm s TRP 302 N -2.90 0.29 -0.24 4.28 -0.00 -1.18 -4.98 118.94 114.21 3dpm s TRP 302 Ca -0.05 -0.66 -0.15 0.00 -0.00 0.00 0.00 56.10 55.24 3dpm s TRP 302 Cb 0.09 -0.21 0.07 0.00 -0.00 0.00 0.00 33.47 33.42 3dpm s TRP 302 CO 0.83 -0.36 0.61 -2.00 -0.00 0.00 0.00 176.95 176.03 3dpm s GLU 303 N -2.87 0.63 0.56 5.86 2.12 -1.26 -2.08 118.70 121.66 3dpm s GLU 303 Ca -0.03 1.04 -0.15 0.00 0.36 0.00 0.00 54.97 56.19 3dpm s GLU 303 Cb 0.00 0.14 -0.06 0.00 0.26 0.00 0.00 34.13 34.48 3dpm s GLU 303 CO -0.06 -0.14 1.02 0.45 -0.54 0.00 0.00 175.26 175.99 3dpm s SER 304 N 1.31 6.27 -0.03 -1.70 0.15 -0.64 -4.99 113.70 114.07 3dpm s SER 304 Ca -0.08 1.62 0.05 0.00 0.70 0.00 0.00 55.95 58.24 3dpm s SER 304 Cb -0.06 -2.51 0.07 0.00 -1.71 0.00 0.00 66.02 61.82 3dpm s SER 304 CO -0.14 -0.83 0.93 -0.62 1.20 0.00 0.00 173.24 173.78 3dpm n GLU 305 N -1.96 1.41 0.00 5.44 1.02 -1.26 -4.75 120.64 120.54 3dpm n GLU 305 Ca 0.07 -1.48 0.00 0.00 -0.02 0.00 0.00 57.16 55.73 3dpm n GLU 305 Cb 0.54 -0.94 0.00 0.00 -0.02 0.00 0.00 31.44 31.02 3dpm n GLU 305 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dpm n GLY 306 N -0.55 0.65 0.14 0.62 0.00 -1.26 -4.98 105.19 99.81 3dpm n GLY 306 Ca 0.04 -1.32 -0.23 0.00 0.00 0.00 0.00 46.02 44.51 3dpm n GLY 306 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dpm h LEU 307 N 0.00 0.68-10.45 0.99 5.85 -1.96 -3.47 115.31 106.95 3dpm h LEU 307 Ca 0.00 -0.93 -0.49 0.00 0.84 0.00 0.00 57.88 57.30 3dpm h LEU 307 Cb 0.00 -0.22 0.09 0.00 0.37 0.00 0.00 40.66 40.90 3dpm h LEU 307 CO 0.00 1.63 0.39 -0.36 -0.34 0.00 0.00 178.44 179.76 3dpm s PHE 308 N -2.54 3.16 -0.39 1.25 0.40 -1.26 -4.98 117.98 113.62 3dpm s PHE 308 Ca -0.12 1.09 -0.10 0.00 -0.60 0.00 0.00 56.93 57.20 3dpm s PHE 308 Cb 0.03 -3.08 0.05 0.00 0.51 0.00 0.00 43.02 40.53 3dpm s PHE 308 CO 0.89 -1.38 0.22 0.50 0.70 0.00 0.00 175.22 176.15 3dpm s ARG 309 N -5.29 2.73 -0.02 0.44 3.52 -1.26 -4.77 118.95 114.30 3dpm s ARG 309 Ca 0.59 -1.22 -0.09 0.00 -0.13 0.00 0.00 55.73 54.87 3dpm s ARG 309 Cb -0.12 -3.73 0.01 0.00 -1.56 0.00 0.00 34.95 29.55 3dpm s ARG 309 CO 0.53 -0.79 0.20 0.00 -0.81 0.00 0.00 175.30 174.43 3dpm s ALA 310 N 1.50 -0.50 0.14 6.12 0.00 -1.26 -2.40 121.76 125.36 3dpm s ALA 310 Ca 0.02 0.18 -0.25 0.00 0.00 0.00 0.00 51.96 51.91 3dpm s ALA 310 Cb -0.21 -0.03 0.06 0.00 0.00 0.00 0.00 23.12 22.95 3dpm s ALA 310 CO 0.05 -0.19 0.91 1.52 0.00 0.00 0.00 175.76 178.04 3dpm s TYR 311 N -0.97 -0.19 -0.07 0.00 -0.85 -0.84 -1.62 117.35 112.81 3dpm s TYR 311 Ca -0.10 -0.11 0.04 0.00 -0.52 0.00 0.00 57.07 56.38 3dpm s TYR 311 Cb -0.05 0.63 -0.02 0.00 0.38 0.00 0.00 41.96 42.90 3dpm s TYR 311 CO 0.02 -0.83 -0.19 0.42 -1.52 0.00 0.00 175.55 173.45 3dpm s ILE 312 N -3.35 2.62 0.16 -3.49 1.01 -0.89 -0.75 121.20 116.51 3dpm s ILE 312 Ca 0.11 -0.86 0.07 0.00 0.00 0.00 0.00 60.65 59.96 3dpm s ILE 312 Cb -0.02 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 3dpm s ILE 312 CO 0.00 0.57 -0.14 -0.44 0.00 0.00 0.00 174.94 174.93 3dpm s SER 313 N -0.23 2.23 -0.50 3.58 0.01 0.61 -1.29 113.70 118.11 3dpm s SER 313 Ca -0.00 -0.92 -0.09 0.00 1.31 0.00 0.00 55.95 56.25 3dpm s SER 313 Cb -0.13 -0.09 0.13 0.00 0.21 0.00 0.00 66.02 66.13 3dpm s SER 313 CO 0.03 -0.17 0.37 -0.94 0.41 0.00 0.00 173.24 172.94 3dpm s SER 314 N -2.87 5.73 -0.41 2.44 1.04 -1.24 0.20 113.70 118.59 3dpm s SER 314 Ca 0.15 -2.00 -0.20 0.00 0.48 0.00 0.00 55.95 54.39 3dpm s SER 314 Cb -0.02 -2.02 0.02 0.00 0.10 0.00 0.00 66.02 64.10 3dpm s SER 314 CO 0.04 -0.68 0.61 -0.69 0.98 0.00 0.00 173.24 173.51 3dpm s VAL 315 N 1.24 4.88 -0.45 5.02 1.01 0.25 -4.73 120.40 127.63 3dpm s VAL 315 Ca 0.07 0.20 -0.26 0.00 0.00 0.00 0.00 61.98 61.99 3dpm s VAL 315 Cb -0.25 -4.14 0.03 0.00 0.00 0.00 0.00 36.38 32.01 3dpm s VAL 315 CO -0.01 -0.48 0.98 0.42 0.00 0.00 0.00 175.10 176.01 3dpm s THR 316 N 2.70 4.42 0.00 3.92 -4.23 -1.26 -0.99 115.64 120.19 3dpm s THR 316 Ca 0.22 0.97 0.00 0.00 -1.18 0.00 0.00 61.69 61.69 3dpm s THR 316 Cb -0.15 -4.46 0.00 0.00 1.34 0.00 0.00 72.50 69.23 3dpm s THR 316 CO 0.17 -0.82 0.00 -0.90 -0.54 0.00 0.00 174.62 172.53 3dpm n ASP 317 N 7.27 -1.46 0.26 3.99 3.85 -0.40 -4.64 116.55 125.42 3dpm n ASP 317 Ca 0.08 0.00 0.18 0.00 -0.71 0.00 0.00 54.79 54.34 3dpm n ASP 317 Cb 0.49 0.00 0.91 0.00 -1.35 0.00 0.00 41.12 41.17 3dpm n ASP 317 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 3dpm h GLY 318 N -0.73 0.00 -4.23 6.12 0.00 -1.96 -2.61 103.07 99.66 3dpm h GLY 318 Ca 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.67 3dpm h GLY 318 CO 0.00 0.00 0.33 1.22 0.00 0.00 0.00 176.54 178.09 3dpm n ASP 319 N -3.57 6.66 0.00 0.19 9.92 -1.26 -4.91 116.55 123.58 3dpm n ASP 319 Ca -0.00 -3.78 0.00 0.00 -0.53 0.00 0.00 54.79 50.47 3dpm n ASP 319 Cb 0.25 -0.79 0.00 0.00 -0.64 0.00 0.00 41.12 39.94 3dpm n ASP 319 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3dpm n GLY 320 N -0.73 0.00 3.61 0.44 0.00 -0.98 -4.86 105.19 102.66 3dpm n GLY 320 Ca 0.54 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.13 3dpm n GLY 320 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dpm s LYS 321 N -0.46 3.73 0.16 1.61 2.47 -1.26 -4.74 119.74 121.25 3dpm s LYS 321 Ca 0.00 0.99 -0.30 0.00 -1.56 0.00 0.00 55.97 55.10 3dpm s LYS 321 Cb 0.00 -3.95 -0.08 0.00 -1.46 0.00 0.00 37.83 32.35 3dpm s LYS 321 CO 0.00 -1.36 1.25 -1.12 0.16 0.00 0.00 175.35 174.28 3dpm s SER 322 N 3.23 7.00 0.02 1.43 0.01 -1.26 -1.28 113.70 122.85 3dpm s SER 322 Ca 0.57 2.25 0.08 0.00 1.31 0.00 0.00 55.95 60.15 3dpm s SER 322 Cb -0.14 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.47 3dpm s SER 322 CO 0.29 -0.46 -0.22 -1.00 0.41 0.00 0.00 173.24 172.25 3dpm s HIS 323 N 0.33 1.97 -0.38 2.43 3.76 -0.16 -4.91 115.29 118.33 3dpm s HIS 323 Ca 0.56 -0.38 -0.21 0.00 -0.15 0.00 0.00 55.06 54.89 3dpm s HIS 323 Cb -0.34 -1.21 0.01 0.00 1.11 0.00 0.00 32.58 32.16 3dpm s HIS 323 CO 0.35 0.06 0.65 0.15 -0.85 0.00 0.00 174.74 175.09 3dpm s LYS 324 N -0.97 3.58 -0.09 1.40 1.02 -1.26 -0.58 119.74 122.84 3dpm s LYS 324 Ca 0.09 -0.04 0.03 0.00 0.02 0.00 0.00 55.97 56.06 3dpm s LYS 324 Cb -0.09 -3.85 -0.01 0.00 -0.52 0.00 0.00 37.83 33.36 3dpm s LYS 324 CO 0.01 -0.82 -0.18 0.08 -0.92 0.00 0.00 175.35 173.52 3dpm s VAL 325 N 2.78 2.65 0.34 3.17 1.01 0.13 -0.25 120.40 130.22 3dpm s VAL 325 Ca 0.24 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.37 3dpm s VAL 325 Cb -0.14 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 3dpm s VAL 325 CO 0.16 0.55 0.58 -0.83 0.00 0.00 0.00 175.10 175.56 3dpm s GLY 326 N 0.03 1.58 -0.05 4.51 0.00 -0.78 -0.28 107.32 112.32 3dpm s GLY 326 Ca -0.07 -0.72 -0.00 0.00 0.00 0.00 0.00 44.72 43.94 3dpm s GLY 326 CO 0.05 -0.62 -0.02 -0.12 0.00 0.00 0.00 173.10 172.39 3dpm s PHE 327 N -2.27 0.61 -0.01 1.90 5.36 0.07 -1.23 117.98 122.41 3dpm s PHE 327 Ca 0.42 -0.14 0.02 0.00 -0.96 0.00 0.00 56.93 56.28 3dpm s PHE 327 Cb -0.10 -0.65 -0.00 0.00 -0.34 0.00 0.00 43.02 41.92 3dpm s PHE 327 CO 0.35 -0.23 -0.07 -1.17 -1.46 0.00 0.00 175.22 172.63 3dpm s LEU 328 N 1.35 1.89 -0.17 6.12 1.98 -0.37 -1.98 118.68 127.49 3dpm s LEU 328 Ca -0.05 -0.14 -0.01 0.00 -2.89 0.00 0.00 54.13 51.04 3dpm s LEU 328 Cb -0.13 -0.42 -0.01 0.00 0.66 0.00 0.00 46.19 46.29 3dpm s LEU 328 CO -0.02 0.07 -0.11 -0.60 -1.89 0.00 0.00 176.35 173.80 3dpm s ARG 329 N 0.02 3.31 -0.53 1.98 3.52 -1.01 0.59 118.95 126.83 3dpm s ARG 329 Ca 0.00 -0.69 -0.15 0.00 -0.13 0.00 0.00 55.73 54.76 3dpm s ARG 329 Cb -0.05 -2.76 0.13 0.00 -1.56 0.00 0.00 34.95 30.71 3dpm s ARG 329 CO -0.00 -0.01 0.48 0.42 -0.81 0.00 0.00 175.30 175.39 3dpm s ILE 330 N 0.92 5.08 0.09 4.11 -1.09 -0.59 -4.53 121.20 125.19 3dpm s ILE 330 Ca -0.02 -1.55 -0.13 0.00 -2.23 0.00 0.00 60.65 56.72 3dpm s ILE 330 Cb -0.15 -4.27 -0.18 0.00 -1.58 0.00 0.00 42.46 36.28 3dpm s ILE 330 CO -0.01 -0.86 1.26 1.55 -1.23 0.00 0.00 174.94 175.66 3dpm h PRO 331 N 8.82 0.76 -3.25 2.79 0.13 -1.82 -3.42 132.00 136.02 3dpm h PRO 331 Ca -0.28 -0.69 0.01 0.00 -0.87 0.00 0.00 66.00 64.16 3dpm h PRO 331 Cb 1.10 0.17 -0.08 0.00 0.13 0.00 0.00 31.00 32.31 3dpm h PRO 331 CO 1.01 1.28 0.08 -0.08 -0.23 0.00 0.00 178.00 180.07 3dpm s THR 332 N -3.58 0.01 -1.18 1.56 -1.32 -1.26 -3.97 115.64 105.89 3dpm s THR 332 Ca -0.10 -1.01 0.11 0.00 -1.21 0.00 0.00 61.69 59.47 3dpm s THR 332 Cb 0.08 -1.91 0.17 0.00 -1.51 0.00 0.00 72.50 69.33 3dpm s THR 332 CO 0.91 -0.03 1.00 -1.22 -2.21 0.00 0.00 174.62 173.08 3dpm n TYR 333 N -0.41 0.18 -3.11 9.09 4.02 -0.84 -4.63 117.16 121.46 3dpm n TYR 333 Ca -0.05 -0.20 -0.38 0.00 -0.01 0.00 0.00 57.90 57.26 3dpm n TYR 333 Cb 0.61 -0.01 -0.02 0.00 -0.02 0.00 0.00 39.34 39.90 3dpm n TYR 333 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3dpm n SER 334 N 0.56 5.66 -0.68 7.72 3.41 -1.23 -1.18 113.62 127.89 3dpm n SER 334 Ca 0.08 -3.44 0.51 0.00 -0.26 0.00 0.00 58.87 55.77 3dpm n SER 334 Cb 0.33 -1.08 0.80 0.00 -0.26 0.00 0.00 64.21 64.00 3dpm n SER 334 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 3dpm n TRP 335 N 1.10 0.09 0.22 7.33 4.27 -1.26 -0.28 117.44 128.91 3dpm n TRP 335 Ca 0.28 0.09 0.08 0.00 -3.89 0.00 0.00 57.50 54.06 3dpm n TRP 335 Cb 0.35 -0.57 0.51 0.00 -1.36 0.00 0.00 31.31 30.24 3dpm n TRP 335 CO 0.00 0.00 0.00 1.96 -2.29 0.00 0.00 177.69 177.36 3dpm h GLN 336 N 0.00 0.00 -0.01 -2.67 4.20 -1.99 -2.71 115.11 111.93 3dpm h GLN 336 Ca 0.93 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.64 3dpm h GLN 336 Cb 3.64 0.00 0.00 0.00 0.30 0.00 0.00 27.48 31.42 3dpm h GLN 336 CO -0.07 0.25 -0.23 -0.25 -0.67 0.00 0.00 178.83 177.87 3dpm n ASP 337 N -3.76 1.14 -4.53 1.46 8.00 0.62 -4.86 116.55 114.62 3dpm n ASP 337 Ca -0.01 -1.00 -0.36 0.00 0.71 0.00 0.00 54.79 54.12 3dpm n ASP 337 Cb 0.35 0.13 0.08 0.00 -0.02 0.00 0.00 41.12 41.66 3dpm n ASP 337 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3dpm n MET 338 N -0.50 0.36 -1.96 -1.24 2.81 -1.02 -4.88 117.12 110.69 3dpm n MET 338 Ca 0.13 0.17 -0.42 0.00 -1.81 0.00 0.00 57.70 55.77 3dpm n MET 338 Cb 0.36 -2.00 -0.03 0.00 -0.71 0.00 0.00 33.22 30.83 3dpm n MET 338 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 3dpm s GLU 339 N -3.05 4.22 -0.10 0.03 2.02 -1.26 -2.53 118.70 118.03 3dpm s GLU 339 Ca 0.69 2.32 0.00 0.00 0.02 0.00 0.00 54.97 58.00 3dpm s GLU 339 Cb -0.34 -3.26 0.00 0.00 0.10 0.00 0.00 34.13 30.63 3dpm s GLU 339 CO 0.55 -0.62 0.00 -0.25 0.02 0.00 0.00 175.26 174.96 3dpm n ASP 340 N 4.31 -4.84 -4.77 -0.19 8.00 -1.26 -4.96 116.55 112.83 3dpm n ASP 340 Ca 0.14 0.02 -0.40 0.00 0.71 0.00 0.00 54.79 55.26 3dpm n ASP 340 Cb 0.39 -2.43 0.00 0.00 -0.02 0.00 0.00 41.12 39.07 3dpm n ASP 340 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3dpm s PHE 341 N -1.46 2.63 -0.20 1.24 5.36 -1.05 -5.00 117.98 119.50 3dpm s PHE 341 Ca 0.00 1.27 -0.00 0.00 -0.96 0.00 0.00 56.93 57.24 3dpm s PHE 341 Cb 0.00 -3.89 0.05 0.00 -0.34 0.00 0.00 43.02 38.84 3dpm s PHE 341 CO 0.00 -2.70 -0.04 0.34 -1.46 0.00 0.00 175.22 171.37 3dpm s ASP 342 N -0.41 3.28 0.18 6.13 -1.08 -1.26 -5.02 116.67 118.48 3dpm s ASP 342 Ca 0.56 -0.91 -0.14 0.00 -0.52 0.00 0.00 52.55 51.54 3dpm s ASP 342 Cb -0.43 -0.97 0.15 0.00 -1.46 0.00 0.00 42.92 40.20 3dpm s ASP 342 CO 0.57 -0.23 1.74 1.55 0.52 0.00 0.00 175.17 179.32 3dpm h PRO 343 N 8.07 0.29 -4.27 4.34 0.13 -1.96 -3.22 132.00 135.39 3dpm h PRO 343 Ca -0.20 -0.02 -0.68 0.00 -0.87 0.00 0.00 66.00 64.23 3dpm h PRO 343 Cb 1.10 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 3dpm h PRO 343 CO 0.40 0.19 2.77 -1.13 -0.23 0.00 0.00 178.00 180.00 3dpm n SER 344 N -5.04 3.41 0.00 1.44 3.41 -1.26 -4.77 113.62 110.82 3dpm n SER 344 Ca 0.04 -2.78 0.00 0.00 -0.26 0.00 0.00 58.87 55.87 3dpm n SER 344 Cb 0.19 -1.47 0.00 0.00 -0.26 0.00 0.00 64.21 62.67 3dpm n SER 344 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dpm n GLY 345 N 4.33 -0.08 3.67 5.00 0.00 -1.22 -5.14 105.19 111.75 3dpm n GLY 345 Ca 0.51 -1.08 -0.46 0.00 0.00 0.00 0.00 46.02 44.99 3dpm n GLY 345 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dpm n PRO 346 N -0.49 2.15 -2.03 1.61 -0.04 -1.26 -4.97 135.00 129.97 3dpm n PRO 346 Ca 0.00 0.77 -0.36 0.00 -0.04 0.00 0.00 63.50 63.88 3dpm n PRO 346 Cb 0.00 -2.54 0.03 0.00 -0.04 0.00 0.00 33.50 30.95 3dpm n PRO 346 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3dpm s PRO 347 N 0.86 3.00 0.49 0.54 0.04 -1.26 -4.91 135.00 133.77 3dpm s PRO 347 Ca 0.78 1.77 0.23 0.00 0.04 0.00 0.00 61.00 63.83 3dpm s PRO 347 Cb -0.68 -1.94 1.29 0.00 0.04 0.00 0.00 34.50 33.21 3dpm s PRO 347 CO 0.38 -1.17 1.94 -1.00 0.04 0.00 0.00 177.00 177.20 3dpm h PRO 348 N 0.87 0.15 0.00 0.56 0.13 -1.93 -0.18 132.00 131.59 3dpm h PRO 348 Ca -0.50 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 64.55 3dpm h PRO 348 Cb 1.29 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 3dpm h PRO 348 CO 0.55 0.10 -0.34 0.11 -0.23 0.00 0.00 178.00 178.18 3dpm h TRP 349 N 0.15 0.00 -0.12 1.56 0.09 -1.92 -1.08 115.95 114.63 3dpm h TRP 349 Ca 0.34 0.00 -0.16 0.00 0.09 0.00 0.00 58.89 59.16 3dpm h TRP 349 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 30.34 3dpm h TRP 349 CO -0.00 0.34 -0.60 0.93 0.09 0.00 0.00 178.44 179.20 3dpm h GLU 350 N 0.00 0.40 -0.03 0.12 5.08 -1.39 -1.87 114.58 116.89 3dpm h GLU 350 Ca -0.00 -0.27 -0.14 0.00 -1.00 0.00 0.00 59.36 57.94 3dpm h GLU 350 Cb 0.66 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 3dpm h GLU 350 CO 0.04 0.88 -0.63 1.49 -1.00 0.00 0.00 179.01 179.80 3dpm h GLU 351 N 0.30 0.11 -0.65 2.33 4.81 -1.31 -2.31 114.58 117.86 3dpm h GLU 351 Ca -0.00 -0.08 -0.06 0.00 -0.13 0.00 0.00 59.36 59.08 3dpm h GLU 351 Cb 1.13 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.50 3dpm h GLU 351 CO 0.10 0.71 0.15 0.35 -0.73 0.00 0.00 179.01 179.59 3dpm h PHE 352 N 0.08 1.09 -0.83 0.92 3.57 -0.98 -1.53 116.94 119.27 3dpm h PHE 352 Ca -0.01 -0.13 -0.03 0.00 3.53 0.00 0.00 57.97 61.32 3dpm h PHE 352 Cb 1.13 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 39.53 3dpm h PHE 352 CO 0.01 0.91 0.38 0.00 -2.23 0.00 0.00 178.31 177.38 3dpm h ALA 353 N 1.06 1.07 0.15 2.41 0.00 -1.08 -1.39 119.26 121.47 3dpm h ALA 353 Ca 0.20 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3dpm h ALA 353 Cb 0.37 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3dpm h ALA 353 CO 0.00 0.65 -0.07 0.87 0.00 0.00 0.00 179.25 180.70 3dpm h LYS 354 N 1.18 -0.19 -0.81 0.00 1.79 -0.94 -1.66 116.57 115.94 3dpm h LYS 354 Ca 0.28 0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.82 3dpm h LYS 354 Cb 0.14 0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 30.78 3dpm h LYS 354 CO -0.03 -0.07 0.50 0.82 -1.08 0.00 0.00 179.45 179.58 3dpm h ILE 355 N -0.27 1.06 -0.51 1.86 1.08 -1.06 -2.42 117.51 117.24 3dpm h ILE 355 Ca -0.02 -0.32 -0.09 0.00 -0.39 0.00 0.00 64.86 64.04 3dpm h ILE 355 Cb 0.21 0.04 -0.02 0.00 -3.07 0.00 0.00 36.82 33.98 3dpm h ILE 355 CO 0.03 0.17 -0.03 0.40 -0.69 0.00 0.00 178.15 178.03 3dpm h ILE 356 N 0.93 1.26 -0.59 -0.67 1.08 -1.07 -2.32 117.51 116.13 3dpm h ILE 356 Ca 0.34 -1.11 0.04 0.00 -0.39 0.00 0.00 64.86 63.74 3dpm h ILE 356 Cb 0.12 0.90 -0.03 0.00 -3.07 0.00 0.00 36.82 34.74 3dpm h ILE 356 CO -0.16 0.39 0.39 1.56 -0.69 0.00 0.00 178.15 179.64 3dpm h GLN 357 N 0.81 0.65 -0.40 2.37 4.20 -0.82 -0.57 115.11 121.36 3dpm h GLN 357 Ca 0.15 -0.04 -0.14 0.00 0.06 0.00 0.00 58.65 58.67 3dpm h GLN 357 Cb 0.53 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 3dpm h GLN 357 CO 0.03 0.43 -0.31 0.28 -0.67 0.00 0.00 178.83 178.59 3dpm h VAL 358 N 0.67 1.28 -0.04 -0.54 2.07 -1.15 -3.15 116.25 115.39 3dpm h VAL 358 Ca 0.24 -1.48 -0.14 0.00 0.82 0.00 0.00 66.70 66.14 3dpm h VAL 358 Cb 0.11 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3dpm h VAL 358 CO -0.06 0.50 -0.60 -0.26 0.02 0.00 0.00 177.57 177.16 3dpm h PHE 359 N 0.73 0.17 0.00 1.57 0.05 -0.89 0.18 116.94 118.75 3dpm h PHE 359 Ca 0.07 -0.06 -0.02 0.00 3.82 0.00 0.00 57.97 61.78 3dpm h PHE 359 Cb 0.90 -0.03 -0.00 0.00 2.00 0.00 0.00 35.95 38.82 3dpm h PHE 359 CO 0.06 0.70 -0.09 0.77 -0.18 0.00 0.00 178.31 179.57 3dpm h SER 360 N 0.10 0.00 0.02 2.17 0.02 -1.09 -2.44 113.55 112.34 3dpm h SER 360 Ca -0.01 0.00 -0.39 0.00 -0.84 0.00 0.00 61.79 60.55 3dpm h SER 360 Cb 1.08 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.57 3dpm h SER 360 CO 0.09 0.09 -2.33 -1.20 -1.14 0.00 0.00 176.83 172.33 3dpm n SER 361 N -3.90 2.00 -1.42 3.07 7.64 -1.05 -4.71 113.62 115.25 3dpm n SER 361 Ca -0.02 0.05 -0.10 0.00 1.01 0.00 0.00 58.87 59.81 3dpm n SER 361 Cb 0.18 -0.61 0.18 0.00 -1.01 0.00 0.00 64.21 62.95 3dpm n SER 361 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3dpm n ASN 362 N -3.57 3.01 -3.80 6.43 3.02 0.03 -5.01 115.26 115.36 3dpm n ASN 362 Ca -0.44 -3.77 -0.09 0.00 -0.03 0.00 0.00 54.58 50.24 3dpm n ASN 362 Cb 0.96 -0.67 -0.07 0.00 -0.61 0.00 0.00 39.78 39.40 3dpm n ASN 362 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3dpm s THR 363 N -3.42 0.12 -0.39 3.41 -4.23 -0.92 -4.76 115.64 105.45 3dpm s THR 363 Ca 0.48 -1.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.02 3dpm s THR 363 Cb 0.42 -1.26 0.00 0.00 1.34 0.00 0.00 72.50 73.01 3dpm s THR 363 CO 0.01 -0.55 0.44 -0.62 -0.54 0.00 0.00 174.62 173.35 3dpm n GLU 364 N -0.03 2.17 -3.61 3.99 1.02 0.66 -4.86 120.64 119.99 3dpm n GLU 364 Ca -0.16 -0.44 -0.07 0.00 -0.02 0.00 0.00 57.16 56.48 3dpm n GLU 364 Cb 0.62 -0.91 -0.02 0.00 -0.02 0.00 0.00 31.44 31.11 3dpm n GLU 364 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dpm s ALA 365 N -0.78 -1.71 -0.04 0.62 0.00 -1.25 -4.60 121.76 114.01 3dpm s ALA 365 Ca 0.04 0.56 -0.01 0.00 0.00 0.00 0.00 51.96 52.54 3dpm s ALA 365 Cb 0.03 0.57 0.03 0.00 0.00 0.00 0.00 23.12 23.76 3dpm s ALA 365 CO 0.10 -0.85 0.07 -1.17 0.00 0.00 0.00 175.76 173.91 3dpm s LEU 366 N -2.71 0.82 -0.25 0.00 0.20 -1.08 -1.87 118.68 113.78 3dpm s LEU 366 Ca 0.08 0.12 -0.08 0.00 0.69 0.00 0.00 54.13 54.93 3dpm s LEU 366 Cb -0.01 0.04 -0.04 0.00 -0.43 0.00 0.00 46.19 45.75 3dpm s LEU 366 CO -0.04 -0.16 0.10 -0.63 -0.29 0.00 0.00 176.35 175.34 3dpm s ILE 367 N 1.30 4.63 -0.30 6.68 1.09 -0.37 -0.95 121.20 133.28 3dpm s ILE 367 Ca -0.07 -0.06 -0.10 0.00 -1.10 0.00 0.00 60.65 59.32 3dpm s ILE 367 Cb -0.13 -3.18 -0.02 0.00 -1.06 0.00 0.00 42.46 38.08 3dpm s ILE 367 CO -0.04 0.32 0.16 -0.63 -0.10 0.00 0.00 174.94 174.65 3dpm s ILE 368 N 1.59 4.82 -0.52 2.92 -1.09 0.15 -1.24 121.20 127.83 3dpm s ILE 368 Ca 0.06 -0.21 -0.22 0.00 -2.23 0.00 0.00 60.65 58.05 3dpm s ILE 368 Cb -0.15 -3.39 0.04 0.00 -1.58 0.00 0.00 42.46 37.38 3dpm s ILE 368 CO 0.06 0.14 0.79 -0.62 -1.23 0.00 0.00 174.94 174.08 3dpm s ASP 369 N 1.66 6.30 -0.15 3.58 3.68 0.20 -0.37 116.67 131.58 3dpm s ASP 369 Ca 0.06 -0.53 0.17 0.00 2.13 0.00 0.00 52.55 54.38 3dpm s ASP 369 Cb -0.17 -2.37 0.35 0.00 -1.45 0.00 0.00 42.92 39.28 3dpm s ASP 369 CO 0.08 -1.04 1.20 1.67 0.13 0.00 0.00 175.17 177.21 3dpm n GLN 370 N 6.83 1.54 -1.59 4.34 7.27 -0.55 -1.54 117.38 133.68 3dpm n GLN 370 Ca -0.01 -2.74 -0.31 0.00 0.07 0.00 0.00 57.00 54.01 3dpm n GLN 370 Cb 0.47 -1.57 0.05 0.00 2.41 0.00 0.00 30.24 31.60 3dpm n GLN 370 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 3dpm s THR 371 N -2.94 3.89 -1.31 1.69 -4.23 -1.12 -4.14 115.64 107.48 3dpm s THR 371 Ca 0.35 0.61 -0.08 0.00 -1.18 0.00 0.00 61.69 61.39 3dpm s THR 371 Cb 0.30 -3.38 -0.00 0.00 1.34 0.00 0.00 72.50 70.77 3dpm s THR 371 CO 0.02 -0.80 0.56 0.59 -0.54 0.00 0.00 174.62 174.45 3dpm n ASN 372 N -3.16 -2.03 -4.23 3.99 4.13 -1.20 -4.83 115.26 107.93 3dpm n ASN 372 Ca 0.07 -1.02 -0.33 0.00 1.68 0.00 0.00 54.58 54.99 3dpm n ASN 372 Cb 0.54 -3.13 -0.16 0.00 -1.54 0.00 0.00 39.78 35.49 3dpm n ASN 372 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 3dpm s ASN 373 N -4.06 3.44 0.00 6.41 3.84 -0.63 0.05 114.94 123.99 3dpm s ASN 373 Ca 0.17 -0.52 0.31 0.00 0.21 0.00 0.00 52.86 53.02 3dpm s ASN 373 Cb -0.06 -1.51 1.64 0.00 -0.55 0.00 0.00 41.25 40.76 3dpm s ASN 373 CO 0.88 0.09 2.10 -0.81 -2.79 0.00 0.00 177.10 176.56 3dpm n PRO 374 N 4.04 0.81 0.00 0.43 -0.04 -1.26 -1.90 135.00 137.08 3dpm n PRO 374 Ca -0.19 -0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.18 3dpm n PRO 374 Cb 0.52 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 3dpm n PRO 374 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dpm n GLY 375 N 1.14 -1.48 0.00 0.55 0.00 -1.24 -4.56 105.19 99.60 3dpm n GLY 375 Ca 0.19 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3dpm n GLY 375 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dpm n GLY 376 N 0.00 0.03 3.65 -0.02 0.00 -1.26 -1.99 105.19 105.61 3dpm n GLY 376 Ca 0.00 -0.64 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 3dpm n GLY 376 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dpm s SER 377 N -4.00 6.74 0.15 1.61 0.15 -0.32 -4.71 113.70 113.32 3dpm s SER 377 Ca 0.00 1.86 -0.16 0.00 0.70 0.00 0.00 55.95 58.35 3dpm s SER 377 Cb 0.00 -2.54 0.03 0.00 -1.71 0.00 0.00 66.02 61.81 3dpm s SER 377 CO 0.00 -0.91 1.79 0.58 1.20 0.00 0.00 173.24 175.89 3dpm h VAL 378 N 5.65 1.02 -0.66 4.45 2.07 -1.99 -2.00 116.25 124.78 3dpm h VAL 378 Ca -0.32 -0.14 0.03 0.00 0.82 0.00 0.00 66.70 67.09 3dpm h VAL 378 Cb 1.14 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.43 3dpm h VAL 378 CO 0.97 0.08 0.41 -0.07 0.02 0.00 0.00 177.57 178.97 3dpm h LEU 379 N 0.42 0.66 -1.26 2.57 3.38 -1.92 0.08 115.31 119.24 3dpm h LEU 379 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3dpm h LEU 379 Cb 0.03 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3dpm h LEU 379 CO -0.08 0.46 0.31 0.22 0.09 0.00 0.00 178.44 179.43 3dpm h TYR 380 N 0.79 0.80 -0.55 1.13 3.20 -1.63 0.42 116.97 121.13 3dpm h TYR 380 Ca 0.27 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 62.03 3dpm h TYR 380 Cb 0.04 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 3dpm h TYR 380 CO -0.05 0.57 -0.02 1.25 -1.64 0.00 0.00 178.16 178.27 3dpm h LEU 381 N 0.82 0.97 -1.00 2.82 7.12 -0.41 -2.18 115.31 123.45 3dpm h LEU 381 Ca 0.21 -0.31 -0.09 0.00 0.13 0.00 0.00 57.88 57.82 3dpm h LEU 381 Cb 0.05 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 39.90 3dpm h LEU 381 CO -0.03 1.05 -0.23 1.88 -0.13 0.00 0.00 178.44 180.97 3dpm h TYR 382 N 0.87 0.49 0.46 1.25 0.05 -0.11 -2.08 116.97 117.89 3dpm h TYR 382 Ca 0.15 -0.10 -0.01 0.00 0.05 0.00 0.00 58.73 58.82 3dpm h TYR 382 Cb 0.56 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.17 3dpm h TYR 382 CO 0.04 0.64 -0.30 0.00 -1.05 0.00 0.00 178.16 177.50 3dpm h ALA 383 N 1.36 -0.73 -0.69 3.88 0.00 -0.52 -0.78 119.26 121.79 3dpm h ALA 383 Ca 0.06 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.86 3dpm h ALA 383 Cb 0.63 0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 3dpm h ALA 383 CO 0.04 -0.93 0.44 -0.07 0.00 0.00 0.00 179.25 178.73 3dpm h LEU 384 N -0.73 0.72 -1.75 0.00 3.38 -1.34 -2.07 115.31 113.52 3dpm h LEU 384 Ca -0.05 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3dpm h LEU 384 Cb 0.60 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 3dpm h LEU 384 CO 0.04 0.51 -0.15 -0.07 0.09 0.00 0.00 178.44 178.86 3dpm h LEU 385 N 0.86 0.00 -0.43 1.67 3.38 -1.15 -1.87 115.31 117.77 3dpm h LEU 385 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 3dpm h LEU 385 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3dpm h LEU 385 CO -0.10 0.15 0.00 0.77 0.09 0.00 0.00 178.44 179.35 3dpm h SER 386 N 0.00 0.00 -0.53 -0.43 4.64 -0.42 -2.90 113.55 113.92 3dpm h SER 386 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dpm h SER 386 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3dpm h SER 386 CO 0.02 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.21 3dpm n MET 387 N -2.58 2.34 -0.05 4.77 2.81 -0.71 0.11 117.12 123.82 3dpm n MET 387 Ca 0.03 -2.08 0.03 0.00 -1.81 0.00 0.00 57.70 53.88 3dpm n MET 387 Cb 0.38 -1.46 0.05 0.00 -0.71 0.00 0.00 33.22 31.47 3dpm n MET 387 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3dpm n LEU 388 N 1.21 1.87 -3.81 4.03 4.77 -1.09 -2.77 117.00 121.20 3dpm n LEU 388 Ca 0.19 -2.15 -0.11 0.00 -0.03 0.00 0.00 56.01 53.91 3dpm n LEU 388 Cb 0.50 -0.14 -0.08 0.00 -2.33 0.00 0.00 43.42 41.37 3dpm n LEU 388 CO 0.14 0.52 -0.05 0.28 -1.33 0.00 0.00 177.39 176.95 3dpm s THR 389 N -1.49 0.09 -0.45 -5.08 -1.32 -1.24 -4.48 115.64 101.67 3dpm s THR 389 Ca 0.10 -0.77 0.04 0.00 -1.21 0.00 0.00 61.69 59.86 3dpm s THR 389 Cb 0.09 -0.86 0.08 0.00 -1.51 0.00 0.00 72.50 70.29 3dpm s THR 389 CO 0.01 -0.42 0.86 -0.90 -2.21 0.00 0.00 174.62 171.96 3dpm n ASP 390 N 0.75 1.85 -4.15 8.08 5.68 -1.26 -4.52 116.55 122.97 3dpm n ASP 390 Ca -0.19 -1.58 -0.17 0.00 -0.50 0.00 0.00 54.79 52.34 3dpm n ASP 390 Cb 0.59 -0.04 -0.12 0.00 -1.14 0.00 0.00 41.12 40.40 3dpm n ASP 390 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3dpm s ARG 391 N -0.67 0.77 0.63 0.11 1.70 -1.26 -4.90 118.95 115.32 3dpm s ARG 391 Ca 0.07 -0.92 -0.18 0.00 -0.47 0.00 0.00 55.73 54.23 3dpm s ARG 391 Cb 0.04 -0.73 -0.02 0.00 -0.57 0.00 0.00 34.95 33.67 3dpm s ARG 391 CO 0.06 0.16 1.22 -1.25 -1.08 0.00 0.00 175.30 174.41 3dpm s PRO 392 N -1.70 2.73 -0.05 3.89 0.04 -1.26 -4.63 135.00 134.01 3dpm s PRO 392 Ca -0.03 1.84 0.06 0.00 0.04 0.00 0.00 61.00 62.91 3dpm s PRO 392 Cb -0.10 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 3dpm s PRO 392 CO 0.02 -1.40 -0.25 -0.51 0.04 0.00 0.00 177.00 174.90 3dpm s LEU 393 N -4.36 2.10 0.36 -3.56 1.43 -0.59 -4.92 118.68 109.12 3dpm s LEU 393 Ca 0.77 -0.49 -0.27 0.00 -1.03 0.00 0.00 54.13 53.11 3dpm s LEU 393 Cb -0.31 -1.38 -0.09 0.00 0.03 0.00 0.00 46.19 44.44 3dpm s LEU 393 CO 0.37 0.26 1.16 -1.61 0.23 0.00 0.00 176.35 176.76 3dpm s GLU 394 N -0.24 4.28 0.08 1.70 0.41 -1.26 0.22 118.70 123.88 3dpm s GLU 394 Ca -0.01 1.86 0.06 0.00 -0.41 0.00 0.00 54.97 56.47 3dpm s GLU 394 Cb -0.13 -2.87 -0.04 0.00 -1.78 0.00 0.00 34.13 29.31 3dpm s GLU 394 CO 0.03 -0.13 -0.08 -0.51 -0.49 0.00 0.00 175.26 174.08 3dpm s LEU 395 N -2.10 3.12 0.88 1.80 1.43 -0.74 -4.84 118.68 118.23 3dpm s LEU 395 Ca 0.52 -0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 53.21 3dpm s LEU 395 Cb -0.32 -1.87 0.12 0.00 0.03 0.00 0.00 46.19 44.15 3dpm s LEU 395 CO 0.41 0.21 1.09 -2.16 0.23 0.00 0.00 176.35 176.12 3dpm s PRO 396 N -2.00 1.39 0.38 1.29 0.04 -1.26 -4.82 135.00 130.02 3dpm s PRO 396 Ca 0.21 0.87 0.06 0.00 0.04 0.00 0.00 61.00 62.18 3dpm s PRO 396 Cb -0.11 -1.82 -0.07 0.00 0.04 0.00 0.00 34.50 32.53 3dpm s PRO 396 CO 0.13 -2.16 0.01 0.15 0.04 0.00 0.00 177.00 175.16 3dpm s LYS 397 N -4.93 1.87 -0.06 4.56 1.02 -0.42 -4.61 119.74 117.16 3dpm s LYS 397 Ca 0.63 -2.05 0.04 0.00 0.02 0.00 0.00 55.97 54.61 3dpm s LYS 397 Cb -0.18 -1.46 0.00 0.00 -0.52 0.00 0.00 37.83 35.67 3dpm s LYS 397 CO 0.57 -0.06 -0.18 -1.01 -0.92 0.00 0.00 175.35 173.74 3dpm s HIS 398 N -2.84 1.93 -0.31 3.18 3.76 0.30 0.12 115.29 121.42 3dpm s HIS 398 Ca 0.35 -0.66 -0.20 0.00 -0.15 0.00 0.00 55.06 54.40 3dpm s HIS 398 Cb 0.09 -1.31 -0.01 0.00 1.11 0.00 0.00 32.58 32.46 3dpm s HIS 398 CO 0.17 -0.26 0.61 1.03 -0.85 0.00 0.00 174.74 175.44 3dpm s ARG 399 N 0.25 3.85 0.19 1.40 1.81 0.09 -1.02 118.95 125.52 3dpm s ARG 399 Ca -0.10 0.22 0.07 0.00 -1.72 0.00 0.00 55.73 54.20 3dpm s ARG 399 Cb -0.14 -3.74 -0.04 0.00 -0.45 0.00 0.00 34.95 30.57 3dpm s ARG 399 CO 0.04 -0.59 0.06 -1.64 -0.68 0.00 0.00 175.30 172.49 3dpm s MET 400 N 2.59 2.60 -0.23 3.54 -1.94 -1.26 -1.11 119.30 123.50 3dpm s MET 400 Ca 0.24 -1.06 -0.11 0.00 -1.71 0.00 0.00 55.69 53.06 3dpm s MET 400 Cb -0.15 -2.45 -0.05 0.00 2.01 0.00 0.00 34.83 34.19 3dpm s MET 400 CO 0.12 0.45 0.17 0.42 -0.01 0.00 0.00 175.02 176.17 3dpm s ILE 401 N -1.83 5.37 -0.02 2.53 1.09 -1.15 -0.94 121.20 126.24 3dpm s ILE 401 Ca 0.29 0.22 0.03 0.00 -1.10 0.00 0.00 60.65 60.09 3dpm s ILE 401 Cb -0.09 -3.51 -0.03 0.00 -1.06 0.00 0.00 42.46 37.77 3dpm s ILE 401 CO 0.21 0.37 -0.08 -0.76 -0.10 0.00 0.00 174.94 174.58 3dpm s LEU 402 N 0.86 3.10 0.23 2.97 1.43 -0.06 -5.00 118.68 122.21 3dpm s LEU 402 Ca 0.08 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 3dpm s LEU 402 Cb -0.13 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 3dpm s LEU 402 CO 0.03 0.32 0.07 0.42 0.23 0.00 0.00 176.35 177.41 3dpm s THR 403 N -0.90 0.56 -0.75 5.49 -4.23 -1.26 -4.85 115.64 109.70 3dpm s THR 403 Ca 0.15 -1.99 0.10 0.00 -1.18 0.00 0.00 61.69 58.77 3dpm s THR 403 Cb -0.11 -2.46 0.10 0.00 1.34 0.00 0.00 72.50 71.37 3dpm s THR 403 CO 0.05 -0.16 1.31 0.00 -0.54 0.00 0.00 174.62 175.28 3dpm n GLN 404 N -0.38 0.05 0.01 3.99 0.00 -1.26 -1.34 117.38 118.45 3dpm n GLN 404 Ca -0.02 0.49 -0.12 0.00 0.00 0.00 0.00 57.00 57.35 3dpm n GLN 404 Cb 0.65 -1.65 -0.06 0.00 0.00 0.00 0.00 30.24 29.18 3dpm n GLN 404 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 3dpm h ASP 405 N 0.00 0.08 0.07 2.61 -0.00 -1.99 0.12 116.42 117.30 3dpm h ASP 405 Ca 0.00 -0.09 -0.11 0.00 -0.00 0.00 0.00 57.03 56.83 3dpm h ASP 405 Cb 0.07 -0.02 -0.01 0.00 -0.00 0.00 0.00 39.33 39.37 3dpm h ASP 405 CO 0.00 0.15 -0.37 -0.33 -0.00 0.00 0.00 179.24 178.69 3dpm h GLU 406 N 0.00 0.41 -0.61 0.28 3.07 -1.60 -2.15 114.58 113.98 3dpm h GLU 406 Ca 0.02 -0.19 -0.06 0.00 -0.50 0.00 0.00 59.36 58.63 3dpm h GLU 406 Cb 0.09 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 27.96 3dpm h GLU 406 CO -0.00 0.72 0.13 0.28 -1.40 0.00 0.00 179.01 178.73 3dpm h VAL 407 N 0.35 1.25 -0.45 3.13 2.07 -1.20 -1.56 116.25 119.84 3dpm h VAL 407 Ca 0.04 -0.93 -0.12 0.00 0.82 0.00 0.00 66.70 66.50 3dpm h VAL 407 Cb 0.81 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 3dpm h VAL 407 CO 0.06 0.35 -0.21 0.58 0.02 0.00 0.00 177.57 178.37 3dpm h VAL 408 N 0.92 1.27 -0.92 2.57 2.07 -0.64 -1.28 116.25 120.24 3dpm h VAL 408 Ca 0.19 -1.36 0.02 0.00 0.82 0.00 0.00 66.70 66.37 3dpm h VAL 408 Cb 0.36 1.15 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 3dpm h VAL 408 CO 0.00 0.46 0.61 0.44 0.02 0.00 0.00 177.57 179.10 3dpm h ASP 409 N 0.78 1.04 -0.03 0.57 3.32 -1.03 -0.54 116.42 120.53 3dpm h ASP 409 Ca 0.10 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 3dpm h ASP 409 Cb 0.76 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 3dpm h ASP 409 CO 0.06 0.74 0.02 0.00 -1.72 0.00 0.00 179.24 178.34 3dpm h ALA 410 N 1.35 0.04 -0.86 3.45 0.00 -0.92 -2.53 119.26 119.80 3dpm h ALA 410 Ca 0.35 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.25 3dpm h ALA 410 Cb -0.09 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 3dpm h ALA 410 CO -0.09 -0.44 0.57 -0.07 0.00 0.00 0.00 179.25 179.22 3dpm h LEU 411 N -0.01 0.96 -0.86 0.00 3.38 -0.72 -2.36 115.31 115.70 3dpm h LEU 411 Ca 0.01 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.97 3dpm h LEU 411 Cb 0.05 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 3dpm h LEU 411 CO -0.00 0.68 0.57 0.44 0.09 0.00 0.00 178.44 180.22 3dpm h ASP 412 N 1.13 0.99 -0.57 -0.43 3.32 -0.85 0.25 116.42 120.27 3dpm h ASP 412 Ca 0.33 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.31 3dpm h ASP 412 Cb -0.07 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.21 3dpm h ASP 412 CO -0.08 0.72 0.22 -0.50 -1.72 0.00 0.00 179.24 177.88 3dpm h TRP 413 N 1.17 0.88 -0.71 4.55 4.06 -1.02 -1.36 115.95 123.52 3dpm h TRP 413 Ca 0.32 -0.07 -0.04 0.00 2.06 0.00 0.00 58.89 61.16 3dpm h TRP 413 Cb -0.14 -0.26 -0.03 0.00 -1.00 0.00 0.00 29.16 27.73 3dpm h TRP 413 CO -0.01 0.72 0.29 -0.07 -3.56 0.00 0.00 178.44 175.80 3dpm h LEU 414 N 0.78 0.95 0.02 -4.49 3.38 -0.87 -1.86 115.31 113.23 3dpm h LEU 414 Ca 0.19 -0.13 -0.25 0.00 0.09 0.00 0.00 57.88 57.78 3dpm h LEU 414 Cb 0.22 -0.24 0.02 0.00 0.09 0.00 0.00 40.66 40.74 3dpm h LEU 414 CO -0.01 0.84 -0.98 0.71 0.09 0.00 0.00 178.44 179.08 3dpm h THR 415 N 1.02 1.31 -0.97 0.22 1.35 -0.84 -1.62 112.91 113.38 3dpm h THR 415 Ca 0.24 -2.25 0.14 0.00 -0.55 0.00 0.00 66.41 63.98 3dpm h THR 415 Cb 0.18 2.49 -0.08 0.00 -1.73 0.00 0.00 68.15 69.01 3dpm h THR 415 CO -0.02 0.69 0.61 0.25 -0.25 0.00 0.00 175.52 176.80 3dpm h LEU 416 N 0.26 0.83 -3.30 3.87 7.12 -1.10 -1.38 115.31 121.61 3dpm h LEU 416 Ca -0.13 0.05 0.00 0.00 0.13 0.00 0.00 57.88 57.93 3dpm h LEU 416 Cb 1.65 -0.11 0.00 0.00 -0.53 0.00 0.00 40.66 41.67 3dpm h LEU 416 CO 0.19 0.42 0.00 0.18 -0.13 0.00 0.00 178.44 179.10 3dpm n LEU 417 N -4.62 4.29 -0.35 2.25 4.77 -0.71 -4.66 117.00 117.97 3dpm n LEU 417 Ca 0.19 -2.91 0.04 0.00 -0.03 0.00 0.00 56.01 53.30 3dpm n LEU 417 Cb 0.42 -0.56 0.19 0.00 -2.33 0.00 0.00 43.42 41.13 3dpm n LEU 417 CO 0.27 0.67 1.23 -0.08 -1.33 0.00 0.00 177.39 178.16 3dpm h GLU 418 N 2.43 1.03 -0.55 3.23 4.81 -0.22 -2.35 114.58 122.95 3dpm h GLU 418 Ca 0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3dpm h GLU 418 Cb 1.52 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.67 3dpm h GLU 418 CO 0.27 0.68 0.00 0.09 -0.73 0.00 0.00 179.01 179.32 3dpm n ASN 419 N -4.58 4.63 -4.64 1.04 5.03 -1.26 -4.91 115.26 110.57 3dpm n ASN 419 Ca 0.16 -2.56 -0.41 0.00 0.87 0.00 0.00 54.58 52.63 3dpm n ASN 419 Cb 0.24 -0.56 -0.05 0.00 -1.02 0.00 0.00 39.78 38.39 3dpm n ASN 419 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3dpm s VAL 420 N -2.05 4.88 0.00 2.41 1.01 -0.89 -4.87 120.40 120.88 3dpm s VAL 420 Ca 0.48 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.90 3dpm s VAL 420 Cb 0.33 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.64 3dpm s VAL 420 CO 0.20 -0.05 0.49 0.47 0.00 0.00 0.00 175.10 176.21 3dpm n ASP 421 N 5.93 0.00 -3.87 3.32 8.00 -1.26 -5.00 116.55 123.67 3dpm n ASP 421 Ca 0.04 -1.04 -0.09 0.00 0.71 0.00 0.00 54.79 54.40 3dpm n ASP 421 Cb 0.48 -0.01 -0.06 0.00 -0.02 0.00 0.00 41.12 41.51 3dpm n ASP 421 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3dpm s THR 422 N 0.00 0.07 0.12 -3.53 -4.23 -1.26 -5.04 115.64 101.77 3dpm s THR 422 Ca 0.00 -1.15 -0.20 0.00 -1.18 0.00 0.00 61.69 59.15 3dpm s THR 422 Cb 0.00 -1.63 -0.05 0.00 1.34 0.00 0.00 72.50 72.16 3dpm s THR 422 CO 0.00 -0.33 1.72 0.78 -0.54 0.00 0.00 174.62 176.25 3dpm h ASN 423 N 2.50 -0.12 -0.45 3.99 2.35 -1.94 -0.74 115.58 121.17 3dpm h ASN 423 Ca -0.32 0.05 0.07 0.00 -0.55 0.00 0.00 56.30 55.55 3dpm h ASN 423 Cb 1.23 0.09 -0.06 0.00 0.05 0.00 0.00 38.32 39.63 3dpm h ASN 423 CO 0.47 -0.04 0.08 0.58 -1.65 0.00 0.00 177.43 176.88 3dpm h VAL 424 N 0.03 0.75 -0.41 2.81 2.07 -1.97 -1.07 116.25 118.46 3dpm h VAL 424 Ca 0.08 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.46 3dpm h VAL 424 Cb 0.12 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 3dpm h VAL 424 CO -0.16 0.04 -0.04 -0.33 0.02 0.00 0.00 177.57 177.10 3dpm h GLU 425 N 0.21 0.68 -0.77 1.57 5.08 -1.91 -1.82 114.58 117.62 3dpm h GLU 425 Ca 0.22 -0.18 0.06 0.00 -1.00 0.00 0.00 59.36 58.46 3dpm h GLU 425 Cb 0.28 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.40 3dpm h GLU 425 CO -0.30 0.72 0.46 0.77 -1.00 0.00 0.00 179.01 179.66 3dpm h SER 426 N 0.63 0.70 1.03 1.42 0.02 0.13 -0.94 113.55 116.54 3dpm h SER 426 Ca 0.12 0.02 -0.14 0.00 -0.84 0.00 0.00 61.79 60.96 3dpm h SER 426 Cb 0.45 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 3dpm h SER 426 CO 0.02 0.44 -0.67 0.03 -1.14 0.00 0.00 176.83 175.52 3dpm h ARG 427 N 0.83 0.00 -0.04 3.45 3.08 -1.04 -0.99 114.38 119.68 3dpm h ARG 427 Ca 0.34 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.31 3dpm h ARG 427 Cb 0.19 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 3dpm h ARG 427 CO -0.18 0.67 -0.38 -0.07 -1.07 0.00 0.00 179.97 178.94 3dpm h LEU 428 N 0.00 0.07 0.11 3.04 4.07 -0.59 0.93 115.31 122.95 3dpm h LEU 428 Ca -0.01 -0.03 -0.33 0.00 0.08 0.00 0.00 57.88 57.60 3dpm h LEU 428 Cb 1.36 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 43.07 3dpm h LEU 428 CO 0.09 0.45 -1.75 0.00 -1.08 0.00 0.00 178.44 176.14 3dpm h ALA 429 N 1.56 0.40 0.00 1.53 0.00 -1.07 -3.41 119.26 118.27 3dpm h ALA 429 Ca 0.01 -1.27 0.00 0.00 0.00 0.00 0.00 54.91 53.64 3dpm h ALA 429 Cb 0.70 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3dpm h ALA 429 CO 0.05 1.26 -1.58 1.28 0.00 0.00 0.00 179.25 180.26 3dpm n LEU 430 N -3.41 0.02 0.00 0.00 4.77 -0.39 -5.11 117.00 112.88 3dpm n LEU 430 Ca -0.23 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 3dpm n LEU 430 Cb 1.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 3dpm n LEU 430 CO 0.47 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3dpm n GLY 431 N 1.73 1.96 0.34 -0.72 0.00 0.32 -4.59 105.19 104.22 3dpm n GLY 431 Ca -0.02 -1.98 0.18 0.00 0.00 0.00 0.00 46.02 44.20 3dpm n GLY 431 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dpm h ASP 432 N 0.00 0.00 -4.91 1.61 3.32 -1.94 -3.41 116.42 111.08 3dpm h ASP 432 Ca 0.00 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.13 3dpm h ASP 432 Cb 0.00 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.43 3dpm h ASP 432 CO 0.00 0.00 0.39 0.54 -1.72 0.00 0.00 179.24 178.45 3dpm s ASN 433 N -5.28 -0.38 -0.37 6.45 4.22 -1.26 -2.14 114.94 116.18 3dpm s ASN 433 Ca -0.04 -0.14 -0.01 0.00 -2.14 0.00 0.00 52.86 50.53 3dpm s ASN 433 Cb 0.13 0.50 0.10 0.00 1.28 0.00 0.00 41.25 43.26 3dpm s ASN 433 CO 0.44 -0.85 0.13 -0.04 -2.04 0.00 0.00 177.10 174.75 3dpm s MET 434 N -3.41 1.88 -1.55 3.55 -1.94 -0.44 -4.68 119.30 112.72 3dpm s MET 434 Ca 0.06 -1.78 -0.14 0.00 -1.71 0.00 0.00 55.69 52.12 3dpm s MET 434 Cb -0.02 -3.42 0.09 0.00 2.01 0.00 0.00 34.83 33.50 3dpm s MET 434 CO -0.06 -0.98 0.97 0.39 -0.01 0.00 0.00 175.02 175.32 3dpm n GLU 435 N 4.49 -5.34 0.00 2.03 1.02 -1.26 -1.60 120.64 119.98 3dpm n GLU 435 Ca -0.02 0.58 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 3dpm n GLU 435 Cb 0.42 -5.45 0.00 0.00 -0.02 0.00 0.00 31.44 26.38 3dpm n GLU 435 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dpm n GLY 436 N -1.67 3.44 3.66 0.62 0.00 -1.26 -3.96 105.19 106.01 3dpm n GLY 436 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 3dpm n GLY 436 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dpm s TYR 437 N -2.98 3.33 -0.14 1.61 5.04 -0.62 -4.78 117.35 118.82 3dpm s TYR 437 Ca 0.00 1.36 -0.37 0.00 -2.44 0.00 0.00 57.07 55.62 3dpm s TYR 437 Cb 0.00 -3.19 -0.14 0.00 0.35 0.00 0.00 41.96 38.97 3dpm s TYR 437 CO 0.00 -0.45 1.73 2.41 -1.34 0.00 0.00 175.55 177.91 3dpm n THR 438 N 5.28 0.34 -3.07 4.34 -1.04 -1.26 -1.32 114.28 117.54 3dpm n THR 438 Ca 0.10 -0.06 -0.39 0.00 -2.04 0.00 0.00 64.05 61.65 3dpm n THR 438 Cb 0.47 -1.43 -0.05 0.00 -1.82 0.00 0.00 70.33 67.50 3dpm n THR 438 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3dpm s VAL 439 N 3.16 4.83 0.18 12.58 1.01 -0.91 -4.89 120.40 136.36 3dpm s VAL 439 Ca 0.93 1.47 -0.13 0.00 0.00 0.00 0.00 61.98 64.25 3dpm s VAL 439 Cb -0.90 -4.04 0.01 0.00 0.00 0.00 0.00 36.38 31.45 3dpm s VAL 439 CO 0.56 0.37 0.40 -0.62 0.00 0.00 0.00 175.10 175.81 3dpm s ASP 440 N -0.00 -0.09 0.37 3.32 3.68 -1.26 -4.81 116.67 117.88 3dpm s ASP 440 Ca 0.36 -0.71 0.10 0.00 2.13 0.00 0.00 52.55 54.43 3dpm s ASP 440 Cb -0.19 0.50 0.85 0.00 -1.45 0.00 0.00 42.92 42.64 3dpm s ASP 440 CO 0.20 -0.98 1.90 0.25 0.13 0.00 0.00 175.17 176.68 3dpm h LEU 441 N 2.38 0.59 -0.76 -1.34 7.12 -1.81 0.11 115.31 121.61 3dpm h LEU 441 Ca -0.30 0.03 0.01 0.00 0.13 0.00 0.00 57.88 57.74 3dpm h LEU 441 Cb 1.24 -0.09 -0.04 0.00 -0.53 0.00 0.00 40.66 41.24 3dpm h LEU 441 CO 0.43 0.32 0.50 -0.61 -0.13 0.00 0.00 178.44 178.96 3dpm h GLN 442 N 0.64 1.00 -0.36 1.25 5.75 -1.96 0.46 115.11 121.90 3dpm h GLN 442 Ca 0.40 -0.06 -0.00 0.00 -0.15 0.00 0.00 58.65 58.84 3dpm h GLN 442 Cb 0.64 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.95 3dpm h GLN 442 CO -0.16 0.66 0.22 0.28 -2.65 0.00 0.00 178.83 177.19 3dpm h VAL 443 N 1.03 1.11 -0.68 2.39 2.07 -1.16 0.36 116.25 121.38 3dpm h VAL 443 Ca 0.28 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 3dpm h VAL 443 Cb -0.12 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 3dpm h VAL 443 CO -0.06 0.11 0.34 0.00 0.02 0.00 0.00 177.57 177.98 3dpm h ALA 444 N 1.10 0.87 -0.51 1.67 0.00 -0.82 -1.29 119.26 120.28 3dpm h ALA 444 Ca 0.13 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3dpm h ALA 444 Cb -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3dpm h ALA 444 CO -0.03 0.42 0.17 0.93 0.00 0.00 0.00 179.25 180.74 3dpm h GLU 445 N 0.94 0.75 -0.40 0.00 4.39 -0.49 -0.98 114.58 118.78 3dpm h GLU 445 Ca 0.23 -0.12 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 3dpm h GLU 445 Cb 0.10 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 3dpm h GLU 445 CO -0.03 0.65 0.24 1.88 -1.16 0.00 0.00 179.01 180.59 3dpm h TYR 446 N 0.74 0.53 -0.59 4.33 0.99 -0.13 -0.32 116.97 122.52 3dpm h TYR 446 Ca 0.17 -0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.81 3dpm h TYR 446 Cb 0.21 -0.17 -0.02 0.00 1.00 0.00 0.00 36.73 37.74 3dpm h TYR 446 CO 0.01 0.38 0.03 -0.07 -0.00 0.00 0.00 178.16 178.52 3dpm h LEU 447 N 0.53 0.97 -0.66 3.88 3.38 -0.64 -1.22 115.31 121.55 3dpm h LEU 447 Ca 0.14 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.75 3dpm h LEU 447 Cb 0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3dpm h LEU 447 CO -0.03 1.00 -0.19 0.11 0.09 0.00 0.00 178.44 179.43 3dpm h LYS 448 N 0.93 0.85 -0.60 1.13 1.57 -1.00 -2.02 116.57 117.42 3dpm h LYS 448 Ca 0.17 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 3dpm h LYS 448 Cb 0.49 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 3dpm h LYS 448 CO 0.02 0.97 0.27 1.03 -0.57 0.00 0.00 179.45 181.16 3dpm h SER 449 N 0.74 0.78 -0.30 0.86 0.87 -0.69 -0.28 113.55 115.53 3dpm h SER 449 Ca 0.11 -0.09 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 3dpm h SER 449 Cb 0.72 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.46 3dpm h SER 449 CO 0.06 0.68 0.09 0.15 -0.53 0.00 0.00 176.83 177.27 3dpm h PHE 450 N 0.85 0.49 -0.48 2.24 3.57 -0.85 0.83 116.94 123.60 3dpm h PHE 450 Ca 0.21 -0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 3dpm h PHE 450 Cb 0.13 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 3dpm h PHE 450 CO 0.01 0.51 0.08 0.78 -2.23 0.00 0.00 178.31 177.46 3dpm h GLY 451 N 0.33 0.79 1.75 2.40 0.00 -0.90 -1.92 103.07 105.52 3dpm h GLY 451 Ca 0.10 -0.46 -0.16 0.00 0.00 0.00 0.00 47.33 46.80 3dpm h GLY 451 CO -0.00 0.43 -0.69 3.21 0.00 0.00 0.00 176.54 179.49 3dpm h ARG 452 N 0.71 0.25 -0.39 4.80 3.08 -0.68 -2.58 114.38 119.56 3dpm h ARG 452 Ca 0.15 -0.20 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 3dpm h ARG 452 Cb 0.31 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 3dpm h ARG 452 CO 0.00 0.84 -0.28 1.96 -1.07 0.00 0.00 179.97 181.43 3dpm h GLN 453 N 0.17 0.84 -0.44 0.04 4.20 -0.52 -1.12 115.11 118.28 3dpm h GLN 453 Ca -0.02 -0.37 -0.12 0.00 0.06 0.00 0.00 58.65 58.20 3dpm h GLN 453 Cb 1.23 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.98 3dpm h GLN 453 CO 0.11 1.01 -0.19 0.28 -0.67 0.00 0.00 178.83 179.36 3dpm h VAL 454 N 0.71 1.27 -0.65 -0.54 2.07 -1.34 -1.85 116.25 115.93 3dpm h VAL 454 Ca 0.08 -1.34 -0.08 0.00 0.82 0.00 0.00 66.70 66.19 3dpm h VAL 454 Cb 0.82 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 3dpm h VAL 454 CO 0.07 0.45 0.09 -0.07 0.02 0.00 0.00 177.57 178.14 3dpm h LEU 455 N 0.73 1.04 -0.56 2.57 3.38 -1.34 -1.51 115.31 119.61 3dpm h LEU 455 Ca 0.10 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.78 3dpm h LEU 455 Cb 0.76 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3dpm h LEU 455 CO 0.06 1.04 0.19 -1.13 0.09 0.00 0.00 178.44 178.68 3dpm h ASN 456 N 1.01 0.81 -0.52 -0.43 -1.24 -1.05 -1.71 115.58 112.45 3dpm h ASN 456 Ca 0.20 -0.20 -0.00 0.00 0.71 0.00 0.00 56.30 57.01 3dpm h ASN 456 Cb 0.45 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 39.26 3dpm h ASN 456 CO 0.01 0.79 0.32 0.00 -1.29 0.00 0.00 177.43 177.27 3dpm h TRP 458 N 0.70 0.17 0.00 0.00 2.91 -1.01 -1.43 115.95 117.29 3dpm h TRP 458 Ca 0.19 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.21 3dpm h TRP 458 Cb -0.02 -0.04 -0.00 0.00 -0.51 0.00 0.00 29.16 28.59 3dpm h TRP 458 CO -0.03 0.08 -0.04 0.66 -1.03 0.00 0.00 178.44 178.08 3dpm h SER 459 N 0.21 0.00 0.18 2.65 4.64 -1.10 -2.28 113.55 117.85 3dpm h SER 459 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 3dpm h SER 459 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3dpm h SER 459 CO -0.12 0.04 -0.50 0.29 -0.87 0.00 0.00 176.83 175.67 3dpm n LYS 460 N -3.29 0.62 -0.90 4.77 5.02 -0.76 -4.94 118.16 118.68 3dpm n LYS 460 Ca -0.02 -0.44 0.00 0.00 -2.02 0.00 0.00 58.31 55.83 3dpm n LYS 460 Cb 0.19 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 3dpm n LYS 460 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dpm n GLY 461 N 1.42 0.55 2.68 0.72 0.00 -0.81 -4.93 105.19 104.83 3dpm n GLY 461 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 3dpm n GLY 461 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3dpm n ASP 462 N 0.00 5.99 -0.03 1.61 2.03 -0.61 -4.42 116.55 121.11 3dpm n ASP 462 Ca 0.00 -3.00 0.01 0.00 0.52 0.00 0.00 54.79 52.32 3dpm n ASP 462 Cb 0.00 -1.50 -0.00 0.00 -0.72 0.00 0.00 41.12 38.90 3dpm n ASP 462 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3dpm n ILE 463 N 3.34 0.00 0.10 5.18 -5.35 -1.26 -3.83 119.36 117.54 3dpm n ILE 463 Ca 0.52 -0.48 -0.23 0.00 -0.27 0.00 0.00 62.75 62.30 3dpm n ILE 463 Cb 0.32 1.01 -0.15 0.00 -1.74 0.00 0.00 39.64 39.09 3dpm n ILE 463 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 3dpm h GLU 464 N 0.14 0.42 -1.07 6.28 4.39 -1.82 -0.12 114.58 122.80 3dpm h GLU 464 Ca 0.00 -0.72 -0.17 0.00 0.34 0.00 0.00 59.36 58.81 3dpm h GLU 464 Cb 0.05 0.27 -0.17 0.00 -0.10 0.00 0.00 28.75 28.79 3dpm h GLU 464 CO 0.00 1.34 -0.51 -1.17 -1.16 0.00 0.00 179.01 177.51 3dpm s LEU 465 N -7.72 -1.31 0.97 1.33 2.96 -1.25 -4.41 118.68 109.25 3dpm s LEU 465 Ca -0.12 -1.79 -0.14 0.00 -0.22 0.00 0.00 54.13 51.87 3dpm s LEU 465 Cb 0.03 1.78 0.01 0.00 0.50 0.00 0.00 46.19 48.51 3dpm s LEU 465 CO 0.89 -0.06 0.19 -1.54 -1.32 0.00 0.00 176.35 174.51 3dpm n SER 466 N 2.97 -2.72 -4.69 3.68 3.41 -0.12 -4.81 113.62 111.34 3dpm n SER 466 Ca 0.18 0.28 -0.32 0.00 -0.26 0.00 0.00 58.87 58.75 3dpm n SER 466 Cb 0.56 -1.12 0.14 0.00 -0.26 0.00 0.00 64.21 63.52 3dpm n SER 466 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3dpm s THR 467 N -2.33 2.14 0.36 6.66 -1.32 -1.26 -4.13 115.64 115.76 3dpm s THR 467 Ca 0.54 0.05 -0.28 0.00 -1.21 0.00 0.00 61.69 60.79 3dpm s THR 467 Cb -0.20 -2.33 -0.11 0.00 -1.51 0.00 0.00 72.50 68.34 3dpm s THR 467 CO 0.70 -0.05 1.49 -0.81 -2.21 0.00 0.00 174.62 173.74 3dpm n PRO 468 N -3.60 2.64 -3.87 7.08 -0.04 -1.26 -4.59 135.00 131.35 3dpm n PRO 468 Ca 0.13 0.93 -0.16 0.00 -0.04 0.00 0.00 63.50 64.35 3dpm n PRO 468 Cb 0.51 -2.65 -0.16 0.00 -0.04 0.00 0.00 33.50 31.16 3dpm n PRO 468 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3dpm s ILE 469 N -0.94 0.09 0.30 0.52 1.01 -0.19 -4.82 121.20 117.17 3dpm s ILE 469 Ca 0.55 0.13 -0.29 0.00 0.00 0.00 0.00 60.65 61.04 3dpm s ILE 469 Cb -0.49 -0.20 -0.10 0.00 0.01 0.00 0.00 42.46 41.69 3dpm s ILE 469 CO 0.61 0.12 1.14 -2.16 0.00 0.00 0.00 174.94 174.66 3dpm s PRO 470 N 1.01 4.55 0.28 2.79 0.04 -1.26 -0.54 135.00 141.88 3dpm s PRO 470 Ca -0.10 1.88 -0.30 0.00 0.04 0.00 0.00 61.00 62.52 3dpm s PRO 470 Cb -0.13 -3.13 -0.12 0.00 0.04 0.00 0.00 34.50 31.16 3dpm s PRO 470 CO -0.02 0.11 1.55 1.28 0.04 0.00 0.00 177.00 179.96 3dpm n LEU 471 N 1.04 4.09 0.00 -3.56 4.77 -1.26 -0.47 117.00 121.61 3dpm n LEU 471 Ca -0.01 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.12 3dpm n LEU 471 Cb 0.44 -1.56 0.00 0.00 -2.33 0.00 0.00 43.42 39.98 3dpm n LEU 471 CO 0.55 0.01 0.00 0.49 -1.33 0.00 0.00 177.39 177.10 3dpm n PHE 472 N 2.03 0.00 -0.89 -1.77 3.01 -1.26 -1.64 117.46 116.93 3dpm n PHE 472 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.55 3dpm n PHE 472 Cb 0.36 -1.76 0.00 0.00 -0.01 0.00 0.00 39.48 38.06 3dpm n PHE 472 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dpm n GLY 473 N -0.35 1.16 3.55 1.37 0.00 0.38 -3.22 105.19 108.07 3dpm n GLY 473 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3dpm n GLY 473 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dpm s PHE 474 N -3.87 1.25 0.10 1.61 0.40 -0.65 -4.83 117.98 111.99 3dpm s PHE 474 Ca 0.00 1.36 -0.17 0.00 -0.60 0.00 0.00 56.93 57.51 3dpm s PHE 474 Cb 0.00 -3.72 -0.06 0.00 0.51 0.00 0.00 43.02 39.75 3dpm s PHE 474 CO 0.00 -2.40 1.55 0.93 0.70 0.00 0.00 175.22 176.00 3dpm h GLU 475 N 17.83 0.51 -3.91 0.44 4.39 -1.93 -3.43 114.58 128.48 3dpm h GLU 475 Ca -0.23 -0.15 -0.11 0.00 0.34 0.00 0.00 59.36 59.21 3dpm h GLU 475 Cb 1.22 -0.05 -0.16 0.00 -0.10 0.00 0.00 28.75 29.66 3dpm h GLU 475 CO 1.17 0.64 -0.50 -1.59 -1.16 0.00 0.00 179.01 177.57 3dpm s LYS 476 N -5.07 0.69 -0.16 2.33 -2.85 -1.26 -1.79 119.74 111.64 3dpm s LYS 476 Ca -0.13 -0.94 -0.24 0.00 -1.00 0.00 0.00 55.97 53.65 3dpm s LYS 476 Cb 0.08 0.27 -0.02 0.00 -2.06 0.00 0.00 37.83 36.10 3dpm s LYS 476 CO 0.76 -0.18 0.79 0.42 0.10 0.00 0.00 175.35 177.23 3dpm s ILE 477 N -3.40 4.92 -0.12 3.79 -1.09 0.13 -4.87 121.20 120.57 3dpm s ILE 477 Ca 0.02 1.55 -0.12 0.00 -2.23 0.00 0.00 60.65 59.87 3dpm s ILE 477 Cb 0.03 -4.10 -0.05 0.00 -1.58 0.00 0.00 42.46 36.77 3dpm s ILE 477 CO -0.08 0.06 0.26 -1.00 -1.23 0.00 0.00 174.94 172.95 3dpm s HIS 478 N 1.96 3.56 0.24 3.97 3.76 -1.26 -1.55 115.29 125.97 3dpm s HIS 478 Ca 0.37 0.64 -0.31 0.00 -0.15 0.00 0.00 55.06 55.61 3dpm s HIS 478 Cb -0.17 -2.19 -0.13 0.00 1.11 0.00 0.00 32.58 31.20 3dpm s HIS 478 CO 0.13 0.49 1.48 -0.35 -0.85 0.00 0.00 174.74 175.64 3dpm n PRO 479 N 2.68 2.21 -1.64 8.40 -0.04 -1.26 -4.69 135.00 140.66 3dpm n PRO 479 Ca -0.15 0.79 -0.45 0.00 -0.04 0.00 0.00 63.50 63.65 3dpm n PRO 479 Cb 0.53 -2.49 -0.02 0.00 -0.04 0.00 0.00 33.50 31.47 3dpm n PRO 479 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 3dpm n HIS 480 N 2.23 1.78 -0.24 0.54 -0.00 0.12 -4.91 115.22 114.75 3dpm n HIS 480 Ca 0.12 0.58 -0.08 0.00 0.46 0.00 0.00 57.72 58.80 3dpm n HIS 480 Cb 0.32 -2.36 0.05 0.00 -0.12 0.00 0.00 29.99 27.89 3dpm n HIS 480 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3dpm h PRO 481 N 3.05 1.11 0.05 1.57 0.13 -1.90 -3.37 132.00 132.64 3dpm h PRO 481 Ca -0.43 -0.29 -0.25 0.00 -0.87 0.00 0.00 66.00 64.15 3dpm h PRO 481 Cb 1.31 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 3dpm h PRO 481 CO 0.67 1.01 -1.36 0.00 -0.23 0.00 0.00 178.00 178.09 3dpm h ARG 482 N 1.04 0.11 -4.90 0.86 3.08 -1.98 -3.47 114.38 109.12 3dpm h ARG 482 Ca 0.21 -0.19 -0.59 0.00 0.07 0.00 0.00 59.98 59.48 3dpm h ARG 482 Cb 0.43 0.07 -0.33 0.00 0.08 0.00 0.00 29.97 30.22 3dpm h ARG 482 CO 0.01 1.09 -0.84 0.54 -1.07 0.00 0.00 179.97 179.70 3dpm s VAL 483 N -2.42 1.55 -0.06 2.04 0.11 -1.26 -5.12 120.40 115.24 3dpm s VAL 483 Ca -0.25 -0.72 -0.05 0.00 -2.93 0.00 0.00 61.98 58.03 3dpm s VAL 483 Cb 0.05 -1.37 0.01 0.00 -1.53 0.00 0.00 36.38 33.55 3dpm s VAL 483 CO 0.67 0.45 0.15 -1.10 -3.33 0.00 0.00 175.10 171.94 3dpm s GLN 484 N 0.53 0.17 -0.31 1.54 -0.21 -1.26 -4.37 119.66 115.75 3dpm s GLN 484 Ca -0.16 0.21 -0.11 0.00 0.02 0.00 0.00 55.36 55.32 3dpm s GLN 484 Cb -0.17 0.08 -0.02 0.00 1.00 0.00 0.00 33.01 33.91 3dpm s GLN 484 CO 0.06 -0.02 0.18 -0.47 -2.12 0.00 0.00 175.29 172.91 3dpm s TYR 485 N 0.10 3.19 -0.10 0.91 5.04 -1.12 -4.92 117.35 120.45 3dpm s TYR 485 Ca -0.00 -0.39 0.09 0.00 -2.44 0.00 0.00 57.07 54.33 3dpm s TYR 485 Cb -0.01 -2.39 -0.24 0.00 0.35 0.00 0.00 41.96 39.68 3dpm s TYR 485 CO 0.00 -0.39 0.44 0.43 -1.34 0.00 0.00 175.55 174.69 3dpm n SER 486 N 5.02 1.05 -4.66 4.32 7.64 -1.26 -3.63 113.62 122.09 3dpm n SER 486 Ca -0.14 0.27 -0.30 0.00 1.01 0.00 0.00 58.87 59.71 3dpm n SER 486 Cb 0.50 -0.06 0.16 0.00 -1.01 0.00 0.00 64.21 63.80 3dpm n SER 486 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3dpm s LYS 487 N -2.57 0.93 0.63 1.43 1.02 -1.26 -4.97 119.74 114.95 3dpm s LYS 487 Ca -0.11 1.25 -0.18 0.00 0.02 0.00 0.00 55.97 56.94 3dpm s LYS 487 Cb 0.07 -1.74 -0.02 0.00 -0.52 0.00 0.00 37.83 35.63 3dpm s LYS 487 CO 0.80 -2.60 1.25 -0.35 -0.92 0.00 0.00 175.35 173.53 3dpm n PRO 488 N -4.18 1.12 -4.39 -1.68 -0.04 -1.26 -4.88 135.00 119.69 3dpm n PRO 488 Ca 0.09 0.44 -0.20 0.00 -0.04 0.00 0.00 63.50 63.78 3dpm n PRO 488 Cb 0.53 -2.48 -0.13 0.00 -0.04 0.00 0.00 33.50 31.38 3dpm n PRO 488 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3dpm s ILE 489 N -1.40 1.13 -0.15 0.52 1.01 -1.26 -2.64 121.20 118.41 3dpm s ILE 489 Ca 0.81 -0.97 0.02 0.00 0.00 0.00 0.00 60.65 60.51 3dpm s ILE 489 Cb -0.39 -1.02 0.01 0.00 0.01 0.00 0.00 42.46 41.08 3dpm s ILE 489 CO 0.42 0.04 -0.21 0.00 0.00 0.00 0.00 174.94 175.19 3dpm s VAL 491 N 0.96 3.30 -0.25 0.00 1.01 0.76 0.33 120.40 126.50 3dpm s VAL 491 Ca -0.04 -0.55 -0.16 0.00 0.00 0.00 0.00 61.98 61.24 3dpm s VAL 491 Cb -0.15 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 3dpm s VAL 491 CO -0.05 0.48 0.41 -0.76 0.00 0.00 0.00 175.10 175.18 3dpm s LEU 492 N 0.81 4.06 0.25 3.92 1.43 0.50 -0.39 118.68 129.27 3dpm s LEU 492 Ca -0.03 0.38 0.07 0.00 -1.03 0.00 0.00 54.13 53.52 3dpm s LEU 492 Cb -0.15 -2.49 -0.05 0.00 0.03 0.00 0.00 46.19 43.53 3dpm s LEU 492 CO 0.01 -0.18 -0.08 0.27 0.23 0.00 0.00 176.35 176.60 3dpm s ILE 493 N 1.96 1.63 0.31 -0.59 -4.36 -0.24 -1.48 121.20 118.43 3dpm s ILE 493 Ca 0.17 -2.15 -0.15 0.00 -0.26 0.00 0.00 60.65 58.26 3dpm s ILE 493 Cb -0.15 -2.32 0.02 0.00 1.25 0.00 0.00 42.46 41.26 3dpm s ILE 493 CO 0.09 -0.39 0.65 0.54 0.24 0.00 0.00 174.94 176.07 3dpm s ASN 494 N -3.39 0.02 0.00 4.36 6.03 -1.17 -1.72 114.94 119.06 3dpm s ASN 494 Ca 0.27 -0.97 0.03 0.00 -1.03 0.00 0.00 52.86 51.17 3dpm s ASN 494 Cb 0.02 0.73 0.18 0.00 -3.03 0.00 0.00 41.25 39.14 3dpm s ASN 494 CO 0.10 -1.40 0.55 -1.84 -2.03 0.00 0.00 177.10 172.48 3dpm n GLU 495 N -0.48 0.13 -2.00 3.55 0.00 -1.06 -2.42 120.64 118.37 3dpm n GLU 495 Ca -0.04 0.00 -0.26 0.00 0.00 0.00 0.00 57.16 56.86 3dpm n GLU 495 Cb 0.60 -1.36 0.02 0.00 0.00 0.00 0.00 31.44 30.71 3dpm n GLU 495 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 3dpm n GLN 496 N -0.86 3.49 -4.05 3.44 6.02 -1.26 -3.90 117.38 120.27 3dpm n GLN 496 Ca 0.02 -4.11 -0.33 0.00 -0.01 0.00 0.00 57.00 52.57 3dpm n GLN 496 Cb 0.01 -2.28 -0.15 0.00 1.02 0.00 0.00 30.24 28.84 3dpm n GLN 496 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3dpm s ASP 497 N -3.38 3.71 0.41 1.08 1.01 -1.01 -1.61 116.67 116.88 3dpm s ASP 497 Ca 0.52 -0.77 0.05 0.00 0.71 0.00 0.00 52.55 53.06 3dpm s ASP 497 Cb 0.42 -1.56 -0.06 0.00 1.01 0.00 0.00 42.92 42.73 3dpm s ASP 497 CO 0.00 -0.06 0.03 -0.36 0.21 0.00 0.00 175.17 175.00 3dpm s PHE 498 N 1.30 2.21 0.00 4.23 0.40 -0.80 -2.43 117.98 122.89 3dpm s PHE 498 Ca 0.02 -0.84 0.00 0.00 -0.60 0.00 0.00 56.93 55.52 3dpm s PHE 498 Cb -0.15 -1.59 0.00 0.00 0.51 0.00 0.00 43.02 41.79 3dpm s PHE 498 CO -0.09 0.25 0.00 0.45 0.70 0.00 0.00 175.22 176.53 3dpm n SER 499 N -0.98 0.00 0.24 1.36 2.88 -0.84 0.31 113.62 116.60 3dpm n SER 499 Ca -0.07 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.53 3dpm n SER 499 Cb 0.67 0.00 0.34 0.00 -0.75 0.00 0.00 64.21 64.47 3dpm n SER 499 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dpm n ALA 501 N -1.58 2.65 -0.06 0.00 0.00 0.15 -1.81 120.51 119.87 3dpm n ALA 501 Ca -0.01 -0.24 -0.22 0.00 0.00 0.00 0.00 53.44 52.97 3dpm n ALA 501 Cb 0.55 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 18.44 3dpm n ALA 501 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3dpm n ASP 502 N -0.86 2.02 -0.18 0.00 8.00 -0.41 -4.40 116.55 120.72 3dpm n ASP 502 Ca 0.20 0.23 -0.10 0.00 0.71 0.00 0.00 54.79 55.82 3dpm n ASP 502 Cb 0.19 -0.82 0.01 0.00 -0.02 0.00 0.00 41.12 40.48 3dpm n ASP 502 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 3dpm h PHE 503 N -0.34 1.07 0.11 1.24 0.05 -1.44 -2.58 116.94 115.05 3dpm h PHE 503 Ca -0.46 -0.21 0.02 0.00 3.82 0.00 0.00 57.97 61.13 3dpm h PHE 503 Cb 1.78 -0.27 -0.05 0.00 2.00 0.00 0.00 35.95 39.41 3dpm h PHE 503 CO 0.06 1.00 -0.50 0.35 -0.18 0.00 0.00 178.31 179.05 3dpm h PHE 504 N 0.83 -1.43 -0.02 -0.55 3.57 -1.57 0.15 116.94 117.91 3dpm h PHE 504 Ca 0.14 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.59 3dpm h PHE 504 Cb 0.63 0.61 -0.01 0.00 2.79 0.00 0.00 35.95 39.97 3dpm h PHE 504 CO 0.05 -0.58 -0.38 -1.00 -2.23 0.00 0.00 178.31 174.17 3dpm h PRO 505 N -0.72 0.05 -0.71 6.41 0.13 -1.77 -2.67 132.00 132.72 3dpm h PRO 505 Ca 0.01 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 65.06 3dpm h PRO 505 Cb 0.74 -0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.84 3dpm h PRO 505 CO -0.28 0.42 0.20 -0.24 -0.23 0.00 0.00 178.00 177.87 3dpm h VAL 506 N 0.04 1.26 -0.11 1.56 3.04 -0.97 -0.97 116.25 120.10 3dpm h VAL 506 Ca 0.00 -0.92 -0.14 0.00 -1.01 0.00 0.00 66.70 64.63 3dpm h VAL 506 Cb 0.69 0.49 0.01 0.00 -2.01 0.00 0.00 31.29 30.47 3dpm h VAL 506 CO 0.05 0.36 -0.48 0.58 -1.01 0.00 0.00 177.57 177.07 3dpm h VAL 507 N 1.06 1.36 -0.48 1.51 2.07 -0.56 -2.11 116.25 119.10 3dpm h VAL 507 Ca 0.23 -1.80 -0.12 0.00 0.82 0.00 0.00 66.70 65.84 3dpm h VAL 507 Cb 0.32 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 3dpm h VAL 507 CO -0.00 0.54 -0.17 -0.07 0.02 0.00 0.00 177.57 177.89 3dpm h LEU 508 N 0.13 0.93 -0.15 2.57 3.38 -1.41 -2.56 115.31 118.19 3dpm h LEU 508 Ca -0.03 -0.32 -0.18 0.00 0.09 0.00 0.00 57.88 57.44 3dpm h LEU 508 Cb 1.12 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.62 3dpm h LEU 508 CO 0.10 1.08 -0.62 0.50 0.09 0.00 0.00 178.44 179.59 3dpm h LYS 509 N 0.81 0.69 0.00 1.13 3.64 -1.24 0.28 116.57 121.88 3dpm h LYS 509 Ca 0.12 -0.54 -0.05 0.00 -1.27 0.00 0.00 60.65 58.91 3dpm h LYS 509 Cb 0.71 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 3dpm h LYS 509 CO 0.05 1.16 -0.24 -0.44 -2.27 0.00 0.00 179.45 177.71 3dpm h ASP 510 N 0.38 0.00 -0.59 4.20 5.19 -1.40 -2.53 116.42 121.66 3dpm h ASP 510 Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 3dpm h ASP 510 Cb 1.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.76 3dpm h ASP 510 CO 0.13 0.24 0.00 0.59 -3.12 0.00 0.00 179.24 177.08 3dpm n ASN 511 N -3.64 3.63 -3.98 6.45 3.02 -0.97 -4.97 115.26 114.80 3dpm n ASN 511 Ca -0.01 -1.99 -0.31 0.00 -0.03 0.00 0.00 54.58 52.24 3dpm n ASN 511 Cb 0.36 -0.39 0.01 0.00 -0.61 0.00 0.00 39.78 39.15 3dpm n ASN 511 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3dpm n ASP 512 N 1.35 -4.12 -0.01 6.41 9.92 -0.80 -4.88 116.55 124.43 3dpm n ASP 512 Ca 0.21 -0.84 -0.04 0.00 -0.53 0.00 0.00 54.79 53.58 3dpm n ASP 512 Cb 0.57 -3.60 -0.12 0.00 -0.64 0.00 0.00 41.12 37.33 3dpm n ASP 512 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 3dpm n ARG 513 N -4.59 0.64 -4.12 -1.24 0.00 0.92 -5.00 116.66 103.27 3dpm n ARG 513 Ca 0.02 0.20 -0.10 0.00 -0.00 0.00 0.00 57.85 57.98 3dpm n ARG 513 Cb 0.53 -1.75 -0.09 0.00 0.00 0.00 0.00 32.46 31.14 3dpm n ARG 513 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3dpm s ALA 514 N -2.77 0.73 -0.25 5.13 0.00 -1.17 -4.15 121.76 119.30 3dpm s ALA 514 Ca -0.05 -1.39 -0.13 0.00 0.00 0.00 0.00 51.96 50.39 3dpm s ALA 514 Cb 0.08 0.93 -0.04 0.00 0.00 0.00 0.00 23.12 24.08 3dpm s ALA 514 CO 0.82 -0.53 0.28 -1.17 0.00 0.00 0.00 175.76 175.17 3dpm s LEU 515 N -3.05 4.08 -0.29 0.00 0.20 0.17 -4.57 118.68 115.22 3dpm s LEU 515 Ca 0.24 0.23 -0.11 0.00 0.69 0.00 0.00 54.13 55.18 3dpm s LEU 515 Cb 0.07 -2.30 -0.04 0.00 -0.43 0.00 0.00 46.19 43.49 3dpm s LEU 515 CO 0.03 -0.07 0.19 -0.63 -0.29 0.00 0.00 176.35 175.58 3dpm s ILE 516 N 1.58 5.27 -0.03 6.68 -1.09 -1.26 -0.17 121.20 132.17 3dpm s ILE 516 Ca 0.12 0.10 0.05 0.00 -2.23 0.00 0.00 60.65 58.68 3dpm s ILE 516 Cb -0.15 -3.54 -0.01 0.00 -1.58 0.00 0.00 42.46 37.18 3dpm s ILE 516 CO 0.08 0.21 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.15 3dpm s VAL 517 N 1.75 1.36 0.00 2.92 1.01 0.48 0.13 120.40 128.04 3dpm s VAL 517 Ca 0.07 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.35 3dpm s VAL 517 Cb -0.16 -1.15 0.00 0.00 0.00 0.00 0.00 36.38 35.07 3dpm s VAL 517 CO 0.11 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.21 3dpm n GLY 518 N 2.93 0.54 2.97 4.51 0.00 -1.04 -1.08 105.19 114.02 3dpm n GLY 518 Ca -0.17 -0.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.76 3dpm n GLY 518 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dpm s THR 519 N 0.00 0.22 0.06 2.61 -4.23 -0.70 -0.92 115.64 112.68 3dpm s THR 519 Ca 0.00 -0.64 -0.24 0.00 -1.18 0.00 0.00 61.69 59.63 3dpm s THR 519 Cb 0.00 -0.29 -0.13 0.00 1.34 0.00 0.00 72.50 73.42 3dpm s THR 519 CO 0.00 -0.27 0.57 -1.14 -0.54 0.00 0.00 174.62 173.24 3dpm n ARG 520 N 2.10 0.00 -1.64 3.99 0.63 -1.26 -3.06 116.66 117.41 3dpm n ARG 520 Ca -0.19 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.43 3dpm n ARG 520 Cb 0.57 -0.88 0.07 0.00 0.45 0.00 0.00 32.46 32.67 3dpm n ARG 520 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3dpm s THR 521 N -0.28 3.33 0.30 5.15 -4.23 -0.89 -2.55 115.64 116.47 3dpm s THR 521 Ca 0.54 0.43 0.05 0.00 -1.18 0.00 0.00 61.69 61.53 3dpm s THR 521 Cb -0.77 -3.24 0.30 0.00 1.34 0.00 0.00 72.50 70.13 3dpm s THR 521 CO 0.39 -0.57 1.82 0.00 -0.54 0.00 0.00 174.62 175.72 3dpm h ALA 522 N -0.92 1.64 -1.11 3.99 0.00 -1.59 -3.39 119.26 117.89 3dpm h ALA 522 Ca -0.46 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3dpm h ALA 522 Cb 1.26 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3dpm h ALA 522 CO 0.60 0.06 0.00 0.41 0.00 0.00 0.00 179.25 180.32 3dpm n GLY 523 N -1.36 0.65 3.11 0.00 0.00 -1.26 -4.53 105.19 101.81 3dpm n GLY 523 Ca 0.20 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 3dpm n GLY 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dpm n ALA 524 N -1.07 3.84 -3.73 4.61 0.00 -1.26 -0.22 120.51 122.67 3dpm n ALA 524 Ca 0.00 -4.61 -0.34 0.00 0.00 0.00 0.00 53.44 48.50 3dpm n ALA 524 Cb 0.34 -1.72 -0.09 0.00 0.00 0.00 0.00 19.45 17.98 3dpm n ALA 524 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3dpm s GLY 525 N -0.17 2.94 -0.21 0.00 0.00 -1.26 -1.98 107.32 106.64 3dpm s GLY 525 Ca 0.28 -3.75 -0.31 0.00 0.00 0.00 0.00 44.72 40.95 3dpm s GLY 525 CO -0.12 1.14 1.18 -0.32 0.00 0.00 0.00 173.10 174.98 3dpm s GLY 526 N -0.41 -0.13 0.57 0.20 0.00 -1.26 -1.34 107.32 104.95 3dpm s GLY 526 Ca 0.25 2.24 -0.14 0.00 0.00 0.00 0.00 44.72 47.08 3dpm s GLY 526 CO -0.12 0.94 1.01 -0.11 0.00 0.00 0.00 173.10 174.82 3dpm s PHE 527 N -1.39 3.54 0.17 1.90 -0.12 -1.26 -4.86 117.98 115.95 3dpm s PHE 527 Ca 0.05 1.38 0.11 0.00 -0.05 0.00 0.00 56.93 58.42 3dpm s PHE 527 Cb -0.01 -2.76 -0.04 0.00 -0.63 0.00 0.00 43.02 39.58 3dpm s PHE 527 CO -0.04 -0.53 -0.23 0.14 -0.05 0.00 0.00 175.22 174.51 3dpm s VAL 528 N -2.90 2.45 0.10 -2.49 -7.23 -1.26 -0.70 120.40 108.37 3dpm s VAL 528 Ca 0.57 -1.91 0.04 0.00 -1.81 0.00 0.00 61.98 58.87 3dpm s VAL 528 Cb -0.10 -2.16 -0.04 0.00 0.56 0.00 0.00 36.38 34.64 3dpm s VAL 528 CO 0.43 -0.06 -0.10 0.72 -0.31 0.00 0.00 175.10 175.78 3dpm s PHE 529 N -1.52 1.08 -0.06 2.82 -0.12 -0.81 -4.93 117.98 114.44 3dpm s PHE 529 Ca 0.20 -0.66 0.06 0.00 -0.05 0.00 0.00 56.93 56.47 3dpm s PHE 529 Cb -0.09 -0.59 -0.01 0.00 -0.63 0.00 0.00 43.02 41.71 3dpm s PHE 529 CO 0.10 0.01 -0.24 -0.80 -0.05 0.00 0.00 175.22 174.23 3dpm s ASN 530 N -2.48 3.18 -0.05 1.98 0.01 -1.26 -1.55 114.94 114.76 3dpm s ASN 530 Ca 0.06 -0.48 0.04 0.00 -0.71 0.00 0.00 52.86 51.77 3dpm s ASN 530 Cb -0.03 -0.87 -0.02 0.00 0.41 0.00 0.00 41.25 40.74 3dpm s ASN 530 CO 0.00 0.25 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.98 3dpm s VAL 531 N -0.18 2.86 0.05 1.60 1.01 0.09 -4.95 120.40 120.88 3dpm s VAL 531 Ca -0.03 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.20 3dpm s VAL 531 Cb -0.14 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 3dpm s VAL 531 CO 0.04 0.58 -0.12 -1.10 0.00 0.00 0.00 175.10 174.50 3dpm s GLN 532 N -0.59 0.74 -0.12 2.72 1.11 -1.26 -1.39 119.66 120.86 3dpm s GLN 532 Ca 0.09 -0.79 -0.29 0.00 0.01 0.00 0.00 55.36 54.38 3dpm s GLN 532 Cb -0.11 -0.67 0.08 0.00 -1.01 0.00 0.00 33.01 31.29 3dpm s GLN 532 CO 0.01 0.15 0.73 -0.59 0.01 0.00 0.00 175.29 175.60 3dpm s PHE 533 N -1.11 -0.67 0.37 0.91 -0.12 -1.26 -5.09 117.98 111.01 3dpm s PHE 533 Ca -0.03 1.30 -0.28 0.00 -0.05 0.00 0.00 56.93 57.88 3dpm s PHE 533 Cb -0.09 0.37 -0.10 0.00 -0.63 0.00 0.00 43.02 42.58 3dpm s PHE 533 CO 0.01 -0.52 1.35 -1.25 -0.05 0.00 0.00 175.22 174.76 3dpm s PRO 534 N -0.72 4.16 -0.09 1.99 0.04 -1.26 -4.92 135.00 134.20 3dpm s PRO 534 Ca -0.07 2.28 -0.31 0.00 0.04 0.00 0.00 61.00 62.94 3dpm s PRO 534 Cb -0.02 -2.93 0.12 0.00 0.04 0.00 0.00 34.50 31.71 3dpm s PRO 534 CO 0.06 -0.38 1.02 0.54 0.04 0.00 0.00 177.00 178.28 3dpm s ASN 535 N -0.49 -0.28 -0.11 6.66 2.20 -1.26 -5.04 114.94 116.62 3dpm s ASN 535 Ca 0.53 0.02 0.17 0.00 -0.94 0.00 0.00 52.86 52.63 3dpm s ASN 535 Cb -0.41 0.29 0.63 0.00 -2.00 0.00 0.00 41.25 39.76 3dpm s ASN 535 CO 0.54 -0.46 1.55 0.54 -2.94 0.00 0.00 177.10 176.33 3dpm n ARG 536 N -0.13 3.53 0.00 3.55 5.12 -1.26 -4.04 116.66 123.43 3dpm n ARG 536 Ca -0.05 -2.77 0.11 0.00 -1.93 0.00 0.00 57.85 53.21 3dpm n ARG 536 Cb 0.60 -1.81 0.08 0.00 -1.16 0.00 0.00 32.46 30.18 3dpm n ARG 536 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 3dpm n THR 537 N 0.76 0.00 -1.50 0.55 -1.04 -1.26 -4.97 114.28 106.82 3dpm n THR 537 Ca 0.23 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 3dpm n THR 537 Cb 0.83 0.74 0.00 0.00 -1.82 0.00 0.00 70.33 70.08 3dpm n THR 537 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dpm n GLY 538 N 1.46 0.46 3.68 3.41 0.00 -1.26 -4.82 105.19 108.13 3dpm n GLY 538 Ca 0.07 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.76 3dpm n GLY 538 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dpm s ILE 539 N -2.00 4.70 -0.09 -0.61 1.01 -1.26 -1.05 121.20 121.89 3dpm s ILE 539 Ca 0.00 1.98 -0.05 0.00 0.00 0.00 0.00 60.65 62.58 3dpm s ILE 539 Cb 0.00 -4.27 -0.02 0.00 0.01 0.00 0.00 42.46 38.18 3dpm s ILE 539 CO 0.00 -0.02 -0.10 0.50 0.00 0.00 0.00 174.94 175.32 3dpm h LYS 540 N 7.20 0.00 -3.84 2.79 3.64 -1.13 -3.45 116.57 121.79 3dpm h LYS 540 Ca -0.30 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 58.92 3dpm h LYS 540 Cb 1.14 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.75 3dpm h LYS 540 CO 0.88 0.00 -0.63 0.99 -2.27 0.00 0.00 179.45 178.41 3dpm s THR 541 N -1.77 0.10 -0.15 1.00 2.01 -1.10 -4.61 115.64 111.12 3dpm s THR 541 Ca -0.08 -0.85 -0.01 0.00 0.31 0.00 0.00 61.69 61.06 3dpm s THR 541 Cb 0.01 -0.33 0.04 0.00 0.01 0.00 0.00 72.50 72.23 3dpm s THR 541 CO 0.12 -0.47 -0.05 0.00 -0.69 0.00 0.00 174.62 173.53 3dpm s SER 543 N 1.68 6.24 0.15 0.00 1.04 -0.63 -0.73 113.70 121.44 3dpm s SER 543 Ca 0.02 0.42 0.03 0.00 0.48 0.00 0.00 55.95 56.90 3dpm s SER 543 Cb -0.15 -1.99 -0.05 0.00 0.10 0.00 0.00 66.02 63.94 3dpm s SER 543 CO -0.08 0.40 -0.05 -0.76 0.98 0.00 0.00 173.24 173.73 3dpm s LEU 544 N -1.05 2.37 -0.23 2.42 1.43 -0.60 -2.18 118.68 120.84 3dpm s LEU 544 Ca 0.15 -1.08 -0.15 0.00 -1.03 0.00 0.00 54.13 52.02 3dpm s LEU 544 Cb -0.12 -0.18 -0.04 0.00 0.03 0.00 0.00 46.19 45.88 3dpm s LEU 544 CO 0.04 -0.45 0.37 -0.89 0.23 0.00 0.00 176.35 175.65 3dpm s THR 545 N -3.51 5.20 -2.37 5.49 2.01 -1.26 -1.93 115.64 119.27 3dpm s THR 545 Ca 0.19 0.61 0.23 0.00 0.31 0.00 0.00 61.69 63.02 3dpm s THR 545 Cb 0.05 -3.70 0.47 0.00 0.01 0.00 0.00 72.50 69.33 3dpm s THR 545 CO 0.01 0.22 1.43 0.61 -0.69 0.00 0.00 174.62 176.20 3dpm n GLY 546 N 4.27 1.90 3.27 4.40 0.00 0.13 -1.32 105.19 117.84 3dpm n GLY 546 Ca -0.09 -0.76 -0.10 0.00 0.00 0.00 0.00 46.02 45.08 3dpm n GLY 546 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dpm s SER 547 N -1.39 -0.10 -0.26 1.61 1.04 -1.25 -2.95 113.70 110.41 3dpm s SER 547 Ca 0.41 -0.44 0.02 0.00 0.48 0.00 0.00 55.95 56.42 3dpm s SER 547 Cb 0.23 0.42 0.06 0.00 0.10 0.00 0.00 66.02 66.84 3dpm s SER 547 CO 0.32 -0.80 -0.07 -0.76 0.98 0.00 0.00 173.24 172.90 3dpm s LEU 548 N -2.81 3.19 0.15 2.42 1.43 -0.27 -4.28 118.68 118.52 3dpm s LEU 548 Ca 0.03 -1.37 -0.30 0.00 -1.03 0.00 0.00 54.13 51.46 3dpm s LEU 548 Cb 0.03 -1.41 -0.07 0.00 0.03 0.00 0.00 46.19 44.77 3dpm s LEU 548 CO -0.12 -0.22 1.20 0.00 0.23 0.00 0.00 176.35 177.44 3dpm s ALA 549 N 1.20 3.43 -0.06 4.21 0.00 -0.45 -0.73 121.76 129.35 3dpm s ALA 549 Ca -0.06 0.92 0.05 0.00 0.00 0.00 0.00 51.96 52.87 3dpm s ALA 549 Cb -0.19 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 3dpm s ALA 549 CO -0.06 -0.38 -0.23 0.08 0.00 0.00 0.00 175.76 175.17 3dpm s VAL 550 N 0.24 1.89 0.51 0.00 1.01 0.32 -3.17 120.40 121.20 3dpm s VAL 550 Ca 0.54 -0.97 -0.09 0.00 0.00 0.00 0.00 61.98 61.47 3dpm s VAL 550 Cb -0.32 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 3dpm s VAL 550 CO 0.34 0.53 0.87 -0.13 0.00 0.00 0.00 175.10 176.71 3dpm s ARG 551 N -0.01 3.63 0.29 2.72 0.52 -0.06 -1.30 118.95 124.74 3dpm s ARG 551 Ca -0.07 0.46 0.02 0.00 -0.52 0.00 0.00 55.73 55.63 3dpm s ARG 551 Cb -0.14 -2.27 0.73 0.00 0.52 0.00 0.00 34.95 33.78 3dpm s ARG 551 CO 0.04 -0.29 1.63 0.93 0.02 0.00 0.00 175.30 177.63 3dpm h GLU 552 N 0.27 0.14 0.00 3.54 5.08 -1.88 0.34 114.58 122.07 3dpm h GLU 552 Ca -0.46 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 3dpm h GLU 552 Cb 1.20 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3dpm h GLU 552 CO 0.62 0.09 0.00 -2.39 -1.00 0.00 0.00 179.01 176.33 3dpm n HIS 553 N -5.29 0.00 -0.03 4.33 1.44 -1.26 -4.87 115.22 109.53 3dpm n HIS 553 Ca 0.22 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.93 3dpm n HIS 553 Cb 0.71 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.82 3dpm n HIS 553 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3dpm n GLY 554 N 0.62 0.51 3.76 -1.39 0.00 0.12 -5.07 105.19 103.75 3dpm n GLY 554 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 3dpm n GLY 554 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dpm s ALA 555 N -2.20 3.37 0.53 4.61 0.00 -1.25 -4.71 121.76 122.12 3dpm s ALA 555 Ca 0.00 0.52 -0.15 0.00 0.00 0.00 0.00 51.96 52.33 3dpm s ALA 555 Cb 0.00 -3.12 -0.07 0.00 0.00 0.00 0.00 23.12 19.93 3dpm s ALA 555 CO 0.00 0.24 0.98 -0.06 0.00 0.00 0.00 175.76 176.92 3dpm s PHE 556 N -1.19 3.49 -0.19 0.00 0.40 -1.26 -0.88 117.98 118.36 3dpm s PHE 556 Ca 0.39 1.41 0.14 0.00 -0.60 0.00 0.00 56.93 58.28 3dpm s PHE 556 Cb -0.25 -2.76 -0.24 0.00 0.51 0.00 0.00 43.02 40.29 3dpm s PHE 556 CO 0.30 -0.42 0.11 -0.89 0.70 0.00 0.00 175.22 175.01 3dpm n ILE 557 N -1.82 1.44 -1.69 0.64 5.41 -1.19 -4.57 119.36 117.59 3dpm n ILE 557 Ca 0.06 -0.80 -0.50 0.00 1.00 0.00 0.00 62.75 62.51 3dpm n ILE 557 Cb 0.54 -0.71 -0.05 0.00 -0.71 0.00 0.00 39.64 38.71 3dpm n ILE 557 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 3dpm n GLU 558 N -2.88 2.04 0.00 0.38 4.07 -1.26 0.12 120.64 123.12 3dpm n GLU 558 Ca -0.33 0.75 0.00 0.00 -0.06 0.00 0.00 57.16 57.52 3dpm n GLU 558 Cb 1.12 -2.57 0.00 0.00 -0.06 0.00 0.00 31.44 29.93 3dpm n GLU 558 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 3dpm n ASN 559 N 6.50 0.00 -0.04 4.31 3.02 0.69 -4.61 115.26 125.14 3dpm n ASN 559 Ca 0.23 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.62 3dpm n ASN 559 Cb 0.27 -0.05 -0.14 0.00 -0.61 0.00 0.00 39.78 39.25 3dpm n ASN 559 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3dpm n ILE 560 N -0.57 1.63 -4.91 2.41 5.41 -0.80 -4.82 119.36 117.71 3dpm n ILE 560 Ca 0.00 -0.70 0.00 0.00 1.00 0.00 0.00 62.75 63.05 3dpm n ILE 560 Cb 0.00 -1.33 0.00 0.00 -0.71 0.00 0.00 39.64 37.60 3dpm n ILE 560 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3dpm n GLY 561 N 1.91 0.78 3.25 7.39 0.00 0.33 -4.73 105.19 114.12 3dpm n GLY 561 Ca -0.31 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.58 3dpm n GLY 561 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dpm s VAL 562 N 0.00 2.12 0.08 1.61 1.01 -1.26 -4.79 120.40 119.17 3dpm s VAL 562 Ca 0.00 -1.02 -0.23 0.00 0.00 0.00 0.00 61.98 60.74 3dpm s VAL 562 Cb 0.00 -1.79 -0.07 0.00 0.00 0.00 0.00 36.38 34.52 3dpm s VAL 562 CO 0.00 0.56 0.68 -1.83 0.00 0.00 0.00 175.10 174.51 3dpm s GLU 563 N 0.12 4.40 0.87 2.72 1.03 -1.26 -2.10 118.70 124.47 3dpm s GLU 563 Ca -0.12 0.93 -0.13 0.00 0.03 0.00 0.00 54.97 55.69 3dpm s GLU 563 Cb -0.16 -3.29 0.12 0.00 -0.80 0.00 0.00 34.13 29.99 3dpm s GLU 563 CO 0.07 0.49 1.18 -1.25 -1.33 0.00 0.00 175.26 174.41 3dpm s PRO 564 N -0.72 1.47 -0.07 -4.83 0.04 -1.26 -4.98 135.00 124.64 3dpm s PRO 564 Ca 0.33 0.12 -0.23 0.00 0.04 0.00 0.00 61.00 61.27 3dpm s PRO 564 Cb -0.21 -1.89 -0.18 0.00 0.04 0.00 0.00 34.50 32.26 3dpm s PRO 564 CO 0.22 -1.94 0.86 0.45 0.04 0.00 0.00 177.00 176.63 3dpm h HIS 565 N -1.31 -0.09 -3.51 0.56 3.86 -0.71 -3.43 115.15 110.53 3dpm h HIS 565 Ca -0.47 -0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.08 3dpm h HIS 565 Cb 1.32 0.03 -0.26 0.00 1.06 0.00 0.00 27.41 29.56 3dpm h HIS 565 CO 0.11 0.47 -0.68 0.42 0.86 0.00 0.00 177.93 179.12 3dpm s ILE 566 N -3.14 3.75 -0.37 2.45 1.09 -1.11 -5.07 121.20 118.82 3dpm s ILE 566 Ca -0.14 -0.40 -0.29 0.00 -1.10 0.00 0.00 60.65 58.72 3dpm s ILE 566 Cb -0.00 -2.75 0.01 0.00 -1.06 0.00 0.00 42.46 38.66 3dpm s ILE 566 CO 0.54 0.36 1.23 -0.62 -0.10 0.00 0.00 174.94 176.35 3dpm s ASP 567 N 1.53 6.66 -0.52 3.58 3.68 -1.26 -2.49 116.67 127.85 3dpm s ASP 567 Ca 0.06 0.93 0.05 0.00 2.13 0.00 0.00 52.55 55.72 3dpm s ASP 567 Cb -0.15 -2.54 0.18 0.00 -1.45 0.00 0.00 42.92 38.96 3dpm s ASP 567 CO -0.00 -1.14 0.44 -0.11 0.13 0.00 0.00 175.17 174.49 3dpm n LEU 568 N 7.71 1.06 -4.84 -1.34 0.00 -0.09 -4.92 117.00 114.58 3dpm n LEU 568 Ca 0.14 -4.76 -0.31 0.00 0.00 0.00 0.00 56.01 51.07 3dpm n LEU 568 Cb 0.47 0.04 0.02 0.00 0.00 0.00 0.00 43.42 43.95 3dpm n LEU 568 CO 0.66 1.86 0.71 -2.16 0.00 0.00 0.00 177.39 178.46 3dpm s PRO 569 N -0.77 3.40 -0.19 1.96 0.04 -1.26 -4.52 135.00 133.66 3dpm s PRO 569 Ca 0.31 0.92 -0.29 0.00 0.04 0.00 0.00 61.00 61.98 3dpm s PRO 569 Cb 0.04 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 3dpm s PRO 569 CO -0.17 -0.73 1.19 -0.06 0.04 0.00 0.00 177.00 177.28 3dpm s PHE 570 N -2.92 3.01 0.67 0.56 2.99 -1.26 -4.92 117.98 116.10 3dpm s PHE 570 Ca 0.58 1.15 -0.10 0.00 0.00 0.00 0.00 56.93 58.56 3dpm s PHE 570 Cb -0.13 -3.44 0.00 0.00 0.00 0.00 0.00 43.02 39.45 3dpm s PHE 570 CO 0.48 -1.29 1.05 0.95 -0.00 0.00 0.00 175.22 176.40 3dpm s THR 571 N 3.43 3.82 0.21 0.64 -4.23 -1.26 -1.69 115.64 116.56 3dpm s THR 571 Ca 0.51 0.50 -0.10 0.00 -1.18 0.00 0.00 61.69 61.43 3dpm s THR 571 Cb -0.19 -3.57 0.15 0.00 1.34 0.00 0.00 72.50 70.23 3dpm s THR 571 CO 0.12 -0.73 1.72 0.00 -0.54 0.00 0.00 174.62 175.19 3dpm h ALA 572 N -0.50 0.74 -0.80 3.99 0.00 -1.95 0.17 119.26 120.92 3dpm h ALA 572 Ca -0.45 0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.63 3dpm h ALA 572 Cb 1.24 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 3dpm h ALA 572 CO 0.63 -0.26 0.52 -0.91 0.00 0.00 0.00 179.25 179.23 3dpm h ASN 573 N 0.32 0.78 -0.16 0.00 2.35 -1.99 0.09 115.58 116.97 3dpm h ASN 573 Ca 0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.07 3dpm h ASN 573 Cb 0.43 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 3dpm h ASN 573 CO -0.36 0.51 0.09 0.44 -1.65 0.00 0.00 177.43 176.46 3dpm h ASP 574 N 0.89 0.16 0.12 5.81 3.32 -1.04 -3.18 116.42 122.50 3dpm h ASP 574 Ca 0.34 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 3dpm h ASP 574 Cb 0.20 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3dpm h ASP 574 CO -0.12 0.12 -0.06 0.40 -1.72 0.00 0.00 179.24 177.86 3dpm h ILE 575 N 0.20 0.70 -0.78 0.35 1.08 -0.62 -2.26 117.51 116.18 3dpm h ILE 575 Ca 0.06 -1.25 0.17 0.00 -0.39 0.00 0.00 64.86 63.45 3dpm h ILE 575 Cb -0.01 1.25 -0.11 0.00 -3.07 0.00 0.00 36.82 34.87 3dpm h ILE 575 CO -0.03 0.21 0.24 0.03 -0.69 0.00 0.00 178.15 177.91 3dpm h ARG 576 N -0.95 0.31 -0.66 2.37 3.08 -1.13 0.17 114.38 117.56 3dpm h ARG 576 Ca -0.02 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3dpm h ARG 576 Cb 0.46 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.45 3dpm h ARG 576 CO 0.03 0.20 0.00 0.66 -1.07 0.00 0.00 179.97 179.79 3dpm n TYR 577 N -5.12 1.55 -2.24 3.04 0.53 -1.20 -4.33 117.16 109.40 3dpm n TYR 577 Ca 0.16 -0.55 -0.11 0.00 -1.02 0.00 0.00 57.90 56.37 3dpm n TYR 577 Cb 0.50 -0.38 -0.02 0.00 -1.03 0.00 0.00 39.34 38.41 3dpm n TYR 577 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 3dpm n LYS 578 N 0.59 -1.11 -0.00 -0.72 5.02 0.60 -4.64 118.16 117.91 3dpm n LYS 578 Ca 0.22 0.04 0.02 0.00 -2.02 0.00 0.00 58.31 56.57 3dpm n LYS 578 Cb 0.94 -1.68 -0.03 0.00 -0.02 0.00 0.00 35.03 34.24 3dpm n LYS 578 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dpm n GLY 579 N -0.57 0.19 3.82 0.72 0.00 -1.06 -4.97 105.19 103.33 3dpm n GLY 579 Ca 0.03 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 3dpm n GLY 579 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3dpm n TYR 580 N -1.37 -1.55 -0.17 1.61 4.02 -0.88 -4.80 117.16 114.04 3dpm n TYR 580 Ca 0.00 0.51 -0.10 0.00 -0.01 0.00 0.00 57.90 58.30 3dpm n TYR 580 Cb 0.10 -2.04 0.00 0.00 -0.02 0.00 0.00 39.34 37.38 3dpm n TYR 580 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3dpm h SER 581 N -0.78 0.89 -0.61 7.72 4.64 -1.88 0.38 113.55 123.92 3dpm h SER 581 Ca -0.43 -0.34 -0.02 0.00 -0.47 0.00 0.00 61.79 60.53 3dpm h SER 581 Cb 1.28 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 63.10 3dpm h SER 581 CO 0.62 1.02 0.31 -0.33 -0.87 0.00 0.00 176.83 177.58 3dpm h GLU 582 N 0.75 0.89 0.24 4.77 5.08 -1.92 -1.76 114.58 122.63 3dpm h GLU 582 Ca 0.13 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3dpm h GLU 582 Cb 0.60 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3dpm h GLU 582 CO 0.04 0.69 -0.11 -0.92 -1.00 0.00 0.00 179.01 177.70 3dpm h TYR 583 N 0.89 -0.29 0.00 4.33 3.20 -1.85 -3.12 116.97 120.14 3dpm h TYR 583 Ca 0.22 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 3dpm h TYR 583 Cb 0.08 0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 3dpm h TYR 583 CO 0.01 0.08 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.47 3dpm h LEU 584 N -0.87 0.00 -0.30 2.82 3.38 -0.91 -1.49 115.31 117.93 3dpm h LEU 584 Ca -0.03 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.74 3dpm h LEU 584 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3dpm h LEU 584 CO 0.05 0.07 -0.75 0.44 0.09 0.00 0.00 178.44 178.34 3dpm h ASP 585 N 0.00 0.68 -0.01 -0.43 3.32 -1.39 -1.60 116.42 116.99 3dpm h ASP 585 Ca -0.00 -0.45 -0.14 0.00 0.02 0.00 0.00 57.03 56.46 3dpm h ASP 585 Cb 0.17 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3dpm h ASP 585 CO 0.01 1.21 -0.45 0.50 -1.72 0.00 0.00 179.24 178.79 3dpm h LYS 586 N 0.39 0.55 -0.09 3.56 3.11 -1.27 -1.35 116.57 121.47 3dpm h LYS 586 Ca -0.04 -0.30 -0.01 0.00 -2.81 0.00 0.00 60.65 57.49 3dpm h LYS 586 Cb 1.35 0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 32.59 3dpm h LYS 586 CO 0.14 0.89 -0.00 0.28 -2.81 0.00 0.00 179.45 177.95 3dpm h VAL 587 N 0.44 1.25 -0.79 2.00 2.07 -1.24 -0.71 116.25 119.28 3dpm h VAL 587 Ca 0.03 -0.80 0.02 0.00 0.82 0.00 0.00 66.70 66.77 3dpm h VAL 587 Cb 0.96 1.61 -0.04 0.00 -1.52 0.00 0.00 31.29 32.30 3dpm h VAL 587 CO 0.09 0.22 0.51 0.11 0.02 0.00 0.00 177.57 178.52 3dpm h LYS 588 N -0.13 0.99 -0.31 1.57 1.57 -1.22 0.03 116.57 119.08 3dpm h LYS 588 Ca 0.02 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 3dpm h LYS 588 Cb 0.35 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 3dpm h LYS 588 CO 0.00 0.66 0.11 0.87 -0.57 0.00 0.00 179.45 180.52 3dpm h LYS 589 N 1.02 0.47 -0.33 3.15 1.57 -1.12 -2.27 116.57 119.06 3dpm h LYS 589 Ca 0.30 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.96 3dpm h LYS 589 Cb -0.06 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 3dpm h LYS 589 CO -0.09 0.50 0.07 -0.07 -0.57 0.00 0.00 179.45 179.30 3dpm h LEU 590 N 0.34 0.44 0.76 2.94 3.38 -0.66 -2.89 115.31 119.62 3dpm h LEU 590 Ca 0.10 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3dpm h LEU 590 Cb 0.22 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.86 3dpm h LEU 590 CO -0.01 0.45 -0.37 0.58 0.09 0.00 0.00 178.44 179.19 3dpm h VAL 591 N 0.47 0.09 -1.03 1.22 2.07 -0.62 -3.09 116.25 115.37 3dpm h VAL 591 Ca 0.11 -0.21 0.26 0.00 0.82 0.00 0.00 66.70 67.68 3dpm h VAL 591 Cb 0.19 0.11 -0.09 0.00 -1.52 0.00 0.00 31.29 29.98 3dpm h VAL 591 CO -0.00 0.01 0.66 0.00 0.02 0.00 0.00 177.57 178.25 3dpm h GLN 593 N 0.43 0.00 0.16 0.00 4.20 -1.44 0.17 115.11 118.63 3dpm h GLN 593 Ca 0.59 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.98 3dpm h GLN 593 Cb 1.43 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.22 3dpm h GLN 593 CO -0.30 0.11 -1.55 -0.07 -0.67 0.00 0.00 178.83 176.34 3dpm h LEU 594 N 0.00 0.53 -1.11 1.46 3.38 0.69 -2.62 115.31 117.65 3dpm h LEU 594 Ca -0.00 -0.70 -0.08 0.00 0.09 0.00 0.00 57.88 57.19 3dpm h LEU 594 Cb 0.30 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3dpm h LEU 594 CO 0.01 1.58 -0.40 0.40 0.09 0.00 0.00 178.44 180.12 3dpm h ILE 595 N 0.09 1.09 -0.00 1.22 2.04 -0.56 0.24 117.51 121.63 3dpm h ILE 595 Ca -0.26 -1.46 0.00 0.00 1.00 0.00 0.00 64.86 64.14 3dpm h ILE 595 Cb 2.06 1.83 0.00 0.00 -0.74 0.00 0.00 36.82 39.98 3dpm h ILE 595 CO 0.19 0.39 -0.02 0.59 0.00 0.00 0.00 178.15 179.30 3dpm n ASN 596 N -3.78 0.23 -4.30 1.72 5.03 0.54 -4.90 115.26 109.80 3dpm n ASN 596 Ca -0.01 -0.78 -0.38 0.00 0.87 0.00 0.00 54.58 54.28 3dpm n ASN 596 Cb 0.47 -0.08 -0.04 0.00 -1.02 0.00 0.00 39.78 39.11 3dpm n ASN 596 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 3dpm n ASN 597 N -0.94 -2.90 -0.72 6.41 5.15 0.07 -5.05 115.26 117.28 3dpm n ASN 597 Ca 0.20 -1.06 0.13 0.00 -0.60 0.00 0.00 54.58 53.24 3dpm n ASN 597 Cb 0.19 -2.41 0.32 0.00 -0.53 0.00 0.00 39.78 37.35 3dpm n ASN 597 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13