#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 0.06 -0.75 2.46 5.85 -1.99 0.13 115.31 121.07 3dpm h LEU 34 Ca 0.00 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.76 3dpm h LEU 34 Cb 0.00 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 3dpm h LEU 34 CO 0.00 0.06 0.48 0.58 -0.34 0.00 0.00 178.44 179.22 3dpm h VAL 35 N 0.12 1.13 -0.48 1.05 2.07 -1.91 -1.00 116.25 117.23 3dpm h VAL 35 Ca 0.06 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.21 3dpm h VAL 35 Cb 0.03 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.87 3dpm h VAL 35 CO -0.06 0.17 0.14 0.00 0.02 0.00 0.00 177.57 177.85 3dpm h LYS 37 N 0.64 1.12 -0.52 0.00 1.57 -0.34 -2.10 116.57 116.93 3dpm h LYS 37 Ca 0.15 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3dpm h LYS 37 Cb 0.28 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 3dpm h LYS 37 CO -0.00 0.94 0.32 -0.91 -0.57 0.00 0.00 179.45 179.22 3dpm h ASN 38 N 1.07 0.62 -0.39 0.86 2.35 -0.96 -1.65 115.58 117.49 3dpm h ASN 38 Ca 0.24 -0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 55.87 3dpm h ASN 38 Cb 0.26 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 3dpm h ASN 38 CO -0.01 0.49 0.02 0.00 -1.65 0.00 0.00 177.43 176.28 3dpm h ALA 39 N 1.15 1.15 -0.26 -0.83 0.00 -1.13 -0.92 119.26 118.43 3dpm h ALA 39 Ca 0.19 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 3dpm h ALA 39 Cb -0.02 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3dpm h ALA 39 CO -0.04 0.55 -0.42 -0.07 0.00 0.00 0.00 179.25 179.27 3dpm h LEU 40 N 0.72 0.67 -0.43 0.00 3.38 -1.13 0.69 115.31 119.20 3dpm h LEU 40 Ca 0.14 -0.31 -0.16 0.00 0.09 0.00 0.00 57.88 57.65 3dpm h LEU 40 Cb 0.41 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3dpm h LEU 40 CO 0.02 1.01 -0.44 -0.61 0.09 0.00 0.00 178.44 178.50 3dpm h GLN 41 N 0.51 0.82 0.00 1.13 -0.00 -1.02 -2.28 115.11 114.27 3dpm h GLN 41 Ca 0.04 -0.46 -0.16 0.00 -0.00 0.00 0.00 58.65 58.07 3dpm h GLN 41 Cb 0.95 0.03 -0.02 0.00 0.00 0.00 0.00 27.48 28.43 3dpm h GLN 41 CO 0.09 1.09 -0.76 -0.44 0.00 0.00 0.00 178.83 178.81 3dpm h ASP 42 N 0.66 0.00 -0.53 -0.69 3.32 -1.07 -2.98 116.42 115.13 3dpm h ASP 42 Ca 0.04 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 3dpm h ASP 42 Cb 1.02 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.55 3dpm h ASP 42 CO 0.10 0.76 0.22 0.25 -1.72 0.00 0.00 179.24 178.85 3dpm h LEU 43 N 0.00 0.73 -1.88 1.55 6.46 -0.73 -1.86 115.31 119.58 3dpm h LEU 43 Ca -0.01 -0.16 -0.02 0.00 -0.12 0.00 0.00 57.88 57.57 3dpm h LEU 43 Cb 1.37 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 41.10 3dpm h LEU 43 CO 0.10 0.69 -0.12 0.77 -0.62 0.00 0.00 178.44 179.26 3dpm h SER 44 N 0.72 0.00 0.04 1.25 4.64 -1.32 -0.62 113.55 118.27 3dpm h SER 44 Ca 0.18 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.28 3dpm h SER 44 Cb 0.18 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.29 3dpm h SER 44 CO -0.02 0.12 -0.89 0.15 -0.87 0.00 0.00 176.83 175.31 3dpm h PHE 45 N 0.00 0.82 -0.34 4.77 3.57 -1.23 -1.80 116.94 122.73 3dpm h PHE 45 Ca -0.00 -0.48 -0.05 0.00 3.53 0.00 0.00 57.97 60.97 3dpm h PHE 45 Cb 0.36 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 3dpm h PHE 45 CO 0.00 1.31 -0.02 -0.07 -2.23 0.00 0.00 178.31 177.31 3dpm h LEU 46 N 0.09 0.50 -0.66 0.59 3.38 -0.97 0.35 115.31 118.59 3dpm h LEU 46 Ca -0.12 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.66 3dpm h LEU 46 Cb 1.59 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 42.19 3dpm h LEU 46 CO 0.17 0.58 0.08 -0.08 0.09 0.00 0.00 178.44 179.29 3dpm h GLU 47 N 0.51 1.11 -0.49 1.13 4.81 -1.11 -2.50 114.58 118.03 3dpm h GLU 47 Ca 0.11 -0.31 -0.06 0.00 -0.13 0.00 0.00 59.36 58.97 3dpm h GLU 47 Cb 0.35 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 3dpm h GLU 47 CO 0.01 1.03 0.07 1.25 -0.73 0.00 0.00 179.01 180.64 3dpm h HIS 48 N 1.03 0.88 -0.87 0.92 2.76 -0.32 -2.93 115.15 116.62 3dpm h HIS 48 Ca 0.20 -0.13 0.03 0.00 -2.20 0.00 0.00 60.37 58.27 3dpm h HIS 48 Cb 0.47 -0.24 -0.05 0.00 1.55 0.00 0.00 27.41 29.14 3dpm h HIS 48 CO 0.04 0.81 0.56 -0.07 -1.30 0.00 0.00 177.93 177.97 3dpm h LEU 49 N 0.69 0.93 -2.39 0.26 3.38 -0.74 -0.62 115.31 116.83 3dpm h LEU 49 Ca 0.15 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3dpm h LEU 49 Cb 0.41 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 3dpm h LEU 49 CO 0.01 0.64 -0.03 -0.07 0.09 0.00 0.00 178.44 179.08 3dpm h LEU 50 N 1.09 0.00 -1.23 1.67 3.38 -1.27 -0.55 115.31 118.39 3dpm h LEU 50 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 3dpm h LEU 50 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3dpm h LEU 50 CO -0.12 0.03 -0.08 0.00 0.09 0.00 0.00 178.44 178.37 3dpm n GLN 51 N -3.49 1.74 -0.05 1.13 6.02 -0.27 -3.89 117.38 118.57 3dpm n GLN 51 Ca -0.02 -1.23 -0.10 0.00 -0.01 0.00 0.00 57.00 55.64 3dpm n GLN 51 Cb 0.14 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.89 3dpm n GLN 51 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 3dpm n VAL 52 N 0.45 0.51 -1.86 5.09 0.31 -0.32 -4.89 118.33 117.61 3dpm n VAL 52 Ca 0.16 -0.14 0.05 0.00 -0.01 0.00 0.00 64.34 64.40 3dpm n VAL 52 Cb 0.45 -1.51 0.12 0.00 -0.91 0.00 0.00 33.84 31.99 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 -3.32 0.89 -3.51 5.55 4.76 -0.55 -4.96 118.16 117.01 3dpm n LYS 53 Ca -0.18 -2.58 -0.42 0.00 -2.87 0.00 0.00 58.31 52.26 3dpm n LYS 53 Cb 0.64 -0.97 -0.06 0.00 -1.84 0.00 0.00 35.03 32.79 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 -1.84 3.54 0.24 2.13 5.04 -1.25 -4.37 117.35 120.84 3dpm s TYR 54 Ca 0.33 -2.19 -0.05 0.00 -2.44 0.00 0.00 57.07 52.72 3dpm s TYR 54 Cb 0.33 -3.53 0.39 0.00 0.35 0.00 0.00 41.96 39.50 3dpm s TYR 54 CO -0.08 -0.94 1.79 0.00 -1.34 0.00 0.00 175.55 174.98 3dpm h ALA 55 N 7.71 1.12 0.00 3.97 0.00 -1.70 -2.51 119.26 127.85 3dpm h ALA 55 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3dpm h ALA 55 Cb 1.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3dpm h ALA 55 CO 0.78 0.03 0.00 -0.35 0.00 0.00 0.00 179.25 179.71 3dpm n PRO 56 N -4.80 0.84 0.02 0.00 -0.04 -1.26 -4.26 135.00 125.51 3dpm n PRO 56 Ca 0.13 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.49 3dpm n PRO 56 Cb 0.29 -1.10 -0.04 0.00 -0.04 0.00 0.00 33.50 32.61 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 0.04 -0.33 -0.72 0.54 3.64 -1.80 -0.54 116.57 117.41 3dpm h LYS 57 Ca 0.00 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 3dpm h LYS 57 Cb 0.10 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.96 3dpm h LYS 57 CO 0.00 -0.22 0.48 1.15 -2.27 0.00 0.00 179.45 178.59 3dpm h THR 58 N -0.34 1.16 -0.49 1.00 2.02 -1.85 -1.97 112.91 112.44 3dpm h THR 58 Ca 0.09 -0.33 -0.08 0.00 0.77 0.00 0.00 66.41 66.86 3dpm h THR 58 Cb 0.46 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 3dpm h THR 58 CO -0.28 0.17 -0.01 -0.25 0.37 0.00 0.00 175.52 175.52 3dpm h TRP 59 N 0.95 0.96 -0.54 3.16 2.91 -1.67 -2.69 115.95 119.03 3dpm h TRP 59 Ca 0.27 -0.17 -0.09 0.00 1.13 0.00 0.00 58.89 60.03 3dpm h TRP 59 Cb -0.07 -0.25 -0.02 0.00 -0.51 0.00 0.00 29.16 28.31 3dpm h TRP 59 CO -0.00 0.91 -0.02 0.87 -1.03 0.00 0.00 178.44 179.17 3dpm h LYS 60 N 0.74 0.94 -0.49 2.65 1.79 -0.61 0.41 116.57 122.00 3dpm h LYS 60 Ca 0.14 -0.28 -0.09 0.00 -2.18 0.00 0.00 60.65 58.23 3dpm h LYS 60 Cb 0.54 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.07 3dpm h LYS 60 CO 0.03 0.94 -0.06 0.93 -1.08 0.00 0.00 179.45 180.20 3dpm h GLU 61 N 0.86 0.87 0.20 3.15 5.08 -1.32 -0.28 114.58 123.13 3dpm h GLU 61 Ca 0.16 -0.28 -0.35 0.00 -1.00 0.00 0.00 59.36 57.89 3dpm h GLU 61 Cb 0.53 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.72 3dpm h GLU 61 CO 0.03 0.91 -1.70 1.96 -1.00 0.00 0.00 179.01 179.21 3dpm h GLN 62 N 0.80 0.42 0.07 2.33 4.20 -1.28 -2.32 115.11 119.33 3dpm h GLN 62 Ca 0.14 -0.72 -0.14 0.00 0.06 0.00 0.00 58.65 57.99 3dpm h GLN 62 Cb 0.57 0.27 0.01 0.00 0.30 0.00 0.00 27.48 28.63 3dpm h GLN 62 CO 0.03 1.34 -0.58 -0.92 -0.67 0.00 0.00 178.83 178.04 3dpm h TYR 63 N 0.10 0.45 0.00 2.96 3.20 -0.23 -3.38 116.97 120.07 3dpm h TYR 63 Ca -0.33 -0.29 -0.06 0.00 3.14 0.00 0.00 58.73 61.19 3dpm h TYR 63 Cb 2.10 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 40.33 3dpm h TYR 63 CO 0.11 1.18 -1.79 1.28 -1.64 0.00 0.00 178.16 177.30 3dpm n LEU 64 N -4.26 0.24 0.00 2.82 4.77 -0.16 -4.96 117.00 115.45 3dpm n LEU 64 Ca -0.12 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3dpm n LEU 64 Cb 0.70 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 3dpm n LEU 64 CO 0.45 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3dpm n GLY 65 N 1.31 0.55 3.76 -0.72 0.00 -0.87 -5.01 105.19 104.21 3dpm n GLY 65 Ca -0.07 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.00 3.36 -0.17 1.61 -0.00 -1.07 -4.96 118.94 115.71 3dpm s TRP 66 Ca 0.00 1.54 -0.01 0.00 -0.00 0.00 0.00 56.10 57.63 3dpm s TRP 66 Cb 0.00 -3.46 0.05 0.00 -0.00 0.00 0.00 33.47 30.06 3dpm s TRP 66 CO 0.00 -1.15 -0.02 0.34 -0.00 0.00 0.00 176.95 176.12 3dpm s ASP 67 N -0.55 2.84 0.17 5.86 2.15 -1.26 -4.12 116.67 121.77 3dpm s ASP 67 Ca 0.48 -0.71 -0.20 0.00 0.43 0.00 0.00 52.55 52.55 3dpm s ASP 67 Cb -0.35 -0.79 0.10 0.00 -0.30 0.00 0.00 42.92 41.58 3dpm s ASP 67 CO 0.44 -0.23 1.62 0.25 -0.17 0.00 0.00 175.17 177.08 3dpm h LEU 68 N 8.16 -0.82 0.31 -1.34 5.85 -1.98 -1.01 115.31 124.48 3dpm h LEU 68 Ca -0.20 0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 3dpm h LEU 68 Cb 1.11 0.42 0.00 0.00 0.37 0.00 0.00 40.66 42.57 3dpm h LEU 68 CO 0.37 -0.26 -0.15 0.58 -0.34 0.00 0.00 178.44 178.63 3dpm h VAL 69 N -0.16 0.71 -0.04 1.05 2.07 -1.98 0.06 116.25 117.95 3dpm h VAL 69 Ca 0.20 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.59 3dpm h VAL 69 Cb 0.48 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3dpm h VAL 69 CO -0.52 0.03 -0.06 -0.61 0.02 0.00 0.00 177.57 176.43 3dpm h GLN 70 N -0.49 -0.08 -0.83 1.57 -0.00 -1.97 0.21 115.11 113.52 3dpm h GLN 70 Ca -0.04 0.01 0.09 0.00 -0.00 0.00 0.00 58.65 58.70 3dpm h GLN 70 Cb 0.37 0.02 -0.07 0.00 0.00 0.00 0.00 27.48 27.80 3dpm h GLN 70 CO 0.07 -0.05 0.48 1.03 0.00 0.00 0.00 178.83 180.36 3dpm h SER 71 N -0.08 0.71 -0.23 -0.69 0.87 -1.18 0.24 113.55 113.18 3dpm h SER 71 Ca 0.04 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.62 3dpm h SER 71 Cb 0.14 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.99 3dpm h SER 71 CO -0.09 0.41 0.06 -1.28 -0.53 0.00 0.00 176.83 175.40 3dpm h SER 72 N 0.82 0.35 -0.58 6.23 0.87 -0.15 -2.50 113.55 118.59 3dpm h SER 72 Ca 0.40 -0.23 -0.05 0.00 -1.23 0.00 0.00 61.79 60.68 3dpm h SER 72 Cb 0.34 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 3dpm h SER 72 CO -0.24 0.49 0.19 0.58 -0.53 0.00 0.00 176.83 177.32 3dpm h VAL 73 N 0.20 1.23 -0.34 2.23 2.07 0.14 -1.07 116.25 120.71 3dpm h VAL 73 Ca 0.07 -0.80 0.01 0.00 0.82 0.00 0.00 66.70 66.80 3dpm h VAL 73 Cb 0.27 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 3dpm h VAL 73 CO 0.00 0.31 0.23 -1.28 0.02 0.00 0.00 177.57 176.85 3dpm h SER 74 N 0.91 0.35 0.34 0.57 0.87 -0.37 -0.67 113.55 115.55 3dpm h SER 74 Ca 0.20 -0.01 -0.31 0.00 -1.23 0.00 0.00 61.79 60.44 3dpm h SER 74 Cb 0.26 -0.09 0.03 0.00 -0.44 0.00 0.00 62.40 62.16 3dpm h SER 74 CO -0.01 0.25 -1.37 0.00 -0.53 0.00 0.00 176.83 175.17 3dpm h ALA 75 N 1.79 -0.06 -0.98 6.23 0.00 -0.87 -3.18 119.26 122.19 3dpm h ALA 75 Ca 0.13 -0.85 0.02 0.00 0.00 0.00 0.00 54.91 54.21 3dpm h ALA 75 Cb 0.03 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.88 3dpm h ALA 75 CO -0.03 0.77 0.65 1.96 0.00 0.00 0.00 179.25 182.60 3dpm h GLN 76 N 0.15 1.26 -0.77 0.00 4.20 -0.64 -2.07 115.11 117.25 3dpm h GLN 76 Ca -0.21 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 58.44 3dpm h GLN 76 Cb 2.07 -0.29 -0.04 0.00 0.30 0.00 0.00 27.48 29.52 3dpm h GLN 76 CO 0.25 0.84 0.50 1.96 -0.67 0.00 0.00 178.83 181.71 3dpm h GLN 77 N 1.30 0.98 -0.41 1.46 4.20 -1.19 0.58 115.11 122.04 3dpm h GLN 77 Ca 0.37 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.93 3dpm h GLN 77 Cb -0.11 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.43 3dpm h GLN 77 CO -0.09 0.65 -0.10 0.87 -0.67 0.00 0.00 178.83 179.49 3dpm h LYS 78 N 1.01 0.72 -0.05 1.46 1.57 -1.38 -1.13 116.57 118.77 3dpm h LYS 78 Ca 0.29 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 3dpm h LYS 78 Cb -0.08 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.16 3dpm h LYS 78 CO -0.08 0.80 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.50 3dpm h LEU 79 N 0.65 0.12 -1.11 2.94 3.38 -0.85 -3.25 115.31 117.19 3dpm h LEU 79 Ca 0.11 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3dpm h LEU 79 Cb 0.56 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3dpm h LEU 79 CO 0.03 0.54 0.00 0.03 0.09 0.00 0.00 178.44 179.13 3dpm h ARG 80 N -0.30 0.00 -0.61 1.13 3.08 -0.79 -3.25 114.38 113.64 3dpm h ARG 80 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3dpm h ARG 80 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 3dpm h ARG 80 CO 0.01 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.16 3dpm n THR 81 N -2.89 1.79 0.00 2.04 -2.24 -0.44 -4.87 114.28 107.67 3dpm n THR 81 Ca 0.01 -1.22 0.00 0.00 -2.27 0.00 0.00 64.05 60.57 3dpm n THR 81 Cb 0.32 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 3dpm n THR 81 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dpm n GLN 82 N 1.02 0.00 0.00 -0.78 1.13 -1.23 -5.06 117.38 112.47 3dpm n GLN 82 Ca 0.25 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.31 3dpm n GLN 82 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.21 3dpm n GLN 82 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3dpm n GLU 83 N 0.00 0.00 -3.88 -1.09 1.02 -1.26 -4.95 120.64 110.48 3dpm n GLU 83 Ca 0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.82 3dpm n GLU 83 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.43 3dpm n GLU 83 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3dpm n ASN 84 N 0.00 -3.17 -4.74 1.62 4.05 -1.26 -4.77 115.26 106.99 3dpm n ASN 84 Ca 0.00 -0.93 -0.37 0.00 0.45 0.00 0.00 54.58 53.73 3dpm n ASN 84 Cb 0.00 -1.18 0.05 0.00 1.23 0.00 0.00 39.78 39.88 3dpm n ASN 84 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 3dpm s PRO 85 N -6.26 2.94 0.54 1.20 0.04 -1.26 -5.02 135.00 127.18 3dpm s PRO 85 Ca 0.29 2.08 -0.03 0.00 0.04 0.00 0.00 61.00 63.38 3dpm s PRO 85 Cb -0.16 -2.07 0.01 0.00 0.04 0.00 0.00 34.50 32.32 3dpm s PRO 85 CO 0.72 -1.30 0.82 -1.54 0.04 0.00 0.00 177.00 175.74 3dpm s SER 86 N -1.23 5.64 0.21 6.66 1.04 -1.26 -4.76 113.70 120.00 3dpm s SER 86 Ca 0.76 0.53 -0.09 0.00 0.48 0.00 0.00 55.95 57.63 3dpm s SER 86 Cb -0.37 -1.59 0.17 0.00 0.10 0.00 0.00 66.02 64.32 3dpm s SER 86 CO 0.42 -0.96 1.84 0.74 0.98 0.00 0.00 173.24 176.26 3dpm h THR 87 N 0.02 1.24 -0.77 2.02 2.02 -1.95 -1.79 112.91 113.69 3dpm h THR 87 Ca -0.45 -0.58 0.08 0.00 0.77 0.00 0.00 66.41 66.22 3dpm h THR 87 Cb 1.26 0.15 -0.06 0.00 -1.74 0.00 0.00 68.15 67.76 3dpm h THR 87 CO 0.59 0.26 0.44 0.28 0.37 0.00 0.00 175.52 177.47 3dpm h SER 88 N 1.12 0.66 -0.13 4.18 0.02 -1.93 -0.64 113.55 116.82 3dpm h SER 88 Ca 0.28 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.28 3dpm h SER 88 Cb 0.02 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 3dpm h SER 88 CO -0.05 0.40 0.06 0.15 -1.14 0.00 0.00 176.83 176.25 3dpm h PHE 89 N 0.78 0.11 -0.77 3.45 3.57 -1.72 -1.20 116.94 121.16 3dpm h PHE 89 Ca 0.36 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.86 3dpm h PHE 89 Cb 0.26 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 3dpm h PHE 89 CO -0.06 0.07 0.47 0.00 -2.23 0.00 0.00 178.31 176.55 3dpm h GLN 91 N 1.06 0.79 -0.86 0.00 4.20 -0.87 -0.87 115.11 118.56 3dpm h GLN 91 Ca 0.28 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.93 3dpm h GLN 91 Cb -0.04 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 27.53 3dpm h GLN 91 CO -0.05 0.58 0.56 1.96 -0.67 0.00 0.00 178.83 181.21 3dpm h GLN 92 N 0.78 1.08 -0.43 1.46 4.20 -0.64 -0.78 115.11 120.78 3dpm h GLN 92 Ca 0.21 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.72 3dpm h GLN 92 Cb 0.00 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.53 3dpm h GLN 92 CO -0.04 0.71 -0.26 0.28 -0.67 0.00 0.00 178.83 178.86 3dpm h VAL 93 N 1.11 1.27 -0.23 -0.54 2.07 -0.81 -2.31 116.25 116.81 3dpm h VAL 93 Ca 0.33 -1.42 -0.13 0.00 0.82 0.00 0.00 66.70 66.30 3dpm h VAL 93 Cb -0.05 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3dpm h VAL 93 CO -0.10 0.48 -0.41 -0.07 0.02 0.00 0.00 177.57 177.50 3dpm h LEU 94 N 0.77 0.57 -0.74 2.57 3.38 -0.73 -1.82 115.31 119.31 3dpm h LEU 94 Ca 0.09 -0.25 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 3dpm h LEU 94 Cb 0.82 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 3dpm h LEU 94 CO 0.07 0.91 -0.15 0.00 0.09 0.00 0.00 178.44 179.36 3dpm h ALA 95 N 1.12 0.93 -0.40 1.53 0.00 -1.11 -2.32 119.26 119.00 3dpm h ALA 95 Ca 0.04 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 3dpm h ALA 95 Cb 0.90 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3dpm h ALA 95 CO 0.08 0.62 -0.13 -0.44 0.00 0.00 0.00 179.25 179.38 3dpm h ASP 96 N 0.71 0.72 0.48 0.00 3.32 -1.18 0.40 116.42 120.87 3dpm h ASP 96 Ca 0.11 -0.22 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 3dpm h ASP 96 Cb 0.65 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 3dpm h ASP 96 CO 0.05 0.87 -0.32 0.15 -1.72 0.00 0.00 179.24 178.26 3dpm h PHE 97 N 0.66 -0.86 0.00 4.55 3.57 -0.94 0.66 116.94 124.57 3dpm h PHE 97 Ca 0.11 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 3dpm h PHE 97 Cb 0.60 0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.64 3dpm h PHE 97 CO 0.03 -0.49 -0.30 0.82 -2.23 0.00 0.00 178.31 176.14 3dpm h ILE 98 N -0.78 1.06 0.00 1.41 1.08 -1.36 -1.84 117.51 117.08 3dpm h ILE 98 Ca -0.05 -1.10 -0.02 0.00 -0.39 0.00 0.00 64.86 63.30 3dpm h ILE 98 Cb 0.65 1.62 -0.00 0.00 -3.07 0.00 0.00 36.82 36.02 3dpm h ILE 98 CO 0.03 0.30 -0.11 1.23 -0.69 0.00 0.00 178.15 178.91 3dpm h GLY 99 N 1.15 0.00 2.00 5.37 0.00 0.71 -2.46 103.07 109.84 3dpm h GLY 99 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3dpm h GLY 99 CO 0.04 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.19 3dpm n GLY 100 N -0.76 -1.10 0.05 4.60 0.00 0.14 -2.52 105.19 105.59 3dpm n GLY 100 Ca -0.02 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.09 3dpm n GLY 100 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dpm n LEU 101 N -1.63 0.33 -3.87 0.99 4.77 -0.92 -4.39 117.00 112.27 3dpm n LEU 101 Ca 0.04 0.55 -0.25 0.00 -0.03 0.00 0.00 56.01 56.31 3dpm n LEU 101 Cb 0.20 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 3dpm n LEU 101 CO 0.16 -0.18 -0.13 -3.20 -1.33 0.00 0.00 177.39 172.71 3dpm n ASN 102 N -1.83 -1.17 -3.96 -1.43 4.05 -1.05 -4.96 115.26 104.92 3dpm n ASN 102 Ca 0.05 -0.92 -0.27 0.00 0.45 0.00 0.00 54.58 53.89 3dpm n ASN 102 Cb 0.32 -3.47 -0.17 0.00 1.23 0.00 0.00 39.78 37.69 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 -4.22 2.27 0.47 1.20 -1.08 -1.26 -4.87 116.67 109.18 3dpm s ASP 103 Ca 0.10 -0.36 0.22 0.00 -0.52 0.00 0.00 52.55 51.99 3dpm s ASP 103 Cb -0.05 -0.94 1.16 0.00 -1.46 0.00 0.00 42.92 41.63 3dpm s ASP 103 CO 0.86 -0.08 1.98 -0.26 0.52 0.00 0.00 175.17 178.19 3dpm h PHE 104 N 7.95 0.00 0.00 -5.34 -1.00 -1.92 -2.37 116.94 114.26 3dpm h PHE 104 Ca -0.32 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.46 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 0.20 -0.42 0.72 -1.61 0.00 0.00 178.31 177.68 3dpm n HIS 105 N -3.82 0.47 -3.51 -0.55 8.25 -1.26 -4.77 115.22 110.04 3dpm n HIS 105 Ca -0.02 0.14 -0.40 0.00 -0.26 0.00 0.00 57.72 57.18 3dpm n HIS 105 Cb 0.30 -0.62 -0.10 0.00 1.12 0.00 0.00 29.99 30.68 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 -3.11 3.51 0.39 -1.41 0.00 -0.89 -4.04 121.76 116.22 3dpm s ALA 106 Ca 0.09 -1.24 -0.13 0.00 0.00 0.00 0.00 51.96 50.67 3dpm s ALA 106 Cb 0.14 -2.66 0.05 0.00 0.00 0.00 0.00 23.12 20.66 3dpm s ALA 106 CO 0.67 -0.87 0.76 0.41 0.00 0.00 0.00 175.76 176.73 3dpm n GLY 107 N 5.04 1.10 2.78 0.00 0.00 -1.11 -4.72 105.19 108.27 3dpm n GLY 107 Ca -0.12 -1.30 -0.15 0.00 0.00 0.00 0.00 46.02 44.45 3dpm n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dpm s VAL 108 N -2.18 -0.06 0.15 1.61 1.01 -1.26 -1.93 120.40 117.74 3dpm s VAL 108 Ca 0.18 0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.47 3dpm s VAL 108 Cb -0.05 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.19 3dpm s VAL 108 CO 0.13 0.10 -0.08 0.42 0.00 0.00 0.00 175.10 175.67 3dpm s THR 109 N 1.18 3.35 0.26 3.92 -4.23 -0.21 -4.59 115.64 115.32 3dpm s THR 109 Ca -0.08 -1.47 0.07 0.00 -1.18 0.00 0.00 61.69 59.03 3dpm s THR 109 Cb -0.13 -2.63 -0.05 0.00 1.34 0.00 0.00 72.50 71.03 3dpm s THR 109 CO -0.03 -0.03 -0.08 -0.36 -0.54 0.00 0.00 174.62 173.58 3dpm s PHE 110 N -1.52 1.89 -1.13 3.99 0.40 0.34 -1.21 117.98 120.74 3dpm s PHE 110 Ca 0.24 -0.68 -0.16 0.00 -0.60 0.00 0.00 56.93 55.73 3dpm s PHE 110 Cb -0.10 -1.04 0.14 0.00 0.51 0.00 0.00 43.02 42.54 3dpm s PHE 110 CO 0.15 0.29 1.39 -0.06 0.70 0.00 0.00 175.22 177.69 3dpm s PHE 111 N -3.02 3.24 -0.18 0.36 0.40 0.88 -4.59 117.98 115.07 3dpm s PHE 111 Ca 0.28 -1.78 -0.09 0.00 -0.60 0.00 0.00 56.93 54.73 3dpm s PHE 111 Cb 0.03 -4.39 0.06 0.00 0.51 0.00 0.00 43.02 39.23 3dpm s PHE 111 CO 0.11 -1.51 0.43 0.00 0.70 0.00 0.00 175.22 174.95 3dpm s ALA 112 N 2.46 -1.12 -0.79 5.36 0.00 -1.26 -4.88 121.76 121.53 3dpm s ALA 112 Ca 0.42 1.59 0.23 0.00 0.00 0.00 0.00 51.96 54.20 3dpm s ALA 112 Cb -0.02 -1.01 0.15 0.00 0.00 0.00 0.00 23.12 22.23 3dpm s ALA 112 CO -0.02 -0.33 1.13 0.44 0.00 0.00 0.00 175.76 176.98 3dpm n ILE 113 N 4.41 0.10 -1.68 0.00 -5.35 -1.26 -3.41 119.36 112.16 3dpm n ILE 113 Ca -0.21 -0.14 -0.42 0.00 -0.27 0.00 0.00 62.75 61.71 3dpm n ILE 113 Cb 0.55 0.33 -0.00 0.00 -1.74 0.00 0.00 39.64 38.78 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 -1.76 1.97 -3.61 6.28 2.13 -1.26 -4.86 120.64 119.53 3dpm n GLU 114 Ca 0.03 0.69 -0.06 0.00 0.66 0.00 0.00 57.16 58.49 3dpm n GLU 114 Cb 0.39 -2.28 -0.02 0.00 0.27 0.00 0.00 31.44 29.80 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 -0.41 -0.27 -0.25 4.31 1.04 -0.79 -1.18 113.70 116.15 3dpm s SER 115 Ca 0.57 -0.17 -0.16 0.00 0.48 0.00 0.00 55.95 56.68 3dpm s SER 115 Cb -0.56 0.41 0.07 0.00 0.10 0.00 0.00 66.02 66.03 3dpm s SER 115 CO 0.61 -0.70 0.62 0.00 0.98 0.00 0.00 173.24 174.75 3dpm s ALA 116 N -3.13 -1.66 0.04 5.32 0.00 -0.51 -0.85 121.76 120.98 3dpm s ALA 116 Ca 0.08 2.13 -0.02 0.00 0.00 0.00 0.00 51.96 54.16 3dpm s ALA 116 Cb -0.01 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.83 3dpm s ALA 116 CO -0.04 -0.34 -0.01 1.52 0.00 0.00 0.00 175.76 176.89 3dpm s TYR 117 N 1.33 0.41 -0.08 0.00 -0.85 -0.86 -0.52 117.35 116.78 3dpm s TYR 117 Ca -0.08 -0.86 0.05 0.00 -0.52 0.00 0.00 57.07 55.65 3dpm s TYR 117 Cb -0.06 -0.30 -0.00 0.00 0.38 0.00 0.00 41.96 41.98 3dpm s TYR 117 CO -0.14 -0.34 -0.23 -0.51 -1.52 0.00 0.00 175.55 172.80 3dpm s LEU 118 N -2.50 2.05 -0.11 -3.49 1.43 0.14 -1.11 118.68 115.10 3dpm s LEU 118 Ca 0.00 -0.52 -0.03 0.00 -1.03 0.00 0.00 54.13 52.55 3dpm s LEU 118 Cb 0.03 -1.35 -0.09 0.00 0.03 0.00 0.00 46.19 44.81 3dpm s LEU 118 CO -0.07 0.18 1.72 -0.81 0.23 0.00 0.00 176.35 177.60 3dpm n PRO 119 N 3.34 0.89 -4.14 1.29 -0.04 -1.26 -4.80 135.00 130.29 3dpm n PRO 119 Ca -0.19 -0.53 -0.16 0.00 -0.04 0.00 0.00 63.50 62.58 3dpm n PRO 119 Cb 0.53 -1.80 -0.12 0.00 -0.04 0.00 0.00 33.50 32.06 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 2.53 1.03 -0.04 0.54 4.12 -1.26 -1.22 117.35 123.04 3dpm s TYR 120 Ca 0.26 -0.49 0.00 0.00 0.02 0.00 0.00 57.07 56.87 3dpm s TYR 120 Cb 0.11 -0.58 0.03 0.00 -1.52 0.00 0.00 41.96 40.00 3dpm s TYR 120 CO -0.00 0.01 -0.01 0.99 0.02 0.00 0.00 175.55 176.55 3dpm s THR 121 N -1.39 0.32 0.29 -0.71 2.01 -0.53 -4.93 115.64 110.70 3dpm s THR 121 Ca -0.04 0.02 0.11 0.00 0.31 0.00 0.00 61.69 62.09 3dpm s THR 121 Cb -0.09 -0.41 -0.05 0.00 0.01 0.00 0.00 72.50 71.96 3dpm s THR 121 CO 0.02 0.19 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.31 3dpm s VAL 122 N 1.13 2.64 -0.01 3.82 1.01 -1.26 -0.86 120.40 126.87 3dpm s VAL 122 Ca -0.08 -2.26 -0.00 0.00 0.00 0.00 0.00 61.98 59.64 3dpm s VAL 122 Cb -0.14 -2.48 0.01 0.00 0.00 0.00 0.00 36.38 33.78 3dpm s VAL 122 CO -0.02 -0.36 0.02 -1.58 0.00 0.00 0.00 175.10 173.17 3dpm s GLN 123 N -3.57 -0.01 -0.10 2.72 0.74 -0.24 -4.87 119.66 114.34 3dpm s GLN 123 Ca 0.31 0.09 -0.15 0.00 0.05 0.00 0.00 55.36 55.65 3dpm s GLN 123 Cb -0.04 -0.09 -0.05 0.00 1.10 0.00 0.00 33.01 33.93 3dpm s GLN 123 CO 0.16 -0.07 0.38 0.21 -0.55 0.00 0.00 175.29 175.42 3dpm s LYS 124 N 0.43 4.15 0.60 1.67 2.20 -1.26 -1.49 119.74 126.04 3dpm s LYS 124 Ca -0.04 0.29 -0.09 0.00 -0.36 0.00 0.00 55.97 55.78 3dpm s LYS 124 Cb -0.05 -3.36 -0.01 0.00 -1.51 0.00 0.00 37.83 32.90 3dpm s LYS 124 CO -0.01 0.37 0.96 -1.54 -0.36 0.00 0.00 175.35 174.77 3dpm s SER 125 N 0.00 5.89 0.59 1.43 1.04 0.17 -4.87 113.70 117.95 3dpm s SER 125 Ca 0.21 1.07 0.35 0.00 0.48 0.00 0.00 55.95 58.06 3dpm s SER 125 Cb -0.15 -2.11 1.83 0.00 0.10 0.00 0.00 66.02 65.70 3dpm s SER 125 CO 0.09 -0.97 2.19 0.77 0.98 0.00 0.00 173.24 176.30 3dpm h SER 126 N -0.25 0.00 -0.41 7.02 4.64 -1.02 -2.06 113.55 121.47 3dpm h SER 126 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3dpm h SER 126 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3dpm h SER 126 CO 0.62 0.04 0.00 -0.90 -0.87 0.00 0.00 176.83 175.72 3dpm n ASP 127 N -3.40 3.52 0.00 4.97 3.85 -1.26 -4.93 116.55 119.29 3dpm n ASP 127 Ca -0.02 -2.39 0.00 0.00 -0.71 0.00 0.00 54.79 51.67 3dpm n ASP 127 Cb 0.17 -0.51 0.00 0.00 -1.35 0.00 0.00 41.12 39.42 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 0.70 0.53 3.61 6.12 0.00 -0.77 -5.07 105.19 110.30 3dpm n GLY 128 Ca 0.17 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.46 2.69 -0.23 1.61 0.52 -1.26 -4.91 118.95 115.90 3dpm s ARG 129 Ca 0.00 -0.62 -0.07 0.00 -0.52 0.00 0.00 55.73 54.52 3dpm s ARG 129 Cb 0.00 -2.58 -0.03 0.00 0.52 0.00 0.00 34.95 32.86 3dpm s ARG 129 CO 0.00 0.64 0.06 -0.06 0.02 0.00 0.00 175.30 175.96 3dpm s PHE 130 N -0.93 3.11 0.02 -0.53 0.40 -1.26 -0.65 117.98 118.12 3dpm s PHE 130 Ca 0.15 -0.33 0.08 0.00 -0.60 0.00 0.00 56.93 56.23 3dpm s PHE 130 Cb -0.11 -2.20 -0.02 0.00 0.51 0.00 0.00 43.02 41.20 3dpm s PHE 130 CO 0.05 -0.26 -0.25 0.71 0.70 0.00 0.00 175.22 176.18 3dpm s TYR 131 N 1.34 2.18 0.07 0.36 1.51 -0.55 -0.76 117.35 121.50 3dpm s TYR 131 Ca 0.05 -0.41 -0.31 0.00 -1.01 0.00 0.00 57.07 55.40 3dpm s TYR 131 Cb -0.15 -1.35 -0.06 0.00 -0.11 0.00 0.00 41.96 40.29 3dpm s TYR 131 CO 0.03 0.04 1.28 -0.06 -1.11 0.00 0.00 175.55 175.73 3dpm s PHE 132 N -0.69 3.31 -0.27 2.71 0.40 -0.56 -1.08 117.98 121.80 3dpm s PHE 132 Ca 0.10 1.14 0.05 0.00 -0.60 0.00 0.00 56.93 57.62 3dpm s PHE 132 Cb -0.10 -3.52 -0.05 0.00 0.51 0.00 0.00 43.02 39.87 3dpm s PHE 132 CO 0.01 -1.73 0.24 1.33 0.70 0.00 0.00 175.22 175.77 3dpm n VAL 133 N 4.03 0.00 -3.64 -0.44 0.24 -0.04 -1.02 118.33 117.46 3dpm n VAL 133 Ca 0.10 -0.39 -0.08 0.00 -2.04 0.00 0.00 64.34 61.93 3dpm n VAL 133 Cb 0.45 1.01 -0.07 0.00 -1.47 0.00 0.00 33.84 33.76 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 -1.39 -0.86 -0.11 -1.34 2.15 -1.14 -4.95 116.67 109.04 3dpm s ASP 134 Ca 0.02 1.43 0.03 0.00 0.43 0.00 0.00 52.55 54.46 3dpm s ASP 134 Cb 0.04 1.37 0.01 0.00 -0.30 0.00 0.00 42.92 44.04 3dpm s ASP 134 CO 0.19 -0.23 -0.21 -0.63 -0.17 0.00 0.00 175.17 174.12 3dpm s ILE 135 N 1.37 1.88 -0.75 4.11 -1.09 -1.26 -1.46 121.20 124.00 3dpm s ILE 135 Ca -0.08 -0.90 0.01 0.00 -2.23 0.00 0.00 60.65 57.45 3dpm s ILE 135 Cb -0.05 -1.65 0.36 0.00 -1.58 0.00 0.00 42.46 39.54 3dpm s ILE 135 CO -0.16 0.52 1.63 0.23 -1.23 0.00 0.00 174.94 175.93 3dpm n MET 136 N 3.77 3.52 0.00 2.79 2.81 -0.36 -4.99 117.12 124.66 3dpm n MET 136 Ca -0.20 -4.16 0.00 0.00 -1.81 0.00 0.00 57.70 51.54 3dpm n MET 136 Cb 0.52 -2.30 0.00 0.00 -0.71 0.00 0.00 33.22 30.73 3dpm n MET 136 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 3dpm n THR 137 N -0.39 0.00 -3.91 2.03 5.66 -1.26 -4.90 114.28 111.51 3dpm n THR 137 Ca 0.46 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 61.21 3dpm n THR 137 Cb 0.36 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.11 3dpm n THR 137 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 3dpm s PHE 138 N -0.16 3.48 -0.12 1.09 -0.12 -1.26 -4.94 117.98 115.93 3dpm s PHE 138 Ca 0.00 0.12 -0.04 0.00 -0.05 0.00 0.00 56.93 56.96 3dpm s PHE 138 Cb 0.00 -1.67 -0.04 0.00 -0.63 0.00 0.00 43.02 40.68 3dpm s PHE 138 CO 0.00 0.47 1.05 -1.13 -0.05 0.00 0.00 175.22 175.56 3dpm n SER 139 N -0.78 -1.33 -4.88 1.98 3.41 -1.26 -4.84 113.62 105.91 3dpm n SER 139 Ca -0.07 -1.40 -0.26 0.00 -0.26 0.00 0.00 58.87 56.89 3dpm n SER 139 Cb 0.55 -0.61 0.07 0.00 -0.26 0.00 0.00 64.21 63.96 3dpm n SER 139 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3dpm s SER 140 N 1.77 4.72 0.00 4.04 0.15 -1.26 -4.90 113.70 118.23 3dpm s SER 140 Ca 0.12 0.39 0.12 0.00 0.70 0.00 0.00 55.95 57.28 3dpm s SER 140 Cb -0.00 -1.00 0.73 0.00 -1.71 0.00 0.00 66.02 64.03 3dpm s SER 140 CO 0.03 -1.65 1.15 1.21 1.20 0.00 0.00 173.24 175.18 3dpm n GLU 141 N -2.94 0.41 -4.00 5.44 2.13 -1.26 -4.45 120.64 115.97 3dpm n GLU 141 Ca 0.09 0.00 -0.35 0.00 0.66 0.00 0.00 57.16 57.56 3dpm n GLU 141 Cb 0.60 -1.46 -0.13 0.00 0.27 0.00 0.00 31.44 30.72 3dpm n GLU 141 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 3dpm s ILE 142 N -2.00 3.83 0.30 6.31 1.01 -1.26 -5.08 121.20 124.30 3dpm s ILE 142 Ca 0.18 -0.35 0.10 0.00 0.00 0.00 0.00 60.65 60.58 3dpm s ILE 142 Cb 0.08 -2.74 -0.06 0.00 0.01 0.00 0.00 42.46 39.76 3dpm s ILE 142 CO 0.14 0.42 -0.13 -0.13 0.00 0.00 0.00 174.94 175.24 3dpm s ARG 143 N 1.20 1.68 0.11 2.79 0.52 -1.26 -4.99 118.95 119.00 3dpm s ARG 143 Ca 0.03 -1.82 -0.31 0.00 -0.52 0.00 0.00 55.73 53.11 3dpm s ARG 143 Cb -0.15 -1.58 -0.08 0.00 0.52 0.00 0.00 34.95 33.66 3dpm s ARG 143 CO 0.01 0.20 1.48 0.08 0.02 0.00 0.00 175.30 177.08 3dpm s VAL 144 N -2.67 3.11 0.00 3.52 1.01 -1.26 -2.47 120.40 121.64 3dpm s VAL 144 Ca 0.30 0.75 0.00 0.00 0.00 0.00 0.00 61.98 63.03 3dpm s VAL 144 Cb -0.00 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.89 3dpm s VAL 144 CO 0.14 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.90 3dpm n GLY 145 N 3.65 2.35 3.79 4.51 0.00 -0.19 -5.01 105.19 114.28 3dpm n GLY 145 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 3dpm n GLY 145 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3dpm s ASP 146 N -1.69 5.65 -0.13 1.61 -0.00 -1.03 -4.70 116.67 116.39 3dpm s ASP 146 Ca 0.00 1.92 -0.04 0.00 -0.00 0.00 0.00 52.55 54.43 3dpm s ASP 146 Cb 0.00 -2.55 -0.03 0.00 -0.00 0.00 0.00 42.92 40.34 3dpm s ASP 146 CO 0.00 -1.26 0.01 -0.70 -0.00 0.00 0.00 175.17 173.22 3dpm s GLU 147 N -3.89 3.42 -0.19 8.23 2.12 -0.49 -1.49 118.70 126.41 3dpm s GLU 147 Ca 0.66 -0.42 -0.23 0.00 0.36 0.00 0.00 54.97 55.35 3dpm s GLU 147 Cb -0.18 -2.93 -0.02 0.00 0.26 0.00 0.00 34.13 31.25 3dpm s GLU 147 CO 0.35 0.47 0.72 -1.17 -0.54 0.00 0.00 175.26 175.10 3dpm s LEU 148 N -0.24 4.15 -0.19 2.70 2.96 0.06 0.92 118.68 129.03 3dpm s LEU 148 Ca 0.06 0.97 -0.03 0.00 -0.22 0.00 0.00 54.13 54.92 3dpm s LEU 148 Cb -0.12 -3.04 -0.11 0.00 0.50 0.00 0.00 46.19 43.41 3dpm s LEU 148 CO 0.02 -0.35 -0.20 0.18 -1.32 0.00 0.00 176.35 174.69 3dpm n LEU 149 N 5.23 2.44 -3.91 -0.68 4.77 0.14 -4.47 117.00 120.53 3dpm n LEU 149 Ca 0.01 0.02 -0.08 0.00 -0.03 0.00 0.00 56.01 55.93 3dpm n LEU 149 Cb 0.49 -0.63 -0.08 0.00 -2.33 0.00 0.00 43.42 40.87 3dpm n LEU 149 CO 0.46 0.68 -0.15 -1.61 -1.33 0.00 0.00 177.39 175.43 3dpm s GLU 150 N -2.37 0.80 -0.12 3.23 2.02 -1.06 -1.94 118.70 119.26 3dpm s GLU 150 Ca -0.26 -1.03 -0.00 0.00 0.02 0.00 0.00 54.97 53.70 3dpm s GLU 150 Cb 0.08 0.31 0.03 0.00 0.10 0.00 0.00 34.13 34.65 3dpm s GLU 150 CO 0.41 -0.24 -0.07 0.08 0.02 0.00 0.00 175.26 175.46 3dpm s VAL 151 N -3.88 1.01 -1.40 2.63 1.01 0.23 -1.51 120.40 118.50 3dpm s VAL 151 Ca 0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 61.98 61.73 3dpm s VAL 151 Cb 0.06 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.39 3dpm s VAL 151 CO -0.10 0.34 0.49 0.47 0.00 0.00 0.00 175.10 176.30 3dpm n ASP 152 N 4.95 -0.64 -1.00 3.32 8.00 0.19 -1.60 116.55 129.77 3dpm n ASP 152 Ca -0.12 -0.96 -0.13 0.00 0.71 0.00 0.00 54.79 54.28 3dpm n ASP 152 Cb 0.50 -3.27 -0.06 0.00 -0.02 0.00 0.00 41.12 38.28 3dpm n ASP 152 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dpm n GLY 153 N -1.88 1.36 3.18 0.44 0.00 -1.26 -5.00 105.19 102.03 3dpm n GLY 153 Ca -0.29 -0.28 -0.26 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.40 1.59 0.27 4.61 0.00 -0.63 -5.10 121.76 120.11 3dpm s ALA 154 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 51.96 50.86 3dpm s ALA 154 Cb 0.00 -0.44 -0.11 0.00 0.00 0.00 0.00 23.12 22.57 3dpm s ALA 154 CO 0.00 0.36 1.61 -1.25 0.00 0.00 0.00 175.76 176.48 3dpm s PRO 155 N -0.31 4.13 0.33 0.00 0.04 -1.26 -0.60 135.00 137.33 3dpm s PRO 155 Ca 0.04 2.57 0.11 0.00 0.04 0.00 0.00 61.00 63.76 3dpm s PRO 155 Cb -0.09 -3.04 1.02 0.00 0.04 0.00 0.00 34.50 32.44 3dpm s PRO 155 CO 0.00 -0.65 1.54 0.28 0.04 0.00 0.00 177.00 178.22 3dpm n VAL 156 N 2.52 -0.41 0.06 -0.36 0.31 -0.82 0.41 118.33 120.05 3dpm n VAL 156 Ca 0.09 2.07 0.03 0.00 -0.01 0.00 0.00 64.34 66.53 3dpm n VAL 156 Cb 0.37 -3.19 0.40 0.00 -0.91 0.00 0.00 33.84 30.51 3dpm n VAL 156 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 3dpm h GLN 157 N 0.00 0.40 0.01 5.55 7.50 -1.89 -1.01 115.11 125.67 3dpm h GLN 157 Ca 0.71 -0.06 -0.21 0.00 0.50 0.00 0.00 58.65 59.59 3dpm h GLN 157 Cb 1.69 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 29.14 3dpm h GLN 157 CO -0.84 0.39 -0.93 -0.44 -1.50 0.00 0.00 178.83 175.51 3dpm h ASP 158 N 0.39 0.31 0.27 1.46 3.32 -0.39 -2.32 116.42 119.46 3dpm h ASP 158 Ca 0.09 -0.26 -0.13 0.00 0.02 0.00 0.00 57.03 56.75 3dpm h ASP 158 Cb 0.19 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3dpm h ASP 158 CO -0.00 1.08 -0.52 0.58 -1.72 0.00 0.00 179.24 178.65 3dpm h VAL 159 N 0.12 1.35 -0.18 -1.35 2.07 -1.07 -2.97 116.25 114.22 3dpm h VAL 159 Ca -0.06 -1.79 -0.05 0.00 0.82 0.00 0.00 66.70 65.62 3dpm h VAL 159 Cb 1.57 1.85 -0.00 0.00 -1.52 0.00 0.00 31.29 33.19 3dpm h VAL 159 CO 0.14 0.53 -0.10 -0.07 0.02 0.00 0.00 177.57 178.10 3dpm h LEU 160 N 0.22 0.40 -1.39 2.57 3.38 -1.16 -2.95 115.31 116.38 3dpm h LEU 160 Ca 0.01 -0.42 0.20 0.00 0.09 0.00 0.00 57.88 57.76 3dpm h LEU 160 Cb 0.99 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.56 3dpm h LEU 160 CO 0.08 0.73 0.61 0.00 0.09 0.00 0.00 178.44 179.95 3dpm h ALA 161 N 0.68 2.08 0.00 1.53 0.00 -1.29 0.95 119.26 123.20 3dpm h ALA 161 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3dpm h ALA 161 Cb 0.59 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3dpm h ALA 161 CO 0.03 -0.39 0.00 0.25 0.00 0.00 0.00 179.25 179.14 3dpm n THR 162 N -4.57 1.03 1.09 0.00 -2.24 -1.11 -1.76 114.28 106.72 3dpm n THR 162 Ca 0.20 0.30 0.12 0.00 -2.27 0.00 0.00 64.05 62.41 3dpm n THR 162 Cb 0.67 -1.16 0.15 0.00 -2.10 0.00 0.00 70.33 67.90 3dpm n THR 162 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3dpm n LEU 163 N -1.83 2.47 -4.80 3.22 4.77 0.33 -4.98 117.00 116.17 3dpm n LEU 163 Ca 0.02 -0.84 -0.30 0.00 -0.03 0.00 0.00 56.01 54.86 3dpm n LEU 163 Cb 0.17 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.33 3dpm n LEU 163 CO 0.14 0.42 0.71 -0.31 -1.33 0.00 0.00 177.39 177.02 3dpm s TYR 164 N -2.13 2.83 0.55 -1.77 2.02 -0.72 -4.90 117.35 113.24 3dpm s TYR 164 Ca 0.27 1.26 -0.05 0.00 -0.37 0.00 0.00 57.07 58.18 3dpm s TYR 164 Cb 0.20 -3.06 -0.01 0.00 -0.40 0.00 0.00 41.96 38.70 3dpm s TYR 164 CO 0.38 -1.69 0.86 0.20 -1.57 0.00 0.00 175.55 173.72 3dpm s GLY 165 N -3.79 1.58 0.48 0.71 0.00 -1.26 -4.98 107.32 100.06 3dpm s GLY 165 Ca 0.60 -0.66 0.25 0.00 0.00 0.00 0.00 44.72 44.91 3dpm s GLY 165 CO 0.55 -0.42 1.87 1.76 0.00 0.00 0.00 173.10 176.86 3dpm h SER 166 N -0.03 0.20 -0.96 1.64 0.02 -1.85 -2.44 113.55 110.13 3dpm h SER 166 Ca -0.46 0.02 -0.58 0.00 -0.84 0.00 0.00 61.79 59.94 3dpm h SER 166 Cb 1.24 -0.01 -0.41 0.00 0.14 0.00 0.00 62.40 63.36 3dpm h SER 166 CO 0.61 0.07 -0.60 0.59 -1.14 0.00 0.00 176.83 176.36 3dpm n ASN 167 N -4.40 5.21 -4.69 3.07 5.03 -1.26 -5.05 115.26 113.17 3dpm n ASN 167 Ca 0.19 -3.75 -0.44 0.00 0.87 0.00 0.00 54.58 51.46 3dpm n ASN 167 Cb 0.85 -0.44 -0.03 0.00 -1.02 0.00 0.00 39.78 39.14 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 -0.68 2.57 0.94 3.10 -0.00 -0.92 -4.88 115.22 115.34 3dpm n HIS 168 Ca 0.45 0.04 0.10 0.00 0.46 0.00 0.00 57.72 58.76 3dpm n HIS 168 Cb 0.86 -2.66 -0.11 0.00 -0.12 0.00 0.00 29.99 27.96 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 4.49 0.35 -0.63 1.57 4.76 -1.26 -5.00 118.16 122.44 3dpm n LYS 169 Ca 0.17 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.61 3dpm n LYS 169 Cb 0.34 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.08 3dpm n LYS 169 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dpm n GLY 170 N 1.47 0.61 3.81 0.72 0.00 -1.26 -5.06 105.19 105.48 3dpm n GLY 170 Ca 0.04 -0.64 -0.32 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.00 3.88 0.23 2.61 -4.23 -1.26 -4.92 115.64 109.95 3dpm s THR 171 Ca 0.00 0.78 -0.07 0.00 -1.18 0.00 0.00 61.69 61.22 3dpm s THR 171 Cb 0.00 -3.38 0.21 0.00 1.34 0.00 0.00 72.50 70.67 3dpm s THR 171 CO 0.00 -0.63 1.89 0.00 -0.54 0.00 0.00 174.62 175.33 3dpm h ALA 172 N -0.00 1.13 -0.20 3.99 0.00 -1.97 -2.20 119.26 120.01 3dpm h ALA 172 Ca -0.46 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.45 3dpm h ALA 172 Cb 1.22 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 3dpm h ALA 172 CO 0.57 0.43 -0.06 0.00 0.00 0.00 0.00 179.25 180.19 3dpm h ALA 173 N 1.35 0.13 -0.44 0.00 0.00 -1.89 0.11 119.26 118.52 3dpm h ALA 173 Ca 0.34 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.26 3dpm h ALA 173 Cb -0.03 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3dpm h ALA 173 CO -0.11 -0.48 0.01 0.93 0.00 0.00 0.00 179.25 179.60 3dpm h GLU 174 N -0.01 0.70 -0.31 0.00 5.08 -1.86 -1.71 114.58 116.47 3dpm h GLU 174 Ca 0.10 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3dpm h GLU 174 Cb 0.16 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3dpm h GLU 174 CO -0.22 0.71 0.14 1.49 -1.00 0.00 0.00 179.01 180.14 3dpm h GLU 175 N 0.67 0.46 -0.55 2.33 4.57 -0.74 -2.13 114.58 119.18 3dpm h GLU 175 Ca 0.14 -0.07 -0.10 0.00 -1.18 0.00 0.00 59.36 58.14 3dpm h GLU 175 Cb 0.40 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.89 3dpm h GLU 175 CO 0.01 0.44 -0.05 0.77 -1.18 0.00 0.00 179.01 179.00 3dpm h SER 176 N 0.37 0.98 -0.43 1.04 0.02 -0.53 -1.59 113.55 113.41 3dpm h SER 176 Ca 0.11 -0.29 -0.04 0.00 -0.84 0.00 0.00 61.79 60.72 3dpm h SER 176 Cb 0.14 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 3dpm h SER 176 CO -0.01 1.06 0.12 0.00 -1.14 0.00 0.00 176.83 176.86 3dpm h ALA 177 N 1.03 1.29 -0.45 3.77 0.00 -1.22 -0.41 119.26 123.26 3dpm h ALA 177 Ca 0.15 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 3dpm h ALA 177 Cb 0.60 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3dpm h ALA 177 CO 0.04 0.50 -0.15 0.00 0.00 0.00 0.00 179.25 179.64 3dpm h ALA 178 N 1.41 0.62 -0.61 0.00 0.00 -1.11 -2.98 119.26 116.59 3dpm h ALA 178 Ca 0.16 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.73 3dpm h ALA 178 Cb 0.27 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3dpm h ALA 178 CO -0.00 0.55 0.39 1.25 0.00 0.00 0.00 179.25 181.44 3dpm h LEU 179 N 0.73 0.66 -2.62 0.00 6.46 -0.50 -1.89 115.31 118.15 3dpm h LEU 179 Ca 0.11 -0.01 0.01 0.00 -0.12 0.00 0.00 57.88 57.87 3dpm h LEU 179 Cb 0.71 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.48 3dpm h LEU 179 CO 0.05 0.47 0.05 0.03 -0.62 0.00 0.00 178.44 178.43 3dpm h ARG 180 N 0.79 0.00 -0.02 1.25 2.47 -0.95 -0.71 114.38 117.21 3dpm h ARG 180 Ca 0.23 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 3dpm h ARG 180 Cb -0.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.27 3dpm h ARG 180 CO -0.07 0.00 -0.25 0.25 0.56 0.00 0.00 179.97 180.46 3dpm n THR 181 N -3.47 0.00 -0.34 2.04 -2.24 -0.73 -4.20 114.28 105.34 3dpm n THR 181 Ca -0.02 -0.29 -0.01 0.00 -2.27 0.00 0.00 64.05 61.46 3dpm n THR 181 Cb 0.13 1.03 0.14 0.00 -2.10 0.00 0.00 70.33 69.53 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 2.70 1.09 -3.10 3.22 7.12 -0.89 -3.10 115.31 122.36 3dpm h LEU 182 Ca 0.00 -0.03 -0.00 0.00 0.13 0.00 0.00 57.88 57.98 3dpm h LEU 182 Cb 0.73 -0.27 -0.00 0.00 -0.53 0.00 0.00 40.66 40.58 3dpm h LEU 182 CO 0.00 0.79 -0.01 0.49 -0.13 0.00 0.00 178.44 179.58 3dpm n PHE 183 N -4.39 0.35 -3.30 1.25 0.99 -1.26 -4.88 117.46 106.22 3dpm n PHE 183 Ca 0.11 -0.97 -0.10 0.00 -0.00 0.00 0.00 57.45 56.49 3dpm n PHE 183 Cb 0.02 -0.22 -0.05 0.00 -1.00 0.00 0.00 39.48 38.23 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 -2.54 0.19 -0.10 4.37 0.15 -1.17 -0.68 113.70 113.91 3dpm s SER 184 Ca 0.36 -1.12 -0.04 0.00 0.70 0.00 0.00 55.95 55.85 3dpm s SER 184 Cb 0.31 1.09 -0.04 0.00 -1.71 0.00 0.00 66.02 65.67 3dpm s SER 184 CO 0.05 -0.25 0.07 -0.13 1.20 0.00 0.00 173.24 174.18 3dpm s ARG 185 N 1.76 3.22 -0.02 5.44 1.81 0.32 -4.63 118.95 126.85 3dpm s ARG 185 Ca 0.15 -0.27 -0.00 0.00 -1.72 0.00 0.00 55.73 53.89 3dpm s ARG 185 Cb -0.11 -2.99 0.03 0.00 -0.45 0.00 0.00 34.95 31.43 3dpm s ARG 185 CO -0.09 0.73 0.03 -1.64 -0.68 0.00 0.00 175.30 173.65 3dpm s MET 186 N -0.94 -0.03 0.52 3.54 -1.94 -1.26 -1.43 119.30 117.77 3dpm s MET 186 Ca 0.14 0.22 0.28 0.00 -1.71 0.00 0.00 55.69 54.62 3dpm s MET 186 Cb -0.12 -0.31 1.42 0.00 2.01 0.00 0.00 34.83 37.83 3dpm s MET 186 CO 0.03 -0.20 2.04 0.00 -0.01 0.00 0.00 175.02 176.89 3dpm h ALA 187 N 7.50 1.21 0.00 3.03 0.00 -1.35 -1.66 119.26 127.99 3dpm h ALA 187 Ca -0.40 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3dpm h ALA 187 Cb 1.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.89 3dpm h ALA 187 CO 0.42 0.15 0.00 -1.13 0.00 0.00 0.00 179.25 178.69 3dpm n SER 188 N -3.53 0.18 -0.18 0.00 3.41 -1.22 -2.08 113.62 110.20 3dpm n SER 188 Ca -0.01 0.55 0.05 0.00 -0.26 0.00 0.00 58.87 59.19 3dpm n SER 188 Cb 0.26 -0.58 -0.01 0.00 -0.26 0.00 0.00 64.21 63.62 3dpm n SER 188 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dpm n LEU 189 N -1.70 1.07 0.00 1.04 4.77 -0.67 -0.50 117.00 121.01 3dpm n LEU 189 Ca 0.03 -0.72 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 3dpm n LEU 189 Cb 0.19 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 3dpm n LEU 189 CO 0.15 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 3dpm n GLY 190 N 0.94 0.88 3.88 -0.72 0.00 -0.88 -4.86 105.19 104.44 3dpm n GLY 190 Ca 0.04 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 3.47 0.06 1.61 3.76 -0.95 -4.37 115.29 116.88 3dpm s HIS 191 Ca 0.00 1.14 -0.21 0.00 -0.15 0.00 0.00 55.06 55.84 3dpm s HIS 191 Cb 0.00 -2.87 -0.06 0.00 1.11 0.00 0.00 32.58 30.76 3dpm s HIS 191 CO 0.00 -0.91 0.61 0.15 -0.85 0.00 0.00 174.74 173.75 3dpm s LYS 192 N -5.24 4.29 -0.21 1.40 1.02 -1.26 -4.40 119.74 115.35 3dpm s LYS 192 Ca 0.56 0.81 -0.04 0.00 0.02 0.00 0.00 55.97 57.32 3dpm s LYS 192 Cb -0.11 -3.28 -0.02 0.00 -0.52 0.00 0.00 37.83 33.91 3dpm s LYS 192 CO 0.52 0.54 -0.02 0.08 -0.92 0.00 0.00 175.35 175.55 3dpm s VAL 193 N -0.82 3.64 0.50 3.17 1.01 -1.26 -4.77 120.40 121.87 3dpm s VAL 193 Ca 0.31 -0.41 -0.04 0.00 0.00 0.00 0.00 61.98 61.83 3dpm s VAL 193 Cb -0.20 -2.65 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 3dpm s VAL 193 CO 0.20 0.42 0.79 -2.16 0.00 0.00 0.00 175.10 174.34 3dpm s PRO 194 N 1.27 3.35 0.13 2.72 0.04 -1.26 -5.03 135.00 136.22 3dpm s PRO 194 Ca 0.03 0.05 -0.01 0.00 0.04 0.00 0.00 61.00 61.12 3dpm s PRO 194 Cb -0.14 -2.39 -0.04 0.00 0.04 0.00 0.00 34.50 31.97 3dpm s PRO 194 CO -0.00 -0.30 0.05 -1.54 0.04 0.00 0.00 177.00 175.24 3dpm s SER 195 N -4.16 0.41 0.00 6.66 1.04 -1.26 -4.69 113.70 111.70 3dpm s SER 195 Ca 0.48 -1.19 0.00 0.00 0.48 0.00 0.00 55.95 55.72 3dpm s SER 195 Cb -0.10 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.29 3dpm s SER 195 CO 0.44 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.56 3dpm n GLY 196 N -0.10 -0.09 3.63 7.32 0.00 -1.26 -4.93 105.19 109.76 3dpm n GLY 196 Ca -0.06 -1.16 -0.23 0.00 0.00 0.00 0.00 46.02 44.57 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 2.22 0.05 1.61 0.52 -1.26 -1.60 118.95 120.49 3dpm s ARG 197 Ca 0.00 -1.46 -0.01 0.00 -0.52 0.00 0.00 55.73 53.74 3dpm s ARG 197 Cb 0.00 -2.11 -0.04 0.00 0.52 0.00 0.00 34.95 33.32 3dpm s ARG 197 CO 0.00 0.36 -0.02 -0.08 0.02 0.00 0.00 175.30 175.58 3dpm s THR 198 N -2.35 0.20 -0.19 0.02 -1.32 -0.34 -4.99 115.64 106.68 3dpm s THR 198 Ca 0.31 -1.68 -0.07 0.00 -1.21 0.00 0.00 61.69 59.04 3dpm s THR 198 Cb -0.06 -1.37 -0.04 0.00 -1.51 0.00 0.00 72.50 69.52 3dpm s THR 198 CO 0.19 -0.93 0.07 -0.89 -2.21 0.00 0.00 174.62 170.85 3dpm s THR 199 N -3.63 4.77 -0.17 5.08 2.01 -1.26 -1.29 115.64 121.15 3dpm s THR 199 Ca 0.04 -0.04 -0.00 0.00 0.31 0.00 0.00 61.69 62.00 3dpm s THR 199 Cb 0.06 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 69.41 3dpm s THR 199 CO -0.09 0.45 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.38 3dpm s LEU 200 N 0.48 2.48 -0.37 4.42 1.43 0.38 -0.63 118.68 126.87 3dpm s LEU 200 Ca 0.03 -0.49 -0.17 0.00 -1.03 0.00 0.00 54.13 52.47 3dpm s LEU 200 Cb -0.13 -1.58 0.00 0.00 0.03 0.00 0.00 46.19 44.52 3dpm s LEU 200 CO 0.01 0.06 0.46 -0.75 0.23 0.00 0.00 176.35 176.36 3dpm s LYS 201 N 0.99 3.45 0.22 1.70 2.20 -0.57 0.21 119.74 127.94 3dpm s LYS 201 Ca -0.02 -0.39 0.09 0.00 -0.36 0.00 0.00 55.97 55.29 3dpm s LYS 201 Cb -0.15 -3.86 -0.04 0.00 -1.51 0.00 0.00 37.83 32.27 3dpm s LYS 201 CO -0.03 -0.69 -0.04 0.96 -0.36 0.00 0.00 175.35 175.19 3dpm s ILE 202 N 2.27 3.38 -0.20 5.43 -5.25 -0.50 0.28 121.20 126.62 3dpm s ILE 202 Ca 0.16 -1.74 0.01 0.00 -0.99 0.00 0.00 60.65 58.08 3dpm s ILE 202 Cb -0.16 -2.74 0.02 0.00 2.95 0.00 0.00 42.46 42.53 3dpm s ILE 202 CO 0.13 -0.23 -0.17 -0.60 -1.79 0.00 0.00 174.94 172.28 3dpm s ARG 203 N -3.22 2.93 0.75 0.37 3.00 0.26 -1.63 118.95 121.41 3dpm s ARG 203 Ca 0.28 -0.88 -0.12 0.00 -1.00 0.00 0.00 55.73 54.01 3dpm s ARG 203 Cb -0.08 -2.66 0.05 0.00 0.00 0.00 0.00 34.95 32.26 3dpm s ARG 203 CO 0.18 -0.26 1.11 1.03 0.00 0.00 0.00 175.30 177.36 3dpm s ARG 204 N 1.28 2.29 0.56 5.12 1.81 0.44 -1.39 118.95 129.07 3dpm s ARG 204 Ca 0.03 1.29 0.29 0.00 -1.72 0.00 0.00 55.73 55.62 3dpm s ARG 204 Cb -0.14 -1.89 1.67 0.00 -0.45 0.00 0.00 34.95 34.13 3dpm s ARG 204 CO -0.11 -1.63 2.18 -1.00 -0.68 0.00 0.00 175.30 174.06 3dpm h PRO 205 N -0.84 0.00 -0.84 3.54 0.13 -1.88 -2.46 132.00 129.66 3dpm h PRO 205 Ca -0.45 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.47 3dpm h PRO 205 Cb 1.24 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.25 3dpm h PRO 205 CO 0.51 0.05 0.27 1.97 -0.23 0.00 0.00 178.00 180.57 3dpm n PHE 206 N -3.78 2.07 -0.42 1.56 1.16 -1.26 -4.91 117.46 111.88 3dpm n PHE 206 Ca -0.03 -1.09 0.00 0.00 -1.87 0.00 0.00 57.45 54.47 3dpm n PHE 206 Cb 0.14 -0.62 0.00 0.00 -1.61 0.00 0.00 39.48 37.39 3dpm n PHE 206 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3dpm n GLY 207 N -0.17 1.42 3.68 4.97 0.00 -0.93 -5.03 105.19 109.13 3dpm n GLY 207 Ca 0.35 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.14 4.80 -0.11 2.61 2.01 -1.26 -4.83 115.64 115.71 3dpm s THR 208 Ca 0.00 1.94 -0.10 0.00 0.31 0.00 0.00 61.69 63.84 3dpm s THR 208 Cb 0.00 -4.27 -0.05 0.00 0.01 0.00 0.00 72.50 68.20 3dpm s THR 208 CO 0.00 -0.01 0.20 0.28 -0.69 0.00 0.00 174.62 174.40 3dpm s THR 209 N 2.17 5.39 -0.01 -0.82 -1.32 -1.26 -0.42 115.64 119.36 3dpm s THR 209 Ca 0.45 0.36 -0.00 0.00 -1.21 0.00 0.00 61.69 61.28 3dpm s THR 209 Cb -0.17 -3.49 0.01 0.00 -1.51 0.00 0.00 72.50 67.34 3dpm s THR 209 CO 0.15 0.56 0.02 -0.13 -2.21 0.00 0.00 174.62 173.02 3dpm s ARG 210 N -0.69 0.00 -0.25 7.08 1.81 -0.64 -5.00 118.95 121.26 3dpm s ARG 210 Ca 0.16 0.08 -0.17 0.00 -1.72 0.00 0.00 55.73 54.08 3dpm s ARG 210 Cb -0.13 -0.07 -0.03 0.00 -0.45 0.00 0.00 34.95 34.27 3dpm s ARG 210 CO 0.05 -0.06 0.47 -1.21 -0.68 0.00 0.00 175.30 173.88 3dpm s GLU 211 N 0.36 4.08 -0.08 3.54 2.02 -1.26 -1.41 118.70 125.94 3dpm s GLU 211 Ca -0.03 0.26 0.00 0.00 0.02 0.00 0.00 54.97 55.22 3dpm s GLU 211 Cb -0.04 -3.63 -0.03 0.00 0.10 0.00 0.00 34.13 30.53 3dpm s GLU 211 CO -0.01 -0.29 -0.06 0.08 0.02 0.00 0.00 175.26 175.00 3dpm s VAL 212 N 2.10 3.73 -0.39 2.63 1.01 0.13 -4.95 120.40 124.67 3dpm s VAL 212 Ca 0.20 -0.46 -0.16 0.00 0.00 0.00 0.00 61.98 61.56 3dpm s VAL 212 Cb -0.16 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.69 3dpm s VAL 212 CO 0.09 0.58 0.35 -0.60 0.00 0.00 0.00 175.10 175.53 3dpm s ARG 213 N -0.63 3.22 0.23 2.72 6.06 -1.26 -0.47 118.95 128.81 3dpm s ARG 213 Ca 0.10 -0.74 0.11 0.00 -2.50 0.00 0.00 55.73 52.69 3dpm s ARG 213 Cb -0.12 -3.91 -0.05 0.00 0.06 0.00 0.00 34.95 30.94 3dpm s ARG 213 CO 0.02 -0.69 -0.14 0.14 -2.50 0.00 0.00 175.30 172.13 3dpm s VAL 214 N 1.92 2.85 -0.17 7.11 -7.23 -0.41 -4.97 120.40 119.50 3dpm s VAL 214 Ca 0.09 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.24 3dpm s VAL 214 Cb -0.18 -2.45 0.00 0.00 0.56 0.00 0.00 36.38 34.32 3dpm s VAL 214 CO 0.12 -0.25 -0.16 -0.75 -0.31 0.00 0.00 175.10 173.74 3dpm s LYS 215 N -3.18 3.15 0.47 4.82 2.20 -1.26 -1.19 119.74 124.75 3dpm s LYS 215 Ca 0.27 -0.77 -0.24 0.00 -0.36 0.00 0.00 55.97 54.86 3dpm s LYS 215 Cb -0.07 -2.63 -0.07 0.00 -1.51 0.00 0.00 37.83 33.55 3dpm s LYS 215 CO 0.15 -0.07 1.41 -1.58 -0.36 0.00 0.00 175.35 174.90 3dpm s TRP 216 N 1.02 2.41 -0.64 4.03 0.52 -0.63 -4.92 118.94 120.73 3dpm s TRP 216 Ca -0.02 1.29 -0.23 0.00 0.02 0.00 0.00 56.10 57.17 3dpm s TRP 216 Cb -0.15 -3.89 0.06 0.00 -1.15 0.00 0.00 33.47 28.35 3dpm s TRP 216 CO -0.04 -2.93 0.95 1.03 0.02 0.00 0.00 176.95 175.98 3dpm s ARG 217 N -2.56 3.15 -0.14 4.98 3.00 -0.27 -4.74 118.95 122.37 3dpm s ARG 217 Ca 0.64 -0.73 -0.05 0.00 0.00 0.00 0.00 55.73 55.59 3dpm s ARG 217 Cb -0.43 -4.19 -0.03 0.00 0.00 0.00 0.00 34.95 30.29 3dpm s ARG 217 CO 0.54 -1.75 0.02 -0.47 0.00 0.00 0.00 175.30 173.65 3dpm s TYR 218 N 4.02 3.19 -0.26 -0.53 5.04 -1.26 -2.03 117.35 125.53 3dpm s TYR 218 Ca 0.23 0.04 -0.00 0.00 -2.44 0.00 0.00 57.07 54.90 3dpm s TYR 218 Cb -0.16 -1.95 0.04 0.00 0.35 0.00 0.00 41.96 40.24 3dpm s TYR 218 CO 0.12 0.24 -0.07 0.08 -1.34 0.00 0.00 175.55 174.57 3dpm s VAL 219 N -0.09 2.67 0.79 3.14 1.01 -0.03 -5.00 120.40 122.89 3dpm s VAL 219 Ca 0.05 -1.23 -0.13 0.00 0.00 0.00 0.00 61.98 60.67 3dpm s VAL 219 Cb -0.12 -2.42 0.08 0.00 0.00 0.00 0.00 36.38 33.91 3dpm s VAL 219 CO 0.02 0.11 1.17 -2.16 0.00 0.00 0.00 175.10 174.24 3dpm s PRO 220 N 1.26 1.79 0.27 2.72 0.04 -1.26 -1.89 135.00 137.92 3dpm s PRO 220 Ca -0.03 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.33 3dpm s PRO 220 Cb -0.18 -1.81 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 3dpm s PRO 220 CO -0.05 -2.07 1.42 -2.00 0.04 0.00 0.00 177.00 174.35 3dpm s GLU 221 N -4.28 4.27 -0.19 4.56 2.56 -1.26 -4.23 118.70 120.13 3dpm s GLU 221 Ca 0.70 2.30 0.17 0.00 0.00 0.00 0.00 54.97 58.15 3dpm s GLU 221 Cb -0.25 -3.10 -0.24 0.00 2.00 0.00 0.00 34.13 32.54 3dpm s GLU 221 CO 0.51 -0.39 0.07 0.41 -0.56 0.00 0.00 175.26 175.30 3dpm n GLY 222 N 1.87 -0.97 3.57 -1.50 0.00 -1.26 -4.86 105.19 102.04 3dpm n GLY 222 Ca 0.05 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.49 4.55 0.28 1.61 1.01 -1.26 -5.00 120.40 119.09 3dpm s VAL 223 Ca -0.10 0.77 -0.30 0.00 0.00 0.00 0.00 61.98 62.36 3dpm s VAL 223 Cb 0.06 -4.37 -0.13 0.00 0.00 0.00 0.00 36.38 31.94 3dpm s VAL 223 CO 0.80 -0.73 1.40 0.61 0.00 0.00 0.00 175.10 177.18 3dpm n GLY 224 N 4.81 0.79 3.70 4.51 0.00 -1.26 -4.89 105.19 112.85 3dpm n GLY 224 Ca 0.05 0.43 -0.42 0.00 0.00 0.00 0.00 46.02 46.08 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 0.12 6.68 0.54 1.61 -1.08 -1.26 -4.89 116.67 118.39 3dpm s ASP 225 Ca 0.63 2.42 0.24 0.00 -0.52 0.00 0.00 52.55 55.32 3dpm s ASP 225 Cb -0.60 -2.57 1.41 0.00 -1.46 0.00 0.00 42.92 39.69 3dpm s ASP 225 CO 0.54 -0.81 2.03 0.25 0.52 0.00 0.00 175.17 177.70 3dpm h LEU 226 N 7.87 0.00 -0.66 -1.34 5.85 -1.94 -2.46 115.31 122.64 3dpm h LEU 226 Ca -0.42 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.23 3dpm h LEU 226 Cb 1.20 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 3dpm h LEU 226 CO 0.91 0.00 0.14 0.00 -0.34 0.00 0.00 178.44 179.15 3dpm h ALA 227 N 1.78 0.87 0.00 1.25 0.00 -1.90 0.93 119.26 122.18 3dpm h ALA 227 Ca 0.19 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3dpm h ALA 227 Cb 0.78 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3dpm h ALA 227 CO -0.00 0.60 -0.23 1.15 0.00 0.00 0.00 179.25 180.77 3dpm h THR 228 N 0.99 1.15 0.00 0.00 2.02 -1.83 -3.06 112.91 112.18 3dpm h THR 228 Ca 0.20 -0.80 -0.18 0.00 0.77 0.00 0.00 66.41 66.41 3dpm h THR 228 Cb 0.39 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 3dpm h THR 228 CO 0.01 0.23 -1.65 -0.38 0.37 0.00 0.00 175.52 174.09 3dpm n ILE 229 N -4.25 1.07 -0.19 3.11 5.41 -1.06 -4.66 119.36 118.80 3dpm n ILE 229 Ca -0.02 -0.70 -0.05 0.00 1.00 0.00 0.00 62.75 62.98 3dpm n ILE 229 Cb 0.29 -0.60 -0.05 0.00 -0.71 0.00 0.00 39.64 38.57 3dpm n ILE 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3dpm n ALA 230 N -2.44 -0.30 0.32 -1.39 0.00 0.30 -1.16 120.51 115.84 3dpm n ALA 230 Ca -0.13 0.39 0.14 0.00 0.00 0.00 0.00 53.44 53.85 3dpm n ALA 230 Cb 0.86 0.15 0.76 0.00 0.00 0.00 0.00 19.45 21.22 3dpm n ALA 230 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3dpm h PRO 231 N 0.00 0.00 -0.59 0.00 0.13 -1.83 -1.19 132.00 128.53 3dpm h PRO 231 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3dpm h PRO 231 Cb 0.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.32 3dpm h PRO 231 CO -0.43 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.21 3dpm n SER 232 N -2.80 3.77 -4.70 1.44 3.41 -0.31 -4.95 113.62 109.48 3dpm n SER 232 Ca -0.02 -2.00 -0.42 0.00 -0.26 0.00 0.00 58.87 56.17 3dpm n SER 232 Cb 0.39 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 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 -1.22 4.14 -0.08 -1.33 1.01 -0.45 -5.03 121.20 118.23 3dpm s ILE 233 Ca 0.45 1.50 -0.01 0.00 0.00 0.00 0.00 60.65 62.60 3dpm s ILE 233 Cb 0.25 -3.96 -0.03 0.00 0.01 0.00 0.00 42.46 38.72 3dpm s ILE 233 CO 0.33 0.05 -0.03 0.00 0.00 0.00 0.00 174.94 175.29 3dpm s ARG 234 N 1.72 2.88 0.50 2.79 3.03 -1.26 -5.09 118.95 123.52 3dpm s ARG 234 Ca 0.58 -0.48 -0.22 0.00 2.03 0.00 0.00 55.73 57.64 3dpm s ARG 234 Cb -0.27 -2.69 -0.07 0.00 -1.03 0.00 0.00 34.95 30.88 3dpm s ARG 234 CO 0.25 0.68 1.11 0.00 -1.13 0.00 0.00 175.30 176.21 3dpm n ALA 235 N 2.20 0.65 -1.82 7.88 0.00 -1.26 -4.87 120.51 123.30 3dpm n ALA 235 Ca -0.18 0.14 -0.42 0.00 0.00 0.00 0.00 53.44 52.98 3dpm n ALA 235 Cb 0.53 -2.18 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 3dpm n ALA 235 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3dpm s PRO 236 N -2.45 4.17 0.06 0.00 0.04 -1.26 -5.01 135.00 130.54 3dpm s PRO 236 Ca 0.68 2.49 0.09 0.00 0.04 0.00 0.00 61.00 64.31 3dpm s PRO 236 Cb -0.47 -3.10 -0.03 0.00 0.04 0.00 0.00 34.50 30.94 3dpm s PRO 236 CO 0.52 -0.66 -0.25 -0.65 0.04 0.00 0.00 177.00 176.00 3dpm s GLN 237 N 0.87 1.78 0.74 4.56 -0.21 -1.26 -5.15 119.66 120.99 3dpm s GLN 237 Ca 0.71 -1.13 -0.07 0.00 0.02 0.00 0.00 55.36 54.89 3dpm s GLN 237 Cb -0.47 -2.00 0.09 0.00 1.00 0.00 0.00 33.01 31.64 3dpm s GLN 237 CO 0.34 0.51 1.05 -0.51 -2.12 0.00 0.00 175.29 174.56 3dpm s LEU 238 N -1.37 2.84 -1.17 2.90 1.43 -1.26 -5.29 118.68 116.76 3dpm s LEU 238 Ca 0.12 0.28 -0.02 0.00 -1.03 0.00 0.00 54.13 53.48 3dpm s LEU 238 Cb -0.10 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.33 3dpm s LEU 238 CO 0.03 -1.80 0.99 0.00 0.23 0.00 0.00 176.35 175.80 3dpm n GLN 239 N -3.02 -6.58 0.00 1.70 1.13 -1.26 -5.33 117.38 104.03 3dpm n GLN 239 Ca 0.10 0.79 0.00 0.00 -1.94 0.00 0.00 57.00 55.96 3dpm n GLN 239 Cb 0.60 -5.67 0.00 0.00 0.11 0.00 0.00 30.24 25.28 3dpm n GLN 239 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dpm n GLY 284 N -1.34 1.82 0.48 1.08 0.00 0.21 -5.34 105.19 102.12 3dpm n GLY 284 Ca -0.20 -1.98 0.12 0.00 0.00 0.00 0.00 46.02 43.96 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 1.59 0.00 -2.09 1.61 4.02 -1.26 -3.61 117.16 117.43 3dpm n TYR 285 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.52 3dpm n TYR 285 Cb 0.00 -0.04 0.02 0.00 -0.02 0.00 0.00 39.34 39.30 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 -2.35 5.61 0.06 7.72 0.02 -1.26 -4.94 114.94 119.80 3dpm s ASN 286 Ca 0.24 2.40 -0.31 0.00 -1.02 0.00 0.00 52.86 54.18 3dpm s ASN 286 Cb 0.19 -2.60 -0.07 0.00 0.02 0.00 0.00 41.25 38.79 3dpm s ASN 286 CO 0.48 -1.31 1.44 -0.63 0.02 0.00 0.00 177.10 177.10 3dpm s ILE 287 N -1.55 3.42 0.00 0.60 1.01 -1.26 -1.91 121.20 121.51 3dpm s ILE 287 Ca 0.71 0.92 0.00 0.00 0.00 0.00 0.00 60.65 62.28 3dpm s ILE 287 Cb -0.31 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.57 3dpm s ILE 287 CO 0.35 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.93 3dpm n GLY 288 N 3.65 0.58 3.74 6.18 0.00 0.92 -4.85 105.19 115.41 3dpm n GLY 288 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.89 6.40 0.11 1.61 0.15 -0.80 -4.65 113.70 113.62 3dpm s SER 289 Ca 0.00 2.89 -0.19 0.00 0.70 0.00 0.00 55.95 59.36 3dpm s SER 289 Cb 0.00 -2.62 -0.06 0.00 -1.71 0.00 0.00 66.02 61.63 3dpm s SER 289 CO 0.00 -0.92 1.66 0.74 1.20 0.00 0.00 173.24 175.92 3dpm h THR 290 N 3.58 1.16 0.00 6.45 2.02 -1.91 -3.28 112.91 120.93 3dpm h THR 290 Ca -0.45 -0.49 -0.18 0.00 0.77 0.00 0.00 66.41 66.06 3dpm h THR 290 Cb 1.21 1.01 -0.03 0.00 -1.74 0.00 0.00 68.15 68.60 3dpm h THR 290 CO 0.86 0.17 -1.09 0.44 0.37 0.00 0.00 175.52 176.26 3dpm h ASP 291 N 0.27 0.00 -1.73 4.18 3.45 -1.92 -3.40 116.42 117.28 3dpm h ASP 291 Ca 0.09 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.55 3dpm h ASP 291 Cb 0.16 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.93 3dpm h ASP 291 CO -0.01 0.74 0.00 0.61 -1.57 0.00 0.00 179.24 179.01 3dpm n GLY 292 N 1.36 -1.65 0.00 2.75 0.00 -1.24 -4.60 105.19 101.81 3dpm n GLY 292 Ca -0.05 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.06 0.00 -2.51 1.61 1.16 -1.24 0.67 117.46 117.10 3dpm n PHE 293 Ca 0.00 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.16 3dpm n PHE 293 Cb 0.00 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 37.84 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 -0.96 4.28 0.83 5.98 1.43 -1.26 -4.97 118.68 124.01 3dpm s LEU 294 Ca 0.00 1.77 -0.11 0.00 -1.03 0.00 0.00 54.13 54.76 3dpm s LEU 294 Cb 0.00 -3.56 0.09 0.00 0.03 0.00 0.00 46.19 42.75 3dpm s LEU 294 CO 0.00 -0.54 1.09 -2.16 0.23 0.00 0.00 176.35 174.97 3dpm s PRO 295 N 2.07 1.78 0.66 1.29 0.04 -1.26 -4.96 135.00 134.62 3dpm s PRO 295 Ca 0.54 0.89 -0.17 0.00 0.04 0.00 0.00 61.00 62.30 3dpm s PRO 295 Cb -0.24 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.41 3dpm s PRO 295 CO 0.22 -1.89 0.92 1.33 0.04 0.00 0.00 177.00 177.62 3dpm n VAL 296 N -3.66 3.29 1.29 -0.36 0.24 -1.26 -4.90 118.33 112.97 3dpm n VAL 296 Ca 0.08 -0.45 0.14 0.00 -2.04 0.00 0.00 64.34 62.06 3dpm n VAL 296 Cb 0.55 -1.09 0.50 0.00 -1.47 0.00 0.00 33.84 32.33 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 -2.09 0.00 0.00 1.34 -5.35 -1.26 -4.99 119.36 107.01 3dpm n ILE 297 Ca 0.13 -0.07 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 3dpm n ILE 297 Cb 0.48 0.06 0.00 0.00 -1.74 0.00 0.00 39.64 38.44 3dpm n ILE 297 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dpm n GLY 298 N 1.34 -0.06 3.56 3.28 0.00 -1.26 -4.95 105.19 107.09 3dpm n GLY 298 Ca 0.12 -1.15 -0.52 0.00 0.00 0.00 0.00 46.02 44.47 3dpm n GLY 298 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dpm n PRO 299 N -0.69 0.85 -3.24 1.61 -0.04 -1.26 -4.73 135.00 127.50 3dpm n PRO 299 Ca 0.00 0.31 -0.40 0.00 -0.04 0.00 0.00 63.50 63.37 3dpm n PRO 299 Cb 0.00 -1.84 -0.08 0.00 -0.04 0.00 0.00 33.50 31.54 3dpm n PRO 299 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3dpm s VAL 300 N 0.10 5.08 -0.88 0.52 1.01 -1.26 -2.70 120.40 122.26 3dpm s VAL 300 Ca 0.81 0.87 0.22 0.00 0.00 0.00 0.00 61.98 63.88 3dpm s VAL 300 Cb -0.99 -3.82 -0.21 0.00 0.00 0.00 0.00 36.38 31.36 3dpm s VAL 300 CO 0.51 0.09 0.91 2.30 0.00 0.00 0.00 175.10 178.91 3dpm n ILE 301 N 5.13 0.01 -3.50 2.22 -5.35 0.01 -4.97 119.36 112.91 3dpm n ILE 301 Ca -0.04 -0.07 -0.16 0.00 -0.27 0.00 0.00 62.75 62.21 3dpm n ILE 301 Cb 0.50 0.79 -0.05 0.00 -1.74 0.00 0.00 39.64 39.14 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 -3.06 -0.61 -0.19 4.28 -0.00 -1.22 -4.98 118.94 113.17 3dpm s TRP 302 Ca 0.06 0.85 -0.14 0.00 -0.00 0.00 0.00 56.10 56.88 3dpm s TRP 302 Cb 0.16 0.45 0.06 0.00 -0.00 0.00 0.00 33.47 34.13 3dpm s TRP 302 CO 0.86 -0.68 0.48 -2.00 -0.00 0.00 0.00 176.95 175.60 3dpm s GLU 303 N -2.00 0.51 0.29 5.86 2.12 -1.26 -1.72 118.70 122.49 3dpm s GLU 303 Ca -0.07 0.78 -0.28 0.00 0.36 0.00 0.00 54.97 55.76 3dpm s GLU 303 Cb -0.00 0.14 -0.10 0.00 0.26 0.00 0.00 34.13 34.43 3dpm s GLU 303 CO 0.03 -0.11 0.95 0.45 -0.54 0.00 0.00 175.26 176.03 3dpm s SER 304 N 0.87 7.44 -0.25 -1.70 0.15 -0.10 -4.96 113.70 115.15 3dpm s SER 304 Ca -0.05 1.89 0.10 0.00 0.70 0.00 0.00 55.95 58.59 3dpm s SER 304 Cb -0.06 -2.59 0.46 0.00 -1.71 0.00 0.00 66.02 62.12 3dpm s SER 304 CO -0.07 0.01 1.34 -0.62 1.20 0.00 0.00 173.24 175.09 3dpm n GLU 305 N 0.91 1.73 0.00 5.44 1.02 -1.26 -4.68 120.64 123.80 3dpm n GLU 305 Ca 0.00 -3.27 0.00 0.00 -0.02 0.00 0.00 57.16 53.87 3dpm n GLU 305 Cb 0.49 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 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 -1.12 3.40 0.19 0.62 0.00 -1.26 -5.03 105.19 101.99 3dpm n GLY 306 Ca 0.26 -1.89 -0.12 0.00 0.00 0.00 0.00 46.02 44.27 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 -0.42-10.29 0.99 5.85 -1.95 -3.44 115.31 106.05 3dpm h LEU 307 Ca 0.00 0.06 -0.50 0.00 0.84 0.00 0.00 57.88 58.28 3dpm h LEU 307 Cb 0.00 0.17 0.05 0.00 0.37 0.00 0.00 40.66 41.25 3dpm h LEU 307 CO 0.00 -0.21 0.40 -0.36 -0.34 0.00 0.00 178.44 177.92 3dpm s PHE 308 N -6.13 3.48 -0.32 1.25 0.40 -1.26 -4.99 117.98 110.40 3dpm s PHE 308 Ca -0.15 1.37 -0.14 0.00 -0.60 0.00 0.00 56.93 57.41 3dpm s PHE 308 Cb 0.08 -2.78 -0.02 0.00 0.51 0.00 0.00 43.02 40.81 3dpm s PHE 308 CO 0.66 -0.67 0.33 0.50 0.70 0.00 0.00 175.22 176.75 3dpm s ARG 309 N -4.74 3.70 -0.18 0.44 3.52 -1.26 -4.77 118.95 115.67 3dpm s ARG 309 Ca 0.57 -0.32 -0.18 0.00 -0.13 0.00 0.00 55.73 55.67 3dpm s ARG 309 Cb -0.11 -3.75 0.05 0.00 -1.56 0.00 0.00 34.95 29.57 3dpm s ARG 309 CO 0.46 -0.42 0.51 0.00 -0.81 0.00 0.00 175.30 175.03 3dpm s ALA 310 N 1.98 -1.26 0.22 6.12 0.00 -1.26 -1.86 121.76 125.70 3dpm s ALA 310 Ca 0.11 1.38 -0.23 0.00 0.00 0.00 0.00 51.96 53.23 3dpm s ALA 310 Cb -0.16 -0.75 0.04 0.00 0.00 0.00 0.00 23.12 22.24 3dpm s ALA 310 CO 0.11 -0.25 0.76 1.52 0.00 0.00 0.00 175.76 177.90 3dpm s TYR 311 N 0.12 -0.25 -0.12 0.00 -0.85 -0.32 -0.92 117.35 115.02 3dpm s TYR 311 Ca -0.01 -0.12 0.01 0.00 -0.52 0.00 0.00 57.07 56.43 3dpm s TYR 311 Cb -0.03 0.66 -0.01 0.00 0.38 0.00 0.00 41.96 42.95 3dpm s TYR 311 CO 0.01 -1.04 -0.14 0.42 -1.52 0.00 0.00 175.55 173.28 3dpm s ILE 312 N -3.71 2.96 0.29 -3.49 -1.09 -0.70 -0.96 121.20 114.50 3dpm s ILE 312 Ca 0.09 -0.70 0.06 0.00 -2.23 0.00 0.00 60.65 57.87 3dpm s ILE 312 Cb -0.04 -2.23 -0.06 0.00 -1.58 0.00 0.00 42.46 38.55 3dpm s ILE 312 CO 0.02 0.53 -0.02 -0.44 -1.23 0.00 0.00 174.94 173.79 3dpm s SER 313 N 0.25 2.66 -0.27 3.58 0.01 -0.56 -0.81 113.70 118.55 3dpm s SER 313 Ca -0.10 -1.24 -0.03 0.00 1.31 0.00 0.00 55.95 55.89 3dpm s SER 313 Cb -0.16 -0.15 0.03 0.00 0.21 0.00 0.00 66.02 65.96 3dpm s SER 313 CO 0.06 -0.42 -0.02 -0.94 0.41 0.00 0.00 173.24 172.33 3dpm s SER 314 N -3.46 4.64 -0.18 2.44 1.04 -1.10 -0.39 113.70 116.69 3dpm s SER 314 Ca 0.31 -0.96 -0.07 0.00 0.48 0.00 0.00 55.95 55.71 3dpm s SER 314 Cb 0.05 -1.72 -0.04 0.00 0.10 0.00 0.00 66.02 64.41 3dpm s SER 314 CO 0.13 -0.18 0.07 -0.69 0.98 0.00 0.00 173.24 173.54 3dpm s VAL 315 N 1.34 4.85 -0.25 5.02 1.01 0.11 -4.55 120.40 127.93 3dpm s VAL 315 Ca -0.01 -0.02 -0.09 0.00 0.00 0.00 0.00 61.98 61.87 3dpm s VAL 315 Cb -0.18 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 3dpm s VAL 315 CO -0.02 0.47 0.11 0.42 0.00 0.00 0.00 175.10 176.08 3dpm s THR 316 N 0.27 4.73 0.42 3.92 -4.23 -1.26 -0.01 115.64 119.48 3dpm s THR 316 Ca 0.04 -0.03 -0.07 0.00 -1.18 0.00 0.00 61.69 60.45 3dpm s THR 316 Cb -0.12 -3.21 0.11 0.00 1.34 0.00 0.00 72.50 70.61 3dpm s THR 316 CO 0.00 0.33 0.29 -0.90 -0.54 0.00 0.00 174.62 173.80 3dpm n ASP 317 N 4.69 -2.20 0.00 3.99 3.85 -1.02 -4.80 116.55 121.07 3dpm n ASP 317 Ca -0.16 -0.42 0.01 0.00 -0.71 0.00 0.00 54.79 53.51 3dpm n ASP 317 Cb 0.52 -0.30 0.05 0.00 -1.35 0.00 0.00 41.12 40.03 3dpm n ASP 317 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dpm n GLY 318 N -1.03 -0.57 2.18 6.12 0.00 -1.26 -2.99 105.19 107.64 3dpm n GLY 318 Ca 0.04 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.89 3dpm n GLY 318 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dpm n ASP 319 N -0.54 3.87 -1.48 1.61 10.43 -1.26 -4.97 116.55 124.21 3dpm n ASP 319 Ca 0.01 -3.27 -0.03 0.00 2.57 0.00 0.00 54.79 54.08 3dpm n ASP 319 Cb 0.01 -0.38 -0.01 0.00 1.84 0.00 0.00 41.12 42.57 3dpm n ASP 319 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3dpm n GLY 320 N -0.68 0.04 3.43 0.44 0.00 -1.16 -4.87 105.19 102.39 3dpm n GLY 320 Ca 0.33 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.01 3.24 0.45 1.61 2.20 -1.26 -4.93 119.74 118.03 3dpm s LYS 321 Ca 0.00 -0.79 -0.23 0.00 -0.36 0.00 0.00 55.97 54.58 3dpm s LYS 321 Cb 0.00 -3.62 -0.08 0.00 -1.51 0.00 0.00 37.83 32.63 3dpm s LYS 321 CO 0.00 -0.48 1.18 -1.12 -0.36 0.00 0.00 175.35 174.57 3dpm s SER 322 N 1.61 6.23 0.01 1.43 0.01 -1.26 -2.44 113.70 119.28 3dpm s SER 322 Ca 0.04 2.34 0.01 0.00 1.31 0.00 0.00 55.95 59.65 3dpm s SER 322 Cb -0.18 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.44 3dpm s SER 322 CO 0.07 -0.88 -0.04 -1.00 0.41 0.00 0.00 173.24 171.80 3dpm s HIS 323 N -1.50 0.35 -0.23 2.43 3.76 0.98 -4.96 115.29 116.13 3dpm s HIS 323 Ca 0.62 -0.21 -0.15 0.00 -0.15 0.00 0.00 55.06 55.17 3dpm s HIS 323 Cb -0.30 -0.22 -0.04 0.00 1.11 0.00 0.00 32.58 33.13 3dpm s HIS 323 CO 0.36 -0.05 0.34 0.15 -0.85 0.00 0.00 174.74 174.70 3dpm s LYS 324 N -0.58 4.11 -0.06 1.40 1.02 -1.26 0.07 119.74 124.43 3dpm s LYS 324 Ca -0.04 0.06 0.04 0.00 0.02 0.00 0.00 55.97 56.06 3dpm s LYS 324 Cb -0.04 -3.57 -0.00 0.00 -0.52 0.00 0.00 37.83 33.69 3dpm s LYS 324 CO -0.00 -0.09 -0.19 0.08 -0.92 0.00 0.00 175.35 174.23 3dpm s VAL 325 N 1.48 1.57 0.29 3.17 1.01 0.47 -0.79 120.40 127.61 3dpm s VAL 325 Ca 0.16 -0.77 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 3dpm s VAL 325 Cb -0.15 -1.36 -0.09 0.00 0.00 0.00 0.00 36.38 34.78 3dpm s VAL 325 CO 0.08 0.45 0.70 -0.83 0.00 0.00 0.00 175.10 175.50 3dpm s GLY 326 N 0.19 2.38 -0.04 4.51 0.00 -0.31 -1.50 107.32 112.54 3dpm s GLY 326 Ca -0.09 0.01 0.01 0.00 0.00 0.00 0.00 44.72 44.65 3dpm s GLY 326 CO 0.04 0.23 -0.03 -0.12 0.00 0.00 0.00 173.10 173.23 3dpm s PHE 327 N -1.87 0.58 -0.08 1.90 5.36 -0.14 -0.39 117.98 123.34 3dpm s PHE 327 Ca 0.51 -0.13 -0.06 0.00 -0.96 0.00 0.00 56.93 56.29 3dpm s PHE 327 Cb -0.12 -0.57 0.03 0.00 -0.34 0.00 0.00 43.02 42.02 3dpm s PHE 327 CO 0.18 -0.17 0.21 -1.17 -1.46 0.00 0.00 175.22 172.81 3dpm s LEU 328 N 1.00 0.97 -0.19 6.12 1.98 -0.52 -1.17 118.68 126.87 3dpm s LEU 328 Ca -0.10 0.44 -0.04 0.00 -2.89 0.00 0.00 54.13 51.54 3dpm s LEU 328 Cb -0.14 0.69 -0.02 0.00 0.66 0.00 0.00 46.19 47.38 3dpm s LEU 328 CO -0.01 -0.10 -0.03 -0.60 -1.89 0.00 0.00 176.35 173.72 3dpm s ARG 329 N 0.48 3.51 -0.50 1.98 3.52 -0.77 -0.81 118.95 126.36 3dpm s ARG 329 Ca -0.03 -0.58 -0.15 0.00 -0.13 0.00 0.00 55.73 54.84 3dpm s ARG 329 Cb -0.04 -2.99 0.10 0.00 -1.56 0.00 0.00 34.95 30.46 3dpm s ARG 329 CO -0.02 -0.02 0.43 0.42 -0.81 0.00 0.00 175.30 175.30 3dpm s ILE 330 N 1.03 5.14 0.10 4.11 1.01 -0.89 -4.47 121.20 127.24 3dpm s ILE 330 Ca 0.01 -1.28 -0.08 0.00 0.00 0.00 0.00 60.65 59.29 3dpm s ILE 330 Cb -0.15 -4.18 -0.22 0.00 0.01 0.00 0.00 42.46 37.93 3dpm s ILE 330 CO 0.01 -0.70 1.24 1.55 0.00 0.00 0.00 174.94 177.03 3dpm h PRO 331 N 8.78 0.51 -3.19 2.79 0.13 -1.83 -3.42 132.00 135.78 3dpm h PRO 331 Ca -0.29 -0.58 0.03 0.00 -0.87 0.00 0.00 66.00 64.29 3dpm h PRO 331 Cb 1.10 0.17 -0.07 0.00 0.13 0.00 0.00 31.00 32.34 3dpm h PRO 331 CO 0.94 1.21 0.12 -0.08 -0.23 0.00 0.00 178.00 179.96 3dpm s THR 332 N -3.21 0.00 -0.70 1.56 -1.32 -1.26 -4.03 115.64 106.68 3dpm s THR 332 Ca -0.07 -1.03 0.09 0.00 -1.21 0.00 0.00 61.69 59.47 3dpm s THR 332 Cb 0.08 -1.96 -0.02 0.00 -1.51 0.00 0.00 72.50 69.09 3dpm s THR 332 CO 0.89 -0.01 0.53 -1.22 -2.21 0.00 0.00 174.62 172.60 3dpm n TYR 333 N -0.42 0.00 -3.11 9.09 4.02 -0.56 -4.67 117.16 121.51 3dpm n TYR 333 Ca -0.05 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.40 3dpm n TYR 333 Cb 0.60 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.92 3dpm n TYR 333 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 3dpm s SER 334 N -1.36 7.14 0.40 7.72 1.04 -1.16 -1.94 113.70 125.54 3dpm s SER 334 Ca 0.06 -3.18 0.18 0.00 0.48 0.00 0.00 55.95 53.50 3dpm s SER 334 Cb 0.07 -2.32 1.09 0.00 0.10 0.00 0.00 66.02 64.96 3dpm s SER 334 CO 0.24 -0.57 1.79 4.11 0.98 0.00 0.00 173.24 179.79 3dpm h TRP 335 N 7.07 0.65 0.00 5.02 5.08 -1.93 -1.49 115.95 130.35 3dpm h TRP 335 Ca 0.25 0.02 -0.03 0.00 1.08 0.00 0.00 58.89 60.21 3dpm h TRP 335 Cb 0.89 -0.19 -0.00 0.00 -3.00 0.00 0.00 29.16 26.85 3dpm h TRP 335 CO 0.97 0.08 -0.13 1.96 -1.28 0.00 0.00 178.44 180.05 3dpm h GLN 336 N 0.41 0.00 -0.28 0.12 4.20 -1.99 -2.50 115.11 115.07 3dpm h GLN 336 Ca 0.57 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.28 3dpm h GLN 336 Cb 1.43 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.21 3dpm h GLN 336 CO -0.27 0.13 0.00 -0.25 -0.67 0.00 0.00 178.83 177.76 3dpm n ASP 337 N -3.49 1.75 -4.77 1.46 8.00 -0.56 -4.84 116.55 114.11 3dpm n ASP 337 Ca -0.01 -1.90 -0.41 0.00 0.71 0.00 0.00 54.79 53.18 3dpm n ASP 337 Cb 0.28 -0.19 -0.02 0.00 -0.02 0.00 0.00 41.12 41.17 3dpm n ASP 337 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3dpm s MET 338 N -1.62 4.36 0.07 -1.24 -1.94 -0.94 -4.92 119.30 113.07 3dpm s MET 338 Ca 0.26 2.21 -0.31 0.00 -1.71 0.00 0.00 55.69 56.14 3dpm s MET 338 Cb 0.14 -3.07 -0.10 0.00 2.01 0.00 0.00 34.83 33.80 3dpm s MET 338 CO 0.19 -0.18 1.90 0.39 -0.01 0.00 0.00 175.02 177.30 3dpm n GLU 339 N 0.83 2.77 -1.00 2.03 1.02 -1.26 -1.35 120.64 123.68 3dpm n GLU 339 Ca 0.00 1.01 -0.00 0.00 -0.02 0.00 0.00 57.16 58.15 3dpm n GLU 339 Cb 0.42 -2.93 -0.00 0.00 -0.02 0.00 0.00 31.44 28.91 3dpm n GLU 339 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3dpm n ASP 340 N 6.47 -3.11 -4.74 1.62 8.00 -1.26 -5.01 116.55 118.52 3dpm n ASP 340 Ca 0.19 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.28 3dpm n ASP 340 Cb 0.38 -0.62 -0.03 0.00 -0.02 0.00 0.00 41.12 40.84 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 -1.97 3.14 -0.23 1.24 5.36 -0.46 -5.00 117.98 120.07 3dpm s PHE 341 Ca 0.00 1.12 0.02 0.00 -0.96 0.00 0.00 56.93 57.11 3dpm s PHE 341 Cb 0.00 -3.71 0.04 0.00 -0.34 0.00 0.00 43.02 39.02 3dpm s PHE 341 CO 0.00 -2.27 -0.14 0.34 -1.46 0.00 0.00 175.22 171.69 3dpm s ASP 342 N 0.36 3.94 0.36 6.13 2.15 -1.26 -5.00 116.67 123.35 3dpm s ASP 342 Ca 0.58 -1.10 0.25 0.00 0.43 0.00 0.00 52.55 52.70 3dpm s ASP 342 Cb -0.39 -1.52 1.32 0.00 -0.30 0.00 0.00 42.92 42.03 3dpm s ASP 342 CO 0.40 -0.12 1.75 1.55 -0.17 0.00 0.00 175.17 178.59 3dpm h PRO 343 N 7.84 0.00 0.15 4.34 0.13 -1.96 -2.63 132.00 139.87 3dpm h PRO 343 Ca -0.30 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.49 3dpm h PRO 343 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3dpm h PRO 343 CO 0.53 0.00 -1.75 0.66 -0.23 0.00 0.00 178.00 177.21 3dpm h SER 344 N 0.00 0.50 -3.07 1.44 4.64 -2.02 -3.47 113.55 111.56 3dpm h SER 344 Ca 0.00 -0.81 -0.32 0.00 -0.47 0.00 0.00 61.79 60.19 3dpm h SER 344 Cb 0.02 -0.16 0.16 0.00 -0.31 0.00 0.00 62.40 62.10 3dpm h SER 344 CO 0.00 1.69 0.13 0.61 -0.87 0.00 0.00 176.83 178.39 3dpm n GLY 345 N 1.83 -2.54 3.77 -0.77 0.00 -0.99 -4.97 105.19 101.51 3dpm n GLY 345 Ca -0.24 -1.51 -0.39 0.00 0.00 0.00 0.00 46.02 43.87 3dpm n GLY 345 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dpm s PRO 346 N -5.05 3.88 0.84 1.61 0.04 -1.26 -4.98 135.00 130.10 3dpm s PRO 346 Ca 0.58 2.18 -0.13 0.00 0.04 0.00 0.00 61.00 63.67 3dpm s PRO 346 Cb -0.05 -2.71 0.09 0.00 0.04 0.00 0.00 34.50 31.87 3dpm s PRO 346 CO 0.44 -0.57 1.08 -0.35 0.04 0.00 0.00 177.00 177.64 3dpm n PRO 347 N 0.01 -0.02 0.28 0.56 -0.04 -1.26 -4.89 135.00 129.64 3dpm n PRO 347 Ca 0.04 0.07 0.13 0.00 -0.04 0.00 0.00 63.50 63.71 3dpm n PRO 347 Cb 0.44 -2.34 0.81 0.00 -0.04 0.00 0.00 33.50 32.37 3dpm n PRO 347 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 3dpm h PRO 348 N -1.19 0.00 0.00 0.54 0.13 -1.93 -2.30 132.00 127.25 3dpm h PRO 348 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 3dpm h PRO 348 Cb 1.29 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 3dpm h PRO 348 CO 0.43 0.06 -0.04 0.11 -0.23 0.00 0.00 178.00 178.34 3dpm h TRP 349 N 0.00 0.00 0.09 1.56 0.09 -1.93 -1.87 115.95 113.89 3dpm h TRP 349 Ca -0.00 0.00 -0.26 0.00 0.09 0.00 0.00 58.89 58.72 3dpm h TRP 349 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 29.39 3dpm h TRP 349 CO 0.00 0.04 -1.18 0.93 0.09 0.00 0.00 178.44 178.32 3dpm h GLU 350 N 0.00 0.18 0.00 0.12 5.08 -1.77 -2.60 114.58 115.60 3dpm h GLU 350 Ca -0.00 -0.31 -0.15 0.00 -1.00 0.00 0.00 59.36 57.90 3dpm h GLU 350 Cb 0.65 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 3dpm h GLU 350 CO 0.00 1.14 -0.71 1.49 -1.00 0.00 0.00 179.01 179.94 3dpm h GLU 351 N 0.05 0.00 -0.51 2.33 4.81 -1.51 -2.59 114.58 117.16 3dpm h GLU 351 Ca -0.10 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.03 3dpm h GLU 351 Cb 1.91 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.27 3dpm h GLU 351 CO 0.18 0.71 -0.06 0.35 -0.73 0.00 0.00 179.01 179.45 3dpm h PHE 352 N 0.00 1.04 -0.74 0.92 3.57 -1.38 -2.49 116.94 117.86 3dpm h PHE 352 Ca -0.01 -0.20 -0.05 0.00 3.53 0.00 0.00 57.97 61.23 3dpm h PHE 352 Cb 1.39 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 39.83 3dpm h PHE 352 CO 0.00 0.98 0.25 0.00 -2.23 0.00 0.00 178.31 177.31 3dpm h ALA 353 N 0.92 0.97 -0.34 2.41 0.00 -1.34 -1.83 119.26 120.05 3dpm h ALA 353 Ca 0.14 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3dpm h ALA 353 Cb 0.61 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3dpm h ALA 353 CO 0.04 0.64 0.03 0.87 0.00 0.00 0.00 179.25 180.82 3dpm h LYS 354 N 1.09 0.51 -0.16 0.00 1.79 -1.26 -2.18 116.57 116.36 3dpm h LYS 354 Ca 0.24 -0.10 -0.20 0.00 -2.18 0.00 0.00 60.65 58.42 3dpm h LYS 354 Cb 0.28 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 3dpm h LYS 354 CO -0.01 0.51 -0.69 0.82 -1.08 0.00 0.00 179.45 179.00 3dpm h ILE 355 N 0.49 1.31 -0.59 1.86 2.04 -1.00 -3.05 117.51 118.57 3dpm h ILE 355 Ca 0.11 -1.95 -0.10 0.00 1.00 0.00 0.00 64.86 63.92 3dpm h ILE 355 Cb 0.27 1.93 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 3dpm h ILE 355 CO 0.00 0.61 -0.02 0.40 0.00 0.00 0.00 178.15 179.14 3dpm h ILE 356 N 0.47 1.26 0.01 -0.67 1.08 -1.01 -1.68 117.51 116.98 3dpm h ILE 356 Ca -0.03 -1.17 0.03 0.00 -0.39 0.00 0.00 64.86 63.30 3dpm h ILE 356 Cb 1.29 0.84 -0.04 0.00 -3.07 0.00 0.00 36.82 35.84 3dpm h ILE 356 CO 0.14 0.42 -0.19 1.56 -0.69 0.00 0.00 178.15 179.39 3dpm h GLN 357 N 0.95 -0.30 -0.27 2.37 4.20 -1.42 0.45 115.11 121.09 3dpm h GLN 357 Ca 0.16 0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.96 3dpm h GLN 357 Cb 0.58 0.07 -0.07 0.00 0.30 0.00 0.00 27.48 28.36 3dpm h GLN 357 CO 0.03 -0.20 -0.17 0.28 -0.67 0.00 0.00 178.83 178.10 3dpm h VAL 358 N -0.32 0.51 -0.41 -0.54 2.07 -1.41 -1.85 116.25 114.31 3dpm h VAL 358 Ca 0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.60 3dpm h VAL 358 Cb 0.38 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 3dpm h VAL 358 CO -0.17 0.00 0.20 -0.26 0.02 0.00 0.00 177.57 177.36 3dpm h PHE 359 N -0.15 0.38 -0.42 1.57 0.05 -0.64 0.24 116.94 117.97 3dpm h PHE 359 Ca 0.14 0.02 0.08 0.00 3.82 0.00 0.00 57.97 62.03 3dpm h PHE 359 Cb 0.37 -0.11 -0.07 0.00 2.00 0.00 0.00 35.95 38.14 3dpm h PHE 359 CO -0.35 0.19 -0.02 0.77 -0.18 0.00 0.00 178.31 178.72 3dpm h SER 360 N 0.41 -0.22 -0.25 2.17 0.02 0.44 -1.82 113.55 114.29 3dpm h SER 360 Ca 0.18 0.10 -0.18 0.00 -0.84 0.00 0.00 61.79 61.05 3dpm h SER 360 Cb 0.08 0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.82 3dpm h SER 360 CO -0.12 -0.07 -0.55 0.28 -1.14 0.00 0.00 176.83 175.22 3dpm h SER 361 N 0.08 0.92 -0.44 3.07 0.02 -0.91 -3.38 113.55 112.92 3dpm h SER 361 Ca 0.21 -0.55 -0.29 0.00 -0.84 0.00 0.00 61.79 60.31 3dpm h SER 361 Cb 0.30 -0.27 -0.20 0.00 0.14 0.00 0.00 62.40 62.38 3dpm h SER 361 CO -0.37 1.30 -0.36 0.59 -1.14 0.00 0.00 176.83 176.86 3dpm n ASN 362 N -4.05 3.45 -3.82 3.07 3.02 0.82 -5.03 115.26 112.72 3dpm n ASN 362 Ca -0.05 -3.81 -0.09 0.00 -0.03 0.00 0.00 54.58 50.59 3dpm n ASN 362 Cb 0.63 -0.54 -0.07 0.00 -0.61 0.00 0.00 39.78 39.19 3dpm n ASN 362 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3dpm s THR 363 N -3.81 0.12 -0.25 3.41 -1.32 -0.71 -4.80 115.64 108.29 3dpm s THR 363 Ca 0.47 -1.07 0.12 0.00 -1.21 0.00 0.00 61.69 60.00 3dpm s THR 363 Cb 0.41 -1.33 -0.17 0.00 -1.51 0.00 0.00 72.50 69.90 3dpm s THR 363 CO -0.01 -0.57 0.37 -0.62 -2.21 0.00 0.00 174.62 171.59 3dpm n GLU 364 N -0.10 1.47 -3.84 7.08 1.02 0.03 -4.87 120.64 121.43 3dpm n GLU 364 Ca -0.15 -0.07 -0.07 0.00 -0.02 0.00 0.00 57.16 56.85 3dpm n GLU 364 Cb 0.63 -1.20 -0.02 0.00 -0.02 0.00 0.00 31.44 30.82 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 -2.57 -1.23 -0.04 0.62 0.00 -1.25 -4.34 121.76 112.95 3dpm s ALA 365 Ca -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 51.96 51.67 3dpm s ALA 365 Cb 0.08 0.85 0.03 0.00 0.00 0.00 0.00 23.12 24.09 3dpm s ALA 365 CO 0.51 -1.03 0.03 -1.17 0.00 0.00 0.00 175.76 174.11 3dpm s LEU 366 N -2.91 0.64 -0.20 0.00 0.20 -0.42 -1.17 118.68 114.82 3dpm s LEU 366 Ca 0.11 0.03 -0.12 0.00 0.69 0.00 0.00 54.13 54.84 3dpm s LEU 366 Cb -0.06 -0.17 -0.05 0.00 -0.43 0.00 0.00 46.19 45.49 3dpm s LEU 366 CO 0.06 -0.18 0.22 -0.63 -0.29 0.00 0.00 176.35 175.53 3dpm s ILE 367 N 1.64 5.34 -0.23 6.68 1.01 0.48 -0.80 121.20 135.31 3dpm s ILE 367 Ca -0.02 0.37 0.01 0.00 0.00 0.00 0.00 60.65 61.01 3dpm s ILE 367 Cb -0.13 -3.56 0.03 0.00 0.01 0.00 0.00 42.46 38.82 3dpm s ILE 367 CO -0.03 0.37 -0.13 -0.63 0.00 0.00 0.00 174.94 174.52 3dpm s ILE 368 N 0.70 2.33 -0.51 2.92 1.01 0.13 -1.43 121.20 126.35 3dpm s ILE 368 Ca 0.12 -1.19 -0.24 0.00 0.00 0.00 0.00 60.65 59.34 3dpm s ILE 368 Cb -0.13 -2.17 0.04 0.00 0.01 0.00 0.00 42.46 40.21 3dpm s ILE 368 CO 0.03 0.26 0.90 -0.62 0.00 0.00 0.00 174.94 175.50 3dpm s ASP 369 N 1.24 6.39 0.00 3.58 3.68 0.01 -0.28 116.67 131.29 3dpm s ASP 369 Ca -0.01 -0.20 0.09 0.00 2.13 0.00 0.00 52.55 54.56 3dpm s ASP 369 Cb -0.16 -2.43 0.23 0.00 -1.45 0.00 0.00 42.92 39.11 3dpm s ASP 369 CO -0.08 -1.11 1.15 1.67 0.13 0.00 0.00 175.17 176.93 3dpm n GLN 370 N 7.21 2.56 -0.69 4.34 7.27 -0.24 -2.09 117.38 135.73 3dpm n GLN 370 Ca 0.03 -1.83 -0.30 0.00 0.07 0.00 0.00 57.00 54.97 3dpm n GLN 370 Cb 0.48 -1.21 0.20 0.00 2.41 0.00 0.00 30.24 32.12 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 -0.97 2.14 -1.25 1.69 -4.23 -1.13 -3.93 115.64 107.96 3dpm s THR 371 Ca 0.18 0.04 -0.27 0.00 -1.18 0.00 0.00 61.69 60.47 3dpm s THR 371 Cb 0.09 -2.15 0.03 0.00 1.34 0.00 0.00 72.50 71.82 3dpm s THR 371 CO 0.13 -0.06 0.62 0.59 -0.54 0.00 0.00 174.62 175.35 3dpm n ASN 372 N -4.51 -3.60 -4.10 3.99 4.13 -1.23 -4.84 115.26 105.10 3dpm n ASN 372 Ca 0.07 -1.23 -0.28 0.00 1.68 0.00 0.00 54.58 54.82 3dpm n ASN 372 Cb 0.53 -2.07 -0.17 0.00 -1.54 0.00 0.00 39.78 36.54 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 -3.66 2.44 0.29 6.41 3.84 -0.83 -0.06 114.94 123.38 3dpm s ASN 373 Ca 0.41 -0.43 0.24 0.00 0.21 0.00 0.00 52.86 53.29 3dpm s ASN 373 Cb -0.21 -1.12 0.40 0.00 -0.55 0.00 0.00 41.25 39.78 3dpm s ASN 373 CO 0.95 0.07 1.50 1.55 -2.79 0.00 0.00 177.10 178.39 3dpm h PRO 374 N 7.02 0.00 0.00 0.43 0.13 -1.80 -2.66 132.00 135.12 3dpm h PRO 374 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3dpm h PRO 374 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3dpm h PRO 374 CO 0.48 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.66 3dpm n GLY 375 N 1.21 -0.87 0.00 1.56 0.00 -1.24 -4.40 105.19 101.44 3dpm n GLY 375 Ca 0.04 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.09 3.70 -0.02 0.00 -1.26 -1.49 105.19 106.02 3dpm n GLY 376 Ca 0.00 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 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 7.15 0.17 1.61 0.15 -0.82 -4.75 113.70 113.20 3dpm s SER 377 Ca 0.00 1.40 -0.11 0.00 0.70 0.00 0.00 55.95 57.93 3dpm s SER 377 Cb 0.00 -2.50 0.06 0.00 -1.71 0.00 0.00 66.02 61.87 3dpm s SER 377 CO 0.00 -0.31 1.67 0.58 1.20 0.00 0.00 173.24 176.38 3dpm h VAL 378 N 4.96 1.25 -0.05 4.45 2.07 -1.99 -1.75 116.25 125.19 3dpm h VAL 378 Ca -0.36 -0.95 -0.04 0.00 0.82 0.00 0.00 66.70 66.17 3dpm h VAL 378 Cb 1.17 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 3dpm h VAL 378 CO 0.80 0.35 -0.18 -0.07 0.02 0.00 0.00 177.57 178.49 3dpm h LEU 379 N 0.85 0.07 -0.12 2.57 3.38 -1.92 0.59 115.31 120.73 3dpm h LEU 379 Ca 0.18 -0.01 -0.23 0.00 0.09 0.00 0.00 57.88 57.91 3dpm h LEU 379 Cb 0.39 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.14 3dpm h LEU 379 CO 0.01 0.26 -0.81 0.22 0.09 0.00 0.00 178.44 178.21 3dpm h TYR 380 N 0.07 1.04 -0.26 1.13 3.20 -1.63 -1.26 116.97 119.26 3dpm h TYR 380 Ca 0.01 -0.48 0.05 0.00 3.14 0.00 0.00 58.73 61.45 3dpm h TYR 380 Cb 0.36 -0.15 -0.05 0.00 1.54 0.00 0.00 36.73 38.43 3dpm h TYR 380 CO 0.00 1.31 -0.07 1.25 -1.64 0.00 0.00 178.16 179.02 3dpm h LEU 381 N 0.47 -0.25 -1.08 2.82 7.12 -0.37 -0.45 115.31 123.57 3dpm h LEU 381 Ca -0.07 0.08 -0.02 0.00 0.13 0.00 0.00 57.88 58.00 3dpm h LEU 381 Cb 1.44 0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 41.71 3dpm h LEU 381 CO 0.16 -0.09 0.37 1.88 -0.13 0.00 0.00 178.44 180.63 3dpm h TYR 382 N -0.00 1.00 -0.31 1.25 0.05 -0.84 -1.46 116.97 116.65 3dpm h TYR 382 Ca 0.13 -0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.92 3dpm h TYR 382 Cb 0.20 -0.32 -0.04 0.00 1.01 0.00 0.00 36.73 37.58 3dpm h TYR 382 CO -0.26 0.72 0.09 0.00 -1.05 0.00 0.00 178.16 177.65 3dpm h ALA 383 N 1.39 0.35 -0.49 3.88 0.00 0.11 -0.32 119.26 124.17 3dpm h ALA 383 Ca 0.25 0.05 -0.13 0.00 0.00 0.00 0.00 54.91 55.08 3dpm h ALA 383 Cb 0.07 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3dpm h ALA 383 CO -0.04 -0.32 -0.21 -0.07 0.00 0.00 0.00 179.25 178.62 3dpm h LEU 384 N 0.21 1.02 -1.32 0.00 3.38 -0.80 -2.91 115.31 114.90 3dpm h LEU 384 Ca 0.14 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 3dpm h LEU 384 Cb 0.14 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3dpm h LEU 384 CO -0.17 1.19 0.38 -0.07 0.09 0.00 0.00 178.44 179.86 3dpm h LEU 385 N 0.86 0.74 -0.86 1.67 3.38 -0.87 -2.29 115.31 117.93 3dpm h LEU 385 Ca 0.11 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3dpm h LEU 385 Cb 0.79 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3dpm h LEU 385 CO 0.07 0.56 0.00 -1.54 0.09 0.00 0.00 178.44 177.62 3dpm n SER 386 N -4.41 0.60 -0.95 -0.43 3.41 -0.17 -2.09 113.62 109.58 3dpm n SER 386 Ca 0.06 0.68 0.11 0.00 -0.26 0.00 0.00 58.87 59.47 3dpm n SER 386 Cb 0.07 -0.80 0.11 0.00 -0.26 0.00 0.00 64.21 63.33 3dpm n SER 386 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3dpm n MET 387 N -2.20 2.22 -0.61 4.33 2.81 -0.86 0.44 117.12 123.24 3dpm n MET 387 Ca 0.01 -1.92 0.03 0.00 -1.81 0.00 0.00 57.70 54.01 3dpm n MET 387 Cb 0.17 -1.45 0.24 0.00 -0.71 0.00 0.00 33.22 31.48 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 1.31 4.21 -3.52 4.03 4.77 -0.89 0.03 117.00 126.94 3dpm n LEU 388 Ca 0.14 -3.26 -0.11 0.00 -0.03 0.00 0.00 56.01 52.74 3dpm n LEU 388 Cb 0.58 -0.60 -0.03 0.00 -2.33 0.00 0.00 43.42 41.04 3dpm n LEU 388 CO 0.14 0.86 0.31 0.28 -1.33 0.00 0.00 177.39 177.65 3dpm s THR 389 N -2.98 0.03 -0.03 -5.08 -1.32 -1.11 -4.65 115.64 100.50 3dpm s THR 389 Ca 0.44 -0.25 0.05 0.00 -1.21 0.00 0.00 61.69 60.71 3dpm s THR 389 Cb 0.37 -1.10 0.07 0.00 -1.51 0.00 0.00 72.50 70.33 3dpm s THR 389 CO 0.07 -0.12 0.94 -0.90 -2.21 0.00 0.00 174.62 172.40 3dpm n ASP 390 N -0.32 1.48 -3.91 8.08 5.68 -1.26 -4.47 116.55 121.82 3dpm n ASP 390 Ca -0.16 -2.06 -0.11 0.00 -0.50 0.00 0.00 54.79 51.96 3dpm n ASP 390 Cb 0.64 -0.12 -0.12 0.00 -1.14 0.00 0.00 41.12 40.38 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 -1.15 0.19 0.52 0.11 1.70 -1.26 -4.90 118.95 114.16 3dpm s ARG 391 Ca 0.08 -0.28 -0.22 0.00 -0.47 0.00 0.00 55.73 54.83 3dpm s ARG 391 Cb 0.07 0.07 -0.07 0.00 -0.57 0.00 0.00 34.95 34.45 3dpm s ARG 391 CO 0.01 -0.03 1.18 -0.35 -1.08 0.00 0.00 175.30 175.03 3dpm n PRO 392 N 2.28 1.48 -4.42 3.89 -0.04 -1.26 -4.61 135.00 132.33 3dpm n PRO 392 Ca -0.18 0.54 -0.33 0.00 -0.04 0.00 0.00 63.50 63.49 3dpm n PRO 392 Cb 0.57 -2.35 -0.15 0.00 -0.04 0.00 0.00 33.50 31.54 3dpm n PRO 392 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dpm s LEU 393 N -2.26 2.48 0.26 1.53 1.43 -0.16 -4.92 118.68 117.04 3dpm s LEU 393 Ca 0.69 -0.48 -0.30 0.00 -1.03 0.00 0.00 54.13 53.02 3dpm s LEU 393 Cb -0.46 -1.57 -0.10 0.00 0.03 0.00 0.00 46.19 44.09 3dpm s LEU 393 CO 0.52 0.07 1.33 -0.70 0.23 0.00 0.00 176.35 177.79 3dpm s GLU 394 N 0.93 4.36 0.09 1.70 -6.30 -1.26 -0.69 118.70 117.53 3dpm s GLU 394 Ca -0.03 2.16 0.05 0.00 -2.50 0.00 0.00 54.97 54.65 3dpm s GLU 394 Cb -0.15 -3.13 -0.04 0.00 0.00 0.00 0.00 34.13 30.81 3dpm s GLU 394 CO -0.02 -0.24 -0.01 -0.51 0.02 0.00 0.00 175.26 174.50 3dpm s LEU 395 N -0.87 3.43 0.93 2.70 1.43 -0.78 -4.86 118.68 120.65 3dpm s LEU 395 Ca 0.54 -0.19 -0.12 0.00 -1.03 0.00 0.00 54.13 53.33 3dpm s LEU 395 Cb -0.39 -2.16 0.15 0.00 0.03 0.00 0.00 46.19 43.82 3dpm s LEU 395 CO 0.45 0.18 1.11 -2.16 0.23 0.00 0.00 176.35 176.16 3dpm s PRO 396 N -2.28 1.00 0.37 1.29 0.04 -1.26 -4.80 135.00 129.36 3dpm s PRO 396 Ca 0.25 0.47 0.06 0.00 0.04 0.00 0.00 61.00 61.82 3dpm s PRO 396 Cb -0.12 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.54 3dpm s PRO 396 CO 0.18 -2.33 0.01 0.15 0.04 0.00 0.00 177.00 175.05 3dpm s LYS 397 N -5.11 1.82 -0.08 4.56 1.02 -0.67 -4.73 119.74 116.54 3dpm s LYS 397 Ca 0.64 -2.01 0.03 0.00 0.02 0.00 0.00 55.97 54.65 3dpm s LYS 397 Cb -0.16 -1.37 0.01 0.00 -0.52 0.00 0.00 37.83 35.78 3dpm s LYS 397 CO 0.55 -0.07 -0.18 -1.01 -0.92 0.00 0.00 175.35 173.72 3dpm s HIS 398 N -2.90 2.05 -0.22 3.18 3.76 0.54 -0.32 115.29 121.38 3dpm s HIS 398 Ca 0.35 -0.81 -0.25 0.00 -0.15 0.00 0.00 55.06 54.19 3dpm s HIS 398 Cb 0.08 -1.41 -0.01 0.00 1.11 0.00 0.00 32.58 32.36 3dpm s HIS 398 CO 0.17 -0.35 0.85 1.03 -0.85 0.00 0.00 174.74 175.58 3dpm s ARG 399 N 0.50 4.22 0.29 1.40 1.81 -0.22 -0.10 118.95 126.85 3dpm s ARG 399 Ca -0.17 1.00 0.10 0.00 -1.72 0.00 0.00 55.73 54.94 3dpm s ARG 399 Cb -0.17 -3.62 -0.05 0.00 -0.45 0.00 0.00 34.95 30.66 3dpm s ARG 399 CO 0.06 -0.47 -0.08 -1.64 -0.68 0.00 0.00 175.30 172.49 3dpm s MET 400 N 2.67 2.00 -0.23 3.54 -1.94 -1.26 -1.35 119.30 122.73 3dpm s MET 400 Ca 0.37 -1.62 -0.07 0.00 -1.71 0.00 0.00 55.69 52.65 3dpm s MET 400 Cb -0.16 -1.96 -0.03 0.00 2.01 0.00 0.00 34.83 34.69 3dpm s MET 400 CO 0.09 0.31 0.07 0.42 -0.01 0.00 0.00 175.02 175.90 3dpm s ILE 401 N -2.44 4.49 -0.07 2.53 1.09 -1.23 0.84 121.20 126.41 3dpm s ILE 401 Ca 0.31 -0.12 -0.02 0.00 -1.10 0.00 0.00 60.65 59.72 3dpm s ILE 401 Cb -0.05 -3.08 -0.04 0.00 -1.06 0.00 0.00 42.46 38.24 3dpm s ILE 401 CO 0.18 0.37 0.04 -0.76 -0.10 0.00 0.00 174.94 174.67 3dpm s LEU 402 N 1.22 3.79 0.16 2.97 1.43 -0.56 -5.02 118.68 122.67 3dpm s LEU 402 Ca 0.05 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.36 3dpm s LEU 402 Cb -0.14 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 3dpm s LEU 402 CO 0.03 0.36 0.00 0.42 0.23 0.00 0.00 176.35 177.40 3dpm s THR 403 N -0.97 0.60 -0.65 5.49 -4.23 -1.26 -4.86 115.64 109.76 3dpm s THR 403 Ca 0.15 -1.97 0.04 0.00 -1.18 0.00 0.00 61.69 58.74 3dpm s THR 403 Cb -0.12 -2.07 0.04 0.00 1.34 0.00 0.00 72.50 71.70 3dpm s THR 403 CO 0.05 -0.51 1.06 0.00 -0.54 0.00 0.00 174.62 174.68 3dpm n GLN 404 N -0.20 0.03 -0.08 3.99 0.00 -1.26 -0.97 117.38 118.89 3dpm n GLN 404 Ca -0.07 0.46 -0.12 0.00 0.00 0.00 0.00 57.00 57.28 3dpm n GLN 404 Cb 0.63 -1.69 -0.04 0.00 0.00 0.00 0.00 30.24 29.13 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 0.46 0.31 2.61 -0.00 -2.00 -2.06 116.42 115.74 3dpm h ASP 405 Ca 0.00 -0.34 -0.11 0.00 -0.00 0.00 0.00 57.03 56.57 3dpm h ASP 405 Cb 0.20 -0.13 -0.01 0.00 -0.00 0.00 0.00 39.33 39.39 3dpm h ASP 405 CO 0.00 0.70 -0.46 -0.33 -0.00 0.00 0.00 179.24 179.14 3dpm h GLU 406 N 0.22 0.19 -0.58 0.28 3.07 -1.45 -2.96 114.58 113.35 3dpm h GLU 406 Ca 0.07 -0.10 -0.07 0.00 -0.50 0.00 0.00 59.36 58.75 3dpm h GLU 406 Cb 0.48 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.37 3dpm h GLU 406 CO 0.02 0.62 0.06 0.28 -1.40 0.00 0.00 179.01 178.59 3dpm h VAL 407 N 0.16 1.25 -0.23 3.13 2.07 -1.40 -1.69 116.25 119.55 3dpm h VAL 407 Ca 0.01 -1.01 -0.11 0.00 0.82 0.00 0.00 66.70 66.41 3dpm h VAL 407 Cb 0.88 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 3dpm h VAL 407 CO 0.07 0.37 -0.34 0.58 0.02 0.00 0.00 177.57 178.27 3dpm h VAL 408 N 0.89 1.29 -0.62 2.57 2.07 -1.23 -1.52 116.25 119.69 3dpm h VAL 408 Ca 0.18 -1.43 -0.05 0.00 0.82 0.00 0.00 66.70 66.21 3dpm h VAL 408 Cb 0.43 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 3dpm h VAL 408 CO 0.01 0.45 0.17 0.44 0.02 0.00 0.00 177.57 178.66 3dpm h ASP 409 N 0.41 0.90 0.06 0.57 3.32 -1.31 -0.28 116.42 120.08 3dpm h ASP 409 Ca 0.05 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 3dpm h ASP 409 Cb 0.79 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.10 3dpm h ASP 409 CO 0.06 0.86 -0.03 0.00 -1.72 0.00 0.00 179.24 178.41 3dpm h ALA 410 N 1.26 -0.08 -0.61 3.45 0.00 -0.71 -1.96 119.26 120.61 3dpm h ALA 410 Ca 0.20 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3dpm h ALA 410 Cb 0.30 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3dpm h ALA 410 CO -0.00 -0.53 0.25 -0.07 0.00 0.00 0.00 179.25 178.90 3dpm h LEU 411 N -0.11 0.80 -0.59 0.00 3.38 -1.03 -2.22 115.31 115.54 3dpm h LEU 411 Ca -0.01 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3dpm h LEU 411 Cb 0.09 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 3dpm h LEU 411 CO 0.01 0.71 0.35 0.44 0.09 0.00 0.00 178.44 180.04 3dpm h ASP 412 N 0.87 0.71 -0.00 -0.43 3.32 -0.78 -2.25 116.42 117.86 3dpm h ASP 412 Ca 0.21 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.20 3dpm h ASP 412 Cb 0.15 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3dpm h ASP 412 CO -0.02 0.57 -0.04 -0.50 -1.72 0.00 0.00 179.24 177.53 3dpm h TRP 413 N 0.79 -0.09 -0.61 4.55 -0.00 -0.94 -1.83 115.95 117.82 3dpm h TRP 413 Ca 0.21 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 59.10 3dpm h TRP 413 Cb -0.01 0.04 -0.03 0.00 -0.00 0.00 0.00 29.16 29.17 3dpm h TRP 413 CO -0.02 -0.06 0.36 -0.07 -0.00 0.00 0.00 178.44 178.65 3dpm h LEU 414 N -0.07 0.73 -0.03 -4.49 3.38 -1.20 -2.19 115.31 111.45 3dpm h LEU 414 Ca 0.02 -0.04 -0.25 0.00 0.09 0.00 0.00 57.88 57.69 3dpm h LEU 414 Cb 0.09 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.66 3dpm h LEU 414 CO -0.04 0.57 -1.10 0.71 0.09 0.00 0.00 178.44 178.67 3dpm h THR 415 N 0.84 1.41 -0.57 0.22 1.35 -1.29 -0.98 112.91 113.88 3dpm h THR 415 Ca 0.22 -2.65 -0.05 0.00 -0.55 0.00 0.00 66.41 63.38 3dpm h THR 415 Cb -0.02 2.64 -0.03 0.00 -1.73 0.00 0.00 68.15 69.02 3dpm h THR 415 CO -0.04 0.79 0.17 0.25 -0.25 0.00 0.00 175.52 176.44 3dpm h LEU 416 N 0.18 0.80 -2.59 3.87 6.46 -1.12 -2.88 115.31 120.05 3dpm h LEU 416 Ca -0.12 -0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.51 3dpm h LEU 416 Cb 1.77 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 41.49 3dpm h LEU 416 CO 0.19 0.77 0.00 0.18 -0.62 0.00 0.00 178.44 178.96 3dpm n LEU 417 N -4.28 3.62 -0.33 2.25 4.77 -0.84 -4.75 117.00 117.44 3dpm n LEU 417 Ca 0.04 -1.80 -0.11 0.00 -0.03 0.00 0.00 56.01 54.12 3dpm n LEU 417 Cb 0.21 -0.36 -0.08 0.00 -2.33 0.00 0.00 43.42 40.85 3dpm n LEU 417 CO 0.40 0.86 0.50 -0.08 -1.33 0.00 0.00 177.39 177.74 3dpm h GLU 418 N 4.05 -0.11 -1.20 3.23 4.81 -0.94 -2.37 114.58 122.05 3dpm h GLU 418 Ca 0.00 0.01 -0.67 0.00 -0.13 0.00 0.00 59.36 58.57 3dpm h GLU 418 Cb 0.95 0.03 -0.27 0.00 0.63 0.00 0.00 28.75 30.08 3dpm h GLU 418 CO 0.00 -0.07 0.87 0.09 -0.73 0.00 0.00 179.01 179.17 3dpm n ASN 419 N -5.31 7.59 -4.52 1.04 5.03 -1.26 -4.94 115.26 112.88 3dpm n ASN 419 Ca 0.01 -3.74 -0.39 0.00 0.87 0.00 0.00 54.58 51.34 3dpm n ASN 419 Cb 0.30 -1.00 -0.11 0.00 -1.02 0.00 0.00 39.78 37.94 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 -4.65 5.02 0.00 2.41 1.01 -0.89 -4.90 120.40 118.40 3dpm s VAL 420 Ca 0.61 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.46 3dpm s VAL 420 Cb 0.48 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 33.37 3dpm s VAL 420 CO -0.08 0.14 0.16 0.47 0.00 0.00 0.00 175.10 175.79 3dpm n ASP 421 N 5.04 0.31 -4.24 3.32 8.00 -1.26 -5.02 116.55 122.70 3dpm n ASP 421 Ca -0.14 -0.95 -0.14 0.00 0.71 0.00 0.00 54.79 54.27 3dpm n ASP 421 Cb 0.51 0.02 -0.10 0.00 -0.02 0.00 0.00 41.12 41.52 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 -0.02 0.62 0.27 -3.53 -4.23 -1.26 -5.04 115.64 102.44 3dpm s THR 422 Ca 0.00 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.52 3dpm s THR 422 Cb 0.00 -2.19 0.11 0.00 1.34 0.00 0.00 72.50 71.76 3dpm s THR 422 CO 0.00 -0.40 1.77 0.78 -0.54 0.00 0.00 174.62 176.23 3dpm h ASN 423 N 2.66 0.71 -0.29 3.99 2.35 -1.97 -2.09 115.58 120.95 3dpm h ASN 423 Ca -0.37 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.19 3dpm h ASN 423 Cb 1.21 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 39.38 3dpm h ASN 423 CO 0.62 0.79 0.10 0.58 -1.65 0.00 0.00 177.43 177.88 3dpm h VAL 424 N 0.69 1.19 -0.68 2.81 2.07 -1.96 -2.65 116.25 117.72 3dpm h VAL 424 Ca 0.13 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 67.10 3dpm h VAL 424 Cb 0.45 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 3dpm h VAL 424 CO 0.02 0.20 0.45 -0.33 0.02 0.00 0.00 177.57 177.92 3dpm h GLU 425 N 0.31 0.83 0.05 1.57 5.08 -1.91 -1.12 114.58 119.39 3dpm h GLU 425 Ca 0.09 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3dpm h GLU 425 Cb 0.21 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3dpm h GLU 425 CO -0.01 0.55 -0.02 0.77 -1.00 0.00 0.00 179.01 179.30 3dpm h SER 426 N 0.86 -0.05 -0.57 1.42 0.02 -1.11 -2.54 113.55 111.58 3dpm h SER 426 Ca 0.26 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 61.11 3dpm h SER 426 Cb -0.01 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 3dpm h SER 426 CO -0.07 -0.00 0.10 0.03 -1.14 0.00 0.00 176.83 175.75 3dpm h ARG 427 N -0.10 0.98 0.00 3.45 3.08 -1.12 0.18 114.38 120.85 3dpm h ARG 427 Ca -0.01 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 59.80 3dpm h ARG 427 Cb 0.08 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 3dpm h ARG 427 CO 0.01 0.90 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.74 3dpm h LEU 428 N 0.92 0.00 0.04 3.04 4.07 -1.05 0.61 115.31 122.94 3dpm h LEU 428 Ca 0.19 0.00 -0.37 0.00 0.08 0.00 0.00 57.88 57.77 3dpm h LEU 428 Cb 0.40 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.09 3dpm h LEU 428 CO 0.01 0.01 -2.28 0.00 -1.08 0.00 0.00 178.44 175.10 3dpm n ALA 429 N -2.49 1.28 -0.06 1.53 0.00 -0.94 -4.65 120.51 115.19 3dpm n ALA 429 Ca -0.03 -0.95 -0.01 0.00 0.00 0.00 0.00 53.44 52.44 3dpm n ALA 429 Cb 0.09 -0.33 -0.15 0.00 0.00 0.00 0.00 19.45 19.06 3dpm n ALA 429 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dpm n LEU 430 N -3.26 0.00 0.00 0.00 4.77 0.60 -5.07 117.00 114.04 3dpm n LEU 430 Ca -0.39 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.59 3dpm n LEU 430 Cb 1.03 0.28 0.00 0.00 -2.33 0.00 0.00 43.42 42.40 3dpm n LEU 430 CO 0.34 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 3dpm n GLY 431 N 1.62 1.87 0.25 -0.72 0.00 0.21 -4.76 105.19 103.67 3dpm n GLY 431 Ca -0.20 -2.11 -0.04 0.00 0.00 0.00 0.00 46.02 43.68 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 0.55 -5.06 1.61 3.32 -1.94 -3.38 116.42 111.52 3dpm h ASP 432 Ca 0.00 -0.17 -0.08 0.00 0.02 0.00 0.00 57.03 56.80 3dpm h ASP 432 Cb 0.00 -0.15 -0.16 0.00 0.22 0.00 0.00 39.33 39.24 3dpm h ASP 432 CO 0.00 0.75 -0.20 0.54 -1.72 0.00 0.00 179.24 178.61 3dpm s ASN 433 N -6.78 -0.16 -0.58 6.45 4.22 -1.26 -1.63 114.94 115.20 3dpm s ASN 433 Ca -0.07 -0.19 -0.02 0.00 -2.14 0.00 0.00 52.86 50.44 3dpm s ASN 433 Cb 0.14 0.39 0.15 0.00 1.28 0.00 0.00 41.25 43.21 3dpm s ASN 433 CO 0.79 -0.66 0.38 -0.04 -2.04 0.00 0.00 177.10 175.53 3dpm s MET 434 N -2.76 2.39 -1.39 3.55 -1.94 0.53 -4.63 119.30 115.05 3dpm s MET 434 Ca -0.03 -2.46 -0.09 0.00 -1.71 0.00 0.00 55.69 51.40 3dpm s MET 434 Cb -0.00 -3.64 0.01 0.00 2.01 0.00 0.00 34.83 33.22 3dpm s MET 434 CO -0.05 -1.15 1.13 0.39 -0.01 0.00 0.00 175.02 175.34 3dpm n GLU 435 N 3.55 -7.61 0.00 2.03 1.02 -1.26 -2.31 120.64 116.06 3dpm n GLU 435 Ca 0.06 0.83 0.00 0.00 -0.02 0.00 0.00 57.16 58.03 3dpm n GLU 435 Cb 0.37 -5.86 0.00 0.00 -0.02 0.00 0.00 31.44 25.93 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 -1.96 2.35 3.67 0.62 0.00 -1.26 -3.99 105.19 104.62 3dpm n GLY 436 Ca 0.00 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.00 2.82 0.13 1.61 5.04 -0.98 -4.83 117.35 119.15 3dpm s TYR 437 Ca 0.00 0.90 -0.31 0.00 -2.44 0.00 0.00 57.07 55.22 3dpm s TYR 437 Cb 0.00 -3.58 -0.11 0.00 0.35 0.00 0.00 41.96 38.62 3dpm s TYR 437 CO 0.00 -2.08 1.83 0.99 -1.34 0.00 0.00 175.55 174.95 3dpm s THR 438 N 2.97 2.46 -0.02 4.34 2.01 -1.26 -0.34 115.64 125.80 3dpm s THR 438 Ca 0.60 0.02 -0.23 0.00 0.31 0.00 0.00 61.69 62.39 3dpm s THR 438 Cb -0.26 -3.01 -0.05 0.00 0.01 0.00 0.00 72.50 69.19 3dpm s THR 438 CO 0.21 0.00 0.67 -0.69 -0.69 0.00 0.00 174.62 174.13 3dpm s VAL 439 N 2.63 4.92 0.17 3.82 1.01 -0.64 -4.87 120.40 127.42 3dpm s VAL 439 Ca 0.81 1.40 0.02 0.00 0.00 0.00 0.00 61.98 64.22 3dpm s VAL 439 Cb -0.47 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 31.89 3dpm s VAL 439 CO 0.36 0.35 0.17 0.47 0.00 0.00 0.00 175.10 176.45 3dpm n ASP 440 N 3.12 -0.45 0.11 3.32 10.43 -1.26 -4.76 116.55 127.06 3dpm n ASP 440 Ca -0.04 -2.03 -0.03 0.00 2.57 0.00 0.00 54.79 55.26 3dpm n ASP 440 Cb 0.51 0.95 0.15 0.00 1.84 0.00 0.00 41.12 44.57 3dpm n ASP 440 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 3dpm h LEU 441 N 0.00 0.14 -0.96 0.64 6.46 -1.83 -2.67 115.31 117.08 3dpm h LEU 441 Ca -0.12 -0.08 -0.02 0.00 -0.12 0.00 0.00 57.88 57.54 3dpm h LEU 441 Cb 0.59 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.44 3dpm h LEU 441 CO 0.17 0.71 0.41 -0.61 -0.62 0.00 0.00 178.44 178.51 3dpm h GLN 442 N 0.09 1.15 -0.25 1.25 5.75 -1.96 0.27 115.11 121.41 3dpm h GLN 442 Ca -0.01 -0.15 -0.05 0.00 -0.15 0.00 0.00 58.65 58.30 3dpm h GLN 442 Cb 1.10 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 29.42 3dpm h GLN 442 CO 0.09 0.87 -0.02 0.28 -2.65 0.00 0.00 178.83 177.39 3dpm h VAL 443 N 1.15 1.27 -0.55 2.39 2.07 -1.83 -1.84 116.25 118.90 3dpm h VAL 443 Ca 0.28 -0.98 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 3dpm h VAL 443 Cb 0.08 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 3dpm h VAL 443 CO -0.04 0.31 0.30 0.00 0.02 0.00 0.00 177.57 178.16 3dpm h ALA 444 N 0.79 1.49 -0.22 1.67 0.00 -1.15 -1.98 119.26 119.86 3dpm h ALA 444 Ca 0.07 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 3dpm h ALA 444 Cb 0.46 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3dpm h ALA 444 CO 0.02 0.42 -0.34 0.93 0.00 0.00 0.00 179.25 180.28 3dpm h GLU 445 N 0.77 0.47 -0.19 0.00 4.39 -0.72 -2.01 114.58 117.28 3dpm h GLU 445 Ca 0.20 -0.21 -0.06 0.00 0.34 0.00 0.00 59.36 59.63 3dpm h GLU 445 Cb 0.02 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3dpm h GLU 445 CO -0.03 0.75 -0.13 1.88 -1.16 0.00 0.00 179.01 180.32 3dpm h TYR 446 N 0.40 0.50 -0.65 4.33 0.99 -0.79 -1.75 116.97 120.00 3dpm h TYR 446 Ca 0.05 -0.13 -0.06 0.00 2.00 0.00 0.00 58.73 60.59 3dpm h TYR 446 Cb 0.79 -0.11 -0.03 0.00 1.00 0.00 0.00 36.73 38.38 3dpm h TYR 446 CO 0.03 0.75 0.18 -0.07 -0.00 0.00 0.00 178.16 179.05 3dpm h LEU 447 N 0.11 0.94 -0.43 3.88 3.38 -1.29 0.14 115.31 122.03 3dpm h LEU 447 Ca 0.04 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 3dpm h LEU 447 Cb 0.64 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3dpm h LEU 447 CO 0.04 0.89 0.02 0.11 0.09 0.00 0.00 178.44 179.59 3dpm h LYS 448 N 0.96 0.75 -0.84 1.13 1.57 -1.36 -1.42 116.57 117.35 3dpm h LYS 448 Ca 0.21 -0.23 0.05 0.00 -1.87 0.00 0.00 60.65 58.81 3dpm h LYS 448 Cb 0.31 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.49 3dpm h LYS 448 CO -0.00 0.81 0.53 1.03 -0.57 0.00 0.00 179.45 181.24 3dpm h SER 449 N 0.59 0.84 -0.15 0.86 0.87 -0.76 -0.02 113.55 115.78 3dpm h SER 449 Ca 0.12 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.70 3dpm h SER 449 Cb 0.46 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 3dpm h SER 449 CO 0.02 0.55 0.07 0.15 -0.53 0.00 0.00 176.83 177.09 3dpm h PHE 450 N 0.98 0.14 -0.76 2.24 3.57 -0.33 -0.06 116.94 122.72 3dpm h PHE 450 Ca 0.36 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.81 3dpm h PHE 450 Cb 0.11 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 3dpm h PHE 450 CO -0.03 0.08 0.28 0.78 -2.23 0.00 0.00 178.31 177.18 3dpm h GLY 451 N 0.16 1.24 1.06 2.40 0.00 -0.58 -1.24 103.07 106.11 3dpm h GLY 451 Ca 0.06 -0.70 -0.08 0.00 0.00 0.00 0.00 47.33 46.61 3dpm h GLY 451 CO -0.04 0.66 0.07 3.21 0.00 0.00 0.00 176.54 180.43 3dpm h ARG 452 N 1.11 1.06 -0.59 4.80 3.08 -0.76 -1.51 114.38 121.57 3dpm h ARG 452 Ca 0.25 -0.30 -0.09 0.00 0.07 0.00 0.00 59.98 59.90 3dpm h ARG 452 Cb 0.25 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3dpm h ARG 452 CO -0.02 1.00 0.01 0.37 -1.07 0.00 0.00 179.97 180.26 3dpm h GLN 453 N 0.97 1.04 -0.28 0.04 4.15 -0.75 -0.13 115.11 120.15 3dpm h GLN 453 Ca 0.19 -0.33 -0.01 0.00 0.77 0.00 0.00 58.65 59.27 3dpm h GLN 453 Cb 0.48 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 3dpm h GLN 453 CO 0.02 1.02 0.13 0.28 -1.93 0.00 0.00 178.83 178.35 3dpm h VAL 454 N 0.94 1.15 -0.70 2.39 2.07 -1.04 -1.03 116.25 120.03 3dpm h VAL 454 Ca 0.17 -0.43 -0.04 0.00 0.82 0.00 0.00 66.70 67.23 3dpm h VAL 454 Cb 0.55 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 3dpm h VAL 454 CO 0.03 0.15 0.29 -0.07 0.02 0.00 0.00 177.57 177.99 3dpm h LEU 455 N 0.31 0.93 -0.20 2.57 3.38 -1.12 -1.43 115.31 119.75 3dpm h LEU 455 Ca 0.09 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 3dpm h LEU 455 Cb 0.12 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3dpm h LEU 455 CO -0.01 0.82 0.03 -1.13 0.09 0.00 0.00 178.44 178.24 3dpm h ASN 456 N 1.00 0.33 -0.64 -0.43 -1.24 -0.70 -2.07 115.58 111.83 3dpm h ASN 456 Ca 0.24 -0.27 0.06 0.00 0.71 0.00 0.00 56.30 57.03 3dpm h ASN 456 Cb 0.17 -0.09 -0.05 0.00 0.73 0.00 0.00 38.32 39.08 3dpm h ASN 456 CO -0.02 0.51 0.34 0.00 -1.29 0.00 0.00 177.43 176.98 3dpm h TRP 458 N 0.64 -0.48 0.00 0.00 2.91 -1.03 -1.40 115.95 116.58 3dpm h TRP 458 Ca 0.29 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.29 3dpm h TRP 458 Cb 0.19 0.19 -0.00 0.00 -0.51 0.00 0.00 29.16 29.02 3dpm h TRP 458 CO -0.09 -0.28 -0.07 0.66 -1.03 0.00 0.00 178.44 177.63 3dpm h SER 459 N -0.39 0.00 0.63 2.65 4.64 -1.12 -2.20 113.55 117.74 3dpm h SER 459 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 3dpm h SER 459 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3dpm h SER 459 CO -0.06 0.07 -0.30 0.29 -0.87 0.00 0.00 176.83 175.97 3dpm n LYS 460 N -3.33 0.11 -0.84 4.77 5.02 -0.61 -4.93 118.16 118.36 3dpm n LYS 460 Ca -0.01 -0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 3dpm n LYS 460 Cb 0.25 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 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 1.47 0.80 2.54 0.72 0.00 -0.59 -4.92 105.19 105.21 3dpm n GLY 461 Ca 0.07 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 6.26 -0.12 1.61 2.03 -0.81 -4.42 116.55 121.09 3dpm n ASP 462 Ca 0.00 -2.74 0.02 0.00 0.52 0.00 0.00 54.79 52.59 3dpm n ASP 462 Cb 0.00 -1.60 0.01 0.00 -0.72 0.00 0.00 41.12 38.81 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 4.25 0.00 0.10 5.18 -6.64 -1.26 -4.06 119.36 116.93 3dpm n ILE 463 Ca 0.64 -0.47 -0.23 0.00 -1.77 0.00 0.00 62.75 60.92 3dpm n ILE 463 Cb 0.31 1.06 -0.15 0.00 -1.44 0.00 0.00 39.64 39.42 3dpm n ILE 463 CO 0.00 0.00 0.00 -0.33 -1.77 0.00 0.00 176.55 174.45 3dpm h GLU 464 N 0.58 0.43 -1.09 6.28 4.39 -1.82 -1.48 114.58 121.87 3dpm h GLU 464 Ca 0.00 -0.73 -0.24 0.00 0.34 0.00 0.00 59.36 58.73 3dpm h GLU 464 Cb 0.15 0.27 -0.20 0.00 -0.10 0.00 0.00 28.75 28.88 3dpm h GLU 464 CO 0.00 1.35 -0.58 -0.11 -1.16 0.00 0.00 179.01 178.51 3dpm n LEU 465 N -3.86 -2.84 -4.08 1.33 7.94 -1.24 -4.38 117.00 109.88 3dpm n LEU 465 Ca -0.17 -3.24 -0.36 0.00 -1.11 0.00 0.00 56.01 51.12 3dpm n LEU 465 Cb 1.00 0.74 0.06 0.00 0.53 0.00 0.00 43.42 45.74 3dpm n LEU 465 CO 0.54 1.94 -1.37 -1.54 -1.11 0.00 0.00 177.39 175.86 3dpm n SER 466 N 2.70 -4.29 -4.75 1.96 3.41 0.25 -4.74 113.62 108.15 3dpm n SER 466 Ca 0.19 0.12 -0.36 0.00 -0.26 0.00 0.00 58.87 58.56 3dpm n SER 466 Cb 0.56 -0.75 0.04 0.00 -0.26 0.00 0.00 64.21 63.80 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 -2.07 2.61 0.22 6.66 -1.32 -1.26 -4.17 115.64 116.32 3dpm s THR 467 Ca 0.42 0.36 -0.32 0.00 -1.21 0.00 0.00 61.69 60.95 3dpm s THR 467 Cb -0.09 -3.09 -0.13 0.00 -1.51 0.00 0.00 72.50 67.68 3dpm s THR 467 CO 0.74 -0.10 1.45 -0.81 -2.21 0.00 0.00 174.62 173.70 3dpm n PRO 468 N -1.82 2.08 -4.64 7.08 -0.04 -1.26 -4.56 135.00 131.84 3dpm n PRO 468 Ca 0.13 0.74 -0.25 0.00 -0.04 0.00 0.00 63.50 64.09 3dpm n PRO 468 Cb 0.50 -2.43 -0.16 0.00 -0.04 0.00 0.00 33.50 31.37 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 0.17 1.18 0.29 0.52 1.01 0.86 -4.77 121.20 120.47 3dpm s ILE 469 Ca 0.71 -0.53 -0.28 0.00 0.00 0.00 0.00 60.65 60.54 3dpm s ILE 469 Cb -0.65 -1.06 -0.09 0.00 0.01 0.00 0.00 42.46 40.67 3dpm s ILE 469 CO 0.47 0.36 1.00 -2.16 0.00 0.00 0.00 174.94 174.60 3dpm s PRO 470 N 0.43 4.66 0.21 2.79 0.04 -1.26 -0.34 135.00 141.53 3dpm s PRO 470 Ca -0.10 1.54 -0.32 0.00 0.04 0.00 0.00 61.00 62.16 3dpm s PRO 470 Cb -0.14 -3.07 -0.12 0.00 0.04 0.00 0.00 34.50 31.22 3dpm s PRO 470 CO 0.03 0.31 1.70 -0.51 0.04 0.00 0.00 177.00 178.57 3dpm s LEU 471 N -1.61 4.37 0.00 -3.56 1.43 -1.26 -0.56 118.68 117.49 3dpm s LEU 471 Ca 0.46 2.84 0.00 0.00 -1.03 0.00 0.00 54.13 56.40 3dpm s LEU 471 Cb -0.26 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.36 3dpm s LEU 471 CO 0.32 -0.95 0.00 0.49 0.23 0.00 0.00 176.35 176.44 3dpm n PHE 472 N 3.92 0.00 -0.99 0.29 3.01 -1.26 -1.90 117.46 120.53 3dpm n PHE 472 Ca 0.15 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.61 3dpm n PHE 472 Cb 0.36 -1.57 0.00 0.00 -0.01 0.00 0.00 39.48 38.26 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 -0.16 0.64 3.57 1.37 0.00 0.28 -3.04 105.19 107.85 3dpm n GLY 473 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.62 1.96 0.11 1.61 0.40 -0.80 -4.73 117.98 113.92 3dpm s PHE 474 Ca 0.00 0.61 0.11 0.00 -0.60 0.00 0.00 56.93 57.06 3dpm s PHE 474 Cb 0.00 -4.23 0.13 0.00 0.51 0.00 0.00 43.02 39.43 3dpm s PHE 474 CO 0.00 -2.31 1.47 0.93 0.70 0.00 0.00 175.22 176.01 3dpm h GLU 475 N 12.81 0.00 -3.20 0.44 5.08 -1.93 -3.43 114.58 124.35 3dpm h GLU 475 Ca -0.28 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 3dpm h GLU 475 Cb 1.13 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.29 3dpm h GLU 475 CO 1.16 0.70 0.10 -1.59 -1.00 0.00 0.00 179.01 178.38 3dpm s LYS 476 N -3.13 1.46 -0.20 2.33 -2.85 -1.26 -1.87 119.74 114.22 3dpm s LYS 476 Ca 0.01 -0.84 -0.12 0.00 -1.00 0.00 0.00 55.97 54.02 3dpm s LYS 476 Cb 0.10 0.55 -0.05 0.00 -2.06 0.00 0.00 37.83 36.38 3dpm s LYS 476 CO 0.77 -0.64 0.20 0.42 0.10 0.00 0.00 175.35 176.21 3dpm s ILE 477 N -3.87 5.36 -0.07 3.79 1.01 0.14 -4.90 121.20 122.65 3dpm s ILE 477 Ca 0.09 0.33 -0.06 0.00 0.00 0.00 0.00 60.65 61.01 3dpm s ILE 477 Cb -0.02 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 3dpm s ILE 477 CO -0.02 0.40 0.16 -1.00 0.00 0.00 0.00 174.94 174.48 3dpm s HIS 478 N 0.57 3.58 0.18 3.97 3.76 -1.26 -0.99 115.29 125.10 3dpm s HIS 478 Ca 0.11 0.48 -0.33 0.00 -0.15 0.00 0.00 55.06 55.17 3dpm s HIS 478 Cb -0.12 -1.91 -0.13 0.00 1.11 0.00 0.00 32.58 31.53 3dpm s HIS 478 CO 0.01 0.70 1.66 -0.35 -0.85 0.00 0.00 174.74 175.92 3dpm n PRO 479 N 1.57 2.46 -1.41 8.40 -0.04 -1.26 -4.69 135.00 140.03 3dpm n PRO 479 Ca -0.16 0.89 -0.42 0.00 -0.04 0.00 0.00 63.50 63.77 3dpm n PRO 479 Cb 0.54 -2.70 0.00 0.00 -0.04 0.00 0.00 33.50 31.30 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 3.83 -0.93 -0.04 0.54 -0.00 0.17 -4.88 115.22 113.92 3dpm n HIS 480 Ca 0.17 0.62 -0.05 0.00 0.46 0.00 0.00 57.72 58.92 3dpm n HIS 480 Cb 0.32 -1.93 0.15 0.00 -0.12 0.00 0.00 29.99 28.41 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 0.68 0.63 0.00 1.57 0.13 -1.90 -3.39 132.00 129.71 3dpm h PRO 481 Ca -0.39 -0.24 -0.44 0.00 -0.87 0.00 0.00 66.00 64.06 3dpm h PRO 481 Cb 1.41 -0.04 -0.07 0.00 0.13 0.00 0.00 31.00 32.44 3dpm h PRO 481 CO 0.50 0.80 -2.49 0.54 -0.23 0.00 0.00 178.00 177.12 3dpm n ARG 482 N -4.12 0.61 -4.79 0.86 1.74 -1.26 -4.98 116.66 104.71 3dpm n ARG 482 Ca 0.00 0.24 -0.33 0.00 -0.77 0.00 0.00 57.85 56.99 3dpm n ARG 482 Cb 0.41 -1.51 -0.13 0.00 -1.02 0.00 0.00 32.46 30.21 3dpm n ARG 482 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3dpm s VAL 483 N -2.51 3.16 -0.23 1.55 -7.23 -1.26 -5.09 120.40 108.79 3dpm s VAL 483 Ca -0.37 -0.65 -0.03 0.00 -1.81 0.00 0.00 61.98 59.11 3dpm s VAL 483 Cb 0.13 -2.29 0.12 0.00 0.56 0.00 0.00 36.38 34.90 3dpm s VAL 483 CO 0.53 0.55 0.32 -1.10 -0.31 0.00 0.00 175.10 175.09 3dpm s GLN 484 N -0.16 0.29 -0.16 4.82 -0.21 -1.26 -4.32 119.66 118.66 3dpm s GLN 484 Ca -0.00 0.39 -0.28 0.00 0.02 0.00 0.00 55.36 55.49 3dpm s GLN 484 Cb -0.13 -0.75 -0.01 0.00 1.00 0.00 0.00 33.01 33.12 3dpm s GLN 484 CO 0.03 -0.67 0.96 -0.47 -2.12 0.00 0.00 175.29 173.02 3dpm s TYR 485 N 2.46 3.44 -0.23 0.91 5.04 0.10 -4.82 117.35 124.25 3dpm s TYR 485 Ca 0.10 1.45 0.02 0.00 -2.44 0.00 0.00 57.07 56.20 3dpm s TYR 485 Cb -0.15 -3.15 0.06 0.00 0.35 0.00 0.00 41.96 39.06 3dpm s TYR 485 CO -0.15 -0.30 0.95 -1.13 -1.34 0.00 0.00 175.55 173.58 3dpm n SER 486 N 5.43 1.98 -4.92 4.32 3.41 -1.26 -2.74 113.62 119.83 3dpm n SER 486 Ca 0.08 -1.79 -0.21 0.00 -0.26 0.00 0.00 58.87 56.69 3dpm n SER 486 Cb 0.48 -0.04 0.05 0.00 -0.26 0.00 0.00 64.21 64.44 3dpm n SER 486 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3dpm s LYS 487 N -0.82 2.37 0.30 4.33 1.02 -1.26 -5.01 119.74 120.67 3dpm s LYS 487 Ca 0.05 -0.91 -0.29 0.00 0.02 0.00 0.00 55.97 54.83 3dpm s LYS 487 Cb 0.03 -2.47 -0.12 0.00 -0.52 0.00 0.00 37.83 34.74 3dpm s LYS 487 CO 0.03 -0.85 1.40 -0.35 -0.92 0.00 0.00 175.35 174.66 3dpm n PRO 488 N -2.42 2.25 -5.24 -1.68 -0.04 -1.26 -4.82 135.00 121.78 3dpm n PRO 488 Ca 0.10 0.79 -0.30 0.00 -0.04 0.00 0.00 63.50 64.05 3dpm n PRO 488 Cb 0.60 -2.45 -0.16 0.00 -0.04 0.00 0.00 33.50 31.45 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 -0.57 1.96 -0.20 0.52 1.01 -1.26 -1.30 121.20 121.36 3dpm s ILE 489 Ca 0.61 -1.06 0.01 0.00 0.00 0.00 0.00 60.65 60.20 3dpm s ILE 489 Cb -0.57 -1.63 0.05 0.00 0.01 0.00 0.00 42.46 40.32 3dpm s ILE 489 CO 0.56 0.55 -0.09 0.00 0.00 0.00 0.00 174.94 175.96 3dpm s VAL 491 N 1.42 5.44 -0.23 0.00 1.01 0.41 -0.69 120.40 127.76 3dpm s VAL 491 Ca -0.02 0.25 -0.09 0.00 0.00 0.00 0.00 61.98 62.12 3dpm s VAL 491 Cb -0.17 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 3dpm s VAL 491 CO -0.08 0.55 0.12 -0.76 0.00 0.00 0.00 175.10 174.94 3dpm s LEU 492 N -0.52 3.93 0.27 3.92 1.43 0.61 -0.40 118.68 127.91 3dpm s LEU 492 Ca 0.13 0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.32 3dpm s LEU 492 Cb -0.12 -2.04 -0.06 0.00 0.03 0.00 0.00 46.19 44.00 3dpm s LEU 492 CO 0.03 0.07 0.03 0.27 0.23 0.00 0.00 176.35 176.97 3dpm s ILE 493 N 1.02 1.06 0.37 -0.59 -0.00 0.40 -1.08 121.20 122.39 3dpm s ILE 493 Ca 0.06 -2.03 -0.12 0.00 -0.00 0.00 0.00 60.65 58.57 3dpm s ILE 493 Cb -0.14 -2.53 0.04 0.00 -0.00 0.00 0.00 42.46 39.83 3dpm s ILE 493 CO 0.04 -0.18 0.70 0.54 -0.00 0.00 0.00 174.94 176.04 3dpm s ASN 494 N -3.37 0.28 0.00 4.36 6.03 -1.22 -2.44 114.94 118.58 3dpm s ASN 494 Ca 0.32 -1.25 0.05 0.00 -1.03 0.00 0.00 52.86 50.96 3dpm s ASN 494 Cb 0.07 0.80 0.26 0.00 -3.03 0.00 0.00 41.25 39.34 3dpm s ASN 494 CO 0.12 -1.58 1.08 -1.84 -2.03 0.00 0.00 177.10 172.84 3dpm n GLU 495 N -0.54 0.05 -1.45 3.55 0.00 -1.17 -2.49 120.64 118.58 3dpm n GLU 495 Ca -0.06 0.30 -0.24 0.00 0.00 0.00 0.00 57.16 57.17 3dpm n GLU 495 Cb 0.60 -1.50 0.09 0.00 0.00 0.00 0.00 31.44 30.63 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 -1.37 2.80 -3.93 3.44 6.02 -1.26 -3.95 117.38 119.12 3dpm n GLN 496 Ca 0.02 -3.55 -0.35 0.00 -0.01 0.00 0.00 57.00 53.11 3dpm n GLN 496 Cb 0.05 -2.18 -0.14 0.00 1.02 0.00 0.00 30.24 28.99 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 -2.55 4.29 0.29 1.08 1.01 -1.04 -1.96 116.67 117.79 3dpm s ASP 497 Ca 0.55 -0.62 0.08 0.00 0.71 0.00 0.00 52.55 53.28 3dpm s ASP 497 Cb 0.45 -1.70 -0.06 0.00 1.01 0.00 0.00 42.92 42.62 3dpm s ASP 497 CO 0.02 -0.08 -0.10 -0.36 0.21 0.00 0.00 175.17 174.86 3dpm s PHE 498 N 1.41 2.09 0.00 4.23 0.40 -1.00 -2.01 117.98 123.10 3dpm s PHE 498 Ca 0.03 -0.58 0.00 0.00 -0.60 0.00 0.00 56.93 55.78 3dpm s PHE 498 Cb -0.15 -1.13 0.00 0.00 0.51 0.00 0.00 43.02 42.24 3dpm s PHE 498 CO -0.04 0.43 0.00 0.45 0.70 0.00 0.00 175.22 176.76 3dpm n SER 499 N -0.62 0.00 -0.31 1.36 2.88 -1.18 -0.43 113.62 115.31 3dpm n SER 499 Ca -0.06 0.00 0.34 0.00 -1.33 0.00 0.00 58.87 57.83 3dpm n SER 499 Cb 0.63 0.00 0.58 0.00 -0.75 0.00 0.00 64.21 64.67 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 -2.45 1.83 -0.01 0.00 0.00 0.43 -1.00 120.51 119.30 3dpm n ALA 501 Ca 0.27 -0.03 -0.21 0.00 0.00 0.00 0.00 53.44 53.47 3dpm n ALA 501 Cb 1.55 -1.33 -0.13 0.00 0.00 0.00 0.00 19.45 19.54 3dpm n ALA 501 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3dpm h ASP 502 N 0.00 0.32 -0.52 0.00 3.32 -1.26 -3.39 116.42 114.88 3dpm h ASP 502 Ca 0.00 -0.82 -0.03 0.00 0.02 0.00 0.00 57.03 56.20 3dpm h ASP 502 Cb 0.36 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 3dpm h ASP 502 CO 0.00 1.66 0.19 -0.26 -1.72 0.00 0.00 179.24 179.11 3dpm h PHE 503 N -0.33 0.81 -0.05 4.55 0.05 -1.09 -2.86 116.94 118.02 3dpm h PHE 503 Ca -0.35 -0.07 0.03 0.00 3.82 0.00 0.00 57.97 61.41 3dpm h PHE 503 Cb 1.75 -0.24 -0.06 0.00 2.00 0.00 0.00 35.95 39.40 3dpm h PHE 503 CO 0.11 0.68 -0.42 0.35 -0.18 0.00 0.00 178.31 178.85 3dpm h PHE 504 N 0.71 -1.20 0.00 -0.55 3.57 -1.27 -0.44 116.94 117.76 3dpm h PHE 504 Ca 0.17 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.65 3dpm h PHE 504 Cb 0.23 0.53 -0.01 0.00 2.79 0.00 0.00 35.95 39.50 3dpm h PHE 504 CO 0.01 -0.49 -0.31 -1.00 -2.23 0.00 0.00 178.31 174.29 3dpm h PRO 505 N -0.55 0.00 -0.21 6.41 0.13 -1.76 -2.73 132.00 133.30 3dpm h PRO 505 Ca 0.06 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.18 3dpm h PRO 505 Cb 0.64 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.76 3dpm h PRO 505 CO -0.35 0.31 0.11 0.28 -0.23 0.00 0.00 178.00 178.12 3dpm h VAL 506 N 0.00 1.12 -0.46 1.56 2.07 -1.06 0.87 116.25 120.36 3dpm h VAL 506 Ca -0.00 -0.33 -0.06 0.00 0.82 0.00 0.00 66.70 67.12 3dpm h VAL 506 Cb 0.70 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 3dpm h VAL 506 CO 0.04 0.12 0.05 0.58 0.02 0.00 0.00 177.57 178.37 3dpm h VAL 507 N 0.22 1.25 -0.09 2.57 2.07 -1.02 0.48 116.25 121.72 3dpm h VAL 507 Ca 0.07 -0.96 -0.17 0.00 0.82 0.00 0.00 66.70 66.46 3dpm h VAL 507 Cb 0.09 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3dpm h VAL 507 CO -0.01 0.34 -0.66 -0.07 0.02 0.00 0.00 177.57 177.18 3dpm h LEU 508 N 0.64 0.41 0.13 2.57 3.38 -1.44 -2.65 115.31 118.34 3dpm h LEU 508 Ca 0.14 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3dpm h LEU 508 Cb 0.43 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3dpm h LEU 508 CO 0.01 0.96 -0.06 0.50 0.09 0.00 0.00 178.44 179.94 3dpm h LYS 509 N 0.25 -0.16 0.00 1.13 3.64 -0.69 0.17 116.57 120.91 3dpm h LYS 509 Ca -0.02 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3dpm h LYS 509 Cb 1.21 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 33.06 3dpm h LYS 509 CO 0.11 0.29 -0.03 -0.44 -2.27 0.00 0.00 179.45 177.11 3dpm h ASP 510 N -0.73 0.00 -0.54 4.20 3.32 -0.97 -1.30 116.42 120.40 3dpm h ASP 510 Ca -0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3dpm h ASP 510 Cb 0.53 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3dpm h ASP 510 CO 0.03 0.03 0.00 0.59 -1.72 0.00 0.00 179.24 178.17 3dpm n ASN 511 N -3.23 3.60 -3.82 6.45 3.02 -1.00 -4.97 115.26 115.31 3dpm n ASN 511 Ca -0.01 -1.98 -0.25 0.00 -0.03 0.00 0.00 54.58 52.30 3dpm n ASN 511 Cb 0.20 -0.35 0.02 0.00 -0.61 0.00 0.00 39.78 39.04 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 1.43 -2.44 -0.06 6.41 10.43 -0.49 -4.89 116.55 126.95 3dpm n ASP 512 Ca 0.21 -0.83 -0.03 0.00 2.57 0.00 0.00 54.79 56.70 3dpm n ASP 512 Cb 0.58 -3.84 -0.16 0.00 1.84 0.00 0.00 41.12 39.55 3dpm n ASP 512 CO 0.00 0.00 0.00 -1.14 -1.07 0.00 0.00 177.20 174.99 3dpm n ARG 513 N -4.44 0.67 -3.91 -1.24 0.00 0.55 -5.03 116.66 103.27 3dpm n ARG 513 Ca -0.17 -0.03 -0.09 0.00 -0.00 0.00 0.00 57.85 57.56 3dpm n ARG 513 Cb 0.62 -1.55 -0.08 0.00 0.00 0.00 0.00 32.46 31.45 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 -2.83 -0.08 -0.22 5.13 0.00 -1.16 -4.26 121.76 118.34 3dpm s ALA 514 Ca -0.09 -0.75 -0.22 0.00 0.00 0.00 0.00 51.96 50.91 3dpm s ALA 514 Cb 0.09 0.52 -0.02 0.00 0.00 0.00 0.00 23.12 23.71 3dpm s ALA 514 CO 0.85 -0.51 0.70 -1.17 0.00 0.00 0.00 175.76 175.64 3dpm s LEU 515 N -2.89 4.11 -0.16 0.00 1.98 0.06 -4.61 118.68 117.17 3dpm s LEU 515 Ca 0.07 0.89 -0.15 0.00 -2.89 0.00 0.00 54.13 52.05 3dpm s LEU 515 Cb 0.05 -2.99 -0.04 0.00 0.66 0.00 0.00 46.19 43.86 3dpm s LEU 515 CO -0.09 -0.38 0.35 -0.63 -1.89 0.00 0.00 176.35 173.71 3dpm s ILE 516 N 2.35 5.26 0.00 6.68 1.09 -1.26 -0.45 121.20 134.88 3dpm s ILE 516 Ca 0.31 0.65 0.02 0.00 -1.10 0.00 0.00 60.65 60.52 3dpm s ILE 516 Cb -0.16 -3.68 -0.01 0.00 -1.06 0.00 0.00 42.46 37.55 3dpm s ILE 516 CO 0.09 0.35 -0.07 -0.69 -0.10 0.00 0.00 174.94 174.52 3dpm s VAL 517 N 0.68 0.51 0.00 2.92 1.01 0.46 -0.45 120.40 125.53 3dpm s VAL 517 Ca 0.19 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.76 3dpm s VAL 517 Cb -0.14 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.79 3dpm s VAL 517 CO 0.06 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.82 3dpm n GLY 518 N 2.68 0.38 3.13 4.51 0.00 -1.04 -0.45 105.19 114.40 3dpm n GLY 518 Ca -0.15 -1.17 -0.16 0.00 0.00 0.00 0.00 46.02 44.55 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 0.87 0.13 2.61 -4.23 -1.02 -0.08 115.64 113.92 3dpm s THR 519 Ca 0.00 -1.27 -0.29 0.00 -1.18 0.00 0.00 61.69 58.95 3dpm s THR 519 Cb 0.00 -0.94 -0.16 0.00 1.34 0.00 0.00 72.50 72.73 3dpm s THR 519 CO 0.00 -0.34 0.61 -1.14 -0.54 0.00 0.00 174.62 173.21 3dpm n ARG 520 N 1.23 0.00 -1.80 3.99 0.63 -1.26 -3.37 116.66 116.09 3dpm n ARG 520 Ca -0.21 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.43 3dpm n ARG 520 Cb 0.55 -1.04 0.09 0.00 0.45 0.00 0.00 32.46 32.51 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 -0.67 2.40 0.46 5.15 -4.23 -0.81 -3.06 115.64 114.87 3dpm s THR 521 Ca 0.65 0.13 0.14 0.00 -1.18 0.00 0.00 61.69 61.43 3dpm s THR 521 Cb -0.93 -3.06 0.30 0.00 1.34 0.00 0.00 72.50 70.15 3dpm s THR 521 CO 0.52 -0.17 2.05 0.00 -0.54 0.00 0.00 174.62 176.48 3dpm h ALA 522 N -1.06 1.97 -0.84 3.99 0.00 -1.53 -3.39 119.26 118.39 3dpm h ALA 522 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3dpm h ALA 522 Cb 1.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3dpm h ALA 522 CO 0.64 -0.03 0.00 0.41 0.00 0.00 0.00 179.25 180.27 3dpm n GLY 523 N -1.52 0.93 3.21 0.00 0.00 -1.26 -4.57 105.19 101.97 3dpm n GLY 523 Ca 0.04 -0.63 -0.44 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.18 4.61 -3.41 4.61 0.00 -1.26 -0.40 120.51 122.48 3dpm n ALA 524 Ca 0.00 -4.66 -0.44 0.00 0.00 0.00 0.00 53.44 48.33 3dpm n ALA 524 Cb 0.45 -2.50 -0.05 0.00 0.00 0.00 0.00 19.45 17.35 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 0.31 2.36 0.00 0.00 0.00 -1.26 -3.13 107.32 105.60 3dpm s GLY 525 Ca 0.32 -2.94 0.00 0.00 0.00 0.00 0.00 44.72 42.11 3dpm s GLY 525 CO -0.00 1.20 0.00 0.61 0.00 0.00 0.00 173.10 174.90 3dpm n GLY 526 N 4.47 3.70 3.80 0.20 0.00 -1.26 -2.40 105.19 113.70 3dpm n GLY 526 Ca 0.01 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 3dpm n GLY 526 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3dpm s PHE 527 N -1.29 3.07 0.24 1.61 -0.12 -1.26 -4.81 117.98 115.42 3dpm s PHE 527 Ca 0.00 1.59 0.03 0.00 -0.05 0.00 0.00 56.93 58.50 3dpm s PHE 527 Cb 0.00 -3.03 -0.03 0.00 -0.63 0.00 0.00 43.02 39.32 3dpm s PHE 527 CO 0.00 -0.69 0.39 0.08 -0.05 0.00 0.00 175.22 174.95 3dpm s VAL 528 N -1.99 5.23 -0.11 -2.49 1.01 -1.26 0.34 120.40 121.13 3dpm s VAL 528 Ca 0.66 -0.74 -0.09 0.00 0.00 0.00 0.00 61.98 61.81 3dpm s VAL 528 Cb -0.15 -3.82 0.03 0.00 0.00 0.00 0.00 36.38 32.43 3dpm s VAL 528 CO 0.19 -0.31 0.27 0.72 0.00 0.00 0.00 175.10 175.97 3dpm s PHE 529 N -1.99 -0.32 -0.01 5.22 -0.12 0.00 -4.83 117.98 115.93 3dpm s PHE 529 Ca 0.36 0.77 -0.01 0.00 -0.05 0.00 0.00 56.93 58.00 3dpm s PHE 529 Cb -0.10 0.10 -0.04 0.00 -0.63 0.00 0.00 43.02 42.35 3dpm s PHE 529 CO 0.30 -0.17 0.07 -0.80 -0.05 0.00 0.00 175.22 174.58 3dpm s ASN 530 N 0.41 5.65 -0.09 1.98 0.01 -1.26 -0.94 114.94 120.71 3dpm s ASN 530 Ca -0.02 0.15 0.03 0.00 -0.71 0.00 0.00 52.86 52.31 3dpm s ASN 530 Cb -0.04 -1.62 0.01 0.00 0.41 0.00 0.00 41.25 40.01 3dpm s ASN 530 CO -0.02 0.28 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.99 3dpm s VAL 531 N -1.17 1.53 0.05 1.60 1.01 -0.12 -4.97 120.40 118.32 3dpm s VAL 531 Ca 0.22 -0.70 0.09 0.00 0.00 0.00 0.00 61.98 61.59 3dpm s VAL 531 Cb -0.12 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 3dpm s VAL 531 CO 0.13 0.44 -0.25 -1.10 0.00 0.00 0.00 175.10 174.32 3dpm s GLN 532 N 0.61 1.82 -0.16 2.72 1.11 -1.26 -1.89 119.66 122.60 3dpm s GLN 532 Ca -0.15 -1.11 -0.24 0.00 0.01 0.00 0.00 55.36 53.88 3dpm s GLN 532 Cb -0.16 -2.01 0.06 0.00 -1.01 0.00 0.00 33.01 29.89 3dpm s GLN 532 CO 0.05 0.51 0.62 -0.59 0.01 0.00 0.00 175.29 175.89 3dpm s PHE 533 N -0.84 -0.64 0.26 0.91 -0.12 -1.26 -5.09 117.98 111.20 3dpm s PHE 533 Ca 0.12 1.39 -0.30 0.00 -0.05 0.00 0.00 56.93 58.10 3dpm s PHE 533 Cb -0.10 0.28 -0.10 0.00 -0.63 0.00 0.00 43.02 42.46 3dpm s PHE 533 CO 0.03 -0.42 1.41 -1.25 -0.05 0.00 0.00 175.22 174.94 3dpm s PRO 534 N -0.28 4.28 0.13 1.99 0.04 -1.26 -4.93 135.00 134.98 3dpm s PRO 534 Ca -0.05 2.29 -0.25 0.00 0.04 0.00 0.00 61.00 63.03 3dpm s PRO 534 Cb -0.03 -3.10 0.07 0.00 0.04 0.00 0.00 34.50 31.47 3dpm s PRO 534 CO 0.04 -0.38 0.88 0.54 0.04 0.00 0.00 177.00 178.12 3dpm s ASN 535 N 0.20 -0.27 -0.20 6.66 2.20 -1.26 -5.04 114.94 117.23 3dpm s ASN 535 Ca 0.57 -0.30 0.15 0.00 -0.94 0.00 0.00 52.86 52.34 3dpm s ASN 535 Cb -0.41 0.51 0.52 0.00 -2.00 0.00 0.00 41.25 39.86 3dpm s ASN 535 CO 0.45 -0.90 1.43 0.54 -2.94 0.00 0.00 177.10 175.68 3dpm n ARG 536 N -0.41 2.60 0.00 3.55 5.12 -1.26 -4.31 116.66 121.95 3dpm n ARG 536 Ca -0.07 -2.91 0.10 0.00 -1.93 0.00 0.00 57.85 53.04 3dpm n ARG 536 Cb 0.61 -1.83 0.03 0.00 -1.16 0.00 0.00 32.46 30.11 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 -0.70 0.00 -0.80 0.55 -1.04 -1.26 -4.97 114.28 106.05 3dpm n THR 537 Ca 0.24 -0.39 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 3dpm n THR 537 Cb 0.92 1.30 0.00 0.00 -1.82 0.00 0.00 70.33 70.73 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 1.20 0.56 3.70 3.41 0.00 -1.26 -4.74 105.19 108.06 3dpm n GLY 538 Ca 0.09 -0.39 -0.42 0.00 0.00 0.00 0.00 46.02 45.30 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 4.35 -0.22 -0.61 1.01 -1.26 -0.08 121.20 122.39 3dpm s ILE 539 Ca 0.00 1.68 -0.15 0.00 0.00 0.00 0.00 60.65 62.18 3dpm s ILE 539 Cb 0.00 -4.08 -0.09 0.00 0.01 0.00 0.00 42.46 38.31 3dpm s ILE 539 CO 0.00 0.07 -0.34 1.17 0.00 0.00 0.00 174.94 175.84 3dpm n LYS 540 N 4.49 0.53 -3.82 2.79 4.81 -0.35 -4.79 118.16 121.84 3dpm n LYS 540 Ca 0.09 0.22 -0.12 0.00 -0.87 0.00 0.00 58.31 57.63 3dpm n LYS 540 Cb 0.47 -1.41 -0.13 0.00 0.02 0.00 0.00 35.03 33.98 3dpm n LYS 540 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 3dpm s THR 541 N -2.67 -0.00 -0.19 3.15 2.01 -1.11 -4.55 115.64 112.28 3dpm s THR 541 Ca -0.32 0.01 0.01 0.00 0.31 0.00 0.00 61.69 61.70 3dpm s THR 541 Cb 0.09 -0.22 0.03 0.00 0.01 0.00 0.00 72.50 72.41 3dpm s THR 541 CO 0.44 0.00 -0.16 0.00 -0.69 0.00 0.00 174.62 174.22 3dpm s SER 543 N 1.33 6.07 0.08 0.00 1.04 -0.81 -0.95 113.70 120.46 3dpm s SER 543 Ca 0.02 0.33 0.02 0.00 0.48 0.00 0.00 55.95 56.79 3dpm s SER 543 Cb -0.15 -1.88 -0.04 0.00 0.10 0.00 0.00 66.02 64.06 3dpm s SER 543 CO -0.10 0.34 -0.06 -0.76 0.98 0.00 0.00 173.24 173.63 3dpm s LEU 544 N -1.37 2.45 -0.17 2.42 1.43 -0.11 -2.75 118.68 120.58 3dpm s LEU 544 Ca 0.19 -0.90 -0.20 0.00 -1.03 0.00 0.00 54.13 52.19 3dpm s LEU 544 Cb -0.12 -0.07 -0.03 0.00 0.03 0.00 0.00 46.19 46.00 3dpm s LEU 544 CO 0.09 -0.42 0.60 -0.89 0.23 0.00 0.00 176.35 175.96 3dpm s THR 545 N -3.15 5.06 -2.57 5.49 2.01 -1.26 -0.82 115.64 120.40 3dpm s THR 545 Ca 0.06 1.15 0.23 0.00 0.31 0.00 0.00 61.69 63.45 3dpm s THR 545 Cb 0.02 -3.92 0.38 0.00 0.01 0.00 0.00 72.50 68.99 3dpm s THR 545 CO -0.04 0.17 1.41 0.61 -0.69 0.00 0.00 174.62 176.08 3dpm n GLY 546 N 3.65 1.23 3.46 4.40 0.00 0.15 -2.29 105.19 115.79 3dpm n GLY 546 Ca -0.03 -0.66 -0.09 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.65 -0.07 -0.26 1.61 1.04 -1.25 -3.50 113.70 109.62 3dpm s SER 547 Ca 0.35 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.96 3dpm s SER 547 Cb 0.21 0.51 0.07 0.00 0.10 0.00 0.00 66.02 66.92 3dpm s SER 547 CO 0.31 -1.01 0.01 -0.22 0.98 0.00 0.00 173.24 173.31 3dpm s LEU 548 N -2.97 2.52 0.43 2.42 0.20 -0.46 -4.23 118.68 116.60 3dpm s LEU 548 Ca 0.18 -1.34 -0.24 0.00 0.69 0.00 0.00 54.13 53.42 3dpm s LEU 548 Cb 0.01 -1.06 -0.08 0.00 -0.43 0.00 0.00 46.19 44.63 3dpm s LEU 548 CO 0.03 -0.31 1.15 0.00 -0.29 0.00 0.00 176.35 176.93 3dpm s ALA 549 N 1.46 3.05 -0.02 5.97 0.00 -1.01 -1.06 121.76 130.17 3dpm s ALA 549 Ca 0.00 0.92 0.02 0.00 0.00 0.00 0.00 51.96 52.90 3dpm s ALA 549 Cb -0.18 -3.37 0.01 0.00 0.00 0.00 0.00 23.12 19.58 3dpm s ALA 549 CO -0.11 -0.56 -0.05 0.08 0.00 0.00 0.00 175.76 175.12 3dpm s VAL 550 N -1.51 0.49 0.57 0.00 1.01 0.57 -2.79 120.40 118.73 3dpm s VAL 550 Ca 0.60 -0.20 -0.07 0.00 0.00 0.00 0.00 61.98 62.31 3dpm s VAL 550 Cb -0.29 -0.46 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 3dpm s VAL 550 CO 0.35 0.17 0.91 -0.13 0.00 0.00 0.00 175.10 176.40 3dpm s ARG 551 N 0.26 3.29 0.20 2.72 0.52 0.68 -1.67 118.95 124.95 3dpm s ARG 551 Ca -0.03 0.28 -0.12 0.00 -0.52 0.00 0.00 55.73 55.34 3dpm s ARG 551 Cb -0.07 -2.24 0.24 0.00 0.52 0.00 0.00 34.95 33.39 3dpm s ARG 551 CO -0.00 -0.52 1.25 0.39 0.02 0.00 0.00 175.30 176.44 3dpm n GLU 552 N -2.54 -0.16 -0.01 3.54 1.02 -1.26 -0.17 120.64 121.06 3dpm n GLU 552 Ca 0.04 1.25 0.02 0.00 -0.02 0.00 0.00 57.16 58.45 3dpm n GLU 552 Cb 0.56 -1.85 0.13 0.00 -0.02 0.00 0.00 31.44 30.26 3dpm n GLU 552 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3dpm n HIS 553 N -5.22 0.03 0.00 -0.32 8.25 -1.26 -4.91 115.22 111.79 3dpm n HIS 553 Ca 0.09 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 3dpm n HIS 553 Cb 0.34 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.45 3dpm n HIS 553 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dpm n GLY 554 N 0.60 3.08 3.74 -1.41 0.00 0.76 -5.07 105.19 106.90 3dpm n GLY 554 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.80 3.62 0.51 4.61 0.00 -1.26 -4.61 121.76 121.82 3dpm s ALA 555 Ca 0.00 1.30 -0.15 0.00 0.00 0.00 0.00 51.96 53.11 3dpm s ALA 555 Cb 0.00 -3.55 -0.07 0.00 0.00 0.00 0.00 23.12 19.50 3dpm s ALA 555 CO 0.00 -0.72 0.95 -0.06 0.00 0.00 0.00 175.76 175.93 3dpm s PHE 556 N 0.03 3.48 -0.16 0.00 0.40 -1.26 -0.23 117.98 120.23 3dpm s PHE 556 Ca 0.59 1.37 0.06 0.00 -0.60 0.00 0.00 56.93 58.34 3dpm s PHE 556 Cb -0.41 -2.72 -0.23 0.00 0.51 0.00 0.00 43.02 40.17 3dpm s PHE 556 CO 0.42 -0.36 0.19 -0.89 0.70 0.00 0.00 175.22 175.28 3dpm n ILE 557 N -1.67 1.57 -1.68 0.64 5.41 -1.12 -4.66 119.36 117.86 3dpm n ILE 557 Ca 0.06 -0.71 -0.56 0.00 1.00 0.00 0.00 62.75 62.54 3dpm n ILE 557 Cb 0.54 -1.21 -0.07 0.00 -0.71 0.00 0.00 39.64 38.20 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 -3.16 1.18 0.00 0.38 4.07 -1.25 -0.84 120.64 121.02 3dpm n GLU 558 Ca -0.33 0.43 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 3dpm n GLU 558 Cb 1.06 -2.11 0.00 0.00 -0.06 0.00 0.00 31.44 30.33 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 4.58 0.00 -0.01 4.31 3.02 0.47 -4.67 115.26 122.96 3dpm n ASN 559 Ca 0.24 0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.58 3dpm n ASN 559 Cb 0.15 -0.03 -0.14 0.00 -0.61 0.00 0.00 39.78 39.16 3dpm n ASN 559 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3dpm h ILE 560 N 0.00 1.02 -0.62 2.41 1.08 -1.56 -3.45 117.51 116.39 3dpm h ILE 560 Ca 0.00 -2.37 0.00 0.00 -0.39 0.00 0.00 64.86 62.10 3dpm h ILE 560 Cb 0.00 2.67 0.00 0.00 -3.07 0.00 0.00 36.82 36.42 3dpm h ILE 560 CO 0.00 0.67 0.00 0.61 -0.69 0.00 0.00 178.15 178.74 3dpm n GLY 561 N 1.72 -1.09 3.36 5.37 0.00 -0.02 -4.75 105.19 109.78 3dpm n GLY 561 Ca -0.26 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.24 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 3.22 0.16 1.61 1.01 -1.26 -4.90 120.40 120.25 3dpm s VAL 562 Ca 0.00 -0.58 -0.27 0.00 0.00 0.00 0.00 61.98 61.13 3dpm s VAL 562 Cb 0.00 -2.40 -0.08 0.00 0.00 0.00 0.00 36.38 33.90 3dpm s VAL 562 CO 0.00 0.49 0.84 -1.83 0.00 0.00 0.00 175.10 174.60 3dpm s GLU 563 N 0.74 4.65 0.66 2.72 1.03 -1.26 -1.93 118.70 125.31 3dpm s GLU 563 Ca -0.04 1.26 -0.11 0.00 0.03 0.00 0.00 54.97 56.11 3dpm s GLU 563 Cb -0.15 -3.29 -0.02 0.00 -0.80 0.00 0.00 34.13 29.87 3dpm s GLU 563 CO 0.02 0.49 1.05 -1.25 -1.33 0.00 0.00 175.26 174.24 3dpm s PRO 564 N -0.91 3.27 0.15 -4.83 0.04 -1.26 -4.96 135.00 126.50 3dpm s PRO 564 Ca 0.39 0.69 -0.13 0.00 0.04 0.00 0.00 61.00 61.99 3dpm s PRO 564 Cb -0.24 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.28 3dpm s PRO 564 CO 0.28 -0.79 1.63 0.45 0.04 0.00 0.00 177.00 178.60 3dpm h HIS 565 N -0.48 0.91 -3.31 0.56 3.86 -1.15 -3.41 115.15 112.13 3dpm h HIS 565 Ca -0.44 -0.13 -0.64 0.00 -1.16 0.00 0.00 60.37 57.99 3dpm h HIS 565 Cb 1.21 -0.25 -0.36 0.00 1.06 0.00 0.00 27.41 29.08 3dpm h HIS 565 CO 0.60 0.83 -0.83 0.42 0.86 0.00 0.00 177.93 179.81 3dpm s ILE 566 N -5.16 1.85 -0.18 2.45 -1.09 -1.01 -5.04 121.20 113.03 3dpm s ILE 566 Ca -0.13 -1.01 -0.29 0.00 -2.23 0.00 0.00 60.65 56.99 3dpm s ILE 566 Cb 0.12 -1.81 -0.01 0.00 -1.58 0.00 0.00 42.46 39.18 3dpm s ILE 566 CO 0.81 0.32 1.28 -0.62 -1.23 0.00 0.00 174.94 175.50 3dpm s ASP 567 N 1.33 6.90 -0.40 3.58 -1.08 -1.26 -2.50 116.67 123.25 3dpm s ASP 567 Ca 0.01 1.65 0.02 0.00 -0.52 0.00 0.00 52.55 53.71 3dpm s ASP 567 Cb -0.15 -2.54 0.15 0.00 -1.46 0.00 0.00 42.92 38.93 3dpm s ASP 567 CO -0.10 -0.80 0.28 -0.22 0.52 0.00 0.00 175.17 174.85 3dpm s LEU 568 N 3.62 1.43 0.77 -1.34 0.20 0.89 -4.89 118.68 119.36 3dpm s LEU 568 Ca 0.55 -2.69 -0.12 0.00 0.69 0.00 0.00 54.13 52.57 3dpm s LEU 568 Cb -0.21 -0.50 0.06 0.00 -0.43 0.00 0.00 46.19 45.10 3dpm s LEU 568 CO 0.16 -0.23 1.15 -2.16 -0.29 0.00 0.00 176.35 174.97 3dpm s PRO 569 N 0.46 2.28 0.08 0.98 0.04 -1.26 -4.39 135.00 133.20 3dpm s PRO 569 Ca 0.25 0.24 -0.24 0.00 0.04 0.00 0.00 61.00 61.30 3dpm s PRO 569 Cb -0.10 -1.97 -0.06 0.00 0.04 0.00 0.00 34.50 32.40 3dpm s PRO 569 CO -0.09 -1.40 0.74 -0.06 0.04 0.00 0.00 177.00 176.22 3dpm s PHE 570 N -3.49 3.79 0.58 0.56 2.99 -1.26 -4.93 117.98 116.21 3dpm s PHE 570 Ca 0.61 1.48 0.01 0.00 0.00 0.00 0.00 56.93 59.02 3dpm s PHE 570 Cb -0.11 -2.76 0.05 0.00 0.00 0.00 0.00 43.02 40.20 3dpm s PHE 570 CO 0.50 0.38 0.82 0.95 -0.00 0.00 0.00 175.22 177.87 3dpm s THR 571 N -0.47 2.56 0.22 0.64 -4.23 -1.26 -0.41 115.64 112.68 3dpm s THR 571 Ca 0.36 -0.64 -0.09 0.00 -1.18 0.00 0.00 61.69 60.14 3dpm s THR 571 Cb -0.21 -2.91 0.18 0.00 1.34 0.00 0.00 72.50 70.90 3dpm s THR 571 CO 0.23 0.00 1.86 0.00 -0.54 0.00 0.00 174.62 176.17 3dpm h ALA 572 N -0.05 1.05 -0.74 3.99 0.00 -1.96 -2.55 119.26 119.00 3dpm h ALA 572 Ca -0.41 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 3dpm h ALA 572 Cb 1.29 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 3dpm h ALA 572 CO 0.50 0.52 0.36 -0.91 0.00 0.00 0.00 179.25 179.72 3dpm h ASN 573 N 1.13 0.96 -0.28 0.00 2.35 -1.98 0.69 115.58 118.46 3dpm h ASN 573 Ca 0.29 -0.13 0.03 0.00 -0.55 0.00 0.00 56.30 55.95 3dpm h ASN 573 Cb -0.03 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.06 3dpm h ASN 573 CO -0.05 0.82 0.08 0.44 -1.65 0.00 0.00 177.43 177.07 3dpm h ASP 574 N 1.04 0.07 0.02 5.81 3.32 -1.85 -3.11 116.42 121.72 3dpm h ASP 574 Ca 0.25 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.34 3dpm h ASP 574 Cb 0.11 0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3dpm h ASP 574 CO -0.03 0.07 -0.01 0.40 -1.72 0.00 0.00 179.24 177.95 3dpm h ILE 575 N 0.19 1.47 -0.96 0.35 2.04 -1.26 -0.91 117.51 118.44 3dpm h ILE 575 Ca 0.12 -1.85 0.27 0.00 1.00 0.00 0.00 64.86 64.40 3dpm h ILE 575 Cb 0.11 2.66 -0.05 0.00 -0.74 0.00 0.00 36.82 38.80 3dpm h ILE 575 CO -0.14 0.45 0.67 -0.09 0.00 0.00 0.00 178.15 179.04 3dpm h ARG 576 N -0.87 0.10 -0.10 2.37 2.43 0.33 -0.24 114.38 118.41 3dpm h ARG 576 Ca -0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3dpm h ARG 576 Cb 0.76 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 3dpm h ARG 576 CO 0.00 0.07 0.00 0.66 -1.51 0.00 0.00 179.97 179.19 3dpm n TYR 577 N -4.33 0.12 -2.46 2.20 0.53 -1.18 -4.64 117.16 107.41 3dpm n TYR 577 Ca 0.20 -0.18 -0.13 0.00 -1.02 0.00 0.00 57.90 56.78 3dpm n TYR 577 Cb 0.96 -0.01 -0.01 0.00 -1.03 0.00 0.00 39.34 39.25 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 0.38 -2.23 -0.02 -0.72 5.02 -0.10 -4.83 118.16 115.66 3dpm n LYS 578 Ca 0.06 0.62 0.07 0.00 -2.02 0.00 0.00 58.31 57.05 3dpm n LYS 578 Cb 0.26 -5.23 -0.15 0.00 -0.02 0.00 0.00 35.03 29.89 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 -0.83 -0.88 3.07 0.72 0.00 -0.87 -4.85 105.19 101.55 3dpm n GLY 579 Ca -0.15 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.23 -1.73 0.19 1.61 4.02 -0.40 -4.78 117.16 113.85 3dpm n TYR 580 Ca -0.07 0.22 0.04 0.00 -0.01 0.00 0.00 57.90 58.08 3dpm n TYR 580 Cb 0.57 -1.64 0.36 0.00 -0.02 0.00 0.00 39.34 38.61 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 -0.33 0.00 0.90 7.72 4.64 -1.89 -0.11 113.55 124.49 3dpm h SER 581 Ca -0.22 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.94 3dpm h SER 581 Cb 1.15 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.22 3dpm h SER 581 CO 0.31 0.38 -0.77 -0.33 -0.87 0.00 0.00 176.83 175.56 3dpm h GLU 582 N 0.00 0.00 0.00 4.77 5.08 -1.94 -0.44 114.58 122.05 3dpm h GLU 582 Ca -0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 3dpm h GLU 582 Cb 0.75 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.01 3dpm h GLU 582 CO 0.05 0.77 -0.34 -0.92 -1.00 0.00 0.00 179.01 177.56 3dpm h TYR 583 N 0.00 0.34 -0.28 4.33 3.20 -1.84 -2.78 116.97 119.93 3dpm h TYR 583 Ca -0.01 -0.19 -0.12 0.00 3.14 0.00 0.00 58.73 61.56 3dpm h TYR 583 Cb 1.43 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.65 3dpm h TYR 583 CO 0.00 1.00 -0.32 -0.07 -1.64 0.00 0.00 178.16 177.13 3dpm h LEU 584 N -0.42 0.61 -0.96 2.82 3.38 -1.04 -0.58 115.31 119.13 3dpm h LEU 584 Ca -0.04 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 3dpm h LEU 584 Cb 1.10 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 3dpm h LEU 584 CO 0.07 0.89 0.24 0.44 0.09 0.00 0.00 178.44 180.17 3dpm h ASP 585 N 0.51 0.92 -0.16 -0.43 3.32 -1.15 0.19 116.42 119.61 3dpm h ASP 585 Ca 0.06 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 56.94 3dpm h ASP 585 Cb 0.80 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 3dpm h ASP 585 CO 0.07 0.84 -0.01 0.50 -1.72 0.00 0.00 179.24 178.91 3dpm h LYS 586 N 0.97 0.29 -0.60 3.56 3.11 -1.18 -2.41 116.57 120.31 3dpm h LYS 586 Ca 0.22 -0.10 0.03 0.00 -2.81 0.00 0.00 60.65 57.99 3dpm h LYS 586 Cb 0.23 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 31.40 3dpm h LYS 586 CO -0.01 0.54 0.37 0.28 -2.81 0.00 0.00 179.45 177.81 3dpm h VAL 587 N 0.02 1.06 -0.80 2.00 2.07 -0.53 -2.35 116.25 117.72 3dpm h VAL 587 Ca 0.04 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 3dpm h VAL 587 Cb 0.41 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 3dpm h VAL 587 CO 0.01 0.13 0.45 0.11 0.02 0.00 0.00 177.57 178.29 3dpm h LYS 588 N 0.72 1.11 -0.05 1.57 1.57 -0.53 -2.04 116.57 118.91 3dpm h LYS 588 Ca 0.24 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3dpm h LYS 588 Cb 0.03 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.12 3dpm h LYS 588 CO -0.11 0.80 0.03 0.87 -0.57 0.00 0.00 179.45 180.47 3dpm h LYS 589 N 1.12 0.07 -0.48 3.15 1.57 -0.93 -1.68 116.57 119.39 3dpm h LYS 589 Ca 0.29 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.12 3dpm h LYS 589 Cb 0.00 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.25 3dpm h LYS 589 CO -0.05 0.15 0.17 -0.07 -0.57 0.00 0.00 179.45 179.08 3dpm h LEU 590 N -0.02 0.17 -0.28 2.94 3.38 -1.22 -1.00 115.31 119.28 3dpm h LEU 590 Ca 0.02 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.06 3dpm h LEU 590 Cb 0.10 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3dpm h LEU 590 CO -0.00 0.12 0.14 0.58 0.09 0.00 0.00 178.44 179.37 3dpm h VAL 591 N 0.34 0.99 -1.00 1.22 2.07 -1.23 -0.53 116.25 118.11 3dpm h VAL 591 Ca 0.23 -0.10 0.08 0.00 0.82 0.00 0.00 66.70 67.73 3dpm h VAL 591 Cb 0.24 0.67 -0.07 0.00 -1.52 0.00 0.00 31.29 30.61 3dpm h VAL 591 CO -0.24 0.05 0.64 0.00 0.02 0.00 0.00 177.57 178.05 3dpm h GLN 593 N 1.10 0.66 -0.43 0.00 4.20 -0.38 -0.54 115.11 119.72 3dpm h GLN 593 Ca 0.45 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.94 3dpm h GLN 593 Cb 0.28 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 3dpm h GLN 593 CO -0.20 0.75 0.20 -0.07 -0.67 0.00 0.00 178.83 178.84 3dpm h LEU 594 N 0.60 0.57 0.91 1.46 3.38 0.63 0.13 115.31 122.99 3dpm h LEU 594 Ca 0.11 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3dpm h LEU 594 Cb 0.53 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.14 3dpm h LEU 594 CO 0.03 0.55 -0.44 0.40 0.09 0.00 0.00 178.44 179.08 3dpm h ILE 595 N 0.56 0.00 0.00 1.22 5.03 -0.72 -2.14 117.51 121.45 3dpm h ILE 595 Ca 0.15 -0.11 0.00 0.00 -0.12 0.00 0.00 64.86 64.78 3dpm h ILE 595 Cb 0.14 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.93 3dpm h ILE 595 CO -0.02 0.00 0.00 0.59 -0.68 0.00 0.00 178.15 178.04 3dpm n ASN 596 N -5.58 0.00 -2.12 1.72 5.03 -0.24 -4.81 115.26 109.26 3dpm n ASN 596 Ca -0.15 0.47 -0.05 0.00 0.87 0.00 0.00 54.58 55.72 3dpm n ASN 596 Cb 0.48 -0.47 -0.01 0.00 -1.02 0.00 0.00 39.78 38.76 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 -1.47 -1.85 0.00 6.41 5.15 0.44 -5.05 115.26 118.88 3dpm n ASN 597 Ca 0.01 0.31 0.12 0.00 -0.60 0.00 0.00 54.58 54.42 3dpm n ASN 597 Cb 0.03 -1.76 0.72 0.00 -0.53 0.00 0.00 39.78 38.24 3dpm n ASN 597 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13