#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1twc n GLU 19 N 0.00 -0.93 -3.24 3.97 4.71 -1.26 -4.98 120.64 118.91 1twc n GLU 19 Ca 0.00 0.90 -0.39 0.00 -0.01 0.00 0.00 57.16 57.66 1twc n GLU 19 Cb 0.00 -0.72 -0.06 0.00 -1.01 0.00 0.00 31.44 29.65 1twc n GLU 19 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1twc s ASP 20 N -0.57 6.98 0.05 1.62 2.15 -1.26 -4.88 116.67 120.77 1twc s ASP 20 Ca 0.00 1.17 0.16 0.00 0.43 0.00 0.00 52.55 54.31 1twc s ASP 20 Cb 0.00 -2.36 0.68 0.00 -0.30 0.00 0.00 42.92 40.95 1twc s ASP 20 CO 0.00 0.16 1.51 -1.84 -0.17 0.00 0.00 175.17 174.82 1twc n GLU 21 N 2.44 0.04 -0.08 4.34 0.28 -1.26 -2.29 120.64 124.10 1twc n GLU 21 Ca -0.08 0.29 0.08 0.00 -0.16 0.00 0.00 57.16 57.29 1twc n GLU 21 Cb 0.51 -1.58 0.12 0.00 1.43 0.00 0.00 31.44 31.92 1twc n GLU 21 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1twc n SER 22 N -1.65 2.69 -4.76 -1.84 7.64 -1.26 -0.51 113.62 113.93 1twc n SER 22 Ca 0.03 -1.79 -0.35 0.00 1.01 0.00 0.00 58.87 57.78 1twc n SER 22 Cb 0.18 -0.11 0.03 0.00 -1.01 0.00 0.00 64.21 63.30 1twc n SER 22 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1twc s ALA 23 N -1.26 2.56 0.45 -0.43 0.00 -0.97 -4.80 121.76 117.32 1twc s ALA 23 Ca 0.24 0.80 -0.21 0.00 0.00 0.00 0.00 51.96 52.79 1twc s ALA 23 Cb 0.15 -3.38 -0.10 0.00 0.00 0.00 0.00 23.12 19.80 1twc s ALA 23 CO 0.22 -1.07 1.00 -2.14 0.00 0.00 0.00 175.76 173.77 1twc s PRO 24 N -3.55 4.02 0.67 0.00 0.02 -1.26 -0.39 135.00 134.51 1twc s PRO 24 Ca 0.72 1.27 -0.07 0.00 0.02 0.00 0.00 61.00 62.94 1twc s PRO 24 Cb -0.25 -2.17 0.04 0.00 0.02 0.00 0.00 34.50 32.14 1twc s PRO 24 CO 0.33 -0.23 0.99 0.96 -0.33 0.00 0.00 177.00 178.72 1twc s ILE 25 N -2.03 2.81 0.27 2.83 -0.00 -1.26 -4.52 121.20 119.30 1twc s ILE 25 Ca 0.64 -0.11 0.06 0.00 -0.00 0.00 0.00 60.65 61.24 1twc s ILE 25 Cb -0.14 -3.19 -0.06 0.00 -0.00 0.00 0.00 42.46 39.08 1twc s ILE 25 CO 0.18 -0.20 -0.04 0.42 -0.00 0.00 0.00 174.94 175.29 1twc s THR 26 N -3.19 1.50 0.15 8.37 -4.23 -1.26 -4.90 115.64 112.08 1twc s THR 26 Ca 0.58 -2.10 -0.02 0.00 -1.18 0.00 0.00 61.69 58.98 1twc s THR 26 Cb -0.11 -2.46 0.22 0.00 1.34 0.00 0.00 72.50 71.50 1twc s THR 26 CO 0.46 -0.28 0.79 0.00 -0.54 0.00 0.00 174.62 175.04 1twc n ALA 27 N -0.56 0.18 -0.01 3.99 0.00 -1.26 0.69 120.51 123.55 1twc n ALA 27 Ca -0.05 0.55 0.10 0.00 0.00 0.00 0.00 53.44 54.04 1twc n ALA 27 Cb 0.64 -0.36 0.52 0.00 0.00 0.00 0.00 19.45 20.24 1twc n ALA 27 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1twc h GLU 28 N 0.00 0.35 0.00 0.00 4.57 -1.99 -2.06 114.58 115.44 1twc h GLU 28 Ca 0.27 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.43 1twc h GLU 28 Cb 0.49 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 1twc h GLU 28 CO -0.50 0.23 0.00 -0.44 -1.18 0.00 0.00 179.01 177.12 1twc h ASP 29 N 0.36 0.00 -0.43 1.04 3.32 -0.13 -3.08 116.42 117.50 1twc h ASP 29 Ca 0.20 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.32 1twc h ASP 29 Cb 0.35 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.84 1twc h ASP 29 CO -0.05 0.00 0.10 0.28 -1.72 0.00 0.00 179.24 177.85 1twc h SER 30 N 0.00 0.04 -0.25 6.45 0.02 -1.47 -0.83 113.55 117.51 1twc h SER 30 Ca 0.00 0.07 0.07 0.00 -0.84 0.00 0.00 61.79 61.09 1twc h SER 30 Cb 0.36 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 1twc h SER 30 CO 0.00 0.06 0.20 -0.50 -1.14 0.00 0.00 176.83 175.44 1twc h TRP 31 N 0.24 0.00 -0.50 3.45 4.06 -1.73 -1.04 115.95 120.42 1twc h TRP 31 Ca 0.21 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.08 1twc h TRP 31 Cb 0.25 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.39 1twc h TRP 31 CO -0.20 0.00 -0.02 0.00 -3.56 0.00 0.00 178.44 174.66 1twc h ALA 32 N 1.84 1.01 -0.17 1.49 0.00 -1.32 0.17 119.26 122.29 1twc h ALA 32 Ca 0.12 -0.29 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 1twc h ALA 32 Cb 0.51 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1twc h ALA 32 CO -0.00 0.61 -0.59 0.28 0.00 0.00 0.00 179.25 179.55 1twc h VAL 33 N 0.80 1.31 -0.51 0.00 2.07 -1.07 -2.50 116.25 116.35 1twc h VAL 33 Ca 0.15 -1.82 -0.11 0.00 0.82 0.00 0.00 66.70 65.73 1twc h VAL 33 Cb 0.51 1.97 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 1twc h VAL 33 CO 0.03 0.57 -0.11 0.40 0.02 0.00 0.00 177.57 178.47 1twc h ILE 34 N 0.38 1.27 -0.95 4.57 2.04 -1.20 -1.69 117.51 121.93 1twc h ILE 34 Ca -0.03 -1.26 0.08 0.00 1.00 0.00 0.00 64.86 64.66 1twc h ILE 34 Cb 1.21 1.03 -0.07 0.00 -0.74 0.00 0.00 36.82 38.25 1twc h ILE 34 CO 0.12 0.44 0.61 0.28 0.00 0.00 0.00 178.15 179.61 1twc h SER 35 N 0.84 0.93 -0.05 1.72 0.02 -0.94 -0.03 113.55 116.04 1twc h SER 35 Ca 0.13 0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 60.98 1twc h SER 35 Cb 0.67 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 1twc h SER 35 CO 0.05 0.57 -0.33 0.00 -1.14 0.00 0.00 176.83 175.97 1twc h ALA 36 N 1.51 0.95 -0.70 3.77 0.00 -0.96 -0.38 119.26 123.45 1twc h ALA 36 Ca 0.43 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1twc h ALA 36 Cb 0.29 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1twc h ALA 36 CO -0.18 0.61 0.25 0.35 0.00 0.00 0.00 179.25 180.28 1twc h PHE 37 N 0.46 1.09 0.00 0.00 3.57 -0.15 -2.37 116.94 119.53 1twc h PHE 37 Ca 0.05 -0.10 -0.21 0.00 3.53 0.00 0.00 57.97 61.25 1twc h PHE 37 Cb 0.80 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 39.19 1twc h PHE 37 CO 0.03 0.86 -0.98 0.74 -2.23 0.00 0.00 178.31 176.73 1twc h PHE 38 N 1.01 0.00 -0.85 0.41 -1.00 -0.71 0.56 116.94 116.36 1twc h PHE 38 Ca 0.23 0.00 0.04 0.00 2.81 0.00 0.00 57.97 61.05 1twc h PHE 38 Cb 0.25 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 39.76 1twc h PHE 38 CO 0.02 0.98 0.55 0.00 -1.61 0.00 0.00 178.31 178.25 1twc h ARG 39 N 0.00 1.02 -0.20 1.51 3.08 -1.02 -0.81 114.38 117.96 1twc h ARG 39 Ca -0.01 -0.06 -0.18 0.00 0.07 0.00 0.00 59.98 59.80 1twc h ARG 39 Cb 1.74 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 31.57 1twc h ARG 39 CO 0.13 0.67 -0.56 1.49 -1.07 0.00 0.00 179.97 180.63 1twc h GLU 40 N 1.05 0.74 0.00 0.04 4.81 -1.21 -3.37 114.58 116.64 1twc h GLU 40 Ca 0.35 -0.52 -0.17 0.00 -0.13 0.00 0.00 59.36 58.88 1twc h GLU 40 Cb 0.03 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1twc h GLU 40 CO -0.13 1.14 -2.17 1.63 -0.73 0.00 0.00 179.01 178.76 1twc n LYS 41 N -4.09 0.69 0.00 1.92 5.02 0.17 -5.10 118.16 116.77 1twc n LYS 41 Ca -0.06 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 1twc n LYS 41 Cb 0.63 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1twc n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1twc n GLY 42 N 1.51 0.80 0.02 0.72 0.00 -0.33 -4.00 105.19 103.91 1twc n GLY 42 Ca -0.18 -0.85 0.11 0.00 0.00 0.00 0.00 46.02 45.10 1twc n GLY 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1twc n LEU 43 N 0.00 0.91 -2.15 0.99 4.77 -1.26 -4.47 117.00 115.78 1twc n LEU 43 Ca 0.00 -0.37 -0.08 0.00 -0.03 0.00 0.00 56.01 55.53 1twc n LEU 43 Cb 0.00 -0.07 0.05 0.00 -2.33 0.00 0.00 43.42 41.07 1twc n LEU 43 CO 0.00 0.22 0.11 1.33 -1.33 0.00 0.00 177.39 177.72 1twc n VAL 44 N -1.43 1.70 0.26 4.08 0.24 -1.26 -4.84 118.33 117.08 1twc n VAL 44 Ca 0.05 -3.23 0.12 0.00 -2.04 0.00 0.00 64.34 59.24 1twc n VAL 44 Cb 0.34 0.19 0.71 0.00 -1.47 0.00 0.00 33.84 33.61 1twc n VAL 44 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1twc h SER 45 N 2.10 0.00 -0.61 -1.34 4.64 -1.78 0.43 113.55 116.99 1twc h SER 45 Ca 0.06 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.46 1twc h SER 45 Cb 1.41 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.44 1twc h SER 45 CO 0.37 0.12 0.27 0.06 -0.87 0.00 0.00 176.83 176.78 1twc h GLN 46 N 0.00 0.47 0.32 4.77 3.07 -1.90 0.33 115.11 122.18 1twc h GLN 46 Ca -0.00 -0.03 -0.02 0.00 0.09 0.00 0.00 58.65 58.69 1twc h GLN 46 Cb 0.32 -0.11 0.00 0.00 0.08 0.00 0.00 27.48 27.78 1twc h GLN 46 CO 0.02 0.31 -0.15 1.96 0.09 0.00 0.00 178.83 181.06 1twc h GLN 47 N 0.49 -0.41 -0.41 0.06 1.08 -1.24 -2.96 115.11 111.71 1twc h GLN 47 Ca 0.30 0.03 0.06 0.00 -1.45 0.00 0.00 58.65 57.58 1twc h GLN 47 Cb 0.31 0.09 -0.09 0.00 -0.05 0.00 0.00 27.48 27.75 1twc h GLN 47 CO -0.26 -0.28 -0.52 -0.07 -0.95 0.00 0.00 178.83 176.75 1twc h LEU 48 N -0.54 -1.75 -1.57 1.46 3.38 -1.58 -1.51 115.31 113.20 1twc h LEU 48 Ca -0.04 0.24 0.17 0.00 0.09 0.00 0.00 57.88 58.33 1twc h LEU 48 Cb 0.33 0.73 -0.06 0.00 0.09 0.00 0.00 40.66 41.75 1twc h LEU 48 CO 0.07 -0.40 0.54 0.44 0.09 0.00 0.00 178.44 179.19 1twc h ASP 49 N -0.38 0.39 0.80 -0.43 3.32 -0.42 -0.33 116.42 119.37 1twc h ASP 49 Ca 0.09 0.03 -0.23 0.00 0.02 0.00 0.00 57.03 56.94 1twc h ASP 49 Cb 0.60 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1twc h ASP 49 CO -0.60 0.18 -1.06 -1.28 -1.72 0.00 0.00 179.24 174.76 1twc h SER 50 N 0.40 0.19 0.20 6.45 0.87 -1.28 -2.50 113.55 117.87 1twc h SER 50 Ca 0.41 -0.19 -0.30 0.00 -1.23 0.00 0.00 61.79 60.48 1twc h SER 50 Cb 0.98 -0.06 0.03 0.00 -0.44 0.00 0.00 62.40 62.90 1twc h SER 50 CO -0.14 1.12 -1.24 0.15 -0.53 0.00 0.00 176.83 176.20 1twc h PHE 51 N 0.04 0.94 -0.81 2.24 3.57 -0.20 -2.16 116.94 120.57 1twc h PHE 51 Ca -0.06 -0.60 0.07 0.00 3.53 0.00 0.00 57.97 60.91 1twc h PHE 51 Cb 1.80 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 40.40 1twc h PHE 51 CO 0.03 1.44 0.48 -0.91 -2.23 0.00 0.00 178.31 177.12 1twc h ASN 52 N 0.25 0.72 0.29 0.41 2.35 -1.13 0.67 115.58 119.15 1twc h ASN 52 Ca -0.18 0.03 -0.16 0.00 -0.55 0.00 0.00 56.30 55.44 1twc h ASN 52 Cb 1.92 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 40.16 1twc h ASN 52 CO 0.23 0.45 -0.64 -0.61 -1.65 0.00 0.00 177.43 175.21 1twc h GLN 53 N 0.85 0.33 -0.92 0.81 5.75 -1.47 -1.40 115.11 119.07 1twc h GLN 53 Ca 0.36 -0.24 0.05 0.00 -0.15 0.00 0.00 58.65 58.68 1twc h GLN 53 Cb 0.23 0.04 -0.06 0.00 1.07 0.00 0.00 27.48 28.76 1twc h GLN 53 CO -0.20 0.86 0.58 0.35 -2.65 0.00 0.00 178.83 177.78 1twc h PHE 54 N 0.24 1.09 0.00 3.99 3.57 -0.23 -0.99 116.94 124.62 1twc h PHE 54 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1twc h PHE 54 Cb 1.17 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 39.55 1twc h PHE 54 CO 0.03 0.59 -0.04 0.28 -2.23 0.00 0.00 178.31 176.94 1twc h VAL 55 N 1.09 0.00 -0.20 1.41 2.07 -0.31 -2.44 116.25 117.88 1twc h VAL 55 Ca 0.38 -0.55 0.06 0.00 0.82 0.00 0.00 66.70 67.41 1twc h VAL 55 Cb 0.10 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 1twc h VAL 55 CO -0.15 0.00 0.76 0.44 0.02 0.00 0.00 177.57 178.64 1twc h ASP 56 N -0.55 0.00 0.00 0.57 3.32 -1.42 -3.37 116.42 114.97 1twc h ASP 56 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1twc h ASP 56 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1twc h ASP 56 CO 0.00 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.30 1twc n TYR 57 N -2.86 -1.43 0.30 4.55 4.02 -0.43 -4.87 117.16 116.44 1twc n TYR 57 Ca 0.04 0.25 0.19 0.00 -0.01 0.00 0.00 57.90 58.37 1twc n TYR 57 Cb 0.84 0.80 0.94 0.00 -0.02 0.00 0.00 39.34 41.91 1twc n TYR 57 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 1twc h THR 58 N 0.00 0.00 0.21 -0.72 2.02 -1.23 -1.44 112.91 111.74 1twc h THR 58 Ca 0.00 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1twc h THR 58 Cb 0.00 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 1twc h THR 58 CO 0.00 0.00 -0.10 0.25 0.37 0.00 0.00 175.52 176.04 1twc h LEU 59 N 0.00 -0.23 -0.78 2.58 5.85 -1.61 -2.30 115.31 118.82 1twc h LEU 59 Ca 0.00 -0.11 0.09 0.00 0.84 0.00 0.00 57.88 58.70 1twc h LEU 59 Cb 0.13 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 1twc h LEU 59 CO 0.00 0.27 0.43 -0.61 -0.34 0.00 0.00 178.44 178.19 1twc h GLN 60 N -1.04 0.72 0.00 1.25 5.75 -1.76 0.44 115.11 120.47 1twc h GLN 60 Ca -0.03 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.43 1twc h GLN 60 Cb 0.33 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 28.72 1twc h GLN 60 CO 0.05 0.47 0.00 -0.44 -2.65 0.00 0.00 178.83 176.26 1twc h ASP 61 N 0.74 0.00 0.32 -0.69 5.19 -1.18 -3.13 116.42 117.67 1twc h ASP 61 Ca 0.37 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 56.53 1twc h ASP 61 Cb 0.33 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.85 1twc h ASP 61 CO -0.24 0.00 -1.05 0.40 -3.12 0.00 0.00 179.24 175.23 1twc h ILE 62 N 0.00 1.39 -0.34 0.35 1.08 0.47 -3.03 117.51 117.43 1twc h ILE 62 Ca 0.00 -2.53 0.01 0.00 -0.39 0.00 0.00 64.86 61.95 1twc h ILE 62 Cb 0.20 2.54 -0.02 0.00 -3.07 0.00 0.00 36.82 36.47 1twc h ILE 62 CO 0.00 0.76 0.22 0.40 -0.69 0.00 0.00 178.15 178.84 1twc h ILE 63 N 0.23 1.07 0.00 -0.67 5.03 -1.49 -3.33 117.51 118.35 1twc h ILE 63 Ca -0.11 -0.15 0.00 0.00 -0.12 0.00 0.00 64.86 64.48 1twc h ILE 63 Cb 1.71 0.60 0.00 0.00 -3.03 0.00 0.00 36.82 36.09 1twc h ILE 63 CO 0.19 0.08 -0.99 0.00 -0.68 0.00 0.00 178.15 176.75 1twc s GLU 65 N -3.35 -0.02 0.00 0.00 2.12 -1.15 -4.21 118.70 112.09 1twc s GLU 65 Ca -0.00 0.78 0.00 0.00 0.36 0.00 0.00 54.97 56.11 1twc s GLU 65 Cb 0.10 -1.66 0.00 0.00 0.26 0.00 0.00 34.13 32.82 1twc s GLU 65 CO 0.79 -3.10 0.00 -0.25 -0.54 0.00 0.00 175.26 172.16 1twc n ASP 66 N -4.47 0.00 -0.13 -1.70 8.00 -1.26 -4.77 116.55 112.22 1twc n ASP 66 Ca 0.05 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.47 1twc n ASP 66 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 1twc n ASP 66 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1twc h SER 67 N 0.18 0.47 -2.89 -2.24 0.87 -1.70 -3.46 113.55 104.77 1twc h SER 67 Ca 0.00 -0.02 -0.61 0.00 -1.23 0.00 0.00 61.79 59.93 1twc h SER 67 Cb 0.00 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 61.80 1twc h SER 67 CO 0.00 0.35 -0.51 0.42 -0.53 0.00 0.00 176.83 176.56 1twc s THR 68 N -6.13 5.29 0.02 2.23 -4.23 -1.26 -3.45 115.64 108.10 1twc s THR 68 Ca -0.13 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 1twc s THR 68 Cb 0.11 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.35 1twc s THR 68 CO 0.73 0.11 0.00 0.18 -0.54 0.00 0.00 174.62 175.10 1twc n LEU 69 N 0.19 0.00 -4.02 4.79 4.77 -1.19 -5.03 117.00 116.51 1twc n LEU 69 Ca -0.06 -0.10 -0.32 0.00 -0.03 0.00 0.00 56.01 55.50 1twc n LEU 69 Cb 0.51 0.01 -0.13 0.00 -2.33 0.00 0.00 43.42 41.48 1twc n LEU 69 CO 0.51 -0.10 -0.16 -0.63 -1.33 0.00 0.00 177.39 175.68 1twc s ILE 70 N -0.72 2.86 -0.09 -0.08 1.09 -1.26 -4.83 121.20 118.16 1twc s ILE 70 Ca 0.00 -2.90 -0.10 0.00 -1.10 0.00 0.00 60.65 56.55 1twc s ILE 70 Cb -0.00 -2.97 -0.03 0.00 -1.06 0.00 0.00 42.46 38.40 1twc s ILE 70 CO 0.00 -0.76 -0.19 1.21 -0.10 0.00 0.00 174.94 175.10 1twc n GLU 89 N 3.59 0.29 -2.45 2.79 2.13 0.31 -4.74 120.64 122.56 1twc n GLU 89 Ca 0.05 0.11 -0.02 0.00 0.66 0.00 0.00 57.16 57.96 1twc n GLU 89 Cb 0.36 -0.98 -0.02 0.00 0.27 0.00 0.00 31.44 31.07 1twc n GLU 89 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1twc n ILE 90 N -3.66-13.30 -3.64 6.31 2.08 -1.19 -4.92 119.36 101.04 1twc n ILE 90 Ca -0.08 3.06 -0.19 0.00 0.56 0.00 0.00 62.75 66.10 1twc n ILE 90 Cb 0.28 -6.26 -0.16 0.00 -0.75 0.00 0.00 39.64 32.75 1twc n ILE 90 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 1twc s SER 91 N -0.62 1.15 0.12 4.38 1.04 -0.58 -3.18 113.70 116.01 1twc s SER 91 Ca -0.10 0.07 -0.30 0.00 0.48 0.00 0.00 55.95 56.10 1twc s SER 91 Cb 0.01 0.09 -0.07 0.00 0.10 0.00 0.00 66.02 66.15 1twc s SER 91 CO 0.27 -0.27 1.14 -0.36 0.98 0.00 0.00 173.24 175.00 1twc s PHE 92 N 2.24 3.52 0.00 5.02 0.40 -1.22 -2.97 117.98 124.96 1twc s PHE 92 Ca 0.04 1.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.84 1twc s PHE 92 Cb -0.13 -3.34 0.00 0.00 0.51 0.00 0.00 43.02 40.06 1twc s PHE 92 CO -0.06 -0.90 0.00 0.41 0.70 0.00 0.00 175.22 175.37 1twc n GLY 93 N 2.56 1.04 3.63 4.36 0.00 0.25 -4.81 105.19 112.23 1twc n GLY 93 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1twc n GLY 93 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1twc n LYS 94 N 0.00 -0.05 -4.70 1.61 4.81 -1.26 -4.67 118.16 113.90 1twc n LYS 94 Ca 0.00 0.06 -0.26 0.00 -0.87 0.00 0.00 58.31 57.24 1twc n LYS 94 Cb 0.00 -2.30 -0.14 0.00 0.02 0.00 0.00 35.03 32.60 1twc n LYS 94 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1twc s ILE 95 N -2.29 1.71 0.22 3.15 1.01 -1.26 -3.06 121.20 120.68 1twc s ILE 95 Ca 0.69 -1.19 0.10 0.00 0.00 0.00 0.00 60.65 60.26 1twc s ILE 95 Cb -0.27 -1.48 -0.05 0.00 0.01 0.00 0.00 42.46 40.68 1twc s ILE 95 CO 0.55 0.24 -0.20 -0.31 0.00 0.00 0.00 174.94 175.23 1twc s TYR 96 N -0.77 2.10 -0.10 3.97 1.51 -1.03 -4.99 117.35 118.04 1twc s TYR 96 Ca 0.08 -0.41 -0.00 0.00 -1.01 0.00 0.00 57.07 55.73 1twc s TYR 96 Cb -0.09 -0.98 0.02 0.00 -0.11 0.00 0.00 41.96 40.80 1twc s TYR 96 CO 0.02 0.52 -0.06 0.08 -1.11 0.00 0.00 175.55 174.99 1twc s VAL 97 N -2.24 0.86 0.68 0.71 1.01 -1.26 -3.04 120.40 117.11 1twc s VAL 97 Ca 0.23 -0.20 -0.17 0.00 0.00 0.00 0.00 61.98 61.84 1twc s VAL 97 Cb -0.05 -0.90 -0.01 0.00 0.00 0.00 0.00 36.38 35.42 1twc s VAL 97 CO 0.10 0.33 1.08 0.41 0.00 0.00 0.00 175.10 177.03 1twc n THR 98 N 4.85 3.69 -0.52 3.92 -1.04 -1.12 -5.01 114.28 119.06 1twc n THR 98 Ca -0.13 -0.43 -0.30 0.00 -2.04 0.00 0.00 64.05 61.15 1twc n THR 98 Cb 0.50 -1.24 0.27 0.00 -1.82 0.00 0.00 70.33 68.04 1twc n THR 98 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1twc s LYS 99 N -3.26 -2.18 0.29 -2.82 1.02 -1.26 -4.57 119.74 106.96 1twc s LYS 99 Ca 0.77 0.30 -0.20 0.00 0.02 0.00 0.00 55.97 56.86 1twc s LYS 99 Cb -0.37 -1.45 -0.09 0.00 -0.52 0.00 0.00 37.83 35.40 1twc s LYS 99 CO 0.46 -4.42 0.79 -2.14 -0.92 0.00 0.00 175.35 169.12 1twc s PRO 100 N -4.94 4.24 0.02 -1.68 0.02 -1.26 -4.46 135.00 126.93 1twc s PRO 100 Ca 0.69 0.91 -0.27 0.00 0.02 0.00 0.00 61.00 62.35 1twc s PRO 100 Cb -0.16 -2.68 0.09 0.00 0.02 0.00 0.00 34.50 31.77 1twc s PRO 100 CO 0.60 0.27 0.76 0.00 -0.33 0.00 0.00 177.00 178.30 1twc s MET 101 N -2.37 1.00 -0.06 5.54 0.23 -1.18 -1.31 119.30 121.14 1twc s MET 101 Ca 0.49 -0.17 0.03 0.00 -1.03 0.00 0.00 55.69 55.01 1twc s MET 101 Cb -0.14 0.46 0.00 0.00 -1.53 0.00 0.00 34.83 33.62 1twc s MET 101 CO 0.20 -0.40 -0.16 0.08 -2.03 0.00 0.00 175.02 172.71 1twc s VAL 102 N -2.63 1.43 -0.35 5.16 1.01 -0.43 -4.45 120.40 120.14 1twc s VAL 102 Ca -0.01 -0.67 -0.28 0.00 0.00 0.00 0.00 61.98 61.02 1twc s VAL 102 Cb -0.01 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1twc s VAL 102 CO -0.05 0.42 2.10 0.21 0.00 0.00 0.00 175.10 177.77 1twc s ASN 103 N 0.38 5.35 0.44 3.32 2.47 -1.26 -2.70 114.94 122.94 1twc s ASN 103 Ca -0.12 1.38 -0.20 0.00 0.42 0.00 0.00 52.86 54.34 1twc s ASN 103 Cb -0.15 -2.52 -0.10 0.00 -1.45 0.00 0.00 41.25 37.03 1twc s ASN 103 CO 0.04 -2.12 0.96 -1.61 -3.72 0.00 0.00 177.10 170.65 1twc s GLU 104 N 6.62 4.16 -0.68 0.43 0.41 -1.26 -4.83 118.70 123.55 1twc s GLU 104 Ca 0.90 1.13 -0.13 0.00 -0.41 0.00 0.00 54.97 56.46 1twc s GLU 104 Cb -0.24 -2.17 -0.18 0.00 -1.78 0.00 0.00 34.13 29.76 1twc s GLU 104 CO 0.31 -0.10 1.86 -1.13 -0.49 0.00 0.00 175.26 175.72 1twc n SER 105 N -0.76 -0.48 -2.19 -0.19 3.41 -0.97 -4.74 113.62 107.69 1twc n SER 105 Ca 0.07 -1.33 -0.03 0.00 -0.26 0.00 0.00 58.87 57.32 1twc n SER 105 Cb 0.54 -0.99 -0.03 0.00 -0.26 0.00 0.00 64.21 63.47 1twc n SER 105 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1twc n ASP 106 N 10.44 -1.59 0.00 4.04 10.43 -1.26 -4.53 116.55 134.07 1twc n ASP 106 Ca 0.39 0.84 0.00 0.00 2.57 0.00 0.00 54.79 58.60 1twc n ASP 106 Cb 0.36 -3.66 0.00 0.00 1.84 0.00 0.00 41.12 39.66 1twc n ASP 106 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1twc n GLY 107 N 0.97 2.58 1.58 0.44 0.00 -1.26 -5.08 105.19 104.42 1twc n GLY 107 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1twc n GLY 107 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1twc n VAL 108 N -1.00 -3.55 -0.88 1.61 0.31 -1.26 -4.97 118.33 108.59 1twc n VAL 108 Ca 0.00 1.69 0.00 0.00 -0.01 0.00 0.00 64.34 66.02 1twc n VAL 108 Cb 0.00 -2.55 0.00 0.00 -0.91 0.00 0.00 33.84 30.38 1twc n VAL 108 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1twc n THR 109 N -1.87 -0.03 -3.72 2.52 -1.04 -1.10 -4.84 114.28 104.20 1twc n THR 109 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 1twc n THR 109 Cb 0.25 -0.66 -0.13 0.00 -1.82 0.00 0.00 70.33 67.97 1twc n THR 109 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1twc s HIS 110 N 0.00 -0.39 0.18 -1.42 5.04 -1.19 -4.95 115.29 112.56 1twc s HIS 110 Ca 0.00 0.90 -0.32 0.00 -1.54 0.00 0.00 55.06 54.10 1twc s HIS 110 Cb 0.00 0.10 -0.16 0.00 0.04 0.00 0.00 32.58 32.56 1twc s HIS 110 CO 0.00 -0.26 1.13 0.00 -2.34 0.00 0.00 174.74 173.27 1twc n ALA 111 N 4.24 -0.79 -4.07 1.58 0.00 -1.26 -1.31 120.51 118.90 1twc n ALA 111 Ca -0.25 0.46 -0.32 0.00 0.00 0.00 0.00 53.44 53.33 1twc n ALA 111 Cb 0.53 -2.02 -0.15 0.00 0.00 0.00 0.00 19.45 17.82 1twc n ALA 111 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1twc s LEU 112 N 0.68 2.98 0.46 0.00 2.96 -0.43 -4.84 118.68 120.49 1twc s LEU 112 Ca 0.72 -1.16 -0.08 0.00 -0.22 0.00 0.00 54.13 53.38 1twc s LEU 112 Cb -0.84 -1.49 -0.05 0.00 0.50 0.00 0.00 46.19 44.31 1twc s LEU 112 CO 0.53 -0.14 0.80 -0.31 -1.32 0.00 0.00 176.35 175.91 1twc s TYR 113 N 1.19 3.53 0.29 5.38 1.51 -1.26 -4.64 117.35 123.33 1twc s TYR 113 Ca -0.05 0.97 -0.01 0.00 -1.01 0.00 0.00 57.07 56.97 1twc s TYR 113 Cb -0.18 -2.41 0.42 0.00 -0.11 0.00 0.00 41.96 39.68 1twc s TYR 113 CO -0.07 -0.24 1.84 -1.00 -1.11 0.00 0.00 175.55 174.97 1twc h PRO 114 N 0.65 0.84 -1.12 -1.71 0.13 -1.99 -2.81 132.00 125.98 1twc h PRO 114 Ca -0.47 -0.16 0.31 0.00 -0.87 0.00 0.00 66.00 64.82 1twc h PRO 114 Cb 1.20 -0.13 -0.08 0.00 0.13 0.00 0.00 31.00 32.11 1twc h PRO 114 CO 0.63 0.73 0.76 0.37 -0.23 0.00 0.00 178.00 180.26 1twc h GLN 115 N 0.81 0.20 0.03 0.86 5.75 -1.89 -1.35 115.11 119.53 1twc h GLN 115 Ca 0.18 -0.01 -0.27 0.00 -0.15 0.00 0.00 58.65 58.40 1twc h GLN 115 Cb 0.25 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.73 1twc h GLN 115 CO -0.01 0.13 -1.43 1.49 -2.65 0.00 0.00 178.83 176.37 1twc h GLU 116 N 0.21 0.06 0.00 1.69 4.81 -1.88 -3.08 114.58 116.39 1twc h GLU 116 Ca 0.60 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.69 1twc h GLU 116 Cb 1.91 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 31.32 1twc h GLU 116 CO -0.19 0.83 -0.19 0.00 -0.73 0.00 0.00 179.01 178.73 1twc h ALA 117 N 0.86 0.94 0.09 2.92 0.00 -1.16 0.42 119.26 123.33 1twc h ALA 117 Ca -0.18 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1twc h ALA 117 Cb 1.93 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1twc h ALA 117 CO 0.12 0.23 -0.04 0.00 0.00 0.00 0.00 179.25 179.56 1twc h ARG 118 N 0.00 -0.12 -0.74 0.00 3.08 -1.23 -2.51 114.38 112.87 1twc h ARG 118 Ca -0.00 0.01 -0.07 0.00 0.07 0.00 0.00 59.98 59.99 1twc h ARG 118 Cb 0.88 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.93 1twc h ARG 118 CO 0.02 0.37 0.20 -0.07 -1.07 0.00 0.00 179.97 179.43 1twc h LEU 119 N -0.68 1.09 -0.59 3.04 3.38 -1.42 -3.05 115.31 117.08 1twc h LEU 119 Ca -0.01 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1twc h LEU 119 Cb 0.54 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1twc h LEU 119 CO 0.02 1.03 0.00 0.54 0.09 0.00 0.00 178.44 180.12 1twc n ARG 120 N -4.24 1.38 -3.33 1.13 1.74 0.12 -4.94 116.66 108.51 1twc n ARG 120 Ca 0.06 -0.58 -0.24 0.00 -0.77 0.00 0.00 57.85 56.32 1twc n ARG 120 Cb 0.25 -1.18 0.02 0.00 -1.02 0.00 0.00 32.46 30.52 1twc n ARG 120 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1twc n ASN 121 N -0.08 -4.93 -3.31 0.55 5.03 -1.15 -4.41 115.26 106.96 1twc n ASN 121 Ca 0.08 -0.42 -0.20 0.00 0.87 0.00 0.00 54.58 54.91 1twc n ASN 121 Cb 0.15 -4.00 0.14 0.00 -1.02 0.00 0.00 39.78 35.05 1twc n ASN 121 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1twc n LEU 122 N -4.05 0.00 -3.55 3.41 4.77 -0.95 -3.59 117.00 113.05 1twc n LEU 122 Ca -0.04 -1.00 -0.29 0.00 -0.03 0.00 0.00 56.01 54.64 1twc n LEU 122 Cb 0.57 -0.70 -0.15 0.00 -2.33 0.00 0.00 43.42 40.81 1twc n LEU 122 CO 0.54 -1.18 -0.33 -0.89 -1.33 0.00 0.00 177.39 174.21 1twc s THR 123 N -2.99 0.06 -0.83 -5.08 2.01 -1.26 0.08 115.64 107.63 1twc s THR 123 Ca 0.52 -0.97 -0.25 0.00 0.31 0.00 0.00 61.69 61.30 1twc s THR 123 Cb -0.01 -1.07 -0.07 0.00 0.01 0.00 0.00 72.50 71.36 1twc s THR 123 CO 0.37 -0.76 2.06 -0.47 -0.69 0.00 0.00 174.62 175.12 1twc s TYR 124 N 1.89 1.61 0.18 4.92 5.04 -0.40 -4.86 117.35 125.73 1twc s TYR 124 Ca 0.10 1.00 0.08 0.00 -2.44 0.00 0.00 57.07 55.81 1twc s TYR 124 Cb -0.17 -3.89 -0.04 0.00 0.35 0.00 0.00 41.96 38.20 1twc s TYR 124 CO -0.30 -1.79 -0.16 -1.54 -1.34 0.00 0.00 175.55 170.41 1twc s SER 125 N 8.86 2.53 0.35 4.32 1.04 -1.26 -1.12 113.70 128.42 1twc s SER 125 Ca 0.76 -0.93 0.05 0.00 0.48 0.00 0.00 55.95 56.31 1twc s SER 125 Cb -0.09 -0.13 -0.07 0.00 0.10 0.00 0.00 66.02 65.83 1twc s SER 125 CO 0.05 -0.11 0.05 -0.44 0.98 0.00 0.00 173.24 173.76 1twc s SER 126 N -2.93 2.82 0.27 7.02 0.01 -0.10 -3.09 113.70 117.71 1twc s SER 126 Ca 0.18 -1.38 0.09 0.00 1.31 0.00 0.00 55.95 56.15 1twc s SER 126 Cb -0.03 -0.16 -0.04 0.00 0.21 0.00 0.00 66.02 66.00 1twc s SER 126 CO 0.06 -0.57 0.01 -0.83 0.41 0.00 0.00 173.24 172.32 1twc s GLY 127 N -3.56 1.69 -0.14 3.44 0.00 -1.25 0.12 107.32 107.62 1twc s GLY 127 Ca 0.36 -1.68 0.01 0.00 0.00 0.00 0.00 44.72 43.41 1twc s GLY 127 CO 0.16 -1.73 -0.18 1.08 0.00 0.00 0.00 173.10 172.44 1twc s LEU 128 N -3.69 2.37 -0.39 0.66 1.02 0.69 -2.78 118.68 116.56 1twc s LEU 128 Ca 0.32 -0.50 -0.01 0.00 0.02 0.00 0.00 54.13 53.96 1twc s LEU 128 Cb -0.06 -1.52 0.10 0.00 0.02 0.00 0.00 46.19 44.73 1twc s LEU 128 CO 0.20 0.10 0.16 -0.36 0.02 0.00 0.00 176.35 176.47 1twc s PHE 129 N 0.72 3.62 1.20 0.29 0.40 -1.17 0.25 117.98 123.28 1twc s PHE 129 Ca -0.08 -2.53 -0.18 0.00 -0.60 0.00 0.00 56.93 53.55 1twc s PHE 129 Cb -0.16 -3.10 0.28 0.00 0.51 0.00 0.00 43.02 40.55 1twc s PHE 129 CO 0.01 -0.96 1.07 0.14 0.70 0.00 0.00 175.22 176.18 1twc s VAL 130 N 1.09 1.64 -0.30 -0.44 -7.23 -1.19 -2.46 120.40 111.51 1twc s VAL 130 Ca 0.08 0.00 -0.01 0.00 -1.81 0.00 0.00 61.98 60.24 1twc s VAL 130 Cb -0.22 -2.40 0.10 0.00 0.56 0.00 0.00 36.38 34.42 1twc s VAL 130 CO -0.05 0.00 0.10 -1.81 -0.31 0.00 0.00 175.10 173.03 1twc s ASP 131 N -3.61 3.87 0.17 4.85 1.01 -1.17 -4.25 116.67 117.54 1twc s ASP 131 Ca 0.69 -1.52 -0.03 0.00 0.71 0.00 0.00 52.55 52.40 1twc s ASP 131 Cb -0.13 -0.77 -0.05 0.00 1.01 0.00 0.00 42.92 42.98 1twc s ASP 131 CO 0.57 -0.41 0.39 -0.69 0.21 0.00 0.00 175.17 175.25 1twc s VAL 132 N 1.70 5.17 -0.04 -1.27 1.01 -1.26 0.84 120.40 126.55 1twc s VAL 132 Ca 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 1twc s VAL 132 Cb -0.17 -3.67 0.03 0.00 0.00 0.00 0.00 36.38 32.57 1twc s VAL 132 CO -0.25 -0.06 0.03 -0.54 0.00 0.00 0.00 175.10 174.28 1twc s LYS 133 N -2.94 0.14 0.02 2.72 3.01 -1.16 -4.98 119.74 116.56 1twc s LYS 133 Ca 0.40 0.21 -0.17 0.00 -1.01 0.00 0.00 55.97 55.40 1twc s LYS 133 Cb -0.12 -0.51 -0.06 0.00 -1.01 0.00 0.00 37.83 36.13 1twc s LYS 133 CO 0.27 -0.23 0.47 0.21 0.51 0.00 0.00 175.35 176.58 1twc s LYS 134 N 1.55 4.05 -0.19 1.68 2.20 -1.26 -1.52 119.74 126.25 1twc s LYS 134 Ca -0.03 0.54 -0.20 0.00 -0.36 0.00 0.00 55.97 55.92 1twc s LYS 134 Cb -0.13 -3.24 0.05 0.00 -1.51 0.00 0.00 37.83 33.01 1twc s LYS 134 CO -0.03 0.64 0.57 1.03 -0.36 0.00 0.00 175.35 177.20 1twc s ARG 135 N -0.99 0.70 0.05 4.03 0.52 -1.26 -4.84 118.95 117.15 1twc s ARG 135 Ca 0.26 0.70 -0.19 0.00 -0.52 0.00 0.00 55.73 55.98 1twc s ARG 135 Cb -0.18 0.34 -0.06 0.00 0.52 0.00 0.00 34.95 35.57 1twc s ARG 135 CO 0.15 -0.10 0.55 0.99 0.02 0.00 0.00 175.30 176.91 1twc s THR 136 N 0.10 4.81 0.00 0.02 2.01 -1.26 -0.53 115.64 120.79 1twc s THR 136 Ca -0.02 1.16 0.00 0.00 0.31 0.00 0.00 61.69 63.15 1twc s THR 136 Cb -0.04 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.60 1twc s THR 136 CO 0.02 0.53 0.00 -1.22 -0.69 0.00 0.00 174.62 173.26 1twc n TYR 137 N 1.92 0.00 -3.45 4.92 4.02 -1.26 -4.86 117.16 118.45 1twc n TYR 137 Ca -0.10 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.52 1twc n TYR 137 Cb 0.51 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.74 1twc n TYR 137 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1twc n GLU 138 N -0.12 1.18 0.00 -0.72 1.02 -1.26 -3.10 120.64 117.63 1twc n GLU 138 Ca 0.00 -3.78 0.00 0.00 -0.02 0.00 0.00 57.16 53.36 1twc n GLU 138 Cb 0.00 -1.80 0.00 0.00 -0.02 0.00 0.00 31.44 29.62 1twc n GLU 138 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1twc n LYS 164 N 1.84 0.00 0.00 3.49 5.02 -1.26 -5.07 118.16 122.18 1twc n LYS 164 Ca 0.25 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1twc n LYS 164 Cb 0.45 -0.61 0.00 0.00 -0.02 0.00 0.00 35.03 34.85 1twc n LYS 164 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1twc n VAL 165 N -0.21 0.00 -2.33 -0.18 0.31 -1.26 -4.33 118.33 110.33 1twc n VAL 165 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.92 1twc n VAL 165 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 1twc n VAL 165 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1twc s PHE 166 N 0.00 3.37 0.00 3.52 5.36 -1.26 -3.18 117.98 125.79 1twc s PHE 166 Ca 0.00 1.51 0.00 0.00 -0.96 0.00 0.00 56.93 57.48 1twc s PHE 166 Cb 0.00 -3.46 0.00 0.00 -0.34 0.00 0.00 43.02 39.22 1twc s PHE 166 CO 0.00 -1.19 0.85 -0.89 -1.46 0.00 0.00 175.22 172.53 1twc n ILE 167 N 1.57 0.71 0.00 3.12 -0.00 0.68 -4.91 119.36 120.52 1twc n ILE 167 Ca 0.01 -0.73 0.00 0.00 -0.00 0.00 0.00 62.75 62.04 1twc n ILE 167 Cb 0.44 0.66 0.00 0.00 -0.00 0.00 0.00 39.64 40.74 1twc n ILE 167 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1twc n GLY 168 N -0.35 2.30 3.10 7.39 0.00 -1.23 -4.62 105.19 111.77 1twc n GLY 168 Ca 0.00 -1.41 -0.32 0.00 0.00 0.00 0.00 46.02 44.30 1twc n GLY 168 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1twc s ARG 169 N -1.95 2.77 -0.26 1.61 0.52 -1.26 -0.22 118.95 120.15 1twc s ARG 169 Ca 0.00 -0.75 -0.06 0.00 -0.52 0.00 0.00 55.73 54.40 1twc s ARG 169 Cb 0.00 -2.37 -0.01 0.00 0.52 0.00 0.00 34.95 33.09 1twc s ARG 169 CO 0.00 -0.16 0.05 -1.17 0.02 0.00 0.00 175.30 174.04 1twc s LEU 170 N 1.20 3.51 0.21 2.53 2.96 0.34 -4.53 118.68 124.91 1twc s LEU 170 Ca 0.01 -0.49 -0.32 0.00 -0.22 0.00 0.00 54.13 53.11 1twc s LEU 170 Cb -0.14 -1.86 -0.12 0.00 0.50 0.00 0.00 46.19 44.57 1twc s LEU 170 CO -0.09 -0.11 1.68 -2.65 -1.32 0.00 0.00 176.35 173.86 1twc n PRO 171 N 4.87 2.65 -4.73 0.98 -0.02 -1.26 -0.93 135.00 136.56 1twc n PRO 171 Ca -0.16 0.95 -0.33 0.00 -2.02 0.00 0.00 63.50 61.94 1twc n PRO 171 Cb 0.50 -2.77 -0.13 0.00 -0.02 0.00 0.00 33.50 31.08 1twc n PRO 171 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1twc s ILE 172 N 0.94 3.37 0.13 4.25 -1.09 -0.28 -4.87 121.20 123.65 1twc s ILE 172 Ca 0.74 -0.59 -0.30 0.00 -2.23 0.00 0.00 60.65 58.27 1twc s ILE 172 Cb -0.54 -2.37 -0.07 0.00 -1.58 0.00 0.00 42.46 37.91 1twc s ILE 172 CO 0.36 0.57 1.08 -0.32 -1.23 0.00 0.00 174.94 175.41 1twc s MET 173 N -0.47 4.58 0.44 2.79 -2.45 -1.26 -4.58 119.30 118.34 1twc s MET 173 Ca 0.06 1.66 -0.25 0.00 -1.25 0.00 0.00 55.69 55.91 1twc s MET 173 Cb -0.12 -3.32 -0.08 0.00 1.25 0.00 0.00 34.83 32.56 1twc s MET 173 CO 0.02 0.03 1.33 -0.51 1.05 0.00 0.00 175.02 176.94 1twc s LEU 174 N 0.05 4.12 0.00 4.11 1.02 -0.14 -2.68 118.68 125.17 1twc s LEU 174 Ca 0.51 2.71 0.00 0.00 0.02 0.00 0.00 54.13 57.37 1twc s LEU 174 Cb -0.28 -3.99 0.00 0.00 0.02 0.00 0.00 46.19 41.94 1twc s LEU 174 CO 0.32 -1.04 0.00 0.54 0.02 0.00 0.00 176.35 176.20 1twc n ARG 175 N -0.17 -1.12 -0.69 1.70 1.74 -1.26 -2.24 116.66 114.61 1twc n ARG 175 Ca 0.05 0.28 -0.29 0.00 -0.77 0.00 0.00 57.85 57.12 1twc n ARG 175 Cb 0.44 -4.52 0.25 0.00 -1.02 0.00 0.00 32.46 27.60 1twc n ARG 175 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1twc s SER 176 N -2.05 0.60 0.18 0.55 1.04 -1.09 -4.67 113.70 108.25 1twc s SER 176 Ca 0.00 1.11 0.03 0.00 0.48 0.00 0.00 55.95 57.56 1twc s SER 176 Cb 0.00 -1.67 0.05 0.00 0.10 0.00 0.00 66.02 64.50 1twc s SER 176 CO 0.00 -4.38 1.42 0.11 0.98 0.00 0.00 173.24 171.37 1twc h LYS 177 N -2.75 0.21 0.00 4.02 1.57 -1.95 -2.34 116.57 115.34 1twc h LYS 177 Ca -0.53 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.04 1twc h LYS 177 Cb 1.33 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.70 1twc h LYS 177 CO 0.43 0.92 0.00 0.09 -0.57 0.00 0.00 179.45 180.32 1twc n ASN 178 N -3.71 0.00 -4.78 0.86 4.13 -1.26 -4.81 115.26 105.68 1twc n ASN 178 Ca -0.03 0.15 -0.26 0.00 1.68 0.00 0.00 54.58 56.11 1twc n ASN 178 Cb 0.76 -0.33 -0.06 0.00 -1.54 0.00 0.00 39.78 38.61 1twc n ASN 178 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1twc h TYR 180 N 2.48 0.00 0.00 0.00 -1.99 -1.87 -3.14 116.97 112.45 1twc h TYR 180 Ca -0.48 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.25 1twc h TYR 180 Cb 1.20 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.93 1twc h TYR 180 CO 0.59 0.00 -0.54 1.28 -0.00 0.00 0.00 178.16 179.49 1twc n LEU 181 N -2.80 0.61 0.07 3.88 4.77 -1.26 -3.30 117.00 118.97 1twc n LEU 181 Ca -0.00 0.19 -0.06 0.00 -0.03 0.00 0.00 56.01 56.11 1twc n LEU 181 Cb 0.18 -0.22 -0.07 0.00 -2.33 0.00 0.00 43.42 40.98 1twc n LEU 181 CO 0.21 -0.01 0.20 0.77 -1.33 0.00 0.00 177.39 177.24 1twc h SER 182 N 0.00 0.00 0.88 -1.43 4.64 -1.77 -2.10 113.55 113.77 1twc h SER 182 Ca 0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 1twc h SER 182 Cb 0.66 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.72 1twc h SER 182 CO 0.00 0.93 -1.20 -0.33 -0.87 0.00 0.00 176.83 175.36 1twc h GLU 183 N 0.00 0.00 -6.60 4.77 3.07 -1.77 -3.48 114.58 110.56 1twc h GLU 183 Ca -0.01 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 58.26 1twc h GLU 183 Cb 1.65 0.00 0.13 0.00 -0.84 0.00 0.00 28.75 29.69 1twc h GLU 183 CO 0.12 0.51 0.16 0.00 -1.40 0.00 0.00 179.01 178.39 1twc n ALA 184 N -2.38 0.11 -1.60 3.43 0.00 -0.79 -5.01 120.51 114.26 1twc n ALA 184 Ca -0.07 0.27 -0.10 0.00 0.00 0.00 0.00 53.44 53.54 1twc n ALA 184 Cb 0.88 -2.07 0.09 0.00 0.00 0.00 0.00 19.45 18.35 1twc n ALA 184 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1twc n THR 185 N -0.30 0.00 0.01 0.00 -2.24 -1.26 -4.81 114.28 105.67 1twc n THR 185 Ca 0.09 -0.51 -0.11 0.00 -2.27 0.00 0.00 64.05 61.25 1twc n THR 185 Cb 0.37 -1.66 -0.09 0.00 -2.10 0.00 0.00 70.33 66.85 1twc n THR 185 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1twc h GLU 186 N 0.00 -0.12 -1.00 -0.78 4.81 -2.00 -1.35 114.58 114.14 1twc h GLU 186 Ca -0.19 0.01 0.27 0.00 -0.13 0.00 0.00 59.36 59.31 1twc h GLU 186 Cb 0.56 0.03 -0.13 0.00 0.63 0.00 0.00 28.75 29.83 1twc h GLU 186 CO 0.15 0.41 0.59 0.77 -0.73 0.00 0.00 179.01 180.20 1twc h SER 187 N -0.82 0.63 0.05 1.04 0.02 -1.99 0.21 113.55 112.68 1twc h SER 187 Ca -0.01 0.15 -0.08 0.00 -0.84 0.00 0.00 61.79 61.01 1twc h SER 187 Cb 0.59 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 1twc h SER 187 CO 0.02 0.03 -0.25 0.44 -1.14 0.00 0.00 176.83 175.93 1twc h ASP 188 N 0.51 0.33 -0.06 3.07 3.32 -1.72 -0.15 116.42 121.72 1twc h ASP 188 Ca 0.67 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.59 1twc h ASP 188 Cb 1.36 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.82 1twc h ASP 188 CO -0.51 0.59 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.47 1twc h LEU 189 N 0.30 0.15 -0.41 1.55 3.38 0.45 -0.42 115.31 120.31 1twc h LEU 189 Ca 0.05 -0.49 0.07 0.00 0.09 0.00 0.00 57.88 57.60 1twc h LEU 189 Cb 0.61 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 1twc h LEU 189 CO 0.04 0.61 0.03 1.88 0.09 0.00 0.00 178.44 181.09 1twc h TYR 190 N -0.31 0.03 -0.69 1.13 0.99 -1.08 0.06 116.97 117.10 1twc h TYR 190 Ca 0.01 0.03 0.12 0.00 2.00 0.00 0.00 58.73 60.89 1twc h TYR 190 Cb 0.57 0.05 -0.04 0.00 1.00 0.00 0.00 36.73 38.30 1twc h TYR 190 CO 0.09 -0.05 0.46 0.87 -0.00 0.00 0.00 178.16 179.53 1twc h LYS 191 N 0.14 0.41 -0.40 4.88 1.57 -0.92 0.76 116.57 123.02 1twc h LYS 191 Ca 0.20 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1twc h LYS 191 Cb 0.27 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.49 1twc h LYS 191 CO -0.31 0.27 0.00 1.28 -0.57 0.00 0.00 179.45 180.13 1twc n LEU 192 N -4.47 1.96 -1.20 2.94 4.77 -0.14 -4.88 117.00 115.98 1twc n LEU 192 Ca 0.12 -0.98 -0.14 0.00 -0.03 0.00 0.00 56.01 54.98 1twc n LEU 192 Cb 0.45 -0.27 -0.05 0.00 -2.33 0.00 0.00 43.42 41.22 1twc n LEU 192 CO 0.33 0.44 -0.15 0.29 -1.33 0.00 0.00 177.39 176.98 1twc n LYS 193 N 0.45 -1.03 -3.75 3.23 5.02 0.26 -4.54 118.16 117.80 1twc n LYS 193 Ca 0.11 0.95 -0.37 0.00 -2.02 0.00 0.00 58.31 56.99 1twc n LYS 193 Cb 0.33 -5.09 -0.13 0.00 -0.02 0.00 0.00 35.03 30.12 1twc n LYS 193 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1twc s GLU 194 N -3.50 3.62 -0.04 1.97 0.41 -0.36 -4.86 118.70 115.94 1twc s GLU 194 Ca 0.00 -0.50 -0.37 0.00 -0.41 0.00 0.00 54.97 53.69 1twc s GLU 194 Cb 0.00 -3.33 -0.15 0.00 -1.78 0.00 0.00 34.13 28.88 1twc s GLU 194 CO 0.00 -0.20 1.62 0.00 -0.49 0.00 0.00 175.26 176.18 1twc h PRO 196 N 6.57 0.00 0.00 0.00 0.11 -1.92 -1.63 132.00 135.13 1twc h PRO 196 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1twc h PRO 196 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1twc h PRO 196 CO 0.89 0.00 -0.09 1.19 -0.21 0.00 0.00 178.00 179.78 1twc n PHE 197 N -3.54 0.03 -1.80 0.65 3.01 -1.26 -4.89 117.46 109.66 1twc n PHE 197 Ca 0.01 0.01 -0.38 0.00 1.01 0.00 0.00 57.45 58.10 1twc n PHE 197 Cb 0.31 -0.47 0.04 0.00 -0.01 0.00 0.00 39.48 39.36 1twc n PHE 197 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1twc s ASP 198 N -3.05 5.16 0.00 4.37 -1.08 -0.62 -4.91 116.67 116.55 1twc s ASP 198 Ca 0.13 2.71 0.05 0.00 -0.52 0.00 0.00 52.55 54.93 1twc s ASP 198 Cb 0.19 -2.63 0.01 0.00 -1.46 0.00 0.00 42.92 39.02 1twc s ASP 198 CO 0.56 -1.64 0.50 1.15 0.52 0.00 0.00 175.17 176.26 1twc n MET 199 N -1.20 1.86 0.00 4.34 0.00 -1.26 -5.02 117.12 115.84 1twc n MET 199 Ca 0.11 -0.52 0.00 0.00 0.00 0.00 0.00 57.70 57.30 1twc n MET 199 Cb 0.46 -0.96 0.00 0.00 0.00 0.00 0.00 33.22 32.72 1twc n MET 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1twc n GLY 200 N 0.60 -2.95 1.02 3.17 0.00 -1.26 -4.89 105.19 100.88 1twc n GLY 200 Ca 0.02 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1twc n GLY 200 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1twc n GLY 201 N -0.47 0.71 3.56 -0.02 0.00 -0.95 -4.94 105.19 103.08 1twc n GLY 201 Ca 0.00 -0.28 -0.27 0.00 0.00 0.00 0.00 46.02 45.47 1twc n GLY 201 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1twc s TYR 202 N -2.00 1.85 0.17 1.61 -0.85 -1.26 -4.75 117.35 112.11 1twc s TYR 202 Ca 0.00 -1.16 0.06 0.00 -0.52 0.00 0.00 57.07 55.45 1twc s TYR 202 Cb 0.00 -1.28 -0.04 0.00 0.38 0.00 0.00 41.96 41.02 1twc s TYR 202 CO 0.00 -0.13 0.09 -0.06 -1.52 0.00 0.00 175.55 173.92 1twc s PHE 203 N -3.15 3.03 -0.26 -3.49 0.40 -0.75 -0.96 117.98 112.80 1twc s PHE 203 Ca 0.22 -0.06 -0.02 0.00 -0.60 0.00 0.00 56.93 56.47 1twc s PHE 203 Cb 0.03 -1.46 0.03 0.00 0.51 0.00 0.00 43.02 42.14 1twc s PHE 203 CO 0.13 0.52 -0.04 0.42 0.70 0.00 0.00 175.22 176.95 1twc s ILE 204 N -1.76 2.98 -0.21 0.64 1.01 -1.26 -0.14 121.20 122.46 1twc s ILE 204 Ca 0.30 -1.06 0.02 0.00 0.00 0.00 0.00 60.65 59.90 1twc s ILE 204 Cb -0.10 -2.55 0.04 0.00 0.01 0.00 0.00 42.46 39.87 1twc s ILE 204 CO 0.22 0.14 -0.13 -0.63 0.00 0.00 0.00 174.94 174.54 1twc s ILE 205 N 1.33 1.90 -1.40 2.92 1.09 -0.85 -1.28 121.20 124.91 1twc s ILE 205 Ca -0.01 -1.20 -0.10 0.00 -1.10 0.00 0.00 60.65 58.24 1twc s ILE 205 Cb -0.17 -1.93 0.03 0.00 -1.06 0.00 0.00 42.46 39.33 1twc s ILE 205 CO -0.03 0.18 1.14 0.59 -0.10 0.00 0.00 174.94 176.72 1twc n ASN 206 N 4.59 -5.98 0.00 3.58 3.02 -0.13 -2.83 115.26 117.50 1twc n ASN 206 Ca -0.16 -0.60 0.00 0.00 -0.03 0.00 0.00 54.58 53.79 1twc n ASN 206 Cb 0.46 -4.75 0.00 0.00 -0.61 0.00 0.00 39.78 34.87 1twc n ASN 206 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1twc n GLY 207 N -1.93 2.19 3.76 7.41 0.00 0.11 -4.44 105.19 112.29 1twc n GLY 207 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 1twc n GLY 207 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1twc s SER 208 N -2.46 6.55 -0.15 1.61 0.15 -1.13 -4.59 113.70 113.69 1twc s SER 208 Ca 0.00 0.65 -0.29 0.00 0.70 0.00 0.00 55.95 57.01 1twc s SER 208 Cb 0.00 -2.21 -0.02 0.00 -1.71 0.00 0.00 66.02 62.08 1twc s SER 208 CO 0.00 0.15 1.36 -1.61 1.20 0.00 0.00 173.24 174.35 1twc s GLU 209 N 0.07 4.19 -0.09 5.44 2.02 -1.26 -2.01 118.70 127.06 1twc s GLU 209 Ca 0.19 1.76 0.04 0.00 0.02 0.00 0.00 54.97 56.99 1twc s GLU 209 Cb -0.14 -3.83 -0.00 0.00 0.10 0.00 0.00 34.13 30.26 1twc s GLU 209 CO 0.07 -0.78 -0.24 0.15 0.02 0.00 0.00 175.26 174.48 1twc s LYS 210 N 3.70 2.90 -0.08 1.61 -0.14 0.81 -1.02 119.74 127.51 1twc s LYS 210 Ca 0.59 -0.87 0.03 0.00 -1.36 0.00 0.00 55.97 54.36 1twc s LYS 210 Cb -0.24 -2.28 -0.01 0.00 -1.68 0.00 0.00 37.83 33.62 1twc s LYS 210 CO 0.19 0.25 -0.19 0.54 -0.76 0.00 0.00 175.35 175.38 1twc s VAL 211 N 0.16 2.57 -0.06 3.17 0.11 0.06 -1.82 120.40 124.59 1twc s VAL 211 Ca -0.13 -0.87 -0.22 0.00 -2.93 0.00 0.00 61.98 57.84 1twc s VAL 211 Cb -0.16 -2.00 -0.04 0.00 -1.53 0.00 0.00 36.38 32.64 1twc s VAL 211 CO 0.07 0.56 0.63 -0.76 -3.33 0.00 0.00 175.10 172.27 1twc s LEU 212 N -0.05 4.33 -0.13 2.54 1.43 -1.26 -1.99 118.68 123.56 1twc s LEU 212 Ca -0.05 1.11 -0.11 0.00 -1.03 0.00 0.00 54.13 54.04 1twc s LEU 212 Cb -0.14 -2.96 -0.05 0.00 0.03 0.00 0.00 46.19 43.07 1twc s LEU 212 CO 0.04 -0.04 0.24 -0.63 0.23 0.00 0.00 176.35 176.20 1twc s ILE 213 N 0.51 5.34 0.27 -0.59 1.09 -0.80 -4.76 121.20 122.25 1twc s ILE 213 Ca 0.33 0.44 -0.31 0.00 -1.10 0.00 0.00 60.65 60.02 1twc s ILE 213 Cb -0.17 -3.55 -0.11 0.00 -1.06 0.00 0.00 42.46 37.56 1twc s ILE 213 CO 0.16 0.50 1.63 0.00 -0.10 0.00 0.00 174.94 177.13 1twc s ALA 214 N -0.24 3.80 -0.20 9.38 0.00 -1.21 -4.82 121.76 128.47 1twc s ALA 214 Ca 0.16 1.58 -0.05 0.00 0.00 0.00 0.00 51.96 53.64 1twc s ALA 214 Cb -0.13 -3.66 -0.03 0.00 0.00 0.00 0.00 23.12 19.30 1twc s ALA 214 CO 0.04 -0.97 0.01 -0.65 0.00 0.00 0.00 175.76 174.20 1twc s GLN 215 N -0.04 3.67 -0.09 0.00 -1.52 -0.43 -0.06 119.66 121.20 1twc s GLN 215 Ca 0.66 -0.49 -0.24 0.00 -1.95 0.00 0.00 55.36 53.34 1twc s GLN 215 Cb -0.48 -3.10 -0.03 0.00 -0.22 0.00 0.00 33.01 29.17 1twc s GLN 215 CO 0.44 0.05 0.74 -2.00 -0.25 0.00 0.00 175.29 174.26 1twc s GLU 216 N 0.91 4.41 0.34 2.91 2.12 -0.72 0.41 118.70 129.07 1twc s GLU 216 Ca 0.02 0.92 0.05 0.00 0.36 0.00 0.00 54.97 56.31 1twc s GLU 216 Cb -0.14 -3.48 -0.03 0.00 0.26 0.00 0.00 34.13 30.74 1twc s GLU 216 CO 0.02 -0.03 0.20 -0.98 -0.54 0.00 0.00 175.26 173.93 1twc s ARG 217 N 1.12 1.73 0.65 4.30 1.70 -0.58 -4.45 118.95 123.42 1twc s ARG 217 Ca 0.38 -2.01 -0.13 0.00 -0.47 0.00 0.00 55.73 53.51 1twc s ARG 217 Cb -0.18 -0.04 -0.02 0.00 -0.57 0.00 0.00 34.95 34.15 1twc s ARG 217 CO 0.17 -0.53 1.05 -1.12 -1.08 0.00 0.00 175.30 173.79 1twc s SER 218 N -3.42 5.67 0.52 -2.89 0.01 -1.26 -1.95 113.70 110.37 1twc s SER 218 Ca 0.35 1.64 -0.17 0.00 1.31 0.00 0.00 55.95 59.08 1twc s SER 218 Cb 0.03 -2.50 -0.07 0.00 0.21 0.00 0.00 66.02 63.69 1twc s SER 218 CO 0.20 -1.24 1.01 0.00 0.41 0.00 0.00 173.24 173.62 1twc s ALA 219 N -2.87 2.94 0.60 1.44 0.00 -0.61 -4.62 121.76 118.64 1twc s ALA 219 Ca 0.59 0.33 0.01 0.00 0.00 0.00 0.00 51.96 52.89 1twc s ALA 219 Cb -0.14 -3.17 0.06 0.00 0.00 0.00 0.00 23.12 19.86 1twc s ALA 219 CO 0.48 -0.35 0.83 0.20 0.00 0.00 0.00 175.76 176.92 1twc s GLY 220 N -2.71 1.80 -0.70 0.00 0.00 -1.26 -4.50 107.32 99.95 1twc s GLY 220 Ca 0.62 -1.41 0.00 0.00 0.00 0.00 0.00 44.72 43.93 1twc s GLY 220 CO 0.29 -1.06 0.00 0.70 0.00 0.00 0.00 173.10 173.03 1twc n ASN 221 N -2.48 -3.95 -4.43 1.64 3.02 -0.17 -4.99 115.26 103.91 1twc n ASN 221 Ca 0.10 0.16 -0.33 0.00 -0.03 0.00 0.00 54.58 54.48 1twc n ASN 221 Cb 0.60 -2.03 -0.13 0.00 -0.61 0.00 0.00 39.78 37.60 1twc n ASN 221 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1twc s ILE 222 N -2.19 3.27 0.08 2.41 -1.09 -1.26 -4.53 121.20 117.88 1twc s ILE 222 Ca 0.00 -0.60 -0.24 0.00 -2.23 0.00 0.00 60.65 57.58 1twc s ILE 222 Cb 0.00 -2.37 -0.06 0.00 -1.58 0.00 0.00 42.46 38.45 1twc s ILE 222 CO 0.00 0.53 0.75 -0.69 -1.23 0.00 0.00 174.94 174.30 1twc s VAL 223 N 0.10 4.65 -0.03 2.92 1.01 -1.26 -4.45 120.40 123.34 1twc s VAL 223 Ca -0.05 1.60 0.00 0.00 0.00 0.00 0.00 61.98 63.54 1twc s VAL 223 Cb -0.14 -4.10 0.03 0.00 0.00 0.00 0.00 36.38 32.17 1twc s VAL 223 CO 0.04 0.42 0.02 -1.10 0.00 0.00 0.00 175.10 174.48 1twc s GLN 224 N -0.41 0.13 0.04 2.72 -0.21 -0.85 -4.96 119.66 116.12 1twc s GLN 224 Ca 0.37 0.14 0.03 0.00 0.02 0.00 0.00 55.36 55.92 1twc s GLN 224 Cb -0.21 -0.39 -0.04 0.00 1.00 0.00 0.00 33.01 33.38 1twc s GLN 224 CO 0.23 -0.16 0.01 0.08 -2.12 0.00 0.00 175.29 173.33 1twc s VAL 225 N 1.12 4.15 -0.04 1.09 1.01 -1.26 -1.50 120.40 124.98 1twc s VAL 225 Ca -0.08 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 1twc s VAL 225 Cb -0.13 -2.91 0.01 0.00 0.00 0.00 0.00 36.38 33.35 1twc s VAL 225 CO -0.02 0.26 0.09 -0.36 0.00 0.00 0.00 175.10 175.06 1twc s PHE 226 N -1.20 -0.09 0.75 5.22 2.99 -0.38 -1.81 117.98 123.46 1twc s PHE 226 Ca 0.23 0.25 -0.11 0.00 0.00 0.00 0.00 56.93 57.30 1twc s PHE 226 Cb -0.12 -0.01 0.04 0.00 0.00 0.00 0.00 43.02 42.94 1twc s PHE 226 CO 0.14 -0.07 1.08 0.15 -0.00 0.00 0.00 175.22 176.53 1twc s LYS 227 N 0.30 2.44 0.05 0.44 1.02 -1.26 -1.92 119.74 120.82 1twc s LYS 227 Ca -0.02 0.78 0.08 0.00 0.02 0.00 0.00 55.97 56.83 1twc s LYS 227 Cb -0.03 -1.95 -0.03 0.00 -0.52 0.00 0.00 37.83 35.30 1twc s LYS 227 CO -0.01 -1.41 -0.21 0.15 -0.92 0.00 0.00 175.35 172.95 1twc s LYS 228 N -5.10 1.39 0.09 1.68 1.02 -1.05 -4.88 119.74 112.89 1twc s LYS 228 Ca 0.60 -1.00 -0.30 0.00 0.02 0.00 0.00 55.97 55.28 1twc s LYS 228 Cb -0.14 -1.55 -0.05 0.00 -0.52 0.00 0.00 37.83 35.57 1twc s LYS 228 CO 0.55 0.39 1.03 0.00 -0.92 0.00 0.00 175.35 176.40 1twc s ALA 229 N -0.86 3.27 0.00 5.17 0.00 -1.26 -4.79 121.76 123.29 1twc s ALA 229 Ca 0.08 0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.70 1twc s ALA 229 Cb -0.09 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1twc s ALA 229 CO 0.02 -0.18 0.00 0.00 0.00 0.00 0.00 175.76 175.61 1twc n ALA 230 N 3.15 0.00 0.38 0.00 0.00 -1.26 -2.58 120.51 120.20 1twc n ALA 230 Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.52 1twc n ALA 230 Cb 0.49 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.14 1twc n ALA 230 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1twc n PRO 231 N 0.00 0.12 -2.58 0.00 -0.04 -1.26 -4.81 135.00 126.43 1twc n PRO 231 Ca 0.00 0.20 -0.36 0.00 -0.04 0.00 0.00 63.50 63.30 1twc n PRO 231 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 1twc n PRO 231 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1twc s SER 232 N -2.56 6.84 0.36 3.54 0.15 -1.07 -4.97 113.70 116.00 1twc s SER 232 Ca 0.08 2.01 0.23 0.00 0.70 0.00 0.00 55.95 58.96 1twc s SER 232 Cb 0.05 -2.58 0.23 0.00 -1.71 0.00 0.00 66.02 62.01 1twc s SER 232 CO 0.12 -0.43 1.43 1.55 1.20 0.00 0.00 173.24 177.11 1twc h PRO 233 N 2.58 0.00 -6.37 5.44 0.13 -1.92 -3.44 132.00 128.42 1twc h PRO 233 Ca -0.48 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.10 1twc h PRO 233 Cb 1.21 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 1twc h PRO 233 CO 0.63 0.02 -0.07 0.42 -0.23 0.00 0.00 178.00 178.76 1twc s ILE 234 N -3.25 4.85 -0.09 -3.56 1.01 -1.26 -0.85 121.20 118.06 1twc s ILE 234 Ca 0.05 0.79 0.11 0.00 0.00 0.00 0.00 60.65 61.60 1twc s ILE 234 Cb 0.06 -3.71 -0.16 0.00 0.01 0.00 0.00 42.46 38.66 1twc s ILE 234 CO 0.71 0.17 0.12 -1.54 0.00 0.00 0.00 174.94 174.39 1twc n SER 235 N 0.58 2.07 -3.98 3.58 3.41 -0.14 -4.63 113.62 114.52 1twc n SER 235 Ca -0.04 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.48 1twc n SER 235 Cb 0.52 1.05 -0.08 0.00 -0.26 0.00 0.00 64.21 65.44 1twc n SER 235 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1twc s HIS 236 N -2.48 0.44 -0.00 7.33 3.76 -1.17 -2.52 115.29 120.65 1twc s HIS 236 Ca -0.05 -0.82 -0.04 0.00 -0.15 0.00 0.00 55.06 53.99 1twc s HIS 236 Cb 0.05 -0.15 -0.00 0.00 1.11 0.00 0.00 32.58 33.59 1twc s HIS 236 CO 0.50 -0.64 0.07 0.08 -0.85 0.00 0.00 174.74 173.90 1twc s VAL 237 N -3.96 0.07 0.04 -0.90 1.01 -0.81 -1.03 120.40 114.82 1twc s VAL 237 Ca 0.16 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 61.62 1twc s VAL 237 Cb 0.05 -0.30 -0.02 0.00 0.00 0.00 0.00 36.38 36.10 1twc s VAL 237 CO -0.02 -0.33 -0.22 0.00 0.00 0.00 0.00 175.10 174.53 1twc s ALA 238 N -1.05 1.89 -0.06 5.51 0.00 0.66 -1.25 121.76 127.45 1twc s ALA 238 Ca -0.11 -1.10 -0.07 0.00 0.00 0.00 0.00 51.96 50.68 1twc s ALA 238 Cb -0.07 -0.39 0.02 0.00 0.00 0.00 0.00 23.12 22.68 1twc s ALA 238 CO 0.00 0.43 0.18 -2.00 0.00 0.00 0.00 175.76 174.38 1twc s GLU 239 N -1.11 0.24 0.03 0.00 2.12 -0.57 -0.33 118.70 119.08 1twc s GLU 239 Ca 0.09 0.21 0.01 0.00 0.36 0.00 0.00 54.97 55.64 1twc s GLU 239 Cb -0.09 0.11 -0.02 0.00 0.26 0.00 0.00 34.13 34.39 1twc s GLU 239 CO 0.02 -0.03 -0.06 -1.50 -0.54 0.00 0.00 175.26 173.15 1twc s ILE 240 N -0.01 0.37 -0.57 -3.70 2.07 -0.29 -2.00 121.20 117.07 1twc s ILE 240 Ca -0.01 -0.81 -0.06 0.00 -1.41 0.00 0.00 60.65 58.36 1twc s ILE 240 Cb -0.02 -0.43 0.15 0.00 0.13 0.00 0.00 42.46 42.29 1twc s ILE 240 CO 0.00 -0.30 0.41 -0.13 -1.91 0.00 0.00 174.94 173.01 1twc s ARG 241 N -1.19 2.54 0.34 3.50 0.52 -1.26 -2.17 118.95 121.22 1twc s ARG 241 Ca -0.09 -2.20 -0.26 0.00 -0.52 0.00 0.00 55.73 52.66 1twc s ARG 241 Cb -0.08 -3.82 -0.09 0.00 0.52 0.00 0.00 34.95 31.48 1twc s ARG 241 CO -0.00 -1.17 1.04 0.45 0.02 0.00 0.00 175.30 175.63 1twc s SER 242 N 1.55 7.08 0.31 0.23 0.15 -0.58 -1.00 113.70 121.43 1twc s SER 242 Ca 0.13 2.06 -0.19 0.00 0.70 0.00 0.00 55.95 58.65 1twc s SER 242 Cb -0.21 -2.60 0.03 0.00 -1.71 0.00 0.00 66.02 61.53 1twc s SER 242 CO -0.04 -0.26 0.73 0.00 1.20 0.00 0.00 173.24 174.87 1twc s ALA 243 N -1.47 -1.02 -0.04 5.45 0.00 -1.26 -3.55 121.76 119.88 1twc s ALA 243 Ca 0.51 -0.47 0.00 0.00 0.00 0.00 0.00 51.96 52.00 1twc s ALA 243 Cb -0.25 0.81 0.03 0.00 0.00 0.00 0.00 23.12 23.71 1twc s ALA 243 CO 0.31 -1.01 -0.01 -0.51 0.00 0.00 0.00 175.76 174.54 1twc s LEU 244 N -2.97 1.12 0.00 0.00 1.43 -1.26 -4.26 118.68 112.74 1twc s LEU 244 Ca 0.13 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 1twc s LEU 244 Cb -0.05 -0.29 0.00 0.00 0.03 0.00 0.00 46.19 45.87 1twc s LEU 244 CO 0.08 -0.10 0.89 -0.62 0.23 0.00 0.00 176.35 176.83 1twc n GLU 245 N 4.24 0.00 -3.18 1.70 1.02 -1.26 -4.61 120.64 118.55 1twc n GLU 245 Ca -0.24 0.49 -0.39 0.00 -0.02 0.00 0.00 57.16 57.00 1twc n GLU 245 Cb 0.50 -1.39 -0.06 0.00 -0.02 0.00 0.00 31.44 30.48 1twc n GLU 245 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1twc s LYS 246 N -2.56 4.33 0.00 3.49 1.02 -1.26 -4.77 119.74 119.99 1twc s LYS 246 Ca 0.00 0.88 0.00 0.00 0.02 0.00 0.00 55.97 56.87 1twc s LYS 246 Cb 0.00 -3.25 0.00 0.00 -0.52 0.00 0.00 37.83 34.06 1twc s LYS 246 CO 0.00 0.61 0.00 0.41 -0.92 0.00 0.00 175.35 175.45 1twc n GLY 247 N 1.70 0.32 0.00 -3.33 0.00 -1.26 -5.05 105.19 97.56 1twc n GLY 247 Ca -0.09 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1twc n GLY 247 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1twc n SER 248 N 0.00 0.10 -2.77 1.61 3.41 -1.26 -4.96 113.62 109.75 1twc n SER 248 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.33 1twc n SER 248 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 1twc n SER 248 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1twc n ARG 249 N 0.00 3.39 -2.18 4.33 0.63 -1.26 -4.58 116.66 116.98 1twc n ARG 249 Ca 0.00 -4.67 -0.43 0.00 -0.92 0.00 0.00 57.85 51.83 1twc n ARG 249 Cb 0.00 -2.25 -0.02 0.00 0.45 0.00 0.00 32.46 30.63 1twc n ARG 249 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 1twc s PHE 250 N -3.55 2.32 -0.71 -0.14 0.40 -1.26 -4.94 117.98 110.09 1twc s PHE 250 Ca 0.48 0.55 0.04 0.00 -0.60 0.00 0.00 56.93 57.41 1twc s PHE 250 Cb 0.33 -3.78 0.22 0.00 0.51 0.00 0.00 43.02 40.30 1twc s PHE 250 CO -0.17 -2.89 0.68 -0.89 0.70 0.00 0.00 175.22 172.65 1twc n ILE 251 N 5.62 2.28 -2.27 0.64 2.08 -1.26 -4.33 119.36 122.11 1twc n ILE 251 Ca 0.16 -5.11 -0.42 0.00 0.56 0.00 0.00 62.75 57.95 1twc n ILE 251 Cb 0.44 -2.16 -0.03 0.00 -0.75 0.00 0.00 39.64 37.14 1twc n ILE 251 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 1twc s SER 252 N -1.82 6.92 -0.34 4.38 0.01 -1.23 -4.89 113.70 116.73 1twc s SER 252 Ca 0.32 2.18 -0.16 0.00 1.31 0.00 0.00 55.95 59.60 1twc s SER 252 Cb 0.05 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.68 1twc s SER 252 CO -0.08 -0.60 0.41 -0.89 0.41 0.00 0.00 173.24 172.49 1twc s THR 253 N 1.32 5.12 -0.10 1.44 2.01 -1.26 -1.53 115.64 122.64 1twc s THR 253 Ca 0.62 0.20 -0.15 0.00 0.31 0.00 0.00 61.69 62.67 1twc s THR 253 Cb -0.33 -3.86 -0.05 0.00 0.01 0.00 0.00 72.50 68.27 1twc s THR 253 CO 0.29 -0.11 0.37 -0.22 -0.69 0.00 0.00 174.62 174.27 1twc s LEU 254 N 2.15 4.32 -0.06 4.42 2.96 -0.92 -4.85 118.68 126.70 1twc s LEU 254 Ca 0.14 0.72 0.04 0.00 -0.22 0.00 0.00 54.13 54.81 1twc s LEU 254 Cb -0.16 -2.51 -0.02 0.00 0.50 0.00 0.00 46.19 43.99 1twc s LEU 254 CO 0.12 0.15 -0.16 -1.10 -1.32 0.00 0.00 176.35 174.03 1twc s GLN 255 N 0.02 2.60 -0.27 1.98 -0.21 -1.23 -1.14 119.66 121.41 1twc s GLN 255 Ca 0.21 -0.74 -0.03 0.00 0.02 0.00 0.00 55.36 54.82 1twc s GLN 255 Cb -0.15 -2.36 0.02 0.00 1.00 0.00 0.00 33.01 31.53 1twc s GLN 255 CO 0.08 0.54 -0.01 0.08 -2.12 0.00 0.00 175.29 173.86 1twc s VAL 256 N -0.51 3.25 -0.19 1.09 1.01 0.55 -1.43 120.40 124.17 1twc s VAL 256 Ca 0.07 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 61.05 1twc s VAL 256 Cb -0.12 -2.69 -0.01 0.00 0.00 0.00 0.00 36.38 33.56 1twc s VAL 256 CO 0.01 0.11 -0.07 -0.54 0.00 0.00 0.00 175.10 174.61 1twc s LYS 257 N 1.37 3.39 -0.45 2.72 1.02 0.18 -0.24 119.74 127.72 1twc s LYS 257 Ca 0.00 -0.64 -0.21 0.00 0.02 0.00 0.00 55.97 55.14 1twc s LYS 257 Cb -0.17 -2.87 0.03 0.00 -0.52 0.00 0.00 37.83 34.29 1twc s LYS 257 CO -0.02 -0.04 0.69 -1.17 -0.92 0.00 0.00 175.35 173.90 1twc s LEU 258 N 1.04 4.47 0.26 3.17 2.96 -0.20 -2.75 118.68 127.62 1twc s LEU 258 Ca 0.00 -0.34 -0.29 0.00 -0.22 0.00 0.00 54.13 53.27 1twc s LEU 258 Cb -0.15 -2.76 -0.09 0.00 0.50 0.00 0.00 46.19 43.69 1twc s LEU 258 CO -0.01 -0.85 1.20 -0.31 -1.32 0.00 0.00 176.35 175.07 1twc s TYR 259 N 2.98 3.36 0.00 5.38 1.51 -0.72 -0.97 117.35 128.89 1twc s TYR 259 Ca 0.24 1.50 0.00 0.00 -1.01 0.00 0.00 57.07 57.80 1twc s TYR 259 Cb -0.14 -3.46 0.00 0.00 -0.11 0.00 0.00 41.96 38.25 1twc s TYR 259 CO 0.19 -1.22 0.00 0.41 -1.11 0.00 0.00 175.55 173.83 1twc n GLY 260 N 1.47 1.68 4.03 0.71 0.00 -0.03 -2.99 105.19 110.06 1twc n GLY 260 Ca 0.01 -1.61 -0.19 0.00 0.00 0.00 0.00 46.02 44.23 1twc n GLY 260 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1twc s ARG 261 N -4.56 2.38 -0.18 1.61 0.52 -1.26 -4.07 118.95 113.39 1twc s ARG 261 Ca 0.00 -1.55 -0.32 0.00 -0.52 0.00 0.00 55.73 53.34 1twc s ARG 261 Cb 0.00 -2.66 -0.09 0.00 0.52 0.00 0.00 34.95 32.72 1twc s ARG 261 CO 0.00 -0.78 2.08 0.39 0.02 0.00 0.00 175.30 177.01 1twc n GLU 262 N -2.19 1.91 -3.26 3.54 1.02 -1.26 0.20 120.64 120.60 1twc n GLU 262 Ca 0.14 0.61 -0.15 0.00 -0.02 0.00 0.00 57.16 57.75 1twc n GLU 262 Cb 0.61 -2.83 0.01 0.00 -0.02 0.00 0.00 31.44 29.21 1twc n GLU 262 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1twc n GLY 263 N 5.39 -1.02 0.00 0.62 0.00 -1.26 -5.08 105.19 103.85 1twc n GLY 263 Ca 0.29 0.84 0.00 0.00 0.00 0.00 0.00 46.02 47.16 1twc n GLY 263 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1twc n SER 264 N -1.29 0.00 -4.73 1.61 7.64 0.54 -5.15 113.62 112.24 1twc n SER 264 Ca -0.06 -0.75 -0.35 0.00 1.01 0.00 0.00 58.87 58.72 1twc n SER 264 Cb 0.57 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.68 1twc n SER 264 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1twc s SER 265 N -1.00 5.61 -0.12 6.43 1.04 -1.26 -4.71 113.70 119.68 1twc s SER 265 Ca 0.00 0.23 -0.11 0.00 0.48 0.00 0.00 55.95 56.55 1twc s SER 265 Cb 0.00 -1.70 0.02 0.00 0.10 0.00 0.00 66.02 64.43 1twc s SER 265 CO 0.00 0.36 0.18 0.00 0.98 0.00 0.00 173.24 174.77 1twc n ALA 266 N 2.26 -1.61 -2.19 5.32 0.00 -1.26 -4.88 120.51 118.13 1twc n ALA 266 Ca -0.19 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 52.92 1twc n ALA 266 Cb 0.54 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 19.21 1twc n ALA 266 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1twc s ARG 267 N -0.94 4.30 0.29 0.00 0.52 -1.26 -4.82 118.95 117.04 1twc s ARG 267 Ca 0.11 2.02 0.10 0.00 -0.52 0.00 0.00 55.73 57.44 1twc s ARG 267 Cb -0.01 -3.41 -0.06 0.00 0.52 0.00 0.00 34.95 31.99 1twc s ARG 267 CO 0.24 -0.50 -0.14 -0.08 0.02 0.00 0.00 175.30 174.84 1twc s THR 268 N 1.72 2.21 -0.06 0.02 -1.32 -1.16 -4.62 115.64 112.43 1twc s THR 268 Ca 0.64 -2.29 0.06 0.00 -1.21 0.00 0.00 61.69 58.90 1twc s THR 268 Cb -0.34 -2.40 -0.01 0.00 -1.51 0.00 0.00 72.50 68.24 1twc s THR 268 CO 0.29 -0.35 -0.25 -0.63 -2.21 0.00 0.00 174.62 171.47 1twc s ILE 269 N -2.66 2.04 0.03 5.08 1.01 -1.26 -1.76 121.20 123.67 1twc s ILE 269 Ca 0.30 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.91 1twc s ILE 269 Cb -0.01 -1.73 -0.02 0.00 0.01 0.00 0.00 42.46 40.71 1twc s ILE 269 CO 0.14 0.56 -0.06 -0.54 0.00 0.00 0.00 174.94 175.05 1twc s LYS 270 N -0.11 0.43 0.10 2.79 1.02 -1.11 -2.41 119.74 120.45 1twc s LYS 270 Ca -0.05 -0.67 0.07 0.00 0.02 0.00 0.00 55.97 55.34 1twc s LYS 270 Cb -0.14 -0.14 -0.04 0.00 -0.52 0.00 0.00 37.83 36.99 1twc s LYS 270 CO 0.04 0.01 -0.10 0.00 -0.92 0.00 0.00 175.35 174.38 1twc s ALA 271 N -1.33 2.94 -0.45 5.17 0.00 0.36 -0.65 121.76 127.80 1twc s ALA 271 Ca -0.12 -1.24 -0.12 0.00 0.00 0.00 0.00 51.96 50.48 1twc s ALA 271 Cb -0.09 -0.89 0.08 0.00 0.00 0.00 0.00 23.12 22.21 1twc s ALA 271 CO -0.00 0.64 0.33 0.99 0.00 0.00 0.00 175.76 177.72 1twc s THR 272 N -1.20 4.72 0.46 0.00 2.01 -0.51 -1.62 115.64 119.50 1twc s THR 272 Ca 0.21 -1.25 -0.18 0.00 0.31 0.00 0.00 61.69 60.78 1twc s THR 272 Cb -0.11 -3.86 -0.09 0.00 0.01 0.00 0.00 72.50 68.45 1twc s THR 272 CO 0.13 -0.55 0.94 -0.76 -0.69 0.00 0.00 174.62 173.69 1twc s LEU 273 N 1.53 3.78 0.14 4.42 1.43 -1.26 -3.54 118.68 125.18 1twc s LEU 273 Ca 0.04 1.57 -0.30 0.00 -1.03 0.00 0.00 54.13 54.41 1twc s LEU 273 Cb -0.24 -4.47 -0.07 0.00 0.03 0.00 0.00 46.19 41.45 1twc s LEU 273 CO 0.04 -0.47 1.18 -2.16 0.23 0.00 0.00 176.35 175.17 1twc s PRO 274 N -3.65 4.50 -0.01 1.29 0.04 -1.26 -2.83 135.00 133.08 1twc s PRO 274 Ca 0.59 1.80 0.00 0.00 0.04 0.00 0.00 61.00 63.44 1twc s PRO 274 Cb -0.10 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1twc s PRO 274 CO 0.23 -0.10 0.00 0.66 0.04 0.00 0.00 177.00 177.83 1twc n TYR 275 N 2.94 0.00 -5.07 0.56 4.02 -1.26 -5.00 117.16 113.34 1twc n TYR 275 Ca 0.05 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.64 1twc n TYR 275 Cb 0.46 -0.16 -0.17 0.00 -0.02 0.00 0.00 39.34 39.45 1twc n TYR 275 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1twc s ILE 276 N -1.99 1.83 -1.29 -0.72 -1.09 -1.13 -4.47 121.20 112.35 1twc s ILE 276 Ca 0.00 -0.90 0.14 0.00 -2.23 0.00 0.00 60.65 57.66 1twc s ILE 276 Cb 0.00 -1.59 0.35 0.00 -1.58 0.00 0.00 42.46 39.63 1twc s ILE 276 CO 0.00 0.51 1.27 0.29 -1.23 0.00 0.00 174.94 175.78 1twc n LYS 277 N 3.51 2.54 -4.23 2.79 4.01 -0.69 -4.76 118.16 121.34 1twc n LYS 277 Ca -0.20 -2.07 -0.17 0.00 -0.51 0.00 0.00 58.31 55.36 1twc n LYS 277 Cb 0.53 -1.33 -0.13 0.00 -0.51 0.00 0.00 35.03 33.58 1twc n LYS 277 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 1twc s GLN 278 N -1.03 0.72 0.28 1.97 0.74 -1.26 -5.12 119.66 115.96 1twc s GLN 278 Ca 0.28 -0.66 -0.29 0.00 0.05 0.00 0.00 55.36 54.73 1twc s GLN 278 Cb 0.15 -0.66 -0.10 0.00 1.10 0.00 0.00 33.01 33.50 1twc s GLN 278 CO 0.20 0.16 1.37 -0.51 -0.55 0.00 0.00 175.29 175.96 1twc s ASP 279 N -1.10 6.72 -0.21 6.67 1.01 -1.26 -4.79 116.67 123.70 1twc s ASP 279 Ca -0.02 2.66 -0.07 0.00 0.71 0.00 0.00 52.55 55.83 1twc s ASP 279 Cb -0.07 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.18 1twc s ASP 279 CO 0.01 -0.62 0.07 -0.63 0.21 0.00 0.00 175.17 174.20 1twc s ILE 280 N -0.46 4.64 -0.03 0.77 1.09 -0.64 -4.80 121.20 121.77 1twc s ILE 280 Ca 0.55 -0.08 -0.39 0.00 -1.10 0.00 0.00 60.65 59.63 1twc s ILE 280 Cb -0.41 -3.12 -0.18 0.00 -1.06 0.00 0.00 42.46 37.69 1twc s ILE 280 CO 0.47 0.41 1.29 -2.65 -0.10 0.00 0.00 174.94 174.36 1twc n PRO 281 N 4.02 0.58 0.18 2.79 -0.02 -1.26 -0.49 135.00 140.79 1twc n PRO 281 Ca -0.16 0.21 0.02 0.00 -2.02 0.00 0.00 63.50 61.55 1twc n PRO 281 Cb 0.52 -1.78 0.33 0.00 -0.02 0.00 0.00 33.50 32.55 1twc n PRO 281 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 1twc h ILE 282 N 3.51 1.29 -0.49 4.25 -2.65 -1.82 -1.69 117.51 119.91 1twc h ILE 282 Ca -0.49 -1.39 -0.07 0.00 1.03 0.00 0.00 64.86 63.94 1twc h ILE 282 Cb 1.38 1.75 -0.02 0.00 -2.05 0.00 0.00 36.82 37.87 1twc h ILE 282 CO 0.76 0.40 0.01 0.58 0.03 0.00 0.00 178.15 179.93 1twc h VAL 283 N 0.00 1.24 -0.75 0.16 2.07 -1.85 -1.77 116.25 115.35 1twc h VAL 283 Ca -0.00 -0.98 0.01 0.00 0.82 0.00 0.00 66.70 66.55 1twc h VAL 283 Cb 0.72 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 1twc h VAL 283 CO 0.05 0.35 0.49 0.40 0.02 0.00 0.00 177.57 178.88 1twc h ILE 284 N 0.75 1.17 -0.87 4.57 5.03 -1.65 -0.94 117.51 125.57 1twc h ILE 284 Ca 0.15 -0.34 -0.01 0.00 -0.12 0.00 0.00 64.86 64.54 1twc h ILE 284 Cb 0.43 0.09 -0.04 0.00 -3.03 0.00 0.00 36.82 34.27 1twc h ILE 284 CO 0.02 0.18 0.51 0.40 -0.68 0.00 0.00 178.15 178.57 1twc h ILE 285 N 1.00 1.25 -0.27 -0.67 2.04 -1.03 -1.22 117.51 118.61 1twc h ILE 285 Ca 0.28 -0.57 0.06 0.00 1.00 0.00 0.00 64.86 65.63 1twc h ILE 285 Cb -0.08 0.04 -0.06 0.00 -0.74 0.00 0.00 36.82 35.98 1twc h ILE 285 CO -0.07 0.27 -0.16 -0.26 0.00 0.00 0.00 178.15 177.93 1twc h PHE 286 N 1.21 -0.39 -0.04 1.37 -1.00 -1.31 -1.58 116.94 115.20 1twc h PHE 286 Ca 0.31 0.03 0.01 0.00 2.81 0.00 0.00 57.97 61.13 1twc h PHE 286 Cb -0.01 0.21 -0.00 0.00 3.61 0.00 0.00 35.95 39.76 1twc h PHE 286 CO 0.00 -0.23 0.03 0.00 -1.61 0.00 0.00 178.31 176.51 1twc h ARG 287 N -0.13 0.00 0.00 1.51 3.08 -0.14 -1.89 114.38 116.81 1twc h ARG 287 Ca 0.14 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 1twc h ARG 287 Cb 0.35 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1twc h ARG 287 CO -0.35 0.00 -0.30 0.00 -1.07 0.00 0.00 179.97 178.25 1twc h ALA 288 N 1.97 0.82 -0.28 0.04 0.00 -0.89 0.21 119.26 121.14 1twc h ALA 288 Ca 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1twc h ALA 288 Cb 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1twc h ALA 288 CO -0.00 0.31 0.00 1.28 0.00 0.00 0.00 179.25 180.84 1twc n LEU 289 N -3.14 1.96 0.00 0.00 4.77 -0.63 -4.84 117.00 115.13 1twc n LEU 289 Ca 0.03 -0.98 0.00 0.00 -0.03 0.00 0.00 56.01 55.02 1twc n LEU 289 Cb 0.63 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1twc n LEU 289 CO 0.37 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 1twc n GLY 290 N 0.76 0.80 3.23 -0.72 0.00 0.75 -4.88 105.19 105.13 1twc n GLY 290 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1twc n GLY 290 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1twc s ILE 291 N -2.58 3.95 -0.20 -0.61 -1.09 -0.95 -4.97 121.20 114.75 1twc s ILE 291 Ca 0.00 -1.55 -0.16 0.00 -2.23 0.00 0.00 60.65 56.72 1twc s ILE 291 Cb 0.00 -3.47 -0.11 0.00 -1.58 0.00 0.00 42.46 37.30 1twc s ILE 291 CO 0.00 -0.53 -0.12 -0.38 -1.23 0.00 0.00 174.94 172.69 1twc n ILE 292 N 4.83 1.49 -2.32 2.92 -0.00 -1.26 -3.30 119.36 121.73 1twc n ILE 292 Ca -0.09 0.00 -0.41 0.00 -0.00 0.00 0.00 62.75 62.26 1twc n ILE 292 Cb 0.42 -2.17 -0.03 0.00 -0.00 0.00 0.00 39.64 37.86 1twc n ILE 292 CO 0.00 0.00 0.00 -2.84 -0.00 0.00 0.00 176.55 173.71 1twc s PRO 293 N -2.45 4.49 0.30 0.38 0.02 -1.26 -4.88 135.00 131.60 1twc s PRO 293 Ca -0.27 1.97 0.02 0.00 0.02 0.00 0.00 61.00 62.74 1twc s PRO 293 Cb 0.06 -3.17 0.75 0.00 0.02 0.00 0.00 34.50 32.16 1twc s PRO 293 CO 0.43 -0.04 1.58 -0.44 -0.33 0.00 0.00 177.00 178.21 1twc h ASP 294 N 4.30 -0.39 -0.64 2.53 3.45 -1.99 0.99 116.42 124.67 1twc h ASP 294 Ca -0.46 0.27 -0.01 0.00 0.43 0.00 0.00 57.03 57.25 1twc h ASP 294 Cb 1.22 0.45 -0.03 0.00 -0.56 0.00 0.00 39.33 40.40 1twc h ASP 294 CO 0.70 -0.33 0.34 1.23 -1.57 0.00 0.00 179.24 179.61 1twc h GLY 295 N 0.03 0.96 1.40 2.75 0.00 -1.98 0.37 103.07 106.61 1twc h GLY 295 Ca 0.59 -0.45 -0.13 0.00 0.00 0.00 0.00 47.33 47.34 1twc h GLY 295 CO -0.87 0.43 -0.37 0.83 0.00 0.00 0.00 176.54 176.55 1twc h GLU 296 N 0.88 0.66 -0.65 4.80 5.08 -1.24 -1.73 114.58 122.37 1twc h GLU 296 Ca 0.22 -0.33 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 1twc h GLU 296 Cb 0.06 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1twc h GLU 296 CO -0.03 0.93 0.07 0.82 -1.00 0.00 0.00 179.01 179.79 1twc h ILE 297 N 0.55 1.27 0.00 3.13 1.08 -0.11 -2.80 117.51 120.63 1twc h ILE 297 Ca 0.05 -1.09 -0.15 0.00 -0.39 0.00 0.00 64.86 63.28 1twc h ILE 297 Cb 0.89 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 35.30 1twc h ILE 297 CO 0.08 0.41 -0.73 -0.07 -0.69 0.00 0.00 178.15 177.14 1twc h LEU 298 N 1.03 0.00 -0.27 1.44 3.38 -0.16 -2.74 115.31 117.98 1twc h LEU 298 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1twc h LEU 298 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1twc h LEU 298 CO 0.02 0.73 0.00 1.21 0.09 0.00 0.00 178.44 180.49 1twc n GLU 299 N -3.47 0.25 0.18 1.13 2.13 -0.66 -1.59 120.64 118.60 1twc n GLU 299 Ca 0.00 0.30 0.13 0.00 0.66 0.00 0.00 57.16 58.25 1twc n GLU 299 Cb 0.76 -1.84 0.43 0.00 0.27 0.00 0.00 31.44 31.06 1twc n GLU 299 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1twc h HIS 300 N 0.00 0.00 0.00 4.31 3.86 -1.31 -3.39 115.15 118.62 1twc h HIS 300 Ca 0.00 0.00 -0.38 0.00 -1.16 0.00 0.00 60.37 58.83 1twc h HIS 300 Cb 0.61 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 29.02 1twc h HIS 300 CO 0.00 0.00 -2.14 -0.89 0.86 0.00 0.00 177.93 175.76 1twc n ILE 301 N -2.66 1.53 -3.83 2.45 5.41 -0.91 -4.07 119.36 117.27 1twc n ILE 301 Ca 0.03 -0.27 -0.35 0.00 1.00 0.00 0.00 62.75 63.17 1twc n ILE 301 Cb 0.38 -1.96 -0.12 0.00 -0.71 0.00 0.00 39.64 37.23 1twc n ILE 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1twc n TYR 303 N 4.17 1.70 -3.15 0.00 4.02 -1.26 -4.63 117.16 118.01 1twc n TYR 303 Ca 0.02 -2.04 0.05 0.00 -0.01 0.00 0.00 57.90 55.91 1twc n TYR 303 Cb 0.40 -1.15 -0.00 0.00 -0.02 0.00 0.00 39.34 38.56 1twc n TYR 303 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1twc s ASP 304 N 0.08 -0.90 0.48 7.72 -1.08 -1.26 -4.90 116.67 116.82 1twc s ASP 304 Ca 0.44 0.22 0.32 0.00 -0.52 0.00 0.00 52.55 53.01 1twc s ASP 304 Cb 0.32 1.62 1.33 0.00 -1.46 0.00 0.00 42.92 44.73 1twc s ASP 304 CO -0.09 -0.17 1.94 0.58 0.52 0.00 0.00 175.17 177.95 1twc h VAL 305 N 5.27 0.00 -0.14 1.11 2.07 -1.97 -2.56 116.25 120.03 1twc h VAL 305 Ca -0.09 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1twc h VAL 305 Cb 1.18 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 1twc h VAL 305 CO 0.02 0.00 0.00 0.59 0.02 0.00 0.00 177.57 178.20 1twc n ASN 306 N -2.86 1.97 -3.47 0.57 3.02 -1.26 -4.69 115.26 108.54 1twc n ASN 306 Ca 0.01 -1.71 -0.36 0.00 -0.03 0.00 0.00 54.58 52.49 1twc n ASN 306 Cb 0.27 -0.08 -0.03 0.00 -0.61 0.00 0.00 39.78 39.32 1twc n ASN 306 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1twc n ASP 307 N 0.53 3.85 0.22 6.41 -0.08 -0.97 -4.71 116.55 121.80 1twc n ASP 307 Ca 0.17 -2.57 0.15 0.00 -1.51 0.00 0.00 54.79 51.03 1twc n ASP 307 Cb 0.40 -1.20 0.73 0.00 2.34 0.00 0.00 41.12 43.38 1twc n ASP 307 CO 0.00 0.00 0.00 4.11 0.12 0.00 0.00 177.20 181.43 1twc h TRP 308 N 6.96 0.00 0.03 -0.67 5.08 -1.88 -1.86 115.95 123.61 1twc h TRP 308 Ca 0.49 0.00 -0.27 0.00 1.08 0.00 0.00 58.89 60.20 1twc h TRP 308 Cb 0.47 0.00 0.02 0.00 -3.00 0.00 0.00 29.16 26.65 1twc h TRP 308 CO 1.55 0.00 -1.07 1.96 -1.28 0.00 0.00 178.44 179.60 1twc h GLN 309 N 0.00 0.63 -0.26 0.12 4.20 -1.99 -2.32 115.11 115.49 1twc h GLN 309 Ca 0.00 -0.71 0.02 0.00 0.06 0.00 0.00 58.65 58.02 1twc h GLN 309 Cb 0.20 0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1twc h GLN 309 CO 0.00 1.30 0.13 1.98 -0.67 0.00 0.00 178.83 181.56 1twc h MET 310 N 0.34 0.26 -0.66 1.46 4.05 -1.77 -3.00 114.93 115.61 1twc h MET 310 Ca -0.13 -0.02 -0.07 0.00 -0.28 0.00 0.00 59.70 59.21 1twc h MET 310 Cb 1.72 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 32.44 1twc h MET 310 CO 0.20 0.17 0.15 -0.07 0.23 0.00 0.00 176.91 177.59 1twc h LEU 311 N 0.27 1.00 -1.66 3.39 3.38 -1.51 0.53 115.31 120.71 1twc h LEU 311 Ca 0.11 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1twc h LEU 311 Cb 0.04 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1twc h LEU 311 CO -0.08 0.97 -0.19 -0.08 0.09 0.00 0.00 178.44 179.15 1twc h GLU 312 N 1.00 0.00 0.00 1.13 4.57 -1.43 -1.68 114.58 118.17 1twc h GLU 312 Ca 0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 1twc h GLU 312 Cb 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1twc h GLU 312 CO 0.00 0.19 0.00 0.52 -1.18 0.00 0.00 179.01 178.54 1twc h MET 313 N 0.00 0.00 -0.01 1.92 2.86 0.20 -3.05 114.93 116.85 1twc h MET 313 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1twc h MET 313 Cb 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1twc h MET 313 CO 0.02 0.00 -0.41 1.28 1.06 0.00 0.00 176.91 178.87 1twc n LEU 314 N -2.56 1.59 -0.06 1.22 4.77 -0.68 -4.37 117.00 116.91 1twc n LEU 314 Ca 0.04 -0.55 -0.08 0.00 -0.03 0.00 0.00 56.01 55.40 1twc n LEU 314 Cb 0.41 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.43 1twc n LEU 314 CO 0.29 0.30 0.84 0.11 -1.33 0.00 0.00 177.39 177.60 1twc h LYS 315 N 1.86 0.03 -0.53 3.23 1.57 -1.30 -2.12 116.57 119.32 1twc h LYS 315 Ca 0.00 -0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.90 1twc h LYS 315 Cb 0.65 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.92 1twc h LYS 315 CO 0.00 0.02 0.37 -1.35 -0.57 0.00 0.00 179.45 177.92 1twc h PRO 316 N 0.03 0.16 -0.34 3.15 0.11 -1.81 0.09 132.00 133.39 1twc h PRO 316 Ca 0.12 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.16 1twc h PRO 316 Cb 0.17 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 1twc h PRO 316 CO -0.23 0.11 -0.02 0.00 -0.21 0.00 0.00 178.00 177.65 1twc h VAL 318 N 0.41 1.06 -0.12 0.00 2.07 -0.40 -1.07 116.25 118.20 1twc h VAL 318 Ca 0.09 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.44 1twc h VAL 318 Cb 0.48 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1twc h VAL 318 CO 0.02 0.11 0.13 -0.33 0.02 0.00 0.00 177.57 177.52 1twc h GLU 319 N 0.61 0.00 0.00 1.57 5.08 -1.07 -1.78 114.58 118.99 1twc h GLU 319 Ca 0.20 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1twc h GLU 319 Cb 0.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 1twc h GLU 319 CO -0.09 0.00 -1.05 -3.47 -1.00 0.00 0.00 179.01 173.40 1twc n ASP 320 N -3.86 0.82 -1.01 1.42 2.03 -0.45 -2.94 116.55 112.56 1twc n ASP 320 Ca -0.00 0.32 0.10 0.00 0.52 0.00 0.00 54.79 55.73 1twc n ASP 320 Cb 0.23 0.50 0.18 0.00 -0.72 0.00 0.00 41.12 41.32 1twc n ASP 320 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1twc n GLY 321 N 1.19 1.56 0.36 0.27 0.00 -0.92 -4.72 105.19 102.93 1twc n GLY 321 Ca -0.00 -0.65 0.09 0.00 0.00 0.00 0.00 46.02 45.46 1twc n GLY 321 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1twc h PHE 322 N 3.97 0.68 0.00 1.61 3.57 -1.21 -1.32 116.94 124.25 1twc h PHE 322 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1twc h PHE 322 Cb 0.90 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.42 1twc h PHE 322 CO 0.20 0.33 0.00 0.28 -2.23 0.00 0.00 178.31 176.89 1twc h VAL 323 N 0.64 0.00 -3.38 1.41 2.07 -1.84 -3.41 116.25 111.74 1twc h VAL 323 Ca 0.33 -0.15 -0.67 0.00 0.82 0.00 0.00 66.70 67.03 1twc h VAL 323 Cb 0.44 0.95 -0.31 0.00 -1.52 0.00 0.00 31.29 30.85 1twc h VAL 323 CO -0.11 0.00 -0.76 -0.63 0.02 0.00 0.00 177.57 176.09 1twc s ILE 324 N -3.71 2.92 -0.07 4.57 1.09 -0.50 -4.93 121.20 120.57 1twc s ILE 324 Ca -0.01 -0.80 0.01 0.00 -1.10 0.00 0.00 60.65 58.74 1twc s ILE 324 Cb 0.09 -2.38 0.01 0.00 -1.06 0.00 0.00 42.46 39.12 1twc s ILE 324 CO 0.37 0.35 0.61 0.00 -0.10 0.00 0.00 174.94 176.17 1twc n GLN 325 N 4.71 -0.21 -4.02 2.79 1.13 -1.26 -4.99 117.38 115.53 1twc n GLN 325 Ca -0.18 -0.71 -0.11 0.00 -1.94 0.00 0.00 57.00 54.06 1twc n GLN 325 Cb 0.49 -1.01 -0.05 0.00 0.11 0.00 0.00 30.24 29.78 1twc n GLN 325 CO 0.00 0.00 0.00 0.16 -1.44 0.00 0.00 177.06 175.78 1twc s ASP 326 N -0.22 0.16 0.36 1.08 3.84 -1.26 -4.99 116.67 115.64 1twc s ASP 326 Ca 0.01 -1.10 0.06 0.00 -0.00 0.00 0.00 52.55 51.52 1twc s ASP 326 Cb 0.01 0.61 0.68 0.00 -1.38 0.00 0.00 42.92 42.83 1twc s ASP 326 CO 0.01 -1.20 1.89 -0.09 -0.00 0.00 0.00 175.17 175.78 1twc h ARG 327 N 2.22 0.41 0.30 2.11 2.43 -1.96 0.29 114.38 120.19 1twc h ARG 327 Ca -0.27 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 58.79 1twc h ARG 327 Cb 1.25 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1twc h ARG 327 CO 0.37 0.48 -0.14 0.93 -1.51 0.00 0.00 179.97 180.10 1twc h GLU 328 N 0.39 -0.39 -0.95 0.20 4.39 -1.95 -1.20 114.58 115.07 1twc h GLU 328 Ca 0.08 0.03 0.30 0.00 0.34 0.00 0.00 59.36 60.11 1twc h GLU 328 Cb 0.34 0.09 -0.15 0.00 -0.10 0.00 0.00 28.75 28.93 1twc h GLU 328 CO 0.01 -0.16 0.37 1.15 -1.16 0.00 0.00 179.01 179.23 1twc h THR 329 N -1.05 0.23 -0.33 1.13 2.02 -1.98 -1.15 112.91 111.78 1twc h THR 329 Ca -0.04 -0.07 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 1twc h THR 329 Cb 0.41 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 1twc h THR 329 CO 0.07 0.04 0.05 0.00 0.37 0.00 0.00 175.52 176.04 1twc h ALA 330 N 1.86 0.43 -0.66 6.16 0.00 -0.54 -1.58 119.26 124.93 1twc h ALA 330 Ca 0.67 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.40 1twc h ALA 330 Cb 1.50 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 1twc h ALA 330 CO -0.69 0.13 0.42 -0.07 0.00 0.00 0.00 179.25 179.05 1twc h LEU 331 N 0.37 0.71 -0.47 0.00 3.38 -0.89 -2.14 115.31 116.26 1twc h LEU 331 Ca 0.10 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.09 1twc h LEU 331 Cb 0.36 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1twc h LEU 331 CO 0.01 0.50 0.25 -0.78 0.09 0.00 0.00 178.44 178.51 1twc h ASP 332 N 0.84 0.39 -0.68 -0.43 -0.00 -0.99 0.77 116.42 116.31 1twc h ASP 332 Ca 0.26 0.02 0.14 0.00 -0.00 0.00 0.00 57.03 57.44 1twc h ASP 332 Cb -0.03 -0.06 -0.13 0.00 -0.00 0.00 0.00 39.33 39.12 1twc h ASP 332 CO -0.09 0.27 -0.12 0.15 -0.00 0.00 0.00 179.24 179.46 1twc h PHE 333 N 0.50 -0.27 0.53 0.28 3.57 -0.89 0.49 116.94 121.16 1twc h PHE 333 Ca 0.20 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 1twc h PHE 333 Cb 0.07 0.22 0.01 0.00 2.79 0.00 0.00 35.95 39.04 1twc h PHE 333 CO -0.09 -0.27 -0.26 0.82 -2.23 0.00 0.00 178.31 176.29 1twc h ILE 334 N 0.03 0.40 -0.70 1.41 2.04 -1.21 -3.23 117.51 116.24 1twc h ILE 334 Ca 0.34 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 65.93 1twc h ILE 334 Cb 0.54 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 1twc h ILE 334 CO -0.67 0.04 0.46 1.23 0.00 0.00 0.00 178.15 179.22 1twc h GLY 335 N -0.93 0.95 2.00 5.37 0.00 0.22 0.24 103.07 110.93 1twc h GLY 335 Ca -0.07 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 1twc h GLY 335 CO 0.12 0.27 -0.12 3.21 0.00 0.00 0.00 176.54 180.01 1twc h ARG 336 N 0.81 0.00 0.00 4.80 3.08 -0.18 -2.13 114.38 120.77 1twc h ARG 336 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1twc h ARG 336 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1twc h ARG 336 CO -0.09 0.12 0.00 0.54 -1.07 0.00 0.00 179.97 179.48 1twc n ARG 337 N -3.70 0.75 0.00 0.04 1.74 0.07 -3.63 116.66 111.94 1twc n ARG 337 Ca -0.02 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1twc n ARG 337 Cb 0.24 -1.16 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 1twc n ARG 337 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1twc n GLY 338 N 0.34 0.97 3.19 -0.13 0.00 -0.82 -1.70 105.19 107.04 1twc n GLY 338 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.91 1twc n GLY 338 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1twc s THR 339 N -0.72 1.09 0.56 2.61 -4.23 -1.07 -4.98 115.64 108.88 1twc s THR 339 Ca 0.00 -1.57 -0.10 0.00 -1.18 0.00 0.00 61.69 58.85 1twc s THR 339 Cb 0.00 -1.32 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 1twc s THR 339 CO 0.00 -0.43 0.94 0.00 -0.54 0.00 0.00 174.62 174.59 1twc s ALA 340 N -2.04 3.20 0.15 3.99 0.00 -1.26 -4.88 121.76 120.92 1twc s ALA 340 Ca 0.04 -0.19 -0.31 0.00 0.00 0.00 0.00 51.96 51.50 1twc s ALA 340 Cb -0.05 -2.92 -0.09 0.00 0.00 0.00 0.00 23.12 20.06 1twc s ALA 340 CO 0.02 -0.51 1.43 -1.17 0.00 0.00 0.00 175.76 175.52 1twc s LEU 341 N -4.88 4.38 0.00 0.00 2.96 -1.26 -1.12 118.68 118.76 1twc s LEU 341 Ca 0.53 2.45 0.00 0.00 -0.22 0.00 0.00 54.13 56.88 1twc s LEU 341 Cb -0.11 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.99 1twc s LEU 341 CO 0.48 -0.69 0.00 0.61 -1.32 0.00 0.00 176.35 175.43 1twc n GLY 342 N 3.28 2.66 3.67 7.98 0.00 -1.26 -5.06 105.19 116.45 1twc n GLY 342 Ca 0.11 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 1twc n GLY 342 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1twc s ILE 343 N -0.69 3.50 0.40 -0.61 1.09 -0.28 -4.98 121.20 119.63 1twc s ILE 343 Ca 0.00 0.68 -0.26 0.00 -1.10 0.00 0.00 60.65 59.98 1twc s ILE 343 Cb 0.00 -3.44 -0.11 0.00 -1.06 0.00 0.00 42.46 37.85 1twc s ILE 343 CO 0.00 -0.05 1.15 0.29 -0.10 0.00 0.00 174.94 176.23 1twc n LYS 344 N 6.81 1.67 -0.28 2.79 5.02 -1.26 -4.78 118.16 128.12 1twc n LYS 344 Ca 0.17 0.59 -0.06 0.00 -2.02 0.00 0.00 58.31 57.00 1twc n LYS 344 Cb 0.42 -2.19 -0.01 0.00 -0.02 0.00 0.00 35.03 33.24 1twc n LYS 344 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1twc h LYS 345 N 1.91 -0.12 -0.37 1.97 3.64 -1.98 0.77 116.57 122.40 1twc h LYS 345 Ca -0.45 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 58.94 1twc h LYS 345 Cb 1.31 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.14 1twc h LYS 345 CO 0.59 -0.08 0.24 1.49 -2.27 0.00 0.00 179.45 179.43 1twc h GLU 346 N -0.12 0.46 -0.07 1.90 4.81 -1.99 -0.49 114.58 119.08 1twc h GLU 346 Ca 0.24 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.31 1twc h GLU 346 Cb 0.56 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.84 1twc h GLU 346 CO -0.80 0.31 -0.49 0.87 -0.73 0.00 0.00 179.01 178.16 1twc h LYS 347 N 0.48 0.45 -0.24 1.92 1.57 0.13 -2.24 116.57 118.64 1twc h LYS 347 Ca 0.14 -0.40 0.06 0.00 -1.87 0.00 0.00 60.65 58.58 1twc h LYS 347 Cb -0.02 0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.31 1twc h LYS 347 CO -0.03 1.04 -0.21 0.00 -0.57 0.00 0.00 179.45 179.68 1twc h ARG 348 N 0.00 -0.20 -0.55 3.15 3.08 -0.12 -0.97 114.38 118.77 1twc h ARG 348 Ca -0.04 0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.12 1twc h ARG 348 Cb 1.16 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 31.17 1twc h ARG 348 CO 0.10 -0.13 0.09 0.82 -1.07 0.00 0.00 179.97 179.78 1twc h ILE 349 N -0.21 0.66 0.00 2.04 2.04 -1.20 -1.98 117.51 118.85 1twc h ILE 349 Ca 0.14 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.88 1twc h ILE 349 Cb 0.42 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1twc h ILE 349 CO -0.36 0.04 -0.21 -0.61 0.00 0.00 0.00 178.15 177.01 1twc h GLN 350 N 0.22 0.00 -0.50 2.37 5.75 -1.21 -0.98 115.11 120.76 1twc h GLN 350 Ca 0.28 0.00 -0.07 0.00 -0.15 0.00 0.00 58.65 58.72 1twc h GLN 350 Cb 0.41 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.94 1twc h GLN 350 CO -0.38 0.21 0.06 -0.92 -2.65 0.00 0.00 178.83 175.14 1twc h TYR 351 N 0.00 0.91 -0.28 3.99 3.20 -0.43 -2.81 116.97 121.55 1twc h TYR 351 Ca -0.00 -0.14 -0.08 0.00 3.14 0.00 0.00 58.73 61.65 1twc h TYR 351 Cb 0.55 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 1twc h TYR 351 CO 0.00 0.84 -0.15 0.00 -1.64 0.00 0.00 178.16 177.21 1twc h ALA 352 N 0.96 0.40 -0.66 1.82 0.00 -0.92 0.27 119.26 121.12 1twc h ALA 352 Ca 0.15 -0.33 0.03 0.00 0.00 0.00 0.00 54.91 54.76 1twc h ALA 352 Cb 0.44 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1twc h ALA 352 CO 0.01 0.29 0.41 0.87 0.00 0.00 0.00 179.25 180.83 1twc h LYS 353 N 0.34 0.77 -0.26 0.00 1.57 -1.21 -0.44 116.57 117.34 1twc h LYS 353 Ca 0.06 -0.05 -0.18 0.00 -1.87 0.00 0.00 60.65 58.62 1twc h LYS 353 Cb 0.67 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.80 1twc h LYS 353 CO 0.04 0.51 -0.55 -0.44 -0.57 0.00 0.00 179.45 178.45 1twc h ASP 354 N 0.80 0.87 0.12 0.86 3.32 -1.12 -0.49 116.42 120.77 1twc h ASP 354 Ca 0.27 -0.47 0.01 0.00 0.02 0.00 0.00 57.03 56.86 1twc h ASP 354 Cb 0.03 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 1twc h ASP 354 CO -0.11 1.24 -0.17 0.40 -1.72 0.00 0.00 179.24 178.88 1twc h ILE 355 N 0.60 0.62 0.00 0.35 1.08 -0.08 -0.42 117.51 119.65 1twc h ILE 355 Ca 0.01 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.45 1twc h ILE 355 Cb 1.14 0.62 -0.01 0.00 -3.07 0.00 0.00 36.82 35.50 1twc h ILE 355 CO 0.12 0.00 -0.17 -0.07 -0.69 0.00 0.00 178.15 177.33 1twc h LEU 356 N -0.34 0.00 0.00 1.44 3.38 -0.85 -0.69 115.31 118.26 1twc h LEU 356 Ca 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1twc h LEU 356 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1twc h LEU 356 CO -0.08 0.17 -1.13 -0.61 0.09 0.00 0.00 178.44 176.89 1twc h GLN 357 N 0.00 0.00 0.00 1.13 4.15 -0.79 -3.38 115.11 116.22 1twc h GLN 357 Ca -0.00 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.36 1twc h GLN 357 Cb 0.42 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1twc h GLN 357 CO 0.02 0.12 -1.23 1.63 -1.93 0.00 0.00 178.83 177.44 1twc n LYS 358 N -2.78 1.35 -0.00 1.69 5.02 -0.19 -4.41 118.16 118.84 1twc n LYS 358 Ca -0.04 0.01 0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1twc n LYS 358 Cb 0.66 -1.08 0.01 0.00 -0.02 0.00 0.00 35.03 34.60 1twc n LYS 358 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1twc n GLU 359 N -2.43 -0.38 -4.18 1.97 -0.58 -0.31 -4.62 120.64 110.10 1twc n GLU 359 Ca -0.06 -0.70 -0.34 0.00 -0.42 0.00 0.00 57.16 55.63 1twc n GLU 359 Cb 0.59 -1.03 -0.13 0.00 -0.57 0.00 0.00 31.44 30.30 1twc n GLU 359 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 1twc s PHE 360 N -0.22 3.01 -0.79 -0.32 5.36 -0.92 -4.60 117.98 119.49 1twc s PHE 360 Ca 0.02 -0.48 -0.23 0.00 -0.96 0.00 0.00 56.93 55.28 1twc s PHE 360 Cb 0.01 -2.04 0.03 0.00 -0.34 0.00 0.00 43.02 40.69 1twc s PHE 360 CO 0.02 -0.22 0.44 1.28 -1.46 0.00 0.00 175.22 175.29 1twc n LEU 361 N 4.07 -0.06 0.03 6.12 4.77 -1.26 -4.79 117.00 125.87 1twc n LEU 361 Ca -0.17 -0.86 0.05 0.00 -0.03 0.00 0.00 56.01 55.00 1twc n LEU 361 Cb 0.52 -1.03 0.25 0.00 -2.33 0.00 0.00 43.42 40.83 1twc n LEU 361 CO 0.32 0.55 0.67 -0.81 -1.33 0.00 0.00 177.39 176.78 1twc n PRO 362 N -3.65 0.04 0.12 3.23 -0.04 -1.26 -1.54 135.00 131.90 1twc n PRO 362 Ca -0.07 0.39 0.12 0.00 -0.04 0.00 0.00 63.50 63.90 1twc n PRO 362 Cb 0.36 -1.59 0.48 0.00 -0.04 0.00 0.00 33.50 32.72 1twc n PRO 362 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1twc n HIS 363 N -1.65 0.76 0.00 0.54 1.44 -1.26 -4.00 115.22 111.04 1twc n HIS 363 Ca 0.02 0.30 0.00 0.00 -2.01 0.00 0.00 57.72 56.03 1twc n HIS 363 Cb 0.10 -0.99 0.00 0.00 0.12 0.00 0.00 29.99 29.23 1twc n HIS 363 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 1twc n ILE 364 N -2.20 0.00 -3.75 0.61 5.41 -0.59 -4.94 119.36 113.91 1twc n ILE 364 Ca 0.02 0.46 -0.13 0.00 1.00 0.00 0.00 62.75 64.10 1twc n ILE 364 Cb 0.22 -1.38 -0.08 0.00 -0.71 0.00 0.00 39.64 37.68 1twc n ILE 364 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1twc s THR 365 N -0.92 0.06 -0.77 1.39 2.01 -1.26 -5.04 115.64 111.11 1twc s THR 365 Ca 0.00 -0.48 0.09 0.00 0.31 0.00 0.00 61.69 61.61 1twc s THR 365 Cb 0.00 -0.69 0.27 0.00 0.01 0.00 0.00 72.50 72.09 1twc s THR 365 CO 0.00 -0.26 1.22 0.00 -0.69 0.00 0.00 174.62 174.89 1twc n GLN 366 N 1.14 2.89 -3.42 4.92 6.02 -1.26 -4.53 117.38 123.13 1twc n GLN 366 Ca -0.21 -1.99 -0.19 0.00 -0.01 0.00 0.00 57.00 54.60 1twc n GLN 366 Cb 0.57 -1.24 -0.01 0.00 1.02 0.00 0.00 30.24 30.57 1twc n GLN 366 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 1twc s LEU 367 N -1.05 3.71 0.09 1.08 2.34 -1.26 -4.62 118.68 118.96 1twc s LEU 367 Ca 0.20 -0.41 -0.18 0.00 0.06 0.00 0.00 54.13 53.79 1twc s LEU 367 Cb 0.11 -2.50 -0.08 0.00 -0.56 0.00 0.00 46.19 43.16 1twc s LEU 367 CO 0.13 -0.55 1.54 -0.33 -1.06 0.00 0.00 176.35 176.08 1twc h GLU 368 N 0.91 0.44 -0.99 1.48 5.08 -1.97 -3.34 114.58 116.19 1twc h GLU 368 Ca -0.43 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1twc h GLU 368 Cb 1.26 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1twc h GLU 368 CO 0.52 0.59 0.00 0.41 -1.00 0.00 0.00 179.01 179.54 1twc n GLY 369 N -0.37 1.61 2.77 -3.84 0.00 -1.26 -4.76 105.19 99.34 1twc n GLY 369 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 1twc n GLY 369 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1twc n PHE 370 N 0.24 3.67 -0.06 1.61 3.01 -1.26 -4.70 117.46 119.97 1twc n PHE 370 Ca 0.00 -3.75 -0.07 0.00 1.01 0.00 0.00 57.45 54.64 1twc n PHE 370 Cb 0.33 -0.65 -0.08 0.00 -0.01 0.00 0.00 39.48 39.07 1twc n PHE 370 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1twc n GLU 371 N 0.15 1.48 0.09 -1.08 4.71 -1.26 -3.74 120.64 120.99 1twc n GLU 371 Ca 0.33 0.03 -0.01 0.00 -0.01 0.00 0.00 57.16 57.50 1twc n GLU 371 Cb 0.37 -1.30 0.28 0.00 -1.01 0.00 0.00 31.44 29.78 1twc n GLU 371 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 1twc h SER 372 N 0.00 0.26 -0.24 1.62 0.87 -1.90 -2.02 113.55 112.15 1twc h SER 372 Ca -0.32 -0.09 -0.07 0.00 -1.23 0.00 0.00 61.79 60.08 1twc h SER 372 Cb 1.64 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.51 1twc h SER 372 CO -0.01 0.56 -0.06 0.03 -0.53 0.00 0.00 176.83 176.82 1twc h ARG 373 N 0.23 0.60 0.06 2.24 3.08 -1.94 -2.26 114.38 116.39 1twc h ARG 373 Ca 0.03 -0.16 -0.26 0.00 0.07 0.00 0.00 59.98 59.67 1twc h ARG 373 Cb 0.65 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1twc h ARG 373 CO 0.05 0.67 -1.26 0.87 -1.07 0.00 0.00 179.97 179.22 1twc h LYS 374 N 0.56 0.12 0.02 0.04 1.57 -1.59 -2.86 116.57 114.43 1twc h LYS 374 Ca 0.11 -0.20 0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1twc h LYS 374 Cb 0.45 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 1twc h LYS 374 CO 0.02 1.01 -0.11 0.00 -0.57 0.00 0.00 179.45 179.81 1twc h ALA 375 N 0.79 -0.13 -0.71 3.86 0.00 -1.20 0.12 119.26 121.99 1twc h ALA 375 Ca -0.12 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.82 1twc h ALA 375 Cb 1.90 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 19.83 1twc h ALA 375 CO 0.15 -0.60 0.44 0.74 0.00 0.00 0.00 179.25 179.98 1twc h PHE 376 N -0.19 0.83 -0.12 0.00 -1.00 -1.48 0.28 116.94 115.26 1twc h PHE 376 Ca 0.03 0.02 -0.17 0.00 2.81 0.00 0.00 57.97 60.67 1twc h PHE 376 Cb 0.23 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.51 1twc h PHE 376 CO -0.16 0.48 -0.63 0.35 -1.61 0.00 0.00 178.31 176.73 1twc h PHE 377 N 0.87 0.58 -0.30 -0.55 3.57 -1.18 -0.23 116.94 119.70 1twc h PHE 377 Ca 0.28 -0.23 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 1twc h PHE 377 Cb 0.02 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 1twc h PHE 377 CO -0.04 0.96 -0.05 1.25 -2.23 0.00 0.00 178.31 178.19 1twc h LEU 378 N 0.33 0.44 -0.21 0.59 5.85 -0.33 -1.55 115.31 120.43 1twc h LEU 378 Ca -0.01 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 1twc h LEU 378 Cb 1.18 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1twc h LEU 378 CO 0.11 0.55 0.09 1.23 -0.34 0.00 0.00 178.44 180.09 1twc h GLY 379 N 0.84 0.33 1.28 3.75 0.00 -0.22 -1.41 103.07 107.64 1twc h GLY 379 Ca 0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 1twc h GLY 379 CO 0.02 0.16 0.27 -1.82 0.00 0.00 0.00 176.54 175.17 1twc h TYR 380 N 0.20 0.93 -0.23 5.60 3.20 -0.11 0.16 116.97 126.72 1twc h TYR 380 Ca 0.07 -0.05 -0.17 0.00 3.14 0.00 0.00 58.73 61.72 1twc h TYR 380 Cb 0.14 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.13 1twc h TYR 380 CO -0.02 0.70 -0.55 0.52 -1.64 0.00 0.00 178.16 177.17 1twc h MET 381 N 0.91 0.69 -0.18 1.82 2.86 -0.97 -2.13 114.93 117.93 1twc h MET 381 Ca 0.22 -0.44 -0.10 0.00 -2.06 0.00 0.00 59.70 57.32 1twc h MET 381 Cb 0.16 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1twc h MET 381 CO -0.02 1.06 -0.31 0.82 1.06 0.00 0.00 176.91 179.52 1twc h ILE 382 N 0.53 1.28 0.19 -1.22 2.04 -0.15 -1.78 117.51 118.39 1twc h ILE 382 Ca 0.01 -1.33 0.01 0.00 1.00 0.00 0.00 64.86 64.55 1twc h ILE 382 Cb 1.12 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 38.66 1twc h ILE 382 CO 0.11 0.41 -0.26 -1.13 0.00 0.00 0.00 178.15 177.28 1twc h ASN 383 N 0.31 -0.72 -0.65 1.72 -1.24 -0.28 -1.12 115.58 113.60 1twc h ASN 383 Ca 0.04 0.07 0.14 0.00 0.71 0.00 0.00 56.30 57.26 1twc h ASN 383 Cb 0.71 0.26 -0.11 0.00 0.73 0.00 0.00 38.32 39.91 1twc h ASN 383 CO 0.05 -0.37 0.05 0.03 -1.29 0.00 0.00 177.43 175.91 1twc h ARG 384 N -0.52 0.16 -0.37 6.67 2.47 -1.32 0.25 114.38 121.72 1twc h ARG 384 Ca 0.01 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1twc h ARG 384 Cb 0.51 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.77 1twc h ARG 384 CO -0.10 0.10 0.24 1.25 0.56 0.00 0.00 179.97 182.02 1twc h LEU 385 N 0.16 0.43 -1.14 3.04 5.85 -1.14 -2.86 115.31 119.65 1twc h LEU 385 Ca 0.35 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.99 1twc h LEU 385 Cb 0.57 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1twc h LEU 385 CO -0.52 0.32 -0.11 -0.07 -0.34 0.00 0.00 178.44 177.72 1twc h LEU 386 N 0.50 0.46 -1.37 2.25 3.38 -0.45 -2.31 115.31 117.77 1twc h LEU 386 Ca 0.14 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1twc h LEU 386 Cb -0.05 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1twc h LEU 386 CO -0.03 0.60 -0.31 0.25 0.09 0.00 0.00 178.44 179.04 1twc h LEU 387 N 0.44 0.00 0.00 1.67 5.85 -0.75 0.24 115.31 122.77 1twc h LEU 387 Ca 0.09 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1twc h LEU 387 Cb 0.46 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 1twc h LEU 387 CO 0.03 0.31 -0.07 0.00 -0.34 0.00 0.00 178.44 178.36 1twc h ALA 389 N -0.03 2.20 -0.01 0.00 0.00 -0.96 -2.28 119.26 118.19 1twc h ALA 389 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1twc h ALA 389 Cb 1.02 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1twc h ALA 389 CO -0.01 -0.42 0.00 1.28 0.00 0.00 0.00 179.25 180.10 1twc n LEU 390 N -4.24 0.78 -1.35 0.00 4.77 0.81 -4.94 117.00 112.82 1twc n LEU 390 Ca 0.05 -0.26 -0.09 0.00 -0.03 0.00 0.00 56.01 55.67 1twc n LEU 390 Cb 0.42 -0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.53 1twc n LEU 390 CO 0.34 0.13 -0.01 0.47 -1.33 0.00 0.00 177.39 176.98 1twc n ASP 391 N -0.39 -3.40 0.08 -1.43 9.92 -0.86 -4.92 116.55 115.55 1twc n ASP 391 Ca 0.21 -0.11 0.03 0.00 -0.53 0.00 0.00 54.79 54.39 1twc n ASP 391 Cb 0.24 -2.36 -0.03 0.00 -0.64 0.00 0.00 41.12 38.33 1twc n ASP 391 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 1twc h ARG 392 N -0.52 0.00 -4.02 -1.24 3.08 -1.19 -3.48 114.38 107.02 1twc h ARG 392 Ca -0.22 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.58 1twc h ARG 392 Cb 1.15 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 30.94 1twc h ARG 392 CO 0.24 0.29 -0.73 0.15 -1.07 0.00 0.00 179.97 178.85 1twc s LYS 393 N -3.01 0.23 0.58 0.04 -0.14 -0.93 -4.97 119.74 111.53 1twc s LYS 393 Ca -0.00 -0.25 -0.16 0.00 -1.36 0.00 0.00 55.97 54.20 1twc s LYS 393 Cb 0.08 -0.11 -0.05 0.00 -1.68 0.00 0.00 37.83 36.07 1twc s LYS 393 CO 0.79 0.02 1.04 -0.51 -0.76 0.00 0.00 175.35 175.93 1twc s ASP 394 N -0.49 6.00 0.65 2.83 1.01 -1.26 -4.27 116.67 121.13 1twc s ASP 394 Ca -0.04 1.75 -0.18 0.00 0.71 0.00 0.00 52.55 54.79 1twc s ASP 394 Cb -0.04 -2.53 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 1twc s ASP 394 CO -0.00 -1.02 1.29 0.00 0.21 0.00 0.00 175.17 175.65 1twc s GLN 395 N -4.10 2.54 0.46 8.23 -2.07 -1.26 -4.93 119.66 118.53 1twc s GLN 395 Ca 0.62 2.06 -0.22 0.00 -1.82 0.00 0.00 55.36 56.00 1twc s GLN 395 Cb -0.14 -1.84 -0.08 0.00 -1.09 0.00 0.00 33.01 29.85 1twc s GLN 395 CO 0.36 -1.61 1.06 -0.51 -1.32 0.00 0.00 175.29 173.28 1twc s ASP 396 N -1.41 6.43 -0.76 12.60 1.01 -0.75 -4.95 116.67 128.83 1twc s ASP 396 Ca 0.82 2.02 -0.22 0.00 0.71 0.00 0.00 52.55 55.89 1twc s ASP 396 Cb -0.37 -2.57 0.09 0.00 1.01 0.00 0.00 42.92 41.07 1twc s ASP 396 CO 0.40 -0.72 1.05 -0.62 0.21 0.00 0.00 175.17 175.49 1twc s ASP 397 N -1.75 6.32 0.00 0.27 -1.08 -1.26 -4.93 116.67 114.24 1twc s ASP 397 Ca 0.64 -1.31 0.02 0.00 -0.52 0.00 0.00 52.55 51.38 1twc s ASP 397 Cb -0.20 -2.43 0.11 0.00 -1.46 0.00 0.00 42.92 38.94 1twc s ASP 397 CO 0.25 -1.35 0.92 0.54 0.52 0.00 0.00 175.17 176.05 1twc n ARG 398 N 7.51 0.02 -0.29 4.34 1.74 -1.26 -2.91 116.66 125.81 1twc n ARG 398 Ca 0.07 0.31 0.11 0.00 -0.77 0.00 0.00 57.85 57.57 1twc n ARG 398 Cb 0.47 -1.50 0.27 0.00 -1.02 0.00 0.00 32.46 30.68 1twc n ARG 398 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1twc n ASP 399 N -1.34 3.69 -4.64 0.55 8.00 -1.26 -4.81 116.55 116.74 1twc n ASP 399 Ca 0.01 -1.99 -0.43 0.00 0.71 0.00 0.00 54.79 53.10 1twc n ASP 399 Cb 0.02 -0.38 -0.03 0.00 -0.02 0.00 0.00 41.12 40.71 1twc n ASP 399 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1twc s HIS 400 N -1.16 1.89 -0.08 1.24 2.46 -1.15 -4.84 115.29 113.65 1twc s HIS 400 Ca 0.43 0.30 0.29 0.00 0.47 0.00 0.00 55.06 56.55 1twc s HIS 400 Cb 0.23 -3.97 1.36 0.00 -0.13 0.00 0.00 32.58 30.07 1twc s HIS 400 CO 0.31 -3.67 1.88 0.35 -2.47 0.00 0.00 174.74 171.14 1twc h PHE 401 N 10.58 0.00 0.00 3.88 3.57 -1.93 -1.84 116.94 131.19 1twc h PHE 401 Ca -0.38 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.12 1twc h PHE 401 Cb 1.18 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.92 1twc h PHE 401 CO 0.91 0.00 0.00 0.41 -2.23 0.00 0.00 178.31 177.40 1twc n GLY 402 N -0.44 -1.07 1.51 2.40 0.00 -1.26 -1.77 105.19 104.56 1twc n GLY 402 Ca 0.00 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.03 1twc n GLY 402 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1twc n LYS 403 N -1.41 3.63 -4.08 1.61 5.02 -0.69 -4.70 118.16 117.54 1twc n LYS 403 Ca 0.07 -2.62 -0.23 0.00 -2.02 0.00 0.00 58.31 53.51 1twc n LYS 403 Cb 0.20 -1.89 -0.06 0.00 -0.02 0.00 0.00 35.03 33.25 1twc n LYS 403 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1twc s LYS 404 N -1.94 2.33 0.01 1.97 -0.14 -0.73 -1.57 119.74 119.68 1twc s LYS 404 Ca 0.47 -1.63 0.02 0.00 -1.36 0.00 0.00 55.97 53.47 1twc s LYS 404 Cb 0.31 -2.13 -0.01 0.00 -1.68 0.00 0.00 37.83 34.32 1twc s LYS 404 CO 0.21 0.04 -0.05 1.03 -0.76 0.00 0.00 175.35 175.81 1twc s ARG 405 N -3.87 0.41 -0.12 1.68 1.81 -0.83 -4.70 118.95 113.33 1twc s ARG 405 Ca 0.39 -0.33 -0.01 0.00 -1.72 0.00 0.00 55.73 54.06 1twc s ARG 405 Cb -0.01 -0.33 -0.02 0.00 -0.45 0.00 0.00 34.95 34.14 1twc s ARG 405 CO 0.23 0.08 -0.10 -0.51 -0.68 0.00 0.00 175.30 174.32 1twc s LEU 406 N -0.54 2.93 -0.27 2.53 1.43 -0.47 -1.53 118.68 122.78 1twc s LEU 406 Ca -0.02 -0.22 -0.10 0.00 -1.03 0.00 0.00 54.13 52.76 1twc s LEU 406 Cb -0.04 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.47 1twc s LEU 406 CO -0.00 0.20 0.16 -1.81 0.23 0.00 0.00 176.35 175.13 1twc s ASP 407 N 0.13 5.80 0.04 2.29 1.01 0.17 -4.30 116.67 121.81 1twc s ASP 407 Ca -0.04 -0.06 0.00 0.00 0.71 0.00 0.00 52.55 53.16 1twc s ASP 407 Cb -0.14 -2.07 0.00 0.00 1.01 0.00 0.00 42.92 41.72 1twc s ASP 407 CO 0.04 -0.04 0.04 0.18 0.21 0.00 0.00 175.17 175.60 1twc n LEU 408 N 5.01 0.00 -0.29 1.23 4.77 -1.26 -1.31 117.00 125.14 1twc n LEU 408 Ca -0.15 -0.20 -0.08 0.00 -0.03 0.00 0.00 56.01 55.56 1twc n LEU 408 Cb 0.52 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.53 1twc n LEU 408 CO 0.33 -0.37 0.37 0.00 -1.33 0.00 0.00 177.39 176.39 1twc n ALA 409 N -2.93 -0.45 0.07 -1.18 0.00 -1.26 -1.88 120.51 112.89 1twc n ALA 409 Ca -0.01 0.59 -0.06 0.00 0.00 0.00 0.00 53.44 53.96 1twc n ALA 409 Cb 0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 1twc n ALA 409 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1twc h GLY 410 N 0.00 -1.06 -0.10 0.00 0.00 -1.89 0.75 103.07 100.76 1twc h GLY 410 Ca 0.11 0.49 0.27 0.00 0.00 0.00 0.00 47.33 48.20 1twc h GLY 410 CO -0.65 -0.35 0.68 -2.55 0.00 0.00 0.00 176.54 173.66 1twc h PRO 411 N -0.30 0.34 -0.13 4.80 0.11 -1.80 -1.07 132.00 133.95 1twc h PRO 411 Ca -0.01 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.96 1twc h PRO 411 Cb 0.28 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.32 1twc h PRO 411 CO -0.06 0.23 -0.39 -0.07 -0.21 0.00 0.00 178.00 177.50 1twc h LEU 412 N 0.36 0.56 -0.80 2.35 3.38 -0.99 -2.42 115.31 117.75 1twc h LEU 412 Ca 0.58 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1twc h LEU 412 Cb 1.54 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.12 1twc h LEU 412 CO -0.25 1.06 0.00 0.18 0.09 0.00 0.00 178.44 179.52 1twc n LEU 413 N -4.32 0.88 0.00 1.67 4.77 0.22 -2.79 117.00 117.43 1twc n LEU 413 Ca -0.07 -0.44 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1twc n LEU 413 Cb 0.53 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1twc n LEU 413 CO 0.44 0.20 -0.49 0.00 -1.33 0.00 0.00 177.39 176.21 1twc n ALA 414 N -0.11 1.99 -0.07 -1.18 0.00 -0.99 -3.38 120.51 116.77 1twc n ALA 414 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.36 1twc n ALA 414 Cb 0.21 0.34 -0.03 0.00 0.00 0.00 0.00 19.45 19.97 1twc n ALA 414 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1twc h GLN 415 N 0.00 -0.31 0.63 0.00 4.20 -1.32 0.37 115.11 118.68 1twc h GLN 415 Ca 0.00 0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1twc h GLN 415 Cb 0.98 0.07 0.01 0.00 0.30 0.00 0.00 27.48 28.84 1twc h GLN 415 CO 0.00 -0.21 -0.30 -0.07 -0.67 0.00 0.00 178.83 177.58 1twc h LEU 416 N -0.32 -0.71 0.00 1.46 3.38 -1.72 -3.04 115.31 114.35 1twc h LEU 416 Ca 0.14 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1twc h LEU 416 Cb 0.55 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1twc h LEU 416 CO -0.46 -0.35 0.00 0.33 0.09 0.00 0.00 178.44 178.05 1twc n PHE 417 N -5.36 0.00 0.04 1.13 -0.00 -1.14 -1.93 117.46 110.20 1twc n PHE 417 Ca -0.12 0.00 -0.03 0.00 -0.00 0.00 0.00 57.45 57.31 1twc n PHE 417 Cb 0.35 -0.18 -0.01 0.00 -0.00 0.00 0.00 39.48 39.64 1twc n PHE 417 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1twc h LYS 418 N 0.00 -0.17 -1.20 -4.13 3.64 -0.30 -1.53 116.57 112.89 1twc h LYS 418 Ca 0.00 0.01 0.43 0.00 -1.27 0.00 0.00 60.65 59.82 1twc h LYS 418 Cb 0.15 0.04 -0.14 0.00 -0.41 0.00 0.00 32.23 31.88 1twc h LYS 418 CO 0.00 -0.11 0.75 2.41 -2.27 0.00 0.00 179.45 180.23 1twc n THR 419 N -3.81 -0.26 -0.05 1.00 -1.04 -1.15 0.28 114.28 109.25 1twc n THR 419 Ca -0.02 1.70 -0.04 0.00 -2.04 0.00 0.00 64.05 63.65 1twc n THR 419 Cb 0.07 -2.78 -0.14 0.00 -1.82 0.00 0.00 70.33 65.65 1twc n THR 419 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1twc n LEU 420 N -4.65 0.31 0.17 -4.42 4.77 -0.81 -2.80 117.00 109.57 1twc n LEU 420 Ca 0.37 0.14 0.03 0.00 -0.03 0.00 0.00 56.01 56.52 1twc n LEU 420 Cb 1.39 0.28 0.28 0.00 -2.33 0.00 0.00 43.42 43.05 1twc n LEU 420 CO 0.14 0.33 0.62 0.15 -1.33 0.00 0.00 177.39 177.30 1twc h PHE 421 N 0.00 0.00 0.00 -1.77 3.57 0.92 -2.82 116.94 116.84 1twc h PHE 421 Ca -0.34 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.11 1twc h PHE 421 Cb 1.88 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.61 1twc h PHE 421 CO 0.00 0.45 -0.22 0.87 -2.23 0.00 0.00 178.31 177.19 1twc h LYS 422 N 0.00 0.00 0.00 1.11 1.79 -1.23 -0.20 116.57 118.04 1twc h LYS 422 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1twc h LYS 422 Cb 0.96 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.61 1twc h LYS 422 CO 0.06 0.22 0.00 1.63 -1.08 0.00 0.00 179.45 180.27 1twc n LYS 423 N -3.79 0.00 -0.28 3.15 5.02 -1.12 -3.31 118.16 117.83 1twc n LYS 423 Ca -0.02 0.49 0.25 0.00 -2.02 0.00 0.00 58.31 57.02 1twc n LYS 423 Cb 0.32 -1.12 0.44 0.00 -0.02 0.00 0.00 35.03 34.65 1twc n LYS 423 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1twc n LEU 424 N -1.98 0.18 0.13 -0.35 0.00 -1.08 -0.10 117.00 113.79 1twc n LEU 424 Ca 0.00 1.01 0.02 0.00 0.00 0.00 0.00 56.01 57.04 1twc n LEU 424 Cb 0.00 -0.49 0.02 0.00 0.00 0.00 0.00 43.42 42.95 1twc n LEU 424 CO 0.00 -1.11 0.44 0.00 0.00 0.00 0.00 177.39 176.72 1twc h THR 425 N 0.00 0.85 -0.21 1.96 1.03 -1.15 -3.17 112.91 112.22 1twc h THR 425 Ca 0.59 -2.21 -0.14 0.00 -0.01 0.00 0.00 66.41 64.64 1twc h THR 425 Cb 1.78 2.41 0.00 0.00 -1.07 0.00 0.00 68.15 71.27 1twc h THR 425 CO -0.39 0.48 -0.43 0.11 -0.01 0.00 0.00 175.52 175.29 1twc h LYS 426 N 0.00 0.66 0.00 0.00 1.57 -0.50 -3.19 116.57 115.11 1twc h LYS 426 Ca -0.01 -0.43 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1twc h LYS 426 Cb 1.39 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.76 1twc h LYS 426 CO 0.06 1.05 0.00 -0.44 -0.57 0.00 0.00 179.45 179.55 1twc h ASP 427 N 0.35 0.00 0.58 0.86 3.32 -1.55 -3.16 116.42 116.83 1twc h ASP 427 Ca 0.01 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.80 1twc h ASP 427 Cb 1.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.58 1twc h ASP 427 CO 0.09 0.00 -1.13 0.40 -1.72 0.00 0.00 179.24 176.88 1twc h ILE 428 N 0.00 1.49 -0.12 0.35 2.04 -1.53 -3.25 117.51 116.49 1twc h ILE 428 Ca 0.00 -2.90 0.00 0.00 1.00 0.00 0.00 64.86 62.96 1twc h ILE 428 Cb 0.07 2.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.93 1twc h ILE 428 CO 0.00 0.85 0.00 0.33 0.00 0.00 0.00 178.15 179.33 1twc n PHE 429 N -3.58 0.34 -0.19 1.37 7.35 -1.20 -2.96 117.46 118.59 1twc n PHE 429 Ca -0.07 -0.13 0.00 0.00 -0.76 0.00 0.00 57.45 56.49 1twc n PHE 429 Cb 0.96 -0.13 0.00 0.00 0.35 0.00 0.00 39.48 40.66 1twc n PHE 429 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1twc n ARG 430 N 0.06 0.23 -0.97 -4.13 1.74 -1.22 -3.15 116.66 109.22 1twc n ARG 430 Ca 0.05 -0.32 -0.20 0.00 -0.77 0.00 0.00 57.85 56.61 1twc n ARG 430 Cb 0.35 -0.81 0.11 0.00 -1.02 0.00 0.00 32.46 31.09 1twc n ARG 430 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1twc n TYR 431 N -0.12 2.31 0.00 -1.55 9.36 -1.16 -4.36 117.16 121.63 1twc n TYR 431 Ca 0.00 -1.78 0.00 0.00 3.32 0.00 0.00 57.90 59.44 1twc n TYR 431 Cb 0.05 -0.89 0.00 0.00 -0.63 0.00 0.00 39.34 37.87 1twc n TYR 431 CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 1twc n MET 432 N -0.60 0.00 -0.09 2.98 2.81 -1.26 -4.51 117.12 116.45 1twc n MET 432 Ca 0.45 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 56.23 1twc n MET 432 Cb 1.16 0.00 -0.15 0.00 -0.71 0.00 0.00 33.22 33.52 1twc n MET 432 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 1twc n GLN 433 N -0.20 0.68 -1.57 0.03 7.27 -1.19 -3.90 117.38 118.50 1twc n GLN 433 Ca 0.00 0.05 -0.35 0.00 0.07 0.00 0.00 57.00 56.77 1twc n GLN 433 Cb 0.00 -1.56 0.06 0.00 2.41 0.00 0.00 30.24 31.15 1twc n GLN 433 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1twc n ARG 434 N -2.84 2.82 -3.44 3.69 1.74 -1.26 -4.81 116.66 112.56 1twc n ARG 434 Ca -0.32 -3.47 -0.37 0.00 -0.77 0.00 0.00 57.85 52.93 1twc n ARG 434 Cb 1.13 -2.28 -0.05 0.00 -1.02 0.00 0.00 32.46 30.24 1twc n ARG 434 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1twc n THR 435 N -0.80 3.55 0.00 0.55 -1.04 -1.25 -4.87 114.28 110.42 1twc n THR 435 Ca 0.58 -5.34 0.00 0.00 -2.04 0.00 0.00 64.05 57.25 1twc n THR 435 Cb 0.60 -2.28 0.00 0.00 -1.82 0.00 0.00 70.33 66.82 1twc n THR 435 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1twc n VAL 436 N 1.86 0.00 0.00 12.58 0.31 -1.26 -4.86 118.33 126.96 1twc n VAL 436 Ca 0.24 0.48 0.00 0.00 -0.01 0.00 0.00 64.34 65.05 1twc n VAL 436 Cb 0.37 -1.45 0.00 0.00 -0.91 0.00 0.00 33.84 31.85 1twc n VAL 436 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1twc n GLU 437 N -0.97 0.00 -0.04 5.55 -0.58 -1.26 -5.26 120.64 118.08 1twc n GLU 437 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1twc n GLU 437 Cb 0.48 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.35 1twc n GLU 437 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1twc n LEU 446 N 0.00 0.81 -0.10 -4.62 4.77 -1.26 -5.30 117.00 111.30 1twc n LEU 446 Ca 0.00 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 1twc n LEU 446 Cb 0.00 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1twc n LEU 446 CO 0.00 0.15 0.00 0.00 -1.33 0.00 0.00 177.39 176.21 1twc n ALA 447 N 1.32 0.00 -2.85 -1.18 0.00 -1.26 -5.11 120.51 111.43 1twc n ALA 447 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1twc n ALA 447 Cb 0.10 -0.35 -0.12 0.00 0.00 0.00 0.00 19.45 19.08 1twc n ALA 447 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1twc s ILE 448 N -2.20 3.73 -0.53 0.00 1.01 -1.26 -5.01 121.20 116.94 1twc s ILE 448 Ca 0.00 -0.43 -0.23 0.00 0.00 0.00 0.00 60.65 59.98 1twc s ILE 448 Cb 0.00 -2.59 0.04 0.00 0.01 0.00 0.00 42.46 39.92 1twc s ILE 448 CO 0.00 0.53 0.88 0.21 0.00 0.00 0.00 174.94 176.56 1twc s ASN 449 N -0.03 6.34 -0.04 3.58 2.47 -1.26 -4.93 114.94 121.08 1twc s ASN 449 Ca 0.00 -0.37 -0.01 0.00 0.42 0.00 0.00 52.86 52.90 1twc s ASN 449 Cb -0.13 -2.41 -0.00 0.00 -1.45 0.00 0.00 41.25 37.25 1twc s ASN 449 CO 0.03 -1.13 0.05 0.00 -3.72 0.00 0.00 177.10 172.33 1twc h ALA 450 N 9.22 -0.05 0.00 1.71 0.00 -1.92 -3.16 119.26 125.06 1twc h ALA 450 Ca -0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1twc h ALA 450 Cb 1.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1twc h ALA 450 CO 1.05 -0.05 0.00 1.17 0.00 0.00 0.00 179.25 181.42 1twc n LYS 451 N -3.08 0.00 -0.57 0.00 3.00 -1.26 -2.41 118.16 113.83 1twc n LYS 451 Ca -0.00 0.00 0.47 0.00 -0.00 0.00 0.00 58.31 58.78 1twc n LYS 451 Cb 0.01 0.00 0.80 0.00 0.00 0.00 0.00 35.03 35.84 1twc n LYS 451 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1twc h THR 452 N 0.00 0.15 0.00 3.15 1.03 -1.91 0.79 112.91 116.12 1twc h THR 452 Ca 0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 1twc h THR 452 Cb 0.00 0.14 0.00 0.00 -1.07 0.00 0.00 68.15 67.22 1twc h THR 452 CO 0.00 0.00 -0.37 0.40 -0.01 0.00 0.00 175.52 175.54 1twc h ILE 453 N 0.00 0.00 -0.84 0.00 1.08 -1.74 -3.11 117.51 112.91 1twc h ILE 453 Ca 0.81 -0.89 0.21 0.00 -0.39 0.00 0.00 64.86 64.60 1twc h ILE 453 Cb 3.24 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 36.85 1twc h ILE 453 CO -0.02 0.00 0.08 0.74 -0.69 0.00 0.00 178.15 178.25 1twc h THR 454 N -0.89 0.27 0.00 -0.27 2.02 -0.56 -1.35 112.91 112.13 1twc h THR 454 Ca 0.00 -0.04 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 1twc h THR 454 Cb 0.37 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 1twc h THR 454 CO 0.00 0.02 -1.89 -1.54 0.37 0.00 0.00 175.52 172.49 1twc n SER 455 N -5.34 0.15 0.24 4.18 3.41 -0.22 -2.17 113.62 113.86 1twc n SER 455 Ca 0.18 0.06 0.10 0.00 -0.26 0.00 0.00 58.87 58.95 1twc n SER 455 Cb 0.59 1.62 0.59 0.00 -0.26 0.00 0.00 64.21 66.74 1twc n SER 455 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1twc h GLY 456 N 3.99 0.00 0.00 5.00 0.00 -1.25 0.44 103.07 111.26 1twc h GLY 456 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1twc h GLY 456 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 1twc n LEU 457 N -3.63 0.88 -0.31 3.11 4.77 -0.60 -2.76 117.00 118.47 1twc n LEU 457 Ca -0.01 0.41 0.10 0.00 -0.03 0.00 0.00 56.01 56.47 1twc n LEU 457 Cb 0.33 -0.32 0.22 0.00 -2.33 0.00 0.00 43.42 41.31 1twc n LEU 457 CO 0.32 -0.32 0.80 0.50 -1.33 0.00 0.00 177.39 177.35 1twc h LYS 458 N 0.00 0.05 -0.26 3.23 3.64 -1.54 -1.22 116.57 120.46 1twc h LYS 458 Ca 0.00 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.43 1twc h LYS 458 Cb 0.00 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 1twc h LYS 458 CO 0.00 0.03 -0.09 -0.92 -2.27 0.00 0.00 179.45 176.20 1twc h TYR 459 N 0.05 -0.21 -0.16 1.91 3.20 -0.22 -2.12 116.97 119.41 1twc h TYR 459 Ca 0.51 0.03 -0.22 0.00 3.14 0.00 0.00 58.73 62.19 1twc h TYR 459 Cb 0.97 0.14 0.01 0.00 1.54 0.00 0.00 36.73 39.38 1twc h TYR 459 CO -0.50 -0.15 -0.75 0.00 -1.64 0.00 0.00 178.16 175.12 1twc h ALA 460 N 1.20 0.35 -0.45 1.82 0.00 -1.06 -2.39 119.26 118.73 1twc h ALA 460 Ca 0.13 -0.59 0.04 0.00 0.00 0.00 0.00 54.91 54.49 1twc h ALA 460 Cb 0.24 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1twc h ALA 460 CO -0.30 0.69 0.30 -0.07 0.00 0.00 0.00 179.25 179.88 1twc h LEU 461 N 0.54 0.41 -0.30 0.00 4.07 -1.26 -1.77 115.31 117.00 1twc h LEU 461 Ca -0.04 -0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.71 1twc h LEU 461 Cb 1.38 -0.10 -0.00 0.00 1.08 0.00 0.00 40.66 43.02 1twc h LEU 461 CO 0.15 0.28 -0.84 0.00 -1.08 0.00 0.00 178.44 176.96 1twc h ALA 462 N 1.74 0.51 0.19 1.53 0.00 -1.13 -3.40 119.26 118.70 1twc h ALA 462 Ca 0.19 -0.68 -0.34 0.00 0.00 0.00 0.00 54.91 54.08 1twc h ALA 462 Cb 0.14 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1twc h ALA 462 CO -0.05 0.83 -1.65 1.79 0.00 0.00 0.00 179.25 180.17 1twc h THR 463 N 0.20 1.06 -0.16 0.00 1.35 -1.00 -3.49 112.91 110.86 1twc h THR 463 Ca -0.05 -2.62 -0.03 0.00 -0.55 0.00 0.00 66.41 63.16 1twc h THR 463 Cb 1.45 2.82 -0.01 0.00 -1.73 0.00 0.00 68.15 70.68 1twc h THR 463 CO 0.14 0.84 -0.04 0.61 -0.25 0.00 0.00 175.52 176.82 1twc n GLY 464 N 1.79 0.41 3.53 5.82 0.00 -0.71 -4.68 105.19 111.36 1twc n GLY 464 Ca -0.21 -0.92 -0.41 0.00 0.00 0.00 0.00 46.02 44.48 1twc n GLY 464 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1twc s ASN 465 N -2.95 6.10 0.00 1.61 0.02 -1.23 -2.13 114.94 116.35 1twc s ASN 465 Ca 0.00 -0.38 0.00 0.00 -1.02 0.00 0.00 52.86 51.46 1twc s ASN 465 Cb 0.00 -2.16 0.00 0.00 0.02 0.00 0.00 41.25 39.11 1twc s ASN 465 CO 0.00 -0.27 0.00 0.79 0.02 0.00 0.00 177.10 177.64 1twc n TRP 466 N 5.19 -0.35 -0.06 2.20 8.01 -1.26 -4.64 117.44 126.53 1twc n TRP 466 Ca -0.12 0.00 -0.07 0.00 -1.31 0.00 0.00 57.50 56.00 1twc n TRP 466 Cb 0.50 0.07 -0.06 0.00 -2.01 0.00 0.00 31.31 29.81 1twc n TRP 466 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1twc n GLY 467 N -1.02 -0.21 0.00 6.99 0.00 -1.26 -5.12 105.19 104.56 1twc n GLY 467 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1twc n GLY 467 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1twc n ALA 477 N -2.75 0.00 -0.46 4.61 0.00 -0.91 -5.20 120.51 115.81 1twc n ALA 477 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1twc n ALA 477 Cb 0.73 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.18 1twc n ALA 477 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1twc n GLY 478 N 0.00 0.75 0.11 0.00 0.00 -0.98 -4.91 105.19 100.16 1twc n GLY 478 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 46.02 45.81 1twc n GLY 478 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1twc h VAL 479 N 0.00 1.19 -3.54 1.61 2.07 -1.90 -3.42 116.25 112.25 1twc h VAL 479 Ca 0.00 -2.63 -0.41 0.00 0.82 0.00 0.00 66.70 64.48 1twc h VAL 479 Cb 0.00 2.55 -0.33 0.00 -1.52 0.00 0.00 31.29 32.00 1twc h VAL 479 CO 0.00 0.67 -0.77 -0.55 0.02 0.00 0.00 177.57 176.93 1twc s SER 480 N -6.56 0.96 0.08 0.57 0.15 -1.26 -1.91 113.70 105.74 1twc s SER 480 Ca 0.03 -0.14 -0.01 0.00 0.70 0.00 0.00 55.95 56.53 1twc s SER 480 Cb 0.09 -0.42 -0.04 0.00 -1.71 0.00 0.00 66.02 63.94 1twc s SER 480 CO 0.77 -0.02 -0.00 -1.10 1.20 0.00 0.00 173.24 174.08 1twc s GLN 481 N 0.71 0.73 0.09 5.44 -0.21 -0.84 -4.14 119.66 121.44 1twc s GLN 481 Ca -0.10 -1.30 -0.31 0.00 0.02 0.00 0.00 55.36 53.67 1twc s GLN 481 Cb -0.13 0.18 -0.06 0.00 1.00 0.00 0.00 33.01 34.00 1twc s GLN 481 CO 0.00 -0.15 1.21 0.08 -2.12 0.00 0.00 175.29 174.31 1twc s VAL 482 N -3.93 3.92 -0.02 1.09 1.01 -1.26 -0.76 120.40 120.44 1twc s VAL 482 Ca 0.13 1.41 -0.30 0.00 0.00 0.00 0.00 61.98 63.22 1twc s VAL 482 Cb 0.08 -3.91 -0.08 0.00 0.00 0.00 0.00 36.38 32.47 1twc s VAL 482 CO -0.06 0.13 2.02 -0.11 0.00 0.00 0.00 175.10 177.09 1twc n LEU 483 N 3.67 3.94 -4.65 3.92 7.94 -0.18 -4.88 117.00 126.75 1twc n LEU 483 Ca 0.08 0.77 -0.44 0.00 -1.11 0.00 0.00 56.01 55.32 1twc n LEU 483 Cb 0.46 -1.52 -0.01 0.00 0.53 0.00 0.00 43.42 42.88 1twc n LEU 483 CO 0.56 0.01 0.78 0.59 -1.11 0.00 0.00 177.39 178.22 1twc n ASN 484 N 8.30 2.19 -2.20 1.96 3.02 -1.26 -4.92 115.26 122.35 1twc n ASN 484 Ca 0.22 1.19 0.01 0.00 -0.03 0.00 0.00 54.58 55.98 1twc n ASN 484 Cb 0.41 -1.40 0.04 0.00 -0.61 0.00 0.00 39.78 38.21 1twc n ASN 484 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1twc n ARG 485 N 0.73 1.05 -0.13 3.52 3.00 -1.26 -4.00 116.66 119.58 1twc n ARG 485 Ca 0.07 -2.89 -0.12 0.00 -0.00 0.00 0.00 57.85 54.92 1twc n ARG 485 Cb 0.34 -0.95 0.00 0.00 0.00 0.00 0.00 32.46 31.85 1twc n ARG 485 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.63 179.51 1twc h TYR 486 N 1.88 1.10 -3.48 -0.14 0.99 -1.91 -3.44 116.97 111.96 1twc h TYR 486 Ca -0.16 -0.30 -0.05 0.00 2.00 0.00 0.00 58.73 60.22 1twc h TYR 486 Cb 1.54 -0.24 -0.11 0.00 1.00 0.00 0.00 36.73 38.91 1twc h TYR 486 CO 0.38 1.12 -0.09 -0.08 -0.00 0.00 0.00 178.16 179.49 1twc s THR 487 N -4.50 0.05 0.19 -2.88 -1.32 -1.26 -4.45 115.64 101.46 1twc s THR 487 Ca -0.11 -0.92 -0.10 0.00 -1.21 0.00 0.00 61.69 59.36 1twc s THR 487 Cb 0.12 -1.57 0.11 0.00 -1.51 0.00 0.00 72.50 69.64 1twc s THR 487 CO 0.87 -0.21 1.74 0.22 -2.21 0.00 0.00 174.62 175.03 1twc h TYR 488 N 2.33 1.06 0.00 9.09 3.20 -1.77 -2.32 116.97 128.56 1twc h TYR 488 Ca -0.30 -0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.47 1twc h TYR 488 Cb 1.25 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.21 1twc h TYR 488 CO 0.36 0.84 -0.03 0.66 -1.64 0.00 0.00 178.16 178.34 1twc h SER 489 N 0.98 0.00 0.65 -2.11 4.64 -1.90 -0.54 113.55 115.27 1twc h SER 489 Ca 0.22 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.49 1twc h SER 489 Cb 0.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1twc h SER 489 CO -0.01 0.00 -0.26 0.77 -0.87 0.00 0.00 176.83 176.46 1twc h SER 490 N 0.00 0.00 -0.11 4.97 4.64 -1.73 -1.50 113.55 119.82 1twc h SER 490 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1twc h SER 490 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1twc h SER 490 CO 0.00 0.26 -0.19 0.74 -0.87 0.00 0.00 176.83 176.77 1twc h THR 491 N 0.00 1.39 -0.90 2.95 2.02 -1.00 -2.47 112.91 114.90 1twc h THR 491 Ca -0.00 -1.46 -0.02 0.00 0.77 0.00 0.00 66.41 65.70 1twc h THR 491 Cb 0.65 2.08 -0.04 0.00 -1.74 0.00 0.00 68.15 69.10 1twc h THR 491 CO 0.03 0.42 0.49 -0.07 0.37 0.00 0.00 175.52 176.76 1twc h LEU 492 N -0.12 1.12 -1.22 2.58 3.38 -1.02 -1.62 115.31 118.41 1twc h LEU 492 Ca 0.01 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.91 1twc h LEU 492 Cb 0.77 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 1twc h LEU 492 CO 0.04 0.90 0.54 -1.28 0.09 0.00 0.00 178.44 178.73 1twc h SER 493 N 1.25 0.88 0.23 -0.43 0.87 -1.26 -2.63 113.55 112.46 1twc h SER 493 Ca 0.31 -0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.75 1twc h SER 493 Cb 0.03 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 1twc h SER 493 CO -0.05 0.61 -0.44 -0.74 -0.53 0.00 0.00 176.83 175.67 1twc h HIS 494 N 1.02 0.32 0.00 2.24 6.17 -0.84 0.23 115.15 124.29 1twc h HIS 494 Ca 0.32 -0.09 0.00 0.00 0.71 0.00 0.00 60.37 61.31 1twc h HIS 494 Cb 0.02 -0.07 0.00 0.00 2.52 0.00 0.00 27.41 29.88 1twc h HIS 494 CO -0.00 0.67 0.00 1.28 0.71 0.00 0.00 177.93 180.59 1twc n LEU 495 N -4.00 0.00 -0.10 0.26 4.77 -0.71 -2.77 117.00 114.45 1twc n LEU 495 Ca -0.02 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 55.99 1twc n LEU 495 Cb 0.50 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.63 1twc n LEU 495 CO 0.42 0.00 0.41 0.54 -1.33 0.00 0.00 177.39 177.43 1twc n ARG 496 N -0.97 1.31 -1.97 3.23 1.74 0.75 -4.87 116.66 115.88 1twc n ARG 496 Ca 0.17 -1.41 -0.31 0.00 -0.77 0.00 0.00 57.85 55.53 1twc n ARG 496 Cb 0.08 -0.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.62 1twc n ARG 496 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1twc s ARG 497 N -1.01 3.65 0.06 5.56 3.52 -0.77 -2.31 118.95 127.66 1twc s ARG 497 Ca 0.07 0.77 0.01 0.00 -0.13 0.00 0.00 55.73 56.46 1twc s ARG 497 Cb 0.07 -2.10 -0.03 0.00 -1.56 0.00 0.00 34.95 31.33 1twc s ARG 497 CO 0.01 -0.51 -0.06 0.99 -0.81 0.00 0.00 175.30 174.91 1twc s THR 498 N -3.08 0.49 0.00 4.11 2.01 -0.63 -3.35 115.64 115.19 1twc s THR 498 Ca 0.55 -1.53 0.00 0.00 0.31 0.00 0.00 61.69 61.02 1twc s THR 498 Cb -0.11 -1.16 -0.00 0.00 0.01 0.00 0.00 72.50 71.24 1twc s THR 498 CO 0.50 -0.71 -0.01 0.21 -0.69 0.00 0.00 174.62 173.93 1twc s ASN 499 N -2.39 0.06 -0.26 3.53 2.47 0.91 -1.59 114.94 117.66 1twc s ASN 499 Ca 0.01 -0.06 0.03 0.00 0.42 0.00 0.00 52.86 53.25 1twc s ASN 499 Cb -0.01 0.01 0.06 0.00 -1.45 0.00 0.00 41.25 39.86 1twc s ASN 499 CO -0.04 -0.03 -0.11 -0.89 -3.72 0.00 0.00 177.10 172.32 1twc s THR 500 N -0.18 2.20 0.13 -5.21 2.01 -0.31 -1.76 115.64 112.51 1twc s THR 500 Ca -0.02 -1.64 -0.31 0.00 0.31 0.00 0.00 61.69 60.03 1twc s THR 500 Cb -0.01 -2.30 -0.08 0.00 0.01 0.00 0.00 72.50 70.12 1twc s THR 500 CO -0.00 -0.04 1.41 -2.84 -0.69 0.00 0.00 174.62 172.46 1twc s PRO 501 N 1.10 4.31 0.58 4.92 0.02 -1.26 -4.84 135.00 139.82 1twc s PRO 501 Ca -0.09 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.05 1twc s PRO 501 Cb -0.20 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.09 1twc s PRO 501 CO -0.05 -0.45 0.00 0.44 -0.33 0.00 0.00 177.00 176.61 1twc n ILE 502 N 3.88 0.00 0.14 2.83 -6.64 -1.26 -5.06 119.36 113.24 1twc n ILE 502 Ca 0.12 0.00 0.07 0.00 -1.77 0.00 0.00 62.75 61.16 1twc n ILE 502 Cb 0.42 -0.07 0.04 0.00 -1.44 0.00 0.00 39.64 38.59 1twc n ILE 502 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1twc h ALA 509 N -0.46 0.73 -1.75 -1.28 0.00 -2.01 -3.48 119.26 111.00 1twc h ALA 509 Ca 0.00 -0.29 -0.55 0.00 0.00 0.00 0.00 54.91 54.08 1twc h ALA 509 Cb 0.20 0.02 -0.42 0.00 0.00 0.00 0.00 17.79 17.60 1twc h ALA 509 CO 0.00 0.36 -0.81 1.63 0.00 0.00 0.00 179.25 180.43 1twc n LYS 510 N -3.01 2.83 0.25 0.00 5.02 -1.26 -4.92 118.16 117.07 1twc n LYS 510 Ca 0.00 -4.35 0.14 0.00 -2.02 0.00 0.00 58.31 52.07 1twc n LYS 510 Cb 0.65 -2.06 0.52 0.00 -0.02 0.00 0.00 35.03 34.12 1twc n LYS 510 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1twc h PRO 511 N 2.81 0.00 0.00 1.97 0.13 -1.94 -2.48 132.00 132.49 1twc h PRO 511 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1twc h PRO 511 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1twc h PRO 511 CO 0.76 0.09 0.00 0.00 -0.23 0.00 0.00 178.00 178.62 1twc h ARG 512 N 0.00 0.00 -7.00 0.86 3.08 -1.86 -3.43 114.38 106.03 1twc h ARG 512 Ca -0.00 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.56 1twc h ARG 512 Cb 0.69 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.76 1twc h ARG 512 CO 0.01 0.00 0.21 -0.65 -1.07 0.00 0.00 179.97 178.47 1twc s GLN 513 N -3.52 3.74 -0.33 0.04 1.11 -0.93 -4.35 119.66 115.42 1twc s GLN 513 Ca 0.03 0.55 -0.28 0.00 0.01 0.00 0.00 55.36 55.66 1twc s GLN 513 Cb 0.08 -2.30 0.02 0.00 -1.01 0.00 0.00 33.01 29.80 1twc s GLN 513 CO 0.56 -0.19 1.04 -1.17 0.01 0.00 0.00 175.29 175.54 1twc s LEU 514 N -4.25 3.94 0.24 2.90 2.96 -1.26 -5.02 118.68 118.20 1twc s LEU 514 Ca 0.52 0.95 -0.22 0.00 -0.22 0.00 0.00 54.13 55.16 1twc s LEU 514 Cb -0.10 -3.47 -0.09 0.00 0.50 0.00 0.00 46.19 43.03 1twc s LEU 514 CO 0.37 -0.86 0.80 -2.28 -1.32 0.00 0.00 176.35 173.06 1twc s HIS 515 N 3.59 3.70 0.39 5.38 5.65 -1.26 -4.96 115.29 127.78 1twc s HIS 515 Ca 0.44 1.54 0.15 0.00 0.25 0.00 0.00 55.06 57.43 1twc s HIS 515 Cb -0.12 -2.73 0.99 0.00 -1.18 0.00 0.00 32.58 29.54 1twc s HIS 515 CO 0.16 0.32 1.85 -0.91 -0.65 0.00 0.00 174.74 175.51 1twc h ASN 516 N 3.47 0.50 0.00 9.88 2.35 -1.95 -0.49 115.58 129.34 1twc h ASN 516 Ca -0.47 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 1twc h ASN 516 Cb 1.19 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.52 1twc h ASN 516 CO 0.65 0.21 0.00 0.35 -1.65 0.00 0.00 177.43 176.99 1twc n THR 517 N -4.55 0.00 1.27 2.81 -2.24 -1.26 -2.04 114.28 108.27 1twc n THR 517 Ca 0.19 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.10 1twc n THR 517 Cb 0.64 -0.60 0.36 0.00 -2.10 0.00 0.00 70.33 68.63 1twc n THR 517 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1twc n HIS 518 N -1.00 0.00 -1.69 4.78 8.25 -0.19 -4.70 115.22 120.67 1twc n HIS 518 Ca 0.19 0.00 -0.64 0.00 -0.26 0.00 0.00 57.72 57.01 1twc n HIS 518 Cb 0.09 -0.07 -0.09 0.00 1.12 0.00 0.00 29.99 31.04 1twc n HIS 518 CO 0.00 0.00 0.00 1.87 0.64 0.00 0.00 176.34 178.85 1twc n TRP 519 N -0.27 1.60 0.00 4.41 -0.00 -0.86 -1.93 117.44 120.37 1twc n TRP 519 Ca 0.14 1.00 0.00 0.00 -0.00 0.00 0.00 57.50 58.63 1twc n TRP 519 Cb 0.38 -2.25 0.00 0.00 -0.00 0.00 0.00 31.31 29.43 1twc n TRP 519 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1twc n GLY 520 N 3.50 2.96 0.17 5.87 0.00 -1.26 -4.77 105.19 111.66 1twc n GLY 520 Ca 0.28 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.09 1twc n GLY 520 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1twc n LEU 521 N 0.00 2.46 -4.23 0.99 4.77 -0.82 -4.48 117.00 115.69 1twc n LEU 521 Ca 0.00 0.06 -0.24 0.00 -0.03 0.00 0.00 56.01 55.80 1twc n LEU 521 Cb 0.00 -0.78 -0.14 0.00 -2.33 0.00 0.00 43.42 40.18 1twc n LEU 521 CO 0.00 0.73 -0.51 -0.69 -1.33 0.00 0.00 177.39 175.60 1twc s VAL 522 N -2.46 1.53 0.26 4.08 1.01 -1.07 -1.27 120.40 122.48 1twc s VAL 522 Ca -0.33 -1.22 -0.29 0.00 0.00 0.00 0.00 61.98 60.14 1twc s VAL 522 Cb 0.10 -1.36 -0.09 0.00 0.00 0.00 0.00 36.38 35.04 1twc s VAL 522 CO 0.49 0.10 1.18 0.00 0.00 0.00 0.00 175.10 176.87 1twc n PRO 524 N 1.55 0.20 -0.12 0.00 -0.04 -1.26 -4.13 135.00 131.20 1twc n PRO 524 Ca 0.01 0.13 -0.18 0.00 -0.04 0.00 0.00 63.50 63.42 1twc n PRO 524 Cb 0.44 -1.70 -0.11 0.00 -0.04 0.00 0.00 33.50 32.09 1twc n PRO 524 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1twc n ALA 525 N -1.72 1.46 -2.53 0.55 0.00 -1.26 -4.93 120.51 112.09 1twc n ALA 525 Ca 0.05 -1.03 -0.41 0.00 0.00 0.00 0.00 53.44 52.05 1twc n ALA 525 Cb 0.41 -0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.80 1twc n ALA 525 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1twc s GLU 526 N -2.48 3.28 -0.07 0.00 2.12 -1.26 -4.18 118.70 116.10 1twc s GLU 526 Ca -0.33 0.01 -0.14 0.00 0.36 0.00 0.00 54.97 54.87 1twc s GLU 526 Cb 0.09 -4.13 0.03 0.00 0.26 0.00 0.00 34.13 30.38 1twc s GLU 526 CO 0.54 -2.00 0.34 -0.08 -0.54 0.00 0.00 175.26 173.52 1twc s THR 527 N 5.64 0.03 0.83 -1.70 -1.32 -1.26 -4.28 115.64 113.59 1twc s THR 527 Ca 0.40 -0.23 -0.10 0.00 -1.21 0.00 0.00 61.69 60.55 1twc s THR 527 Cb -0.08 -0.56 0.09 0.00 -1.51 0.00 0.00 72.50 70.44 1twc s THR 527 CO 0.19 -0.13 1.11 -2.16 -2.21 0.00 0.00 174.62 171.43 1twc s PRO 528 N -0.56 1.73 0.51 7.08 0.04 -1.26 -4.87 135.00 137.66 1twc s PRO 528 Ca -0.07 1.31 -0.17 0.00 0.04 0.00 0.00 61.00 62.11 1twc s PRO 528 Cb -0.04 -1.83 -0.08 0.00 0.04 0.00 0.00 34.50 32.60 1twc s PRO 528 CO 0.02 -2.06 0.99 -1.21 0.04 0.00 0.00 177.00 174.78 1twc s GLU 529 N -4.80 3.94 2.43 4.56 2.02 -1.26 -3.52 118.70 122.07 1twc s GLU 529 Ca 0.63 0.98 0.00 0.00 0.02 0.00 0.00 54.97 56.60 1twc s GLU 529 Cb -0.19 -2.13 0.00 0.00 0.10 0.00 0.00 34.13 31.90 1twc s GLU 529 CO 0.57 -0.28 0.00 0.41 0.02 0.00 0.00 175.26 175.98 1twc n GLY 530 N -1.49 0.69 0.20 -1.39 0.00 -1.26 -3.80 105.19 98.14 1twc n GLY 530 Ca 0.07 -1.18 -0.01 0.00 0.00 0.00 0.00 46.02 44.89 1twc n GLY 530 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1twc h GLN 531 N 0.00 0.22 -0.16 1.61 -0.00 -2.05 -3.07 115.11 111.67 1twc h GLN 531 Ca 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 58.65 58.55 1twc h GLN 531 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 27.48 27.47 1twc h GLN 531 CO 0.00 0.57 0.00 0.00 -0.00 0.00 0.00 178.83 179.40 1twc n ALA 532 N -2.47 2.51 -1.58 0.06 0.00 -1.25 -4.82 120.51 112.96 1twc n ALA 532 Ca -0.01 -0.60 -0.47 0.00 0.00 0.00 0.00 53.44 52.35 1twc n ALA 532 Cb 0.45 -1.04 -0.05 0.00 0.00 0.00 0.00 19.45 18.81 1twc n ALA 532 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1twc n GLY 534 N 5.57 1.64 0.10 0.00 0.00 -1.26 -4.77 105.19 106.46 1twc n GLY 534 Ca 0.31 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.22 1twc n GLY 534 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1twc n LEU 535 N 0.00 0.94 -4.71 0.99 4.77 0.16 -4.48 117.00 114.66 1twc n LEU 535 Ca 0.00 -0.04 -0.42 0.00 -0.03 0.00 0.00 56.01 55.53 1twc n LEU 535 Cb 0.00 0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 1twc n LEU 535 CO 0.00 0.58 0.64 -0.69 -1.33 0.00 0.00 177.39 176.59 1twc s VAL 536 N -2.44 4.87 0.36 4.08 1.01 -0.61 -1.16 120.40 126.51 1twc s VAL 536 Ca -0.16 1.97 0.04 0.00 0.00 0.00 0.00 61.98 63.83 1twc s VAL 536 Cb 0.06 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 1twc s VAL 536 CO 0.66 0.18 0.08 -0.54 0.00 0.00 0.00 175.10 175.49 1twc s LYS 537 N 0.91 1.77 -0.04 2.72 1.02 -0.62 -4.48 119.74 121.01 1twc s LYS 537 Ca 0.50 -2.02 0.02 0.00 0.02 0.00 0.00 55.97 54.48 1twc s LYS 537 Cb -0.21 -0.81 0.02 0.00 -0.52 0.00 0.00 37.83 36.31 1twc s LYS 537 CO 0.27 -0.29 -0.06 -0.80 -0.92 0.00 0.00 175.35 173.54 1twc s ASN 538 N -3.54 1.06 0.20 2.83 0.01 -1.26 -1.60 114.94 112.63 1twc s ASN 538 Ca 0.31 -0.16 -0.33 0.00 -0.71 0.00 0.00 52.86 51.97 1twc s ASN 538 Cb 0.06 -0.44 -0.14 0.00 0.41 0.00 0.00 41.25 41.15 1twc s ASN 538 CO 0.14 -0.01 1.49 0.18 -1.51 0.00 0.00 177.10 177.40 1twc n LEU 539 N 3.77 3.10 -4.50 0.60 4.77 -0.98 -1.09 117.00 122.67 1twc n LEU 539 Ca -0.23 1.11 -0.35 0.00 -0.03 0.00 0.00 56.01 56.52 1twc n LEU 539 Cb 0.52 -1.43 0.09 0.00 -2.33 0.00 0.00 43.42 40.28 1twc n LEU 539 CO 0.24 -0.39 0.17 -1.20 -1.33 0.00 0.00 177.39 174.88 1twc n SER 540 N 2.75 -0.93 0.24 -1.43 7.64 -0.39 -4.33 113.62 117.18 1twc n SER 540 Ca 0.14 0.54 0.10 0.00 1.01 0.00 0.00 58.87 60.65 1twc n SER 540 Cb 0.30 -1.27 0.62 0.00 -1.01 0.00 0.00 64.21 62.85 1twc n SER 540 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1twc h LEU 541 N -0.72 0.00 -2.82 -3.43 3.38 -1.25 -1.71 115.31 108.76 1twc h LEU 541 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1twc h LEU 541 Cb 1.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.07 1twc h LEU 541 CO 0.41 0.16 0.00 0.23 0.09 0.00 0.00 178.44 179.34 1twc n MET 542 N -3.87 2.77 -1.46 1.13 2.81 -1.26 -5.01 117.12 112.24 1twc n MET 542 Ca -0.02 -2.02 -0.30 0.00 -1.81 0.00 0.00 57.70 53.55 1twc n MET 542 Cb 0.26 -1.27 0.08 0.00 -0.71 0.00 0.00 33.22 31.58 1twc n MET 542 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1twc s SER 543 N -1.00 4.64 0.26 7.83 0.01 -0.65 -4.51 113.70 120.28 1twc s SER 543 Ca 0.23 1.52 -0.09 0.00 1.31 0.00 0.00 55.95 58.92 1twc s SER 543 Cb 0.12 -2.29 -0.01 0.00 0.21 0.00 0.00 66.02 64.05 1twc s SER 543 CO 0.16 -1.90 0.42 0.00 0.41 0.00 0.00 173.24 172.32 1twc s ILE 545 N -3.85 0.55 0.64 0.00 1.01 -1.26 -0.59 121.20 117.70 1twc s ILE 545 Ca 0.27 -0.21 -0.18 0.00 0.00 0.00 0.00 60.65 60.53 1twc s ILE 545 Cb 0.01 -0.52 -0.01 0.00 0.01 0.00 0.00 42.46 41.95 1twc s ILE 545 CO 0.12 0.19 1.24 -0.94 0.00 0.00 0.00 174.94 175.55 1twc s SER 546 N 0.38 4.74 -0.00 3.58 1.04 -0.03 -4.84 113.70 118.56 1twc s SER 546 Ca -0.05 2.48 0.16 0.00 0.48 0.00 0.00 55.95 59.02 1twc s SER 546 Cb -0.09 -2.60 -0.19 0.00 0.10 0.00 0.00 66.02 63.24 1twc s SER 546 CO 0.00 -1.91 0.63 0.55 0.98 0.00 0.00 173.24 173.49 1twc n VAL 547 N -1.96 0.00 0.00 5.02 3.14 -1.26 -1.81 118.33 121.46 1twc n VAL 547 Ca 0.15 -0.16 0.00 0.00 -2.96 0.00 0.00 64.34 61.36 1twc n VAL 547 Cb 0.49 0.86 0.00 0.00 -1.06 0.00 0.00 33.84 34.14 1twc n VAL 547 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1twc n GLY 548 N 1.40 -1.59 3.50 7.55 0.00 -1.26 -4.53 105.19 110.27 1twc n GLY 548 Ca 0.02 -1.37 -0.17 0.00 0.00 0.00 0.00 46.02 44.49 1twc n GLY 548 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1twc s THR 549 N -3.02 0.00 0.02 2.61 -1.32 -0.43 -4.88 115.64 108.62 1twc s THR 549 Ca 0.00 -0.04 -0.18 0.00 -1.21 0.00 0.00 61.69 60.26 1twc s THR 549 Cb 0.00 -0.97 -0.06 0.00 -1.51 0.00 0.00 72.50 69.96 1twc s THR 549 CO 0.00 -0.02 0.52 -0.62 -2.21 0.00 0.00 174.62 172.29 1twc s ASP 550 N -1.13 6.94 0.05 8.08 2.15 -1.26 -4.56 116.67 126.94 1twc s ASP 550 Ca -0.11 1.12 0.28 0.00 0.43 0.00 0.00 52.55 54.27 1twc s ASP 550 Cb -0.01 -2.32 0.99 0.00 -0.30 0.00 0.00 42.92 41.28 1twc s ASP 550 CO 0.09 0.24 1.79 -0.81 -0.17 0.00 0.00 175.17 176.31 1twc n PRO 551 N 2.08 0.07 -0.28 4.34 -0.04 -1.26 -4.31 135.00 135.59 1twc n PRO 551 Ca -0.11 0.05 -0.06 0.00 -0.04 0.00 0.00 63.50 63.35 1twc n PRO 551 Cb 0.51 -1.57 0.06 0.00 -0.04 0.00 0.00 33.50 32.46 1twc n PRO 551 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1twc h MET 552 N 0.00 1.12 -0.22 0.54 2.86 -1.99 0.61 114.93 117.85 1twc h MET 552 Ca 0.00 -0.17 -0.06 0.00 -2.06 0.00 0.00 59.70 57.41 1twc h MET 552 Cb 0.56 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1twc h MET 552 CO 0.00 0.87 -0.14 -1.00 1.06 0.00 0.00 176.91 177.70 1twc h PRO 553 N 1.09 0.36 -0.70 -0.22 0.13 -2.01 -2.01 132.00 128.64 1twc h PRO 553 Ca 0.26 -0.10 -0.03 0.00 -0.87 0.00 0.00 66.00 65.26 1twc h PRO 553 Cb 0.13 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.19 1twc h PRO 553 CO -0.03 0.51 0.31 0.82 -0.23 0.00 0.00 178.00 179.37 1twc h ILE 554 N 0.34 1.24 -0.42 -3.56 5.03 -1.20 -1.21 117.51 117.73 1twc h ILE 554 Ca 0.06 -0.71 -0.01 0.00 -0.12 0.00 0.00 64.86 64.09 1twc h ILE 554 Cb 0.46 0.41 -0.02 0.00 -3.03 0.00 0.00 36.82 34.64 1twc h ILE 554 CO 0.03 0.29 0.22 0.40 -0.68 0.00 0.00 178.15 178.40 1twc h ILE 555 N 0.98 1.16 -0.51 -0.67 1.08 -0.89 -1.77 117.51 116.90 1twc h ILE 555 Ca 0.24 -0.44 0.02 0.00 -0.39 0.00 0.00 64.86 64.28 1twc h ILE 555 Cb 0.16 0.69 -0.03 0.00 -3.07 0.00 0.00 36.82 34.57 1twc h ILE 555 CO -0.02 0.17 0.32 0.74 -0.69 0.00 0.00 178.15 178.67 1twc h THR 556 N 0.54 1.09 -0.63 -0.27 2.02 -1.33 -2.70 112.91 111.63 1twc h THR 556 Ca 0.15 -0.22 0.01 0.00 0.77 0.00 0.00 66.41 67.12 1twc h THR 556 Cb 0.08 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 1twc h THR 556 CO -0.02 0.12 0.41 0.15 0.37 0.00 0.00 175.52 176.54 1twc h PHE 557 N 0.64 0.77 -0.79 3.16 3.57 -0.60 -0.31 116.94 123.37 1twc h PHE 557 Ca 0.20 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.77 1twc h PHE 557 Cb -0.02 -0.26 -0.05 0.00 2.79 0.00 0.00 35.95 38.41 1twc h PHE 557 CO -0.05 0.47 0.52 -0.07 -2.23 0.00 0.00 178.31 176.94 1twc h LEU 558 N 0.82 0.78 0.00 0.59 3.38 -1.00 0.26 115.31 120.14 1twc h LEU 558 Ca 0.24 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 1twc h LEU 558 Cb -0.05 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1twc h LEU 558 CO -0.07 0.51 -0.95 0.77 0.09 0.00 0.00 178.44 178.80 1twc h SER 559 N 0.89 0.00 -0.20 -0.43 4.64 -1.36 -0.03 113.55 117.06 1twc h SER 559 Ca 0.33 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.71 1twc h SER 559 Cb 0.18 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1twc h SER 559 CO -0.11 0.19 0.17 -0.33 -0.87 0.00 0.00 176.83 175.89 1twc h GLU 560 N 0.00 0.00 -0.49 4.77 5.08 0.79 -2.62 114.58 122.11 1twc h GLU 560 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1twc h GLU 560 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1twc h GLU 560 CO 0.02 0.00 0.00 0.91 -1.00 0.00 0.00 179.01 178.94 1twc n TRP 561 N -4.14 1.55 0.00 4.33 7.02 -0.72 -4.90 117.44 120.58 1twc n TRP 561 Ca 0.02 -0.74 0.00 0.00 -1.02 0.00 0.00 57.50 55.76 1twc n TRP 561 Cb 0.31 -0.38 0.00 0.00 -2.42 0.00 0.00 31.31 28.82 1twc n TRP 561 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1twc n GLY 562 N 0.38 0.77 3.74 6.99 0.00 -0.99 -4.95 105.19 111.13 1twc n GLY 562 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1twc n GLY 562 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1twc s MET 563 N -0.66 4.33 -0.10 1.61 0.00 -0.07 -4.80 119.30 119.61 1twc s MET 563 Ca 0.00 2.18 -0.07 0.00 0.00 0.00 0.00 55.69 57.80 1twc s MET 563 Cb 0.00 -3.15 -0.04 0.00 0.00 0.00 0.00 34.83 31.64 1twc s MET 563 CO 0.00 -0.34 0.15 -1.21 0.00 0.00 0.00 175.02 173.62 1twc s GLU 564 N -0.19 3.45 0.45 4.11 2.02 -0.24 -4.69 118.70 123.60 1twc s GLU 564 Ca 0.58 -0.15 -0.21 0.00 0.02 0.00 0.00 54.97 55.22 1twc s GLU 564 Cb -0.39 -3.18 -0.10 0.00 0.10 0.00 0.00 34.13 30.56 1twc s GLU 564 CO 0.40 0.76 0.99 -1.25 0.02 0.00 0.00 175.26 176.18 1twc s PRO 565 N -1.16 4.07 0.18 0.39 0.04 -1.26 -1.23 135.00 136.03 1twc s PRO 565 Ca 0.17 1.22 -0.16 0.00 0.04 0.00 0.00 61.00 62.28 1twc s PRO 565 Cb -0.12 -2.17 0.14 0.00 0.04 0.00 0.00 34.50 32.39 1twc s PRO 565 CO 0.06 -0.18 1.66 -0.07 0.04 0.00 0.00 177.00 178.52 1twc h LEU 566 N 1.82 -0.39 -1.67 -3.56 4.07 -1.91 -0.46 115.31 113.21 1twc h LEU 566 Ca -0.49 0.13 0.42 0.00 0.08 0.00 0.00 57.88 58.02 1twc h LEU 566 Cb 1.20 0.27 -0.09 0.00 1.08 0.00 0.00 40.66 43.11 1twc h LEU 566 CO 0.60 -0.14 0.96 1.05 -1.08 0.00 0.00 178.44 179.83 1twc h GLU 567 N 0.02 0.09 -0.00 1.13 9.09 -1.93 0.57 114.58 123.55 1twc h GLU 567 Ca 0.23 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.63 1twc h GLU 567 Cb 0.35 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.43 1twc h GLU 567 CO -0.46 0.06 -0.34 -0.25 0.05 0.00 0.00 179.01 178.06 1twc n ASP 568 N -4.40 0.39 -4.71 3.06 8.00 -0.19 -4.88 116.55 113.83 1twc n ASP 568 Ca 0.34 -0.10 -0.42 0.00 0.71 0.00 0.00 54.79 55.33 1twc n ASP 568 Cb 1.44 0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 42.55 1twc n ASP 568 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1twc s TYR 569 N -2.95 3.29 -0.26 1.24 5.04 0.20 -4.98 117.35 118.93 1twc s TYR 569 Ca 0.13 1.18 -0.00 0.00 -2.44 0.00 0.00 57.07 55.94 1twc s TYR 569 Cb 0.18 -3.48 0.07 0.00 0.35 0.00 0.00 41.96 39.08 1twc s TYR 569 CO 0.64 -1.57 0.02 0.08 -1.34 0.00 0.00 175.55 173.37 1twc s VAL 570 N 1.46 1.21 0.09 3.14 1.01 -1.26 -5.03 120.40 121.03 1twc s VAL 570 Ca 0.60 -1.23 -0.18 0.00 0.00 0.00 0.00 61.98 61.17 1twc s VAL 570 Cb -0.30 -1.68 -0.07 0.00 0.00 0.00 0.00 36.38 34.33 1twc s VAL 570 CO 0.28 -0.32 1.53 -0.65 0.00 0.00 0.00 175.10 175.93 1twc h PRO 571 N 8.02 0.50 -0.43 2.72 0.11 -1.86 -1.04 132.00 140.01 1twc h PRO 571 Ca -0.15 -0.16 0.12 0.00 0.11 0.00 0.00 66.00 65.92 1twc h PRO 571 Cb 1.06 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1twc h PRO 571 CO 0.42 0.66 0.43 1.12 -0.21 0.00 0.00 178.00 180.42 1twc h HIS 572 N 0.29 0.00 0.00 0.65 2.07 -1.90 -1.86 115.15 114.40 1twc h HIS 572 Ca 0.08 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.60 1twc h HIS 572 Cb 0.43 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.41 1twc h HIS 572 CO 0.04 0.00 -1.82 1.04 -3.07 0.00 0.00 177.93 174.11 1twc n GLN 573 N -3.82 0.58 -3.54 5.12 6.02 -0.83 -4.59 117.38 116.32 1twc n GLN 573 Ca 0.08 -0.17 -0.27 0.00 -0.01 0.00 0.00 57.00 56.63 1twc n GLN 573 Cb 0.61 -1.45 -0.10 0.00 1.02 0.00 0.00 30.24 30.32 1twc n GLN 573 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1twc n SER 574 N -2.13 0.90 0.14 1.08 3.41 -0.46 -4.98 113.62 111.58 1twc n SER 574 Ca -0.03 -2.72 0.13 0.00 -0.26 0.00 0.00 58.87 55.99 1twc n SER 574 Cb 0.48 -0.63 0.35 0.00 -0.26 0.00 0.00 64.21 64.15 1twc n SER 574 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1twc h PRO 575 N 5.35 0.00 -0.09 4.33 0.13 -1.77 -2.92 132.00 137.04 1twc h PRO 575 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1twc h PRO 575 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1twc h PRO 575 CO 0.51 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.03 1twc n ASP 576 N -2.49 0.86 -4.80 1.44 8.00 -1.26 -4.96 116.55 113.34 1twc n ASP 576 Ca 0.05 -1.58 -0.35 0.00 0.71 0.00 0.00 54.79 53.62 1twc n ASP 576 Cb 0.45 -0.05 -0.07 0.00 -0.02 0.00 0.00 41.12 41.43 1twc n ASP 576 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1twc s ALA 577 N -1.89 3.16 -0.20 2.24 0.00 -1.10 -4.97 121.76 118.99 1twc s ALA 577 Ca 0.30 0.42 -0.19 0.00 0.00 0.00 0.00 51.96 52.49 1twc s ALA 577 Cb 0.15 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 20.12 1twc s ALA 577 CO 0.24 0.18 0.53 0.99 0.00 0.00 0.00 175.76 177.69 1twc s THR 578 N -1.86 5.10 0.12 0.00 2.01 0.11 -4.88 115.64 116.23 1twc s THR 578 Ca 0.55 0.97 -0.30 0.00 0.31 0.00 0.00 61.69 63.23 1twc s THR 578 Cb -0.14 -3.85 -0.06 0.00 0.01 0.00 0.00 72.50 68.46 1twc s THR 578 CO 0.19 0.17 0.94 -0.13 -0.69 0.00 0.00 174.62 175.10 1twc s ARG 579 N 1.69 4.70 -0.17 4.92 0.52 0.17 -0.74 118.95 130.04 1twc s ARG 579 Ca 0.24 1.43 -0.01 0.00 -0.52 0.00 0.00 55.73 56.88 1twc s ARG 579 Cb -0.15 -3.36 0.00 0.00 0.52 0.00 0.00 34.95 31.95 1twc s ARG 579 CO 0.10 0.26 -0.14 0.08 0.02 0.00 0.00 175.30 175.62 1twc s VAL 580 N -0.17 2.72 -0.01 3.52 1.01 0.27 -0.44 120.40 127.32 1twc s VAL 580 Ca 0.45 -0.74 0.06 0.00 0.00 0.00 0.00 61.98 61.76 1twc s VAL 580 Cb -0.23 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1twc s VAL 580 CO 0.30 0.50 -0.20 -0.36 0.00 0.00 0.00 175.10 175.33 1twc s PHE 581 N 1.02 1.82 -0.06 5.22 0.40 -0.65 -2.29 117.98 123.44 1twc s PHE 581 Ca -0.01 -0.35 -0.01 0.00 -0.60 0.00 0.00 56.93 55.96 1twc s PHE 581 Cb -0.15 -1.16 0.03 0.00 0.51 0.00 0.00 43.02 42.25 1twc s PHE 581 CO -0.03 -0.01 0.00 0.08 0.70 0.00 0.00 175.22 175.97 1twc s VAL 582 N -0.53 0.30 -1.01 -0.44 1.01 -0.64 -0.71 120.40 118.38 1twc s VAL 582 Ca 0.08 0.13 -0.08 0.00 0.00 0.00 0.00 61.98 62.11 1twc s VAL 582 Cb -0.08 -0.45 0.07 0.00 0.00 0.00 0.00 36.38 35.92 1twc s VAL 582 CO -0.00 0.23 0.31 0.59 0.00 0.00 0.00 175.10 176.23 1twc n ASN 583 N 4.92 -2.62 0.00 3.32 3.02 -0.83 -1.56 115.26 121.51 1twc n ASN 583 Ca -0.11 -0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.21 1twc n ASN 583 Cb 0.50 -2.24 0.00 0.00 -0.61 0.00 0.00 39.78 37.43 1twc n ASN 583 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1twc n GLY 584 N -0.92 0.66 3.59 7.41 0.00 -1.26 -4.92 105.19 109.75 1twc n GLY 584 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1twc n GLY 584 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1twc s VAL 585 N -2.54 4.54 -0.54 1.61 1.01 -0.60 -4.88 120.40 118.99 1twc s VAL 585 Ca 0.00 -0.12 -0.28 0.00 0.00 0.00 0.00 61.98 61.57 1twc s VAL 585 Cb 0.00 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.37 1twc s VAL 585 CO 0.00 0.46 1.22 0.86 0.00 0.00 0.00 175.10 177.64 1twc s TRP 586 N 0.46 2.60 -0.05 5.22 -0.00 -1.26 -1.63 118.94 124.29 1twc s TRP 586 Ca 0.01 0.51 0.13 0.00 -0.00 0.00 0.00 56.10 56.75 1twc s TRP 586 Cb -0.13 -4.47 -0.19 0.00 -0.00 0.00 0.00 33.47 28.67 1twc s TRP 586 CO 0.01 -1.58 0.80 0.45 -0.00 0.00 0.00 176.95 176.63 1twc h HIS 587 N 9.72 0.00 0.00 5.86 3.86 -1.83 -3.48 115.15 129.28 1twc h HIS 587 Ca -0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 1twc h HIS 587 Cb 1.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.53 1twc h HIS 587 CO 1.02 0.88 0.00 0.41 0.86 0.00 0.00 177.93 181.10 1twc n GLY 588 N 1.48 -0.95 2.98 2.45 0.00 -1.20 -3.36 105.19 106.59 1twc n GLY 588 Ca -0.12 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 1twc n GLY 588 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1twc s VAL 589 N -4.00 -0.00 0.04 1.61 0.11 -0.37 -0.56 120.40 117.23 1twc s VAL 589 Ca 0.00 0.02 0.03 0.00 -2.93 0.00 0.00 61.98 59.10 1twc s VAL 589 Cb 0.00 -0.16 -0.02 0.00 -1.53 0.00 0.00 36.38 34.67 1twc s VAL 589 CO 0.00 0.01 -0.10 -2.28 -3.33 0.00 0.00 175.10 169.40 1twc s HIS 590 N 0.15 0.87 -0.09 1.54 5.04 0.08 -1.08 115.29 121.81 1twc s HIS 590 Ca -0.01 -0.38 0.17 0.00 -1.54 0.00 0.00 55.06 53.30 1twc s HIS 590 Cb -0.02 -0.52 -0.25 0.00 0.04 0.00 0.00 32.58 31.83 1twc s HIS 590 CO -0.00 -0.02 0.39 0.54 -2.34 0.00 0.00 174.74 173.31 1twc n ARG 591 N 1.82 0.62 -3.52 2.88 1.74 -1.26 -0.71 116.66 118.22 1twc n ARG 591 Ca -0.19 -0.14 -0.29 0.00 -0.77 0.00 0.00 57.85 56.46 1twc n ARG 591 Cb 0.55 -1.38 -0.08 0.00 -1.02 0.00 0.00 32.46 30.53 1twc n ARG 591 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1twc n ASN 592 N -2.01 3.84 0.14 0.55 3.02 -1.26 -4.91 115.26 114.63 1twc n ASN 592 Ca -0.02 -3.37 0.12 0.00 -0.03 0.00 0.00 54.58 51.27 1twc n ASN 592 Cb 0.41 -0.77 0.51 0.00 -0.61 0.00 0.00 39.78 39.32 1twc n ASN 592 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1twc n PRO 593 N 1.25 0.19 0.02 3.52 -0.04 -1.26 -1.72 135.00 136.95 1twc n PRO 593 Ca 0.27 0.46 -0.04 0.00 -0.04 0.00 0.00 63.50 64.15 1twc n PRO 593 Cb 0.39 -1.89 0.19 0.00 -0.04 0.00 0.00 33.50 32.15 1twc n PRO 593 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1twc h ALA 594 N 2.22 1.06 -0.49 0.55 0.00 -1.97 -0.97 119.26 119.67 1twc h ALA 594 Ca 0.00 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1twc h ALA 594 Cb 0.30 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1twc h ALA 594 CO 0.00 0.57 0.15 0.00 0.00 0.00 0.00 179.25 179.97 1twc h ARG 595 N 0.42 0.77 0.03 0.00 -0.00 -1.77 -1.98 114.38 111.84 1twc h ARG 595 Ca 0.06 -0.17 -0.00 0.00 -0.50 0.00 0.00 59.98 59.37 1twc h ARG 595 Cb 0.71 -0.11 0.00 0.00 0.00 0.00 0.00 29.97 30.57 1twc h ARG 595 CO 0.05 0.72 -0.01 1.25 0.00 0.00 0.00 179.97 181.98 1twc h LEU 596 N 0.67 -0.03 -0.41 3.04 5.85 -1.38 -2.46 115.31 120.58 1twc h LEU 596 Ca 0.16 -0.40 0.06 0.00 0.84 0.00 0.00 57.88 58.54 1twc h LEU 596 Cb 0.28 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 1twc h LEU 596 CO -0.00 0.39 0.09 -0.03 -0.34 0.00 0.00 178.44 178.55 1twc h MET 597 N -0.46 0.22 -0.56 1.25 4.05 -1.20 0.33 114.93 118.56 1twc h MET 597 Ca -0.00 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1twc h MET 597 Cb 0.43 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 31.15 1twc h MET 597 CO 0.01 0.15 0.36 0.93 0.23 0.00 0.00 176.91 178.58 1twc h GLU 598 N 0.23 0.75 0.88 0.39 5.08 -1.22 -1.48 114.58 119.22 1twc h GLU 598 Ca 0.19 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 1twc h GLU 598 Cb 0.23 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.32 1twc h GLU 598 CO -0.24 0.51 -0.42 1.15 -1.00 0.00 0.00 179.01 179.01 1twc h THR 599 N 0.76 0.04 -0.92 1.13 2.02 -1.12 -0.96 112.91 113.86 1twc h THR 599 Ca 0.20 -0.11 0.19 0.00 0.77 0.00 0.00 66.41 67.46 1twc h THR 599 Cb -0.06 0.04 -0.17 0.00 -1.74 0.00 0.00 68.15 66.22 1twc h THR 599 CO -0.04 0.00 -0.21 -0.07 0.37 0.00 0.00 175.52 175.57 1twc h LEU 600 N -1.29 -0.83 -0.56 2.58 3.38 -0.19 0.85 115.31 119.25 1twc h LEU 600 Ca -0.12 0.27 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1twc h LEU 600 Cb 0.91 0.56 -0.02 0.00 0.09 0.00 0.00 40.66 42.20 1twc h LEU 600 CO 0.20 -0.30 0.07 0.03 0.09 0.00 0.00 178.44 178.52 1twc h ARG 601 N 0.00 0.94 -0.93 1.13 3.08 -1.12 -0.71 114.38 116.78 1twc h ARG 601 Ca 0.45 -0.27 0.10 0.00 0.07 0.00 0.00 59.98 60.33 1twc h ARG 601 Cb 0.70 -0.10 -0.07 0.00 0.08 0.00 0.00 29.97 30.57 1twc h ARG 601 CO -0.94 0.92 0.60 1.15 -1.07 0.00 0.00 179.97 180.63 1twc h THR 602 N 0.83 0.97 -0.35 2.04 2.02 0.27 0.14 112.91 118.84 1twc h THR 602 Ca 0.17 -0.32 -0.08 0.00 0.77 0.00 0.00 66.41 66.94 1twc h THR 602 Cb 0.45 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 1twc h THR 602 CO 0.02 0.17 -0.11 -0.07 0.37 0.00 0.00 175.52 175.90 1twc h LEU 603 N 0.94 0.70 -0.97 2.58 3.38 -0.18 -2.97 115.31 118.81 1twc h LEU 603 Ca 0.43 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 1twc h LEU 603 Cb 0.40 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1twc h LEU 603 CO -0.19 0.92 -0.06 -0.09 0.09 0.00 0.00 178.44 179.10 1twc h ARG 604 N 0.48 0.68 0.00 1.13 2.43 -0.67 0.14 114.38 118.57 1twc h ARG 604 Ca 0.08 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1twc h ARG 604 Cb 0.63 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1twc h ARG 604 CO 0.04 0.74 0.00 0.54 -1.51 0.00 0.00 179.97 179.78 1twc n ARG 605 N -4.20 0.03 0.00 0.20 1.74 0.46 -2.63 116.66 112.26 1twc n ARG 605 Ca 0.02 0.34 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 1twc n ARG 605 Cb 0.32 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 1twc n ARG 605 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1twc n LYS 606 N -1.41 2.68 0.00 5.56 4.81 -1.15 -1.96 118.16 126.69 1twc n LYS 606 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 1twc n LYS 606 Cb 0.05 -0.80 0.00 0.00 0.02 0.00 0.00 35.03 34.30 1twc n LYS 606 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1twc n GLY 607 N 1.89 0.82 0.10 3.14 0.00 -0.93 -4.87 105.19 105.34 1twc n GLY 607 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1twc n GLY 607 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1twc h ASP 608 N 0.00 0.15 -2.77 1.61 5.19 -0.98 -3.39 116.42 116.23 1twc h ASP 608 Ca 0.00 -0.13 -0.65 0.00 -0.62 0.00 0.00 57.03 55.63 1twc h ASP 608 Cb 0.00 -0.05 -0.07 0.00 0.18 0.00 0.00 39.33 39.39 1twc h ASP 608 CO 0.00 0.99 -0.42 -0.63 -3.12 0.00 0.00 179.24 176.07 1twc s ILE 609 N -3.01 5.40 0.33 0.35 1.01 -0.98 -4.92 121.20 119.37 1twc s ILE 609 Ca -0.01 0.35 -0.29 0.00 0.00 0.00 0.00 60.65 60.70 1twc s ILE 609 Cb 0.10 -3.48 -0.11 0.00 0.01 0.00 0.00 42.46 38.98 1twc s ILE 609 CO 0.82 0.60 1.54 0.21 0.00 0.00 0.00 174.94 178.11 1twc s ASN 610 N -0.93 6.37 0.39 3.58 3.84 -1.26 -4.41 114.94 122.52 1twc s ASN 610 Ca 0.17 2.98 0.18 0.00 0.21 0.00 0.00 52.86 56.40 1twc s ASN 610 Cb -0.13 -2.65 1.00 0.00 -0.55 0.00 0.00 41.25 38.92 1twc s ASN 610 CO 0.06 -0.89 1.50 -0.65 -2.79 0.00 0.00 177.10 174.33 1twc h PRO 611 N 4.10 0.00 -0.42 0.43 0.11 -1.90 -1.46 132.00 132.86 1twc h PRO 611 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1twc h PRO 611 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1twc h PRO 611 CO 0.73 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.67 1twc n GLU 612 N -2.25 2.45 -2.51 1.05 0.28 -1.26 -4.52 120.64 113.87 1twc n GLU 612 Ca -0.01 -2.17 -0.40 0.00 -0.16 0.00 0.00 57.16 54.41 1twc n GLU 612 Cb 0.27 -1.41 -0.04 0.00 1.43 0.00 0.00 31.44 31.68 1twc n GLU 612 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1twc s VAL 613 N -1.14 3.56 -0.06 3.84 1.01 -0.55 -4.92 120.40 122.14 1twc s VAL 613 Ca 0.33 1.57 0.02 0.00 0.00 0.00 0.00 61.98 63.90 1twc s VAL 613 Cb 0.18 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 1twc s VAL 613 CO 0.25 0.37 -0.12 -0.55 0.00 0.00 0.00 175.10 175.05 1twc s SER 614 N -0.88 4.20 -0.11 3.32 0.15 -0.70 -4.97 113.70 114.71 1twc s SER 614 Ca 0.44 -0.16 -0.05 0.00 0.70 0.00 0.00 55.95 56.88 1twc s SER 614 Cb -0.31 -1.00 0.05 0.00 -1.71 0.00 0.00 66.02 63.05 1twc s SER 614 CO 0.40 0.34 0.26 -0.04 1.20 0.00 0.00 173.24 175.39 1twc s MET 615 N -0.66 0.20 -0.09 5.44 -1.94 -1.26 -0.42 119.30 120.57 1twc s MET 615 Ca 0.10 0.59 -0.01 0.00 -1.71 0.00 0.00 55.69 54.66 1twc s MET 615 Cb -0.11 -0.10 0.03 0.00 2.01 0.00 0.00 34.83 36.65 1twc s MET 615 CO 0.01 -0.19 -0.04 0.42 -0.01 0.00 0.00 175.02 175.22 1twc s ILE 616 N 1.51 0.66 -0.15 2.53 1.01 -0.64 -4.86 121.20 121.26 1twc s ILE 616 Ca -0.07 -0.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.44 1twc s ILE 616 Cb -0.11 -0.75 -0.04 0.00 0.01 0.00 0.00 42.46 41.58 1twc s ILE 616 CO -0.09 0.30 0.06 -0.60 0.00 0.00 0.00 174.94 174.62 1twc s ARG 617 N 1.75 3.71 -0.38 2.79 3.52 -1.26 -1.54 118.95 127.54 1twc s ARG 617 Ca 0.03 -0.32 -0.12 0.00 -0.13 0.00 0.00 55.73 55.19 1twc s ARG 617 Cb -0.13 -3.13 0.02 0.00 -1.56 0.00 0.00 34.95 30.15 1twc s ARG 617 CO -0.06 0.44 0.24 0.34 -0.81 0.00 0.00 175.30 175.45 1twc s ASP 618 N -0.10 5.87 0.13 -2.12 -1.08 0.16 -4.92 116.67 114.61 1twc s ASP 618 Ca 0.07 -0.89 -0.07 0.00 -0.52 0.00 0.00 52.55 51.14 1twc s ASP 618 Cb -0.12 -2.08 -0.09 0.00 -1.46 0.00 0.00 42.92 39.18 1twc s ASP 618 CO 0.01 -0.38 1.33 0.40 0.52 0.00 0.00 175.17 177.04 1twc h ILE 619 N 5.75 1.34 0.00 4.11 2.04 -1.97 -0.50 117.51 128.28 1twc h ILE 619 Ca -0.27 -2.20 0.00 0.00 1.00 0.00 0.00 64.86 63.39 1twc h ILE 619 Cb 1.12 2.21 0.00 0.00 -0.74 0.00 0.00 36.82 39.40 1twc h ILE 619 CO 0.68 0.67 -0.87 0.54 0.00 0.00 0.00 178.15 179.18 1twc n ARG 620 N -3.84 0.11 0.00 2.37 1.74 -1.26 -2.90 116.66 112.88 1twc n ARG 620 Ca -0.07 -0.01 0.13 0.00 -0.77 0.00 0.00 57.85 57.13 1twc n ARG 620 Cb 0.78 -1.53 0.31 0.00 -1.02 0.00 0.00 32.46 31.00 1twc n ARG 620 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1twc n GLU 621 N -1.67 1.40 -3.75 5.56 4.07 -1.17 -4.98 120.64 120.10 1twc n GLU 621 Ca 0.04 -0.96 -0.29 0.00 -0.06 0.00 0.00 57.16 55.89 1twc n GLU 621 Cb 0.37 -1.48 0.02 0.00 -0.06 0.00 0.00 31.44 30.29 1twc n GLU 621 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1twc n LYS 622 N 0.04 -5.17 -5.26 5.31 5.02 -0.23 -4.89 118.16 112.98 1twc n LYS 622 Ca 0.14 0.61 -0.31 0.00 -2.02 0.00 0.00 58.31 56.73 1twc n LYS 622 Cb 0.41 -5.47 -0.16 0.00 -0.02 0.00 0.00 35.03 29.79 1twc n LYS 622 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1twc s GLU 623 N -6.45 2.23 -0.12 1.97 2.02 -1.00 0.45 118.70 117.80 1twc s GLU 623 Ca 0.60 -0.90 -0.00 0.00 0.02 0.00 0.00 54.97 54.68 1twc s GLU 623 Cb -0.30 -2.10 0.03 0.00 0.10 0.00 0.00 34.13 31.86 1twc s GLU 623 CO 0.74 0.53 -0.08 -1.17 0.02 0.00 0.00 175.26 175.29 1twc s LEU 624 N -0.54 1.31 -0.09 1.80 2.96 0.41 -0.67 118.68 123.86 1twc s LEU 624 Ca 0.08 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.65 1twc s LEU 624 Cb -0.11 -0.90 0.00 0.00 0.50 0.00 0.00 46.19 45.69 1twc s LEU 624 CO 0.00 -0.12 -0.21 -0.54 -1.32 0.00 0.00 176.35 174.17 1twc s LYS 625 N 1.67 2.70 0.02 1.98 1.02 -0.59 -1.64 119.74 124.90 1twc s LYS 625 Ca 0.05 -0.76 0.08 0.00 0.02 0.00 0.00 55.97 55.36 1twc s LYS 625 Cb -0.13 -2.09 -0.02 0.00 -0.52 0.00 0.00 37.83 35.07 1twc s LYS 625 CO -0.09 0.12 -0.24 0.42 -0.92 0.00 0.00 175.35 174.65 1twc s ILE 626 N 0.47 1.92 -0.05 2.17 1.01 0.11 -1.61 121.20 125.22 1twc s ILE 626 Ca -0.17 -1.18 0.01 0.00 0.00 0.00 0.00 60.65 59.31 1twc s ILE 626 Cb -0.17 -1.63 0.02 0.00 0.01 0.00 0.00 42.46 40.69 1twc s ILE 626 CO 0.07 0.41 -0.04 -0.36 0.00 0.00 0.00 174.94 175.01 1twc s PHE 627 N -0.69 0.81 -0.09 3.97 0.40 0.44 -1.96 117.98 120.87 1twc s PHE 627 Ca 0.10 -0.25 0.01 0.00 -0.60 0.00 0.00 56.93 56.19 1twc s PHE 627 Cb -0.09 -0.74 0.01 0.00 0.51 0.00 0.00 43.02 42.71 1twc s PHE 627 CO 0.01 -0.23 0.57 0.25 0.70 0.00 0.00 175.22 176.52 1twc n THR 628 N 4.24 0.10 -2.17 0.64 -2.24 -1.26 -1.73 114.28 111.86 1twc n THR 628 Ca -0.21 -0.55 -0.34 0.00 -2.27 0.00 0.00 64.05 60.67 1twc n THR 628 Cb 0.51 0.96 0.01 0.00 -2.10 0.00 0.00 70.33 69.71 1twc n THR 628 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1twc s ASP 629 N -0.15 5.70 0.74 3.42 -4.77 -1.26 -1.32 116.67 119.02 1twc s ASP 629 Ca 0.01 2.06 -0.14 0.00 -3.30 0.00 0.00 52.55 51.18 1twc s ASP 629 Cb 0.01 -2.57 0.04 0.00 -1.09 0.00 0.00 42.92 39.31 1twc s ASP 629 CO 0.01 -1.23 1.15 0.00 0.70 0.00 0.00 175.17 175.80 1twc s ALA 630 N -2.01 2.17 0.00 2.11 0.00 -1.26 -4.31 121.76 118.46 1twc s ALA 630 Ca 0.70 0.66 0.00 0.00 0.00 0.00 0.00 51.96 53.31 1twc s ALA 630 Cb -0.21 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1twc s ALA 630 CO 0.30 -1.78 0.00 0.41 0.00 0.00 0.00 175.76 174.69 1twc n GLY 631 N -0.12 0.91 3.72 0.00 0.00 -0.75 -4.89 105.19 104.05 1twc n GLY 631 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1twc n GLY 631 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1twc s ARG 632 N -0.58 4.56 0.05 1.61 0.52 -1.26 -1.36 118.95 122.49 1twc s ARG 632 Ca 0.00 1.29 -0.12 0.00 -0.52 0.00 0.00 55.73 56.38 1twc s ARG 632 Cb 0.00 -3.43 -0.06 0.00 0.52 0.00 0.00 34.95 31.99 1twc s ARG 632 CO 0.00 0.07 0.41 0.08 0.02 0.00 0.00 175.30 175.88 1twc s VAL 633 N 0.61 5.07 0.31 3.52 1.01 -1.26 -0.85 120.40 128.80 1twc s VAL 633 Ca 0.47 0.61 -0.05 0.00 0.00 0.00 0.00 61.98 63.01 1twc s VAL 633 Cb -0.21 -3.67 -0.00 0.00 0.00 0.00 0.00 36.38 32.50 1twc s VAL 633 CO 0.26 0.40 0.45 -0.72 0.00 0.00 0.00 175.10 175.50 1twc s TYR 634 N -1.27 0.89 0.16 5.22 -0.85 0.24 -4.00 117.35 117.74 1twc s TYR 634 Ca 0.29 -1.16 -0.15 0.00 -0.52 0.00 0.00 57.07 55.54 1twc s TYR 634 Cb -0.15 -0.04 0.02 0.00 0.38 0.00 0.00 41.96 42.17 1twc s TYR 634 CO 0.16 -1.07 0.41 -0.98 -1.52 0.00 0.00 175.55 172.55 1twc s ARG 635 N -3.35 1.20 0.01 -3.49 1.70 -0.47 -1.55 118.95 113.00 1twc s ARG 635 Ca 0.29 -0.89 -0.07 0.00 -0.47 0.00 0.00 55.73 54.60 1twc s ARG 635 Cb 0.00 0.46 -0.05 0.00 -0.57 0.00 0.00 34.95 34.80 1twc s ARG 635 CO 0.17 -0.48 0.27 -1.25 -1.08 0.00 0.00 175.30 172.93 1twc s PRO 636 N -3.87 3.59 0.12 3.89 0.04 -1.26 0.14 135.00 137.65 1twc s PRO 636 Ca 0.09 -0.07 0.05 0.00 0.04 0.00 0.00 61.00 61.11 1twc s PRO 636 Cb 0.01 -3.07 -0.04 0.00 0.04 0.00 0.00 34.50 31.44 1twc s PRO 636 CO -0.06 0.64 -0.12 -0.51 0.04 0.00 0.00 177.00 177.00 1twc s LEU 637 N -1.77 2.44 0.43 -3.56 1.43 -0.54 -4.64 118.68 112.48 1twc s LEU 637 Ca 0.28 -0.86 -0.21 0.00 -1.03 0.00 0.00 54.13 52.31 1twc s LEU 637 Cb -0.13 -0.42 -0.11 0.00 0.03 0.00 0.00 46.19 45.56 1twc s LEU 637 CO 0.16 -0.23 0.95 -0.36 0.23 0.00 0.00 176.35 177.11 1twc s PHE 638 N -2.53 3.29 0.05 0.29 2.99 -0.18 -2.56 117.98 119.32 1twc s PHE 638 Ca 0.10 1.61 -0.08 0.00 0.00 0.00 0.00 56.93 58.55 1twc s PHE 638 Cb -0.02 -2.86 -0.05 0.00 0.00 0.00 0.00 43.02 40.08 1twc s PHE 638 CO 0.01 -0.15 0.34 0.42 -0.00 0.00 0.00 175.22 175.84 1twc s ILE 639 N -2.17 5.19 -0.12 0.64 1.01 -0.74 -1.24 121.20 123.77 1twc s ILE 639 Ca 0.62 0.31 0.02 0.00 0.00 0.00 0.00 60.65 61.61 1twc s ILE 639 Cb -0.09 -3.61 0.01 0.00 0.01 0.00 0.00 42.46 38.78 1twc s ILE 639 CO 0.13 0.32 -0.20 -0.69 0.00 0.00 0.00 174.94 174.51 1twc s VAL 640 N -1.35 1.87 -0.00 2.92 1.01 -0.86 -2.06 120.40 121.93 1twc s VAL 640 Ca 0.30 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.43 1twc s VAL 640 Cb -0.14 -1.66 -0.00 0.00 0.00 0.00 0.00 36.38 34.58 1twc s VAL 640 CO 0.17 0.51 -0.05 -1.61 0.00 0.00 0.00 175.10 174.13 1twc s GLU 641 N 0.80 0.37 -0.48 2.72 0.41 -0.22 -4.62 118.70 117.69 1twc s GLU 641 Ca -0.09 -0.19 -0.24 0.00 -0.41 0.00 0.00 54.97 54.04 1twc s GLU 641 Cb -0.16 -0.35 0.03 0.00 -1.78 0.00 0.00 34.13 31.88 1twc s GLU 641 CO -0.00 0.09 0.86 0.16 -0.49 0.00 0.00 175.26 175.88 1twc s ASP 642 N -0.19 6.42 0.00 -0.19 -4.77 -1.26 -1.68 116.67 115.00 1twc s ASP 642 Ca 0.01 -0.10 0.00 0.00 -3.30 0.00 0.00 52.55 49.16 1twc s ASP 642 Cb -0.02 -2.42 0.00 0.00 -1.09 0.00 0.00 42.92 39.39 1twc s ASP 642 CO -0.00 -1.03 0.00 -0.67 0.70 0.00 0.00 175.17 174.17 1twc n ASP 643 N 7.02 0.00 -0.95 2.11 2.03 -1.26 -5.04 116.55 120.47 1twc n ASP 643 Ca 0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.34 1twc n ASP 643 Cb 0.48 0.18 0.00 0.00 -0.72 0.00 0.00 41.12 41.06 1twc n ASP 643 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1twc n GLU 644 N -1.54 0.00 0.00 -0.67 1.02 -1.26 -4.14 120.64 114.04 1twc n GLU 644 Ca 0.00 0.48 0.00 0.00 -0.02 0.00 0.00 57.16 57.62 1twc n GLU 644 Cb 0.00 -0.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.95 1twc n GLU 644 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1twc n SER 645 N 0.00 0.00 -1.96 1.62 2.88 -1.26 -2.53 113.62 112.38 1twc n SER 645 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1twc n SER 645 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1twc n SER 645 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1twc n LEU 646 N 0.00 0.00 0.00 2.46 4.77 -1.26 -4.95 117.00 118.02 1twc n LEU 646 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1twc n LEU 646 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1twc n LEU 646 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 1twc n GLY 647 N 1.60 0.94 0.08 -0.72 0.00 -1.05 -4.98 105.19 101.06 1twc n GLY 647 Ca 0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.27 1twc n GLY 647 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1twc n HIS 648 N 0.00 -3.02 -3.01 1.61 -0.00 -1.26 -4.93 115.22 104.60 1twc n HIS 648 Ca 0.00 -0.02 -0.38 0.00 -0.00 0.00 0.00 57.72 57.32 1twc n HIS 648 Cb 0.00 -0.02 -0.06 0.00 -0.00 0.00 0.00 29.99 29.90 1twc n HIS 648 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 1twc s LYS 649 N -3.05 4.45 -0.00 -1.40 1.02 -1.26 -4.45 119.74 115.04 1twc s LYS 649 Ca 0.02 1.06 -0.06 0.00 0.02 0.00 0.00 55.97 57.01 1twc s LYS 649 Cb -0.00 -3.08 -0.00 0.00 -0.52 0.00 0.00 37.83 34.23 1twc s LYS 649 CO 0.01 0.48 0.11 -2.00 -0.92 0.00 0.00 175.35 173.03 1twc s GLU 650 N -1.53 0.41 0.14 1.68 2.56 -0.68 -4.79 118.70 116.50 1twc s GLU 650 Ca 0.39 -0.36 -0.34 0.00 0.00 0.00 0.00 54.97 54.66 1twc s GLU 650 Cb -0.20 0.17 -0.14 0.00 2.00 0.00 0.00 34.13 35.96 1twc s GLU 650 CO 0.24 -0.09 1.57 1.28 -0.56 0.00 0.00 175.26 177.69 1twc n LEU 651 N 1.68 2.97 -0.28 2.70 4.77 -1.26 -1.05 117.00 126.51 1twc n LEU 651 Ca -0.22 1.08 0.03 0.00 -0.03 0.00 0.00 56.01 56.87 1twc n LEU 651 Cb 0.56 -1.40 0.16 0.00 -2.33 0.00 0.00 43.42 40.41 1twc n LEU 651 CO 0.21 -0.35 1.13 0.11 -1.33 0.00 0.00 177.39 177.15 1twc h LYS 652 N 5.91 0.73 -7.02 3.23 1.57 -1.72 -3.42 116.57 115.86 1twc h LYS 652 Ca -0.45 -0.04 -0.50 0.00 -1.87 0.00 0.00 60.65 57.78 1twc h LYS 652 Cb 1.26 -0.16 0.06 0.00 0.08 0.00 0.00 32.23 33.47 1twc h LYS 652 CO 0.88 0.48 0.47 0.14 -0.57 0.00 0.00 179.45 180.85 1twc s VAL 653 N -6.03 3.19 0.35 0.50 -7.23 -1.26 -5.01 120.40 104.90 1twc s VAL 653 Ca -0.12 0.86 -0.03 0.00 -1.81 0.00 0.00 61.98 60.88 1twc s VAL 653 Cb 0.19 -3.42 0.00 0.00 0.56 0.00 0.00 36.38 33.72 1twc s VAL 653 CO 0.78 -0.05 0.48 -0.13 -0.31 0.00 0.00 175.10 175.87 1twc s ARG 654 N -2.81 1.92 0.39 4.82 1.81 -1.26 -4.34 118.95 119.48 1twc s ARG 654 Ca 0.65 -1.76 0.07 0.00 -1.72 0.00 0.00 55.73 52.98 1twc s ARG 654 Cb -0.27 0.45 0.79 0.00 -0.45 0.00 0.00 34.95 35.47 1twc s ARG 654 CO 0.32 -0.80 1.97 0.87 -0.68 0.00 0.00 175.30 176.99 1twc h LYS 655 N 2.10 0.43 -0.41 3.54 1.79 -0.81 0.13 116.57 123.34 1twc h LYS 655 Ca -0.28 -0.06 -0.03 0.00 -2.18 0.00 0.00 60.65 58.09 1twc h LYS 655 Cb 1.24 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.79 1twc h LYS 655 CO 0.39 0.40 0.12 0.78 -1.08 0.00 0.00 179.45 180.06 1twc h GLY 656 N 0.65 0.64 1.30 3.86 0.00 -1.04 -0.87 103.07 107.61 1twc h GLY 656 Ca 0.10 -0.33 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 1twc h GLY 656 CO -0.00 0.31 -0.04 0.45 0.00 0.00 0.00 176.54 177.25 1twc h HIS 657 N 0.59 0.91 0.00 5.60 3.86 -0.97 -2.38 115.15 122.76 1twc h HIS 657 Ca 0.14 -0.15 -0.07 0.00 -1.16 0.00 0.00 60.37 59.13 1twc h HIS 657 Cb 0.19 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 1twc h HIS 657 CO 0.01 0.85 -0.35 0.82 0.86 0.00 0.00 177.93 180.12 1twc h ILE 658 N 0.77 1.13 -0.01 2.45 1.08 -0.88 -2.28 117.51 119.77 1twc h ILE 658 Ca 0.14 -1.24 -0.24 0.00 -0.39 0.00 0.00 64.86 63.13 1twc h ILE 658 Cb 0.53 1.69 0.01 0.00 -3.07 0.00 0.00 36.82 35.98 1twc h ILE 658 CO 0.03 0.34 -0.96 0.00 -0.69 0.00 0.00 178.15 176.87 1twc h ALA 659 N 1.65 0.31 -0.48 1.87 0.00 -0.91 -1.94 119.26 119.76 1twc h ALA 659 Ca -0.00 -0.70 0.05 0.00 0.00 0.00 0.00 54.91 54.26 1twc h ALA 659 Cb 0.67 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1twc h ALA 659 CO 0.05 0.78 0.32 0.87 0.00 0.00 0.00 179.25 181.26 1twc h LYS 660 N 0.29 0.45 0.35 0.00 1.57 -0.92 -0.16 116.57 118.14 1twc h LYS 660 Ca -0.09 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1twc h LYS 660 Cb 1.60 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.81 1twc h LYS 660 CO 0.17 0.30 -0.17 -0.07 -0.57 0.00 0.00 179.45 179.11 1twc h LEU 661 N 0.46 -0.39 -1.44 2.94 3.38 -1.08 -2.15 115.31 117.02 1twc h LEU 661 Ca 0.21 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1twc h LEU 661 Cb 0.23 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1twc h LEU 661 CO -0.05 -0.05 0.00 0.24 0.09 0.00 0.00 178.44 178.67 1twc h MET 662 N -0.78 0.00 -0.11 1.13 2.86 -1.27 -0.72 114.93 116.04 1twc h MET 662 Ca -0.05 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 57.40 1twc h MET 662 Cb 0.51 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.17 1twc h MET 662 CO 0.08 0.00 -0.72 0.00 1.06 0.00 0.00 176.91 177.33 1twc h ALA 663 N 2.09 0.54 -0.08 6.32 0.00 -0.66 -3.11 119.26 124.35 1twc h ALA 663 Ca 0.00 -0.59 -0.14 0.00 0.00 0.00 0.00 54.91 54.18 1twc h ALA 663 Cb 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1twc h ALA 663 CO 0.00 0.73 -0.56 1.15 0.00 0.00 0.00 179.25 180.57 1twc h THR 664 N 0.36 1.37 -0.00 0.00 2.02 -0.50 -2.38 112.91 113.79 1twc h THR 664 Ca -0.03 -1.88 -0.00 0.00 0.77 0.00 0.00 66.41 65.27 1twc h THR 664 Cb 1.30 1.93 0.00 0.00 -1.74 0.00 0.00 68.15 69.64 1twc h THR 664 CO 0.13 0.56 -0.01 -0.08 0.37 0.00 0.00 175.52 176.49 1twc h GLU 665 N 0.19 0.01 -0.53 6.66 4.81 -1.45 -2.71 114.58 121.56 1twc h GLU 665 Ca -0.00 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.33 1twc h GLU 665 Cb 1.04 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.40 1twc h GLU 665 CO 0.09 0.61 0.36 -0.92 -0.73 0.00 0.00 179.01 178.42 1twc h TYR 666 N -0.59 0.26 -0.25 0.92 3.20 -1.53 -3.37 116.97 115.61 1twc h TYR 666 Ca -0.00 0.01 -0.70 0.00 3.14 0.00 0.00 58.73 61.17 1twc h TYR 666 Cb 0.61 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.74 1twc h TYR 666 CO 0.14 0.12 2.88 1.04 -1.64 0.00 0.00 178.16 180.70 1twc n GLN 667 N -4.45 2.95 -0.48 1.82 6.02 -0.90 -5.10 117.38 117.24 1twc n GLN 667 Ca 0.09 -2.79 -0.02 0.00 -0.01 0.00 0.00 57.00 54.27 1twc n GLN 667 Cb 0.43 -3.33 -0.02 0.00 1.02 0.00 0.00 30.24 28.34 1twc n GLN 667 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1twc n ASP 668 N 6.60 -0.23 -3.36 1.08 9.92 -1.26 -5.02 116.55 124.29 1twc n ASP 668 Ca 0.51 -0.80 -0.15 0.00 -0.53 0.00 0.00 54.79 53.83 1twc n ASP 668 Cb 0.41 0.07 -0.08 0.00 -0.64 0.00 0.00 41.12 40.87 1twc n ASP 668 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1twc s GLU 678 N 0.00 0.42 -0.11 -1.24 2.12 -1.26 -5.16 118.70 113.47 1twc s GLU 678 Ca 0.00 -0.22 0.00 0.00 0.36 0.00 0.00 54.97 55.11 1twc s GLU 678 Cb 0.00 -0.56 -0.02 0.00 0.26 0.00 0.00 34.13 33.81 1twc s GLU 678 CO 0.00 -1.07 -0.11 -0.47 -0.54 0.00 0.00 175.26 173.07 1twc s TYR 679 N 2.21 2.83 0.14 5.30 5.04 -1.26 -4.99 117.35 126.63 1twc s TYR 679 Ca 0.11 -0.44 0.02 0.00 -2.44 0.00 0.00 57.07 54.32 1twc s TYR 679 Cb -0.14 -1.81 -0.04 0.00 0.35 0.00 0.00 41.96 40.32 1twc s TYR 679 CO -0.26 -0.06 -0.02 0.99 -1.34 0.00 0.00 175.55 174.86 1twc s THR 680 N 0.04 0.63 0.30 4.34 2.01 -1.26 -4.61 115.64 117.09 1twc s THR 680 Ca -0.04 -1.96 0.05 0.00 0.31 0.00 0.00 61.69 60.05 1twc s THR 680 Cb -0.14 -1.95 0.38 0.00 0.01 0.00 0.00 72.50 70.80 1twc s THR 680 CO 0.04 -0.62 1.46 1.87 -0.69 0.00 0.00 174.62 176.68 1twc n TRP 681 N -0.15 0.68 0.19 4.92 -0.00 -1.26 -1.10 117.44 120.71 1twc n TRP 681 Ca -0.08 1.12 0.05 0.00 -0.00 0.00 0.00 57.50 58.58 1twc n TRP 681 Cb 0.62 -1.25 0.36 0.00 -0.00 0.00 0.00 31.31 31.05 1twc n TRP 681 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 177.69 178.46 1twc h SER 682 N 0.00 0.00 -0.51 5.87 0.02 -1.96 0.21 113.55 117.18 1twc h SER 682 Ca 0.60 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.54 1twc h SER 682 Cb 1.32 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.83 1twc h SER 682 CO -0.85 0.38 0.27 0.28 -1.14 0.00 0.00 176.83 175.77 1twc h SER 683 N 0.00 0.64 -0.84 3.07 0.02 -1.50 -1.73 113.55 113.21 1twc h SER 683 Ca -0.00 -0.10 0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1twc h SER 683 Cb 0.80 -0.16 -0.06 0.00 0.14 0.00 0.00 62.40 63.12 1twc h SER 683 CO 0.05 0.55 0.51 -0.07 -1.14 0.00 0.00 176.83 176.73 1twc h LEU 684 N 0.67 0.77 -0.71 5.07 3.38 0.30 -1.64 115.31 123.15 1twc h LEU 684 Ca 0.18 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1twc h LEU 684 Cb 0.06 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1twc h LEU 684 CO -0.03 0.48 0.36 -0.07 0.09 0.00 0.00 178.44 179.28 1twc h LEU 685 N 0.90 0.90 -1.10 1.67 3.38 -1.19 -2.38 115.31 117.49 1twc h LEU 685 Ca 0.38 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.15 1twc h LEU 685 Cb 0.23 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1twc h LEU 685 CO -0.20 0.76 -0.23 0.78 0.09 0.00 0.00 178.44 179.65 1twc h ASN 686 N 0.98 0.36 -0.24 -0.43 2.35 -0.41 -2.13 115.58 116.06 1twc h ASN 686 Ca 0.25 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1twc h ASN 686 Cb 0.08 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.35 1twc h ASN 686 CO -0.04 0.60 0.00 -0.62 -1.65 0.00 0.00 177.43 175.72 1twc n GLU 687 N -4.16 1.81 -2.01 0.81 1.02 -0.79 -4.05 120.64 113.27 1twc n GLU 687 Ca -0.00 -0.96 -0.16 0.00 -0.02 0.00 0.00 57.16 56.02 1twc n GLU 687 Cb 0.37 -1.36 -0.03 0.00 -0.02 0.00 0.00 31.44 30.39 1twc n GLU 687 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1twc n GLY 688 N 0.70 0.37 0.09 0.62 0.00 -0.80 -4.88 105.19 101.29 1twc n GLY 688 Ca 0.09 -0.23 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 1twc n GLY 688 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1twc n LEU 689 N -2.13 0.66 -4.15 0.99 4.77 -0.90 -4.82 117.00 111.41 1twc n LEU 689 Ca -0.18 0.30 -0.12 0.00 -0.03 0.00 0.00 56.01 55.98 1twc n LEU 689 Cb 0.60 0.18 -0.11 0.00 -2.33 0.00 0.00 43.42 41.77 1twc n LEU 689 CO 0.23 0.29 -0.40 -0.69 -1.33 0.00 0.00 177.39 175.49 1twc s VAL 690 N -2.76 0.74 -0.02 4.08 1.01 -1.22 -1.79 120.40 120.45 1twc s VAL 690 Ca -0.05 -1.66 -0.28 0.00 0.00 0.00 0.00 61.98 60.00 1twc s VAL 690 Cb 0.08 -1.35 0.06 0.00 0.00 0.00 0.00 36.38 35.18 1twc s VAL 690 CO 0.82 -0.67 0.61 -0.70 0.00 0.00 0.00 175.10 175.17 1twc s GLU 691 N -3.01 1.02 -0.06 2.72 2.12 -1.06 -4.48 118.70 115.96 1twc s GLU 691 Ca 0.05 0.10 -0.13 0.00 0.36 0.00 0.00 54.97 55.36 1twc s GLU 691 Cb -0.01 0.48 -0.05 0.00 0.26 0.00 0.00 34.13 34.81 1twc s GLU 691 CO -0.02 -0.33 0.33 0.71 -0.54 0.00 0.00 175.26 175.41 1twc s TYR 692 N -1.50 3.65 -0.04 5.30 4.12 -1.26 -1.46 117.35 126.16 1twc s TYR 692 Ca -0.10 0.82 0.03 0.00 0.02 0.00 0.00 57.07 57.84 1twc s TYR 692 Cb -0.01 -2.23 0.00 0.00 -1.52 0.00 0.00 41.96 38.20 1twc s TYR 692 CO 0.07 0.58 -0.11 0.42 0.02 0.00 0.00 175.55 176.52 1twc s ILE 693 N -0.74 0.98 0.63 2.71 -1.09 0.12 -4.85 121.20 118.96 1twc s ILE 693 Ca 0.21 -0.45 0.04 0.00 -2.23 0.00 0.00 60.65 58.22 1twc s ILE 693 Cb -0.15 -0.87 0.10 0.00 -1.58 0.00 0.00 42.46 39.96 1twc s ILE 693 CO 0.10 0.30 0.87 1.51 -1.23 0.00 0.00 174.94 176.48 1twc s ASP 694 N 0.24 4.81 0.36 3.58 -4.77 -1.26 -1.36 116.67 118.27 1twc s ASP 694 Ca -0.05 -0.55 0.05 0.00 -3.30 0.00 0.00 52.55 48.70 1twc s ASP 694 Cb -0.10 0.02 0.68 0.00 -1.09 0.00 0.00 42.92 42.43 1twc s ASP 694 CO 0.01 -1.52 1.95 0.00 0.70 0.00 0.00 175.17 176.31 1twc h ALA 695 N -0.11 1.50 -0.23 2.11 0.00 -1.92 0.17 119.26 120.79 1twc h ALA 695 Ca -0.34 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.31 1twc h ALA 695 Cb 1.28 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1twc h ALA 695 CO 0.41 0.38 -0.40 1.49 0.00 0.00 0.00 179.25 181.14 1twc h GLU 696 N 0.58 0.67 0.00 0.00 4.57 -1.93 -2.85 114.58 115.62 1twc h GLU 696 Ca 0.14 -0.42 -0.04 0.00 -1.18 0.00 0.00 59.36 57.87 1twc h GLU 696 Cb 0.14 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1twc h GLU 696 CO -0.01 1.03 -0.17 1.49 -1.18 0.00 0.00 179.01 180.17 1twc h GLU 697 N 0.38 0.00 0.00 1.92 4.81 -1.76 -2.72 114.58 117.21 1twc h GLU 697 Ca 0.02 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1twc h GLU 697 Cb 0.99 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.37 1twc h GLU 697 CO 0.09 0.17 -0.10 1.49 -0.73 0.00 0.00 179.01 179.93 1twc h GLU 698 N 0.00 0.00 0.00 1.92 4.81 -0.43 -1.23 114.58 119.66 1twc h GLU 698 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1twc h GLU 698 Cb 0.60 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.98 1twc h GLU 698 CO 0.02 0.10 0.00 0.93 -0.73 0.00 0.00 179.01 179.33 1twc h GLU 699 N 0.00 0.00 -0.34 1.92 4.39 -1.52 -3.08 114.58 115.94 1twc h GLU 699 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1twc h GLU 699 Cb 0.20 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1twc h GLU 699 CO 0.01 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 176.73 1twc n SER 700 N -2.36 2.99 -4.15 1.42 3.41 -0.46 -5.01 113.62 109.45 1twc n SER 700 Ca 0.00 -1.89 -0.21 0.00 -0.26 0.00 0.00 58.87 56.51 1twc n SER 700 Cb 0.14 -0.22 -0.01 0.00 -0.26 0.00 0.00 64.21 63.85 1twc n SER 700 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1twc n ILE 701 N 0.90 0.00 -3.70 -1.33 -5.35 -1.17 -5.06 119.36 103.66 1twc n ILE 701 Ca 0.14 -1.72 -0.18 0.00 -0.27 0.00 0.00 62.75 60.72 1twc n ILE 701 Cb 0.46 -0.01 -0.17 0.00 -1.74 0.00 0.00 39.64 38.18 1twc n ILE 701 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 1twc s LEU 702 N 0.00 0.32 -0.04 7.28 2.96 -1.26 -5.01 118.68 122.93 1twc s LEU 702 Ca 0.18 0.16 0.05 0.00 -0.22 0.00 0.00 54.13 54.30 1twc s LEU 702 Cb -0.01 0.03 -0.02 0.00 0.50 0.00 0.00 46.19 46.68 1twc s LEU 702 CO 0.12 -0.21 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.12 1twc s ILE 703 N 1.89 2.75 0.22 6.68 1.01 -1.26 -1.42 121.20 131.07 1twc s ILE 703 Ca 0.00 -0.84 -0.25 0.00 0.00 0.00 0.00 60.65 59.56 1twc s ILE 703 Cb -0.12 -2.05 -0.09 0.00 0.01 0.00 0.00 42.46 40.22 1twc s ILE 703 CO -0.04 0.59 0.83 0.00 0.00 0.00 0.00 174.94 176.31 1twc s ALA 704 N -0.64 3.37 -0.01 9.38 0.00 -0.25 -4.93 121.76 128.68 1twc s ALA 704 Ca 0.10 0.39 0.12 0.00 0.00 0.00 0.00 51.96 52.57 1twc s ALA 704 Cb -0.11 -3.01 0.01 0.00 0.00 0.00 0.00 23.12 20.01 1twc s ALA 704 CO 0.00 0.26 1.40 1.98 0.00 0.00 0.00 175.76 179.41 1twc h MET 705 N 3.83 0.00 -3.02 0.00 4.05 -1.92 -0.35 114.93 117.53 1twc h MET 705 Ca -0.47 0.00 -0.12 0.00 -0.28 0.00 0.00 59.70 58.83 1twc h MET 705 Cb 1.20 0.00 -0.20 0.00 -0.80 0.00 0.00 31.60 31.80 1twc h MET 705 CO 0.66 0.70 -0.27 -0.65 0.23 0.00 0.00 176.91 177.57 1twc s GLN 706 N -2.93 0.66 0.59 0.39 1.11 -1.26 -4.42 119.66 113.79 1twc s GLN 706 Ca 0.02 -0.15 0.29 0.00 0.01 0.00 0.00 55.36 55.53 1twc s GLN 706 Cb 0.09 0.29 1.75 0.00 -1.01 0.00 0.00 33.01 34.14 1twc s GLN 706 CO 0.77 -0.18 2.19 -1.35 0.01 0.00 0.00 175.29 176.73 1twc h PRO 707 N 3.95 0.00 0.00 2.91 0.11 -1.89 -2.27 132.00 134.81 1twc h PRO 707 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1twc h PRO 707 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1twc h PRO 707 CO 0.39 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.57 1twc n GLU 708 N -3.82 0.66 0.00 1.05 4.71 -1.26 -0.95 120.64 121.02 1twc n GLU 708 Ca -0.01 0.00 0.14 0.00 -0.01 0.00 0.00 57.16 57.28 1twc n GLU 708 Cb 0.18 -1.50 0.55 0.00 -1.01 0.00 0.00 31.44 29.67 1twc n GLU 708 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1twc n ASP 709 N -1.01 1.07 -0.05 1.62 8.00 -0.85 -3.80 116.55 121.52 1twc n ASP 709 Ca 0.16 -1.17 -0.22 0.00 0.71 0.00 0.00 54.79 54.28 1twc n ASP 709 Cb 0.08 0.02 -0.13 0.00 -0.02 0.00 0.00 41.12 41.07 1twc n ASP 709 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1twc h LEU 710 N 1.56 0.19 -9.54 0.64 -0.00 -1.25 -3.45 115.31 103.46 1twc h LEU 710 Ca 0.00 -0.71 -0.58 0.00 -0.00 0.00 0.00 57.88 56.59 1twc h LEU 710 Cb 0.42 -0.06 0.16 0.00 -0.00 0.00 0.00 40.66 41.19 1twc h LEU 710 CO 0.00 1.63 -0.29 -0.62 -0.00 0.00 0.00 178.44 179.16 1twc n GLU 711 N -4.05 0.62 -3.15 1.13 1.02 -1.25 -4.89 120.64 110.07 1twc n GLU 711 Ca -0.31 0.24 -0.41 0.00 -0.02 0.00 0.00 57.16 56.66 1twc n GLU 711 Cb 0.83 -1.76 -0.01 0.00 -0.02 0.00 0.00 31.44 30.48 1twc n GLU 711 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1twc n PRO 712 N -0.10 3.98 -3.75 3.49 -0.05 -1.26 -5.04 135.00 132.27 1twc n PRO 712 Ca 0.12 -4.55 -0.23 0.00 -0.05 0.00 0.00 63.50 58.79 1twc n PRO 712 Cb 0.46 -2.48 0.03 0.00 -0.05 0.00 0.00 33.50 31.46 1twc n PRO 712 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 175.50 171.98 1twc n ASP 722 N 1.55 -1.70 -4.80 3.54 -0.08 -1.26 -5.17 116.55 108.63 1twc n ASP 722 Ca 0.26 -0.83 -0.34 0.00 -1.51 0.00 0.00 54.79 52.37 1twc n ASP 722 Cb 0.35 -3.96 -0.06 0.00 2.34 0.00 0.00 41.12 39.79 1twc n ASP 722 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1twc s VAL 723 N -3.63 4.21 -0.97 5.18 1.01 -1.26 -4.96 120.40 119.98 1twc s VAL 723 Ca 0.11 1.52 -0.30 0.00 0.00 0.00 0.00 61.98 63.31 1twc s VAL 723 Cb -0.06 -3.70 -0.22 0.00 0.00 0.00 0.00 36.38 32.41 1twc s VAL 723 CO 0.82 -0.16 2.67 -0.67 0.00 0.00 0.00 175.10 177.76 1twc n ASP 724 N -0.31 0.35 0.24 3.32 -0.08 -1.26 -4.88 116.55 113.93 1twc n ASP 724 Ca 0.06 0.12 0.17 0.00 -1.51 0.00 0.00 54.79 53.63 1twc n ASP 724 Cb 0.52 -0.94 0.77 0.00 2.34 0.00 0.00 41.12 43.81 1twc n ASP 724 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1twc h PRO 725 N 12.36 0.00 -0.01 -0.67 0.13 -2.01 -0.56 132.00 141.24 1twc h PRO 725 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1twc h PRO 725 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1twc h PRO 725 CO 1.38 0.00 -0.35 0.00 -0.23 0.00 0.00 178.00 178.81 1twc n ALA 726 N -2.04 3.27 -1.74 -0.56 0.00 -1.26 -4.83 120.51 113.35 1twc n ALA 726 Ca 0.02 -0.44 -0.33 0.00 0.00 0.00 0.00 53.44 52.69 1twc n ALA 726 Cb 0.49 -1.07 -0.01 0.00 0.00 0.00 0.00 19.45 18.85 1twc n ALA 726 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1twc s LYS 727 N -2.58 3.58 0.56 0.00 1.02 -0.22 -4.85 119.74 117.25 1twc s LYS 727 Ca 0.21 1.24 -0.20 0.00 0.02 0.00 0.00 55.97 57.24 1twc s LYS 727 Cb 0.19 -2.07 -0.05 0.00 -0.52 0.00 0.00 37.83 35.38 1twc s LYS 727 CO 0.56 -0.60 1.21 -0.98 -0.92 0.00 0.00 175.35 174.62 1twc s ARG 728 N -3.74 3.16 -0.19 1.68 1.70 -1.26 -5.00 118.95 115.31 1twc s ARG 728 Ca 0.64 1.84 -0.29 0.00 -0.47 0.00 0.00 55.73 57.45 1twc s ARG 728 Cb -0.15 -2.05 -0.02 0.00 -0.57 0.00 0.00 34.95 32.15 1twc s ARG 728 CO 0.29 -1.05 1.48 0.42 -1.08 0.00 0.00 175.30 175.36 1twc s ILE 729 N -1.57 3.90 -0.09 4.99 1.01 -1.26 -5.05 121.20 123.13 1twc s ILE 729 Ca 0.74 1.05 -0.06 0.00 0.00 0.00 0.00 60.65 62.37 1twc s ILE 729 Cb -0.30 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.32 1twc s ILE 729 CO 0.34 -0.24 0.16 -0.13 0.00 0.00 0.00 174.94 175.07 1twc s ARG 730 N 4.17 3.46 -0.24 2.79 0.52 -1.26 -5.09 118.95 123.29 1twc s ARG 730 Ca 0.65 -0.16 -0.05 0.00 -0.52 0.00 0.00 55.73 55.65 1twc s ARG 730 Cb -0.24 -3.17 -0.01 0.00 0.52 0.00 0.00 34.95 32.05 1twc s ARG 730 CO 0.25 0.75 0.01 0.08 0.02 0.00 0.00 175.30 176.41 1twc s VAL 731 N -1.11 3.80 0.64 3.52 1.01 -1.26 -5.08 120.40 121.92 1twc s VAL 731 Ca 0.19 -0.39 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 1twc s VAL 731 Cb -0.12 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.46 1twc s VAL 731 CO 0.08 0.35 1.29 -1.54 0.00 0.00 0.00 175.10 175.28 1twc n SER 732 N 4.85 2.11 0.00 3.32 3.41 -1.26 -4.96 113.62 121.09 1twc n SER 732 Ca -0.17 0.85 0.00 0.00 -0.26 0.00 0.00 58.87 59.29 1twc n SER 732 Cb 0.51 -1.55 0.00 0.00 -0.26 0.00 0.00 64.21 62.90 1twc n SER 732 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1twc n HIS 733 N -1.81 0.00 -1.08 7.33 1.44 -1.26 -4.83 115.22 115.02 1twc n HIS 733 Ca 0.15 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.65 1twc n HIS 733 Cb 0.48 0.00 0.02 0.00 0.12 0.00 0.00 29.99 30.60 1twc n HIS 733 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1twc n HIS 734 N 0.00 1.70 -3.65 -1.40 8.25 -1.26 -4.95 115.22 113.91 1twc n HIS 734 Ca 0.00 -2.05 -0.19 0.00 -0.26 0.00 0.00 57.72 55.21 1twc n HIS 734 Cb 0.00 -1.10 -0.16 0.00 1.12 0.00 0.00 29.99 29.84 1twc n HIS 734 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1twc s ALA 735 N -1.97 0.05 -0.44 -1.41 0.00 -1.26 -5.03 121.76 111.70 1twc s ALA 735 Ca 0.41 0.30 0.13 0.00 0.00 0.00 0.00 51.96 52.80 1twc s ALA 735 Cb 0.30 -0.80 0.38 0.00 0.00 0.00 0.00 23.12 22.99 1twc s ALA 735 CO -0.06 -0.65 1.30 0.25 0.00 0.00 0.00 175.76 176.60 1twc n THR 736 N 5.31 1.65 -0.78 0.00 -2.24 -1.26 -4.78 114.28 112.18 1twc n THR 736 Ca -0.04 -1.50 0.07 0.00 -2.27 0.00 0.00 64.05 60.30 1twc n THR 736 Cb 0.50 0.10 0.10 0.00 -2.10 0.00 0.00 70.33 68.92 1twc n THR 736 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1twc n THR 737 N -0.21 1.57 -1.70 4.28 -2.24 -1.26 -5.00 114.28 109.73 1twc n THR 737 Ca 0.15 -1.83 -0.41 0.00 -2.27 0.00 0.00 64.05 59.69 1twc n THR 737 Cb 0.64 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.88 1twc n THR 737 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1twc n PHE 738 N -1.12 2.09 0.13 4.78 0.99 -1.26 -4.76 117.46 118.30 1twc n PHE 738 Ca 0.11 0.50 0.05 0.00 -0.00 0.00 0.00 57.45 58.11 1twc n PHE 738 Cb 0.53 -2.37 -0.07 0.00 -1.00 0.00 0.00 39.48 36.57 1twc n PHE 738 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1twc n THR 739 N -0.27 0.00 -3.95 4.37 -2.24 -0.51 -4.78 114.28 106.90 1twc n THR 739 Ca 0.07 -0.24 -0.10 0.00 -2.27 0.00 0.00 64.05 61.51 1twc n THR 739 Cb 0.40 0.48 -0.07 0.00 -2.10 0.00 0.00 70.33 69.04 1twc n THR 739 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1twc s HIS 740 N -2.50 0.37 0.04 4.78 3.76 -1.05 -2.02 115.29 118.66 1twc s HIS 740 Ca -0.02 -0.73 0.02 0.00 -0.15 0.00 0.00 55.06 54.19 1twc s HIS 740 Cb 0.07 -0.00 -0.02 0.00 1.11 0.00 0.00 32.58 33.74 1twc s HIS 740 CO 0.43 -0.77 -0.08 0.00 -0.85 0.00 0.00 174.74 173.47 1twc s GLU 742 N -1.33 2.40 -0.08 0.00 0.41 -0.14 -1.01 118.70 118.94 1twc s GLU 742 Ca -0.07 1.63 -0.03 0.00 -0.41 0.00 0.00 54.97 56.09 1twc s GLU 742 Cb -0.09 -1.88 -0.02 0.00 -1.78 0.00 0.00 34.13 30.37 1twc s GLU 742 CO 0.00 -1.61 0.14 0.82 -0.49 0.00 0.00 175.26 174.12 1twc h ILE 743 N -0.13 0.00 -2.75 -1.63 1.08 -1.90 -3.44 117.51 108.74 1twc h ILE 743 Ca -0.47 -0.88 -0.12 0.00 -0.39 0.00 0.00 64.86 62.99 1twc h ILE 743 Cb 1.28 0.00 -0.25 0.00 -3.07 0.00 0.00 36.82 34.78 1twc h ILE 743 CO 0.51 0.00 -0.27 -2.28 -0.69 0.00 0.00 178.15 175.42 1twc s HIS 744 N -1.91 -0.47 0.11 1.37 2.46 -1.26 -4.77 115.29 110.81 1twc s HIS 744 Ca -0.02 1.11 0.33 0.00 0.47 0.00 0.00 55.06 56.95 1twc s HIS 744 Cb 0.00 0.17 1.59 0.00 -0.13 0.00 0.00 32.58 34.21 1twc s HIS 744 CO 0.05 -0.24 1.99 -1.35 -2.47 0.00 0.00 174.74 172.72 1twc h PRO 745 N 5.95 0.00 0.00 2.88 0.11 -1.89 -0.80 132.00 138.25 1twc h PRO 745 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1twc h PRO 745 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1twc h PRO 745 CO 0.27 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.93 1twc n SER 746 N -2.76 0.00 -0.15 -2.05 3.41 -1.26 -2.49 113.62 108.31 1twc n SER 746 Ca -0.01 -0.46 0.15 0.00 -0.26 0.00 0.00 58.87 58.30 1twc n SER 746 Cb 0.17 -0.15 0.81 0.00 -0.26 0.00 0.00 64.21 64.77 1twc n SER 746 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1twc n MET 747 N -1.15 1.19 0.25 4.33 2.81 -0.31 -2.81 117.12 121.44 1twc n MET 747 Ca 0.17 -0.30 0.16 0.00 -1.81 0.00 0.00 57.70 55.92 1twc n MET 747 Cb 0.16 -1.49 0.64 0.00 -0.71 0.00 0.00 33.22 31.82 1twc n MET 747 CO 0.00 0.00 0.00 -0.84 1.51 0.00 0.00 175.97 176.64 1twc h ILE 748 N 0.74 0.00 -4.13 2.02 3.07 -1.71 -3.28 117.51 114.22 1twc h ILE 748 Ca 0.00 -0.49 -0.50 0.00 1.55 0.00 0.00 64.86 65.42 1twc h ILE 748 Cb 0.17 1.45 0.04 0.00 -0.27 0.00 0.00 36.82 38.21 1twc h ILE 748 CO 0.00 0.00 0.33 -0.76 -1.05 0.00 0.00 178.15 176.67 1twc s LEU 749 N -5.94 3.42 0.00 0.16 1.43 -1.12 -4.13 118.68 112.50 1twc s LEU 749 Ca 0.02 1.33 0.00 0.00 -1.03 0.00 0.00 54.13 54.45 1twc s LEU 749 Cb 0.09 -4.33 0.00 0.00 0.03 0.00 0.00 46.19 41.98 1twc s LEU 749 CO 0.53 -0.73 0.00 0.61 0.23 0.00 0.00 176.35 176.99 1twc n GLY 750 N -2.34 1.54 0.25 -3.19 0.00 -1.26 -1.29 105.19 98.89 1twc n GLY 750 Ca 0.05 -2.03 -0.10 0.00 0.00 0.00 0.00 46.02 43.93 1twc n GLY 750 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1twc h VAL 751 N -0.07 0.49 -0.35 1.61 2.07 -1.93 -2.37 116.25 115.69 1twc h VAL 751 Ca 0.00 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.42 1twc h VAL 751 Cb 0.00 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1twc h VAL 751 CO 0.00 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 177.42 1twc h ALA 752 N 0.62 0.50 0.00 1.67 0.00 -1.91 -2.93 119.26 117.20 1twc h ALA 752 Ca 0.08 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1twc h ALA 752 Cb 0.41 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1twc h ALA 752 CO -0.23 0.42 0.00 0.00 0.00 0.00 0.00 179.25 179.44 1twc n ALA 753 N -2.47 2.24 1.84 0.00 0.00 -1.20 -2.71 120.51 118.22 1twc n ALA 753 Ca -0.02 -0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.52 1twc n ALA 753 Cb 0.40 -1.46 0.83 0.00 0.00 0.00 0.00 19.45 19.22 1twc n ALA 753 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1twc n SER 754 N -2.03 0.00 -0.26 0.00 7.64 -0.90 -2.70 113.62 115.38 1twc n SER 754 Ca 0.06 -0.97 0.09 0.00 1.01 0.00 0.00 58.87 59.05 1twc n SER 754 Cb 0.39 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.55 1twc n SER 754 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1twc n ILE 755 N -0.97 0.00 -2.80 0.44 2.08 -1.10 -4.48 119.36 112.53 1twc n ILE 755 Ca 0.21 -0.22 -0.41 0.00 0.56 0.00 0.00 62.75 62.89 1twc n ILE 755 Cb 0.10 1.13 -0.04 0.00 -0.75 0.00 0.00 39.64 40.08 1twc n ILE 755 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 1twc s ILE 756 N -2.35 4.79 0.09 1.39 1.01 -1.10 -4.91 121.20 120.12 1twc s ILE 756 Ca 0.12 1.92 -0.28 0.00 0.00 0.00 0.00 60.65 62.41 1twc s ILE 756 Cb 0.14 -4.25 -0.06 0.00 0.01 0.00 0.00 42.46 38.30 1twc s ILE 756 CO 0.57 0.24 0.89 -2.16 0.00 0.00 0.00 174.94 174.48 1twc s PRO 757 N 0.59 4.63 -1.09 2.79 0.04 -1.26 -4.23 135.00 136.47 1twc s PRO 757 Ca 0.47 1.31 -0.02 0.00 0.04 0.00 0.00 61.00 62.80 1twc s PRO 757 Cb -0.21 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 30.96 1twc s PRO 757 CO 0.26 0.25 0.92 1.19 0.04 0.00 0.00 177.00 179.66 1twc n PHE 758 N 2.73 -2.07 0.25 0.56 0.99 0.54 -4.85 117.46 115.62 1twc n PHE 758 Ca 0.00 0.84 0.13 0.00 -0.00 0.00 0.00 57.45 58.43 1twc n PHE 758 Cb 0.49 -4.67 0.60 0.00 -1.00 0.00 0.00 39.48 34.90 1twc n PHE 758 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 1twc h PRO 759 N -1.84 0.00 0.00 -1.08 0.13 -1.83 0.06 132.00 127.44 1twc h PRO 759 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1twc h PRO 759 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1twc h PRO 759 CO 0.45 0.13 0.00 -0.40 -0.23 0.00 0.00 178.00 177.95 1twc n ASP 760 N -3.34 0.00 -0.36 1.44 5.75 -1.26 -1.70 116.55 117.08 1twc n ASP 760 Ca -0.00 -0.54 0.03 0.00 -0.01 0.00 0.00 54.79 54.27 1twc n ASP 760 Cb 0.35 0.00 0.09 0.00 -1.03 0.00 0.00 41.12 40.53 1twc n ASP 760 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1twc n HIS 761 N -0.97 0.27 -4.81 2.11 8.25 0.01 -4.99 115.22 115.08 1twc n HIS 761 Ca 0.12 -0.51 -0.31 0.00 -0.26 0.00 0.00 57.72 56.75 1twc n HIS 761 Cb 0.05 -0.04 -0.13 0.00 1.12 0.00 0.00 29.99 30.99 1twc n HIS 761 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1twc s ASN 762 N -1.04 3.61 0.35 0.41 0.01 -0.69 -3.45 114.94 114.14 1twc s ASN 762 Ca 0.14 -0.44 -0.29 0.00 -0.71 0.00 0.00 52.86 51.56 1twc s ASN 762 Cb 0.08 -0.54 -0.11 0.00 0.41 0.00 0.00 41.25 41.08 1twc s ASN 762 CO 0.09 0.27 1.52 1.67 -1.51 0.00 0.00 177.10 179.14 1twc n GLN 763 N 1.78 2.68 -0.20 -0.60 7.27 -1.24 -4.89 117.38 122.19 1twc n GLN 763 Ca -0.16 0.94 -0.05 0.00 0.07 0.00 0.00 57.00 57.80 1twc n GLN 763 Cb 0.52 -2.69 0.13 0.00 2.41 0.00 0.00 30.24 30.60 1twc n GLN 763 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1twc h SER 764 N 3.57 0.92 0.18 1.69 0.87 -1.96 -2.25 113.55 116.58 1twc h SER 764 Ca -0.49 -0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 59.87 1twc h SER 764 Cb 1.24 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1twc h SER 764 CO 0.69 0.88 -0.12 -0.65 -0.53 0.00 0.00 176.83 177.10 1twc h PRO 765 N 0.95 0.00 -0.27 2.24 0.10 -1.98 -2.72 132.00 130.31 1twc h PRO 765 Ca 0.21 0.00 -0.11 0.00 0.10 0.00 0.00 66.00 66.19 1twc h PRO 765 Cb 0.31 0.00 -0.01 0.00 0.10 0.00 0.00 31.00 31.40 1twc h PRO 765 CO -0.00 0.12 -0.31 0.00 0.10 0.00 0.00 178.00 177.91 1twc h ARG 766 N 0.00 0.57 -0.22 1.05 2.47 -1.74 -0.56 114.38 115.94 1twc h ARG 766 Ca -0.00 -0.25 -0.06 0.00 -1.26 0.00 0.00 59.98 58.41 1twc h ARG 766 Cb 0.25 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 1twc h ARG 766 CO 0.02 0.81 -0.13 -0.91 0.56 0.00 0.00 179.97 180.32 1twc h ASN 767 N 0.49 0.35 -0.55 7.04 2.35 -1.52 -1.02 115.58 122.71 1twc h ASN 767 Ca 0.06 -0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.67 1twc h ASN 767 Cb 0.78 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 39.03 1twc h ASN 767 CO 0.06 0.52 0.13 0.74 -1.65 0.00 0.00 177.43 177.23 1twc h THR 768 N 0.34 1.24 0.08 2.81 2.02 -0.92 -2.40 112.91 116.09 1twc h THR 768 Ca 0.07 -0.90 -0.25 0.00 0.77 0.00 0.00 66.41 66.10 1twc h THR 768 Cb 0.45 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.50 1twc h THR 768 CO 0.03 0.34 -1.14 1.88 0.37 0.00 0.00 175.52 176.99 1twc h TYR 769 N 0.89 0.40 -0.38 3.16 0.99 -0.61 -1.70 116.97 119.73 1twc h TYR 769 Ca 0.19 -0.28 0.06 0.00 2.00 0.00 0.00 58.73 60.70 1twc h TYR 769 Cb 0.34 -0.02 -0.02 0.00 1.00 0.00 0.00 36.73 38.03 1twc h TYR 769 CO 0.02 1.19 0.26 0.37 -0.00 0.00 0.00 178.16 180.00 1twc h GLN 770 N 0.08 0.25 -0.08 4.88 5.75 -1.04 -2.21 115.11 122.74 1twc h GLN 770 Ca -0.10 -0.02 -0.16 0.00 -0.15 0.00 0.00 58.65 58.22 1twc h GLN 770 Cb 1.86 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 30.34 1twc h GLN 770 CO 0.18 0.17 -0.66 0.77 -2.65 0.00 0.00 178.83 176.64 1twc h SER 771 N 0.26 0.39 0.13 -0.69 0.02 -0.79 -1.09 113.55 111.78 1twc h SER 771 Ca 0.17 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 1twc h SER 771 Cb 0.33 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1twc h SER 771 CO -0.03 0.94 -0.06 0.00 -1.14 0.00 0.00 176.83 176.54 1twc h ALA 772 N 1.05 -0.18 -0.67 3.77 0.00 -1.25 -3.38 119.26 118.60 1twc h ALA 772 Ca -0.02 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1twc h ALA 772 Cb 1.20 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 1twc h ALA 772 CO 0.11 -0.49 0.21 0.52 0.00 0.00 0.00 179.25 179.59 1twc h MET 773 N -0.39 1.03 -0.56 0.00 2.07 -0.79 0.16 114.93 116.44 1twc h MET 773 Ca -0.02 -0.21 0.16 0.00 -2.07 0.00 0.00 59.70 57.57 1twc h MET 773 Cb 0.32 -0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 29.87 1twc h MET 773 CO 0.03 0.88 0.59 0.78 1.07 0.00 0.00 176.91 180.26 1twc h GLY 774 N 1.06 0.00 1.95 8.32 0.00 -1.40 0.26 103.07 113.27 1twc h GLY 774 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1twc h GLY 774 CO -0.01 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.81 1twc n LYS 775 N -3.68 0.05 -0.33 4.80 5.02 0.57 -2.74 118.16 121.85 1twc n LYS 775 Ca 0.11 0.02 0.08 0.00 -2.02 0.00 0.00 58.31 56.50 1twc n LYS 775 Cb 0.80 -1.50 0.25 0.00 -0.02 0.00 0.00 35.03 34.56 1twc n LYS 775 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1twc n GLN 776 N -1.48 2.97 -2.35 1.97 6.02 0.92 -4.73 117.38 120.71 1twc n GLN 776 Ca 0.08 -2.45 -0.25 0.00 -0.01 0.00 0.00 57.00 54.37 1twc n GLN 776 Cb 0.32 -1.51 0.09 0.00 1.02 0.00 0.00 30.24 30.15 1twc n GLN 776 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1twc s ALA 777 N -1.28 3.34 -0.07 -1.58 0.00 -1.11 -1.31 121.76 119.75 1twc s ALA 777 Ca 0.37 -1.24 0.02 0.00 0.00 0.00 0.00 51.96 51.12 1twc s ALA 777 Cb 0.21 -2.37 -0.02 0.00 0.00 0.00 0.00 23.12 20.94 1twc s ALA 777 CO 0.22 -1.36 -0.13 -1.64 0.00 0.00 0.00 175.76 172.86 1twc s MET 778 N -5.20 2.74 0.00 0.00 -1.94 -0.58 -4.65 119.30 109.68 1twc s MET 778 Ca 0.63 -0.67 0.00 0.00 -1.71 0.00 0.00 55.69 53.94 1twc s MET 778 Cb -0.09 -2.47 0.00 0.00 2.01 0.00 0.00 34.83 34.28 1twc s MET 778 CO 0.44 0.54 0.00 0.41 -0.01 0.00 0.00 175.02 176.40 1twc n GLY 779 N 2.57 2.80 2.53 -0.03 0.00 -1.26 -4.15 105.19 107.66 1twc n GLY 779 Ca -0.17 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 1twc n GLY 779 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1twc s VAL 780 N 2.28 0.07 0.39 1.61 1.01 -1.23 -1.38 120.40 123.16 1twc s VAL 780 Ca 0.00 -1.11 0.15 0.00 0.00 0.00 0.00 61.98 61.02 1twc s VAL 780 Cb 0.00 -1.08 0.14 0.00 0.00 0.00 0.00 36.38 35.45 1twc s VAL 780 CO 0.00 -0.81 1.90 2.19 0.00 0.00 0.00 175.10 178.39 1twc h PHE 781 N 7.94 0.00 -3.62 5.22 -5.15 -1.84 -3.40 116.94 116.10 1twc h PHE 781 Ca -0.12 0.00 -0.06 0.00 -0.20 0.00 0.00 57.97 57.59 1twc h PHE 781 Cb 1.00 0.00 -0.11 0.00 0.22 0.00 0.00 35.95 37.06 1twc h PHE 781 CO 0.34 0.28 -0.16 -0.51 -2.00 0.00 0.00 178.31 176.27 1twc s LEU 782 N -8.20 0.54 0.00 2.10 1.43 -1.26 -4.16 118.68 109.13 1twc s LEU 782 Ca -0.03 -0.72 0.28 0.00 -1.03 0.00 0.00 54.13 52.63 1twc s LEU 782 Cb 0.15 1.64 0.98 0.00 0.03 0.00 0.00 46.19 48.98 1twc s LEU 782 CO 0.70 -0.98 1.75 0.35 0.23 0.00 0.00 176.35 178.39 1twc n THR 783 N -0.28 0.00 -1.38 5.49 -2.24 -1.26 -3.90 114.28 110.71 1twc n THR 783 Ca -0.08 -0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.36 1twc n THR 783 Cb 0.63 -0.22 0.08 0.00 -2.10 0.00 0.00 70.33 68.71 1twc n THR 783 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1twc n ASN 784 N -1.49 7.53 0.16 3.42 6.94 -1.26 -4.65 115.26 125.91 1twc n ASN 784 Ca 0.07 -3.79 0.11 0.00 -0.02 0.00 0.00 54.58 50.95 1twc n ASN 784 Cb 0.34 -0.94 0.08 0.00 -2.36 0.00 0.00 39.78 36.90 1twc n ASN 784 CO 0.00 0.00 0.00 0.10 -1.03 0.00 0.00 177.26 176.33 1twc h TYR 785 N 2.01 0.00 0.00 -2.53 -0.00 -1.95 -3.05 116.97 111.45 1twc h TYR 785 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.32 1twc h TYR 785 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.59 1twc h TYR 785 CO 1.40 0.04 0.00 -1.71 -0.00 0.00 0.00 178.16 177.89 1twc n ASN 786 N -2.90 0.50 -0.00 0.10 2.85 -1.26 -2.33 115.26 112.22 1twc n ASN 786 Ca 0.02 0.61 0.08 0.00 -0.11 0.00 0.00 54.58 55.17 1twc n ASN 786 Cb 0.56 -0.72 -0.10 0.00 1.24 0.00 0.00 39.78 40.76 1twc n ASN 786 CO 0.00 0.00 0.00 0.52 -2.11 0.00 0.00 177.26 175.67 1twc n VAL 787 N -2.04 0.00 -2.98 3.44 0.31 -1.15 -4.97 118.33 110.94 1twc n VAL 787 Ca 0.03 -0.14 -0.19 0.00 -0.01 0.00 0.00 64.34 64.02 1twc n VAL 787 Cb 0.24 0.91 0.02 0.00 -0.91 0.00 0.00 33.84 34.10 1twc n VAL 787 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1twc s ARG 788 N -2.59 2.82 -0.31 5.55 0.52 -0.98 -5.07 118.95 118.89 1twc s ARG 788 Ca 0.05 -0.98 -0.02 0.00 -0.52 0.00 0.00 55.73 54.25 1twc s ARG 788 Cb 0.12 -2.67 0.11 0.00 0.52 0.00 0.00 34.95 33.03 1twc s ARG 788 CO 0.67 -0.35 0.13 -1.64 0.02 0.00 0.00 175.30 174.14 1twc s MET 789 N -4.46 0.41 0.32 3.54 -1.94 -1.26 -5.01 119.30 110.89 1twc s MET 789 Ca 0.53 -0.81 0.08 0.00 -1.71 0.00 0.00 55.69 53.78 1twc s MET 789 Cb -0.10 -1.44 -0.06 0.00 2.01 0.00 0.00 34.83 35.24 1twc s MET 789 CO 0.35 -1.04 -0.07 0.16 -0.01 0.00 0.00 175.02 174.41 1twc s ASP 790 N 1.80 3.35 0.20 3.03 3.84 -1.26 -4.96 116.67 122.67 1twc s ASP 790 Ca 0.10 -1.21 -0.10 0.00 -0.00 0.00 0.00 52.55 51.35 1twc s ASP 790 Cb -0.17 -0.28 0.14 0.00 -1.38 0.00 0.00 42.92 41.23 1twc s ASP 790 CO -0.28 -0.27 1.83 0.74 -0.00 0.00 0.00 175.17 177.18 1twc h THR 791 N 2.11 1.22 -3.42 2.11 2.02 -1.91 -3.24 112.91 111.80 1twc h THR 791 Ca -0.41 -0.54 -0.12 0.00 0.77 0.00 0.00 66.41 66.11 1twc h THR 791 Cb 1.24 0.23 -0.19 0.00 -1.74 0.00 0.00 68.15 67.69 1twc h THR 791 CO 0.70 0.24 -0.39 -0.04 0.37 0.00 0.00 175.52 176.40 1twc s MET 792 N -5.88 0.63 -0.02 6.66 -1.94 -1.26 -1.23 119.30 116.26 1twc s MET 792 Ca -0.13 -0.46 -0.30 0.00 -1.71 0.00 0.00 55.69 53.09 1twc s MET 792 Cb 0.15 0.27 0.07 0.00 2.01 0.00 0.00 34.83 37.32 1twc s MET 792 CO 0.80 -0.17 0.67 0.00 -0.01 0.00 0.00 175.02 176.30 1twc s ALA 793 N -1.95 -1.74 -0.04 3.03 0.00 -0.66 -4.95 121.76 115.46 1twc s ALA 793 Ca -0.10 1.21 -0.01 0.00 0.00 0.00 0.00 51.96 53.06 1twc s ALA 793 Cb -0.04 0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.22 1twc s ALA 793 CO -0.00 -0.42 0.03 -0.80 0.00 0.00 0.00 175.76 174.57 1twc s ASN 794 N -1.38 0.84 -0.03 0.00 0.01 -1.26 -1.56 114.94 111.57 1twc s ASN 794 Ca -0.10 0.02 0.03 0.00 -0.71 0.00 0.00 52.86 52.10 1twc s ASN 794 Cb -0.00 -0.20 0.00 0.00 0.41 0.00 0.00 41.25 41.46 1twc s ASN 794 CO 0.07 -0.18 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.75 1twc s ILE 795 N 1.65 0.87 0.38 0.60 -1.09 -0.73 -4.22 121.20 118.64 1twc s ILE 795 Ca -0.01 -0.41 -0.12 0.00 -2.23 0.00 0.00 60.65 57.87 1twc s ILE 795 Cb -0.13 -0.76 -0.07 0.00 -1.58 0.00 0.00 42.46 39.92 1twc s ILE 795 CO -0.03 0.27 0.76 -0.22 -1.23 0.00 0.00 174.94 174.49 1twc s LEU 796 N 0.14 3.91 0.02 2.97 2.96 -0.48 -0.64 118.68 127.56 1twc s LEU 796 Ca -0.03 1.21 -0.25 0.00 -0.22 0.00 0.00 54.13 54.84 1twc s LEU 796 Cb -0.09 -4.06 -0.18 0.00 0.50 0.00 0.00 46.19 42.37 1twc s LEU 796 CO 0.01 -0.33 1.38 1.88 -1.32 0.00 0.00 176.35 177.97 1twc h TYR 797 N 1.64 -0.14 -2.09 5.38 -1.99 -1.65 -3.40 116.97 114.73 1twc h TYR 797 Ca -0.47 -0.00 -0.57 0.00 2.00 0.00 0.00 58.73 59.68 1twc h TYR 797 Cb 1.18 0.05 -0.40 0.00 2.00 0.00 0.00 36.73 39.55 1twc h TYR 797 CO 0.61 0.17 -0.89 0.66 -0.00 0.00 0.00 178.16 178.71 1twc n TYR 798 N -5.01 1.44 -1.60 4.88 4.02 -1.26 -5.10 117.16 114.52 1twc n TYR 798 Ca -0.09 -3.83 -0.45 0.00 -0.01 0.00 0.00 57.90 53.52 1twc n TYR 798 Cb 0.20 -0.44 -0.02 0.00 -0.02 0.00 0.00 39.34 39.06 1twc n TYR 798 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1twc n PRO 799 N 1.03 1.43 -4.29 -0.72 -0.02 -1.26 -4.90 135.00 126.27 1twc n PRO 799 Ca 0.25 0.50 -0.21 0.00 -2.02 0.00 0.00 63.50 62.02 1twc n PRO 799 Cb 0.49 -1.93 -0.12 0.00 -0.02 0.00 0.00 33.50 31.92 1twc n PRO 799 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1twc s GLN 800 N -1.28 1.16 0.28 -0.52 -0.21 -0.59 -5.00 119.66 113.51 1twc s GLN 800 Ca 0.62 -1.29 -0.12 0.00 0.02 0.00 0.00 55.36 54.59 1twc s GLN 800 Cb -0.71 -1.24 -0.08 0.00 1.00 0.00 0.00 33.01 31.98 1twc s GLN 800 CO 0.58 0.26 0.65 -1.59 -2.12 0.00 0.00 175.29 173.07 1twc s LYS 801 N -2.48 3.90 0.03 2.91 -2.85 -1.26 -4.46 119.74 115.53 1twc s LYS 801 Ca 0.11 0.49 -0.30 0.00 -1.00 0.00 0.00 55.97 55.26 1twc s LYS 801 Cb -0.07 -2.52 -0.04 0.00 -2.06 0.00 0.00 37.83 33.14 1twc s LYS 801 CO 0.05 0.22 1.07 -1.25 0.10 0.00 0.00 175.35 175.54 1twc s PRO 802 N -2.94 4.51 0.60 1.78 0.04 -1.26 -4.76 135.00 132.97 1twc s PRO 802 Ca 0.51 1.57 0.28 0.00 0.04 0.00 0.00 61.00 63.40 1twc s PRO 802 Cb -0.11 -3.41 1.39 0.00 0.04 0.00 0.00 34.50 32.41 1twc s PRO 802 CO 0.20 -0.13 1.80 -0.07 0.04 0.00 0.00 177.00 178.84 1twc h LEU 803 N 6.75 0.00 -7.69 -3.56 3.38 -1.94 -3.37 115.31 108.87 1twc h LEU 803 Ca -0.41 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 56.91 1twc h LEU 803 Cb 1.22 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.58 1twc h LEU 803 CO 0.77 0.00 -0.76 -0.83 0.09 0.00 0.00 178.44 177.71 1twc s GLY 804 N -3.78 1.63 0.51 0.83 0.00 -1.26 -1.52 107.32 103.72 1twc s GLY 804 Ca -0.04 -1.95 0.02 0.00 0.00 0.00 0.00 44.72 42.75 1twc s GLY 804 CO 0.50 0.89 0.06 -0.51 0.00 0.00 0.00 173.10 174.04 1twc s THR 805 N 1.14 1.27 0.16 0.90 -4.23 -0.84 -4.80 115.64 109.24 1twc s THR 805 Ca 0.01 -1.92 0.09 0.00 -1.18 0.00 0.00 61.69 58.68 1twc s THR 805 Cb -0.19 -2.19 -0.04 0.00 1.34 0.00 0.00 72.50 71.42 1twc s THR 805 CO -0.08 0.00 -0.20 -0.89 -0.54 0.00 0.00 174.62 172.91 1twc s THR 806 N -2.85 1.88 0.33 3.99 2.01 -1.26 -1.19 115.64 118.54 1twc s THR 806 Ca 0.11 -1.86 0.25 0.00 0.31 0.00 0.00 61.69 60.50 1twc s THR 806 Cb 0.01 -1.83 0.25 0.00 0.01 0.00 0.00 72.50 70.94 1twc s THR 806 CO 0.06 -0.24 1.97 0.03 -0.69 0.00 0.00 174.62 175.76 1twc h ARG 807 N 3.40 0.00 0.00 4.92 2.47 -1.93 -3.02 114.38 120.22 1twc h ARG 807 Ca -0.44 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.28 1twc h ARG 807 Cb 1.20 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.52 1twc h ARG 807 CO 0.48 0.18 -0.02 0.00 0.56 0.00 0.00 179.97 181.17 1twc h ALA 808 N 1.82 1.29 0.00 0.04 0.00 -1.95 -2.97 119.26 117.48 1twc h ALA 808 Ca -0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1twc h ALA 808 Cb 0.50 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1twc h ALA 808 CO 0.02 0.03 -0.20 0.52 0.00 0.00 0.00 179.25 179.62 1twc h MET 809 N 0.00 0.00 -0.73 0.00 2.86 -1.75 -1.90 114.93 113.41 1twc h MET 809 Ca -0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1twc h MET 809 Cb 0.08 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 1twc h MET 809 CO 0.00 0.20 0.40 1.49 1.06 0.00 0.00 176.91 180.06 1twc h GLU 810 N 0.00 1.01 0.00 1.72 4.81 -1.73 0.13 114.58 120.52 1twc h GLU 810 Ca -0.00 -0.11 -0.06 0.00 -0.13 0.00 0.00 59.36 59.06 1twc h GLU 810 Cb 0.40 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1twc h GLU 810 CO 0.03 0.74 -0.28 1.88 -0.73 0.00 0.00 179.01 180.65 1twc h TYR 811 N 1.02 0.00 -0.01 0.92 -1.99 -1.57 -2.84 116.97 112.50 1twc h TYR 811 Ca 0.26 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.99 1twc h TYR 811 Cb 0.03 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.76 1twc h TYR 811 CO 0.01 0.28 -0.19 1.28 -0.00 0.00 0.00 178.16 179.53 1twc n LEU 812 N -3.21 1.42 -1.91 3.88 4.77 -0.53 -4.94 117.00 116.47 1twc n LEU 812 Ca 0.02 -0.44 -0.17 0.00 -0.03 0.00 0.00 56.01 55.40 1twc n LEU 812 Cb 0.60 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.62 1twc n LEU 812 CO 0.37 0.25 -0.20 0.29 -1.33 0.00 0.00 177.39 176.77 1twc n LYS 813 N -0.20 -1.43 0.07 3.23 4.76 0.35 -4.86 118.16 120.07 1twc n LYS 813 Ca 0.14 0.80 -0.09 0.00 -2.87 0.00 0.00 58.31 56.29 1twc n LYS 813 Cb 0.38 -5.22 -0.13 0.00 -1.84 0.00 0.00 35.03 28.22 1twc n LYS 813 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1twc h PHE 814 N -0.05 0.11 0.00 2.13 3.57 -1.83 -2.30 116.94 118.57 1twc h PHE 814 Ca -0.39 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.01 1twc h PHE 814 Cb 1.29 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.03 1twc h PHE 814 CO 0.44 1.06 -0.06 0.00 -2.23 0.00 0.00 178.31 177.53 1twc h ARG 815 N 0.02 0.00 0.01 1.11 3.08 -1.89 -2.17 114.38 114.53 1twc h ARG 815 Ca -0.05 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.70 1twc h ARG 815 Cb 1.82 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.83 1twc h ARG 815 CO 0.14 0.06 -1.70 0.93 -1.07 0.00 0.00 179.97 178.33 1twc h GLU 816 N 0.00 0.03 -2.15 0.04 3.07 -1.85 -3.41 114.58 110.31 1twc h GLU 816 Ca -0.00 -0.05 -0.56 0.00 -0.50 0.00 0.00 59.36 58.25 1twc h GLU 816 Cb 0.49 0.02 -0.41 0.00 -0.84 0.00 0.00 28.75 28.01 1twc h GLU 816 CO 0.01 0.59 -0.83 1.28 -1.40 0.00 0.00 179.01 178.66 1twc n LEU 817 N -3.11 2.74 -4.76 1.33 4.77 -0.90 -5.10 117.00 111.98 1twc n LEU 817 Ca -0.18 -5.30 -0.29 0.00 -0.03 0.00 0.00 56.01 50.21 1twc n LEU 817 Cb 1.05 -0.10 0.17 0.00 -2.33 0.00 0.00 43.42 42.21 1twc n LEU 817 CO 0.45 2.21 0.72 -2.84 -1.33 0.00 0.00 177.39 176.60 1twc s PRO 818 N -2.57 0.40 -0.39 3.23 0.02 -0.82 -4.60 135.00 130.26 1twc s PRO 818 Ca 0.42 0.08 0.11 0.00 0.02 0.00 0.00 61.00 61.63 1twc s PRO 818 Cb 0.24 -1.77 0.38 0.00 0.02 0.00 0.00 34.50 33.37 1twc s PRO 818 CO -0.09 -2.66 1.02 0.00 -0.33 0.00 0.00 177.00 174.95 1twc n ALA 819 N -4.05 1.47 0.00 -1.55 0.00 -1.26 -3.53 120.51 111.59 1twc n ALA 819 Ca 0.10 -2.37 0.00 0.00 0.00 0.00 0.00 53.44 51.17 1twc n ALA 819 Cb 0.59 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.04 1twc n ALA 819 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1twc n GLY 820 N 0.02 -0.84 3.25 0.00 0.00 -1.26 -4.54 105.19 101.82 1twc n GLY 820 Ca 0.10 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 44.91 1twc n GLY 820 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1twc s GLN 821 N -2.00 0.63 -0.50 1.61 -0.21 -0.86 -1.54 119.66 116.79 1twc s GLN 821 Ca 0.00 -0.04 -0.26 0.00 0.02 0.00 0.00 55.36 55.08 1twc s GLN 821 Cb 0.00 0.28 0.03 0.00 1.00 0.00 0.00 33.01 34.32 1twc s GLN 821 CO 0.00 -0.16 0.99 -0.80 -2.12 0.00 0.00 175.29 173.20 1twc s ASN 822 N -1.02 6.47 -0.08 5.90 0.01 -1.26 -2.48 114.94 122.47 1twc s ASN 822 Ca -0.11 0.04 -0.05 0.00 -0.71 0.00 0.00 52.86 52.03 1twc s ASN 822 Cb -0.05 -2.47 -0.04 0.00 0.41 0.00 0.00 41.25 39.10 1twc s ASN 822 CO 0.04 -1.18 0.14 0.00 -1.51 0.00 0.00 177.10 174.59 1twc s ALA 823 N 4.05 3.86 -0.11 0.60 0.00 -0.92 -4.87 121.76 124.38 1twc s ALA 823 Ca 0.37 -0.70 -0.27 0.00 0.00 0.00 0.00 51.96 51.36 1twc s ALA 823 Cb -0.10 -1.90 -0.02 0.00 0.00 0.00 0.00 23.12 21.10 1twc s ALA 823 CO 0.25 0.66 0.90 0.42 0.00 0.00 0.00 175.76 177.99 1twc s ILE 824 N -1.13 4.87 -0.09 0.00 -1.09 -1.26 -1.19 121.20 121.30 1twc s ILE 824 Ca 0.19 1.82 0.03 0.00 -2.23 0.00 0.00 60.65 60.46 1twc s ILE 824 Cb -0.12 -4.21 0.01 0.00 -1.58 0.00 0.00 42.46 36.55 1twc s ILE 824 CO 0.09 0.07 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.01 1twc s VAL 825 N 1.73 1.56 0.00 2.92 1.01 0.92 -0.23 120.40 128.32 1twc s VAL 825 Ca 0.44 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 1twc s VAL 825 Cb -0.18 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1twc s VAL 825 CO 0.17 0.45 0.21 0.00 0.00 0.00 0.00 175.10 175.93 1twc s ALA 826 N 0.62 3.93 -0.39 5.51 0.00 -0.54 -2.27 121.76 128.62 1twc s ALA 826 Ca -0.14 -0.72 -0.08 0.00 0.00 0.00 0.00 51.96 51.01 1twc s ALA 826 Cb -0.16 -1.92 0.06 0.00 0.00 0.00 0.00 23.12 21.10 1twc s ALA 826 CO 0.04 0.73 0.21 0.42 0.00 0.00 0.00 175.76 177.17 1twc s ILE 827 N -1.34 4.13 -0.00 0.00 1.01 -0.78 -1.46 121.20 122.75 1twc s ILE 827 Ca 0.28 -1.29 -0.24 0.00 0.00 0.00 0.00 60.65 59.40 1twc s ILE 827 Cb -0.13 -3.46 0.05 0.00 0.01 0.00 0.00 42.46 38.93 1twc s ILE 827 CO 0.19 -0.40 0.54 0.00 0.00 0.00 0.00 174.94 175.27 1twc s ALA 828 N 1.42 -1.40 -0.09 9.38 0.00 0.12 -4.38 121.76 126.80 1twc s ALA 828 Ca 0.02 0.83 -0.22 0.00 0.00 0.00 0.00 51.96 52.59 1twc s ALA 828 Cb -0.22 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 1twc s ALA 828 CO 0.03 -0.41 0.64 0.00 0.00 0.00 0.00 175.76 176.01 1twc s TYR 830 N 0.88 -1.43 0.00 0.00 5.04 -1.26 -4.96 117.35 115.62 1twc s TYR 830 Ca 0.34 0.13 0.00 0.00 -2.44 0.00 0.00 57.07 55.10 1twc s TYR 830 Cb -0.17 0.27 0.00 0.00 0.35 0.00 0.00 41.96 42.41 1twc s TYR 830 CO 0.15 -0.99 0.00 -1.13 -1.34 0.00 0.00 175.55 172.24 1twc n SER 831 N 4.10 0.00 0.00 4.32 3.41 -1.26 -4.34 113.62 119.85 1twc n SER 831 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1twc n SER 831 Cb 0.58 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 1twc n SER 831 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1twc n GLY 832 N -1.61 0.79 0.91 5.00 0.00 -1.26 -4.94 105.19 104.08 1twc n GLY 832 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1twc n GLY 832 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1twc n TYR 833 N -2.13 0.67 -1.87 1.61 4.02 -1.26 -3.80 117.16 114.40 1twc n TYR 833 Ca 0.00 -0.33 -0.02 0.00 -0.01 0.00 0.00 57.90 57.54 1twc n TYR 833 Cb 0.00 -0.01 0.13 0.00 -0.02 0.00 0.00 39.34 39.45 1twc n TYR 833 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1twc n ASN 834 N 0.93 2.43 -4.86 7.72 6.94 -1.26 -4.45 115.26 122.70 1twc n ASN 834 Ca 0.16 -3.56 -0.31 0.00 -0.02 0.00 0.00 54.58 50.85 1twc n ASN 834 Cb 0.42 -0.45 -0.03 0.00 -2.36 0.00 0.00 39.78 37.36 1twc n ASN 834 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 1twc s GLN 835 N -2.99 3.83 -1.13 -3.83 -0.21 -1.25 -4.19 119.66 109.89 1twc s GLN 835 Ca 0.40 0.75 -0.16 0.00 0.02 0.00 0.00 55.36 56.37 1twc s GLN 835 Cb 0.38 -2.21 -0.02 0.00 1.00 0.00 0.00 33.01 32.15 1twc s GLN 835 CO -0.05 -0.24 0.81 0.39 -2.12 0.00 0.00 175.29 174.08 1twc n GLU 836 N -1.69 -1.75 -3.47 2.91 -0.58 -1.26 -3.17 120.64 111.62 1twc n GLU 836 Ca 0.05 0.57 -0.19 0.00 -0.42 0.00 0.00 57.16 57.17 1twc n GLU 836 Cb 0.54 -4.62 0.07 0.00 -0.57 0.00 0.00 31.44 26.86 1twc n GLU 836 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1twc n ASP 837 N -2.84 -3.36 -4.28 1.62 8.00 -1.26 -5.02 116.55 109.41 1twc n ASP 837 Ca -0.10 -0.73 -0.15 0.00 0.71 0.00 0.00 54.79 54.52 1twc n ASP 837 Cb 0.61 -4.75 -0.10 0.00 -0.02 0.00 0.00 41.12 36.85 1twc n ASP 837 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1twc s SER 838 N -4.02 1.16 -0.03 -2.24 1.04 -1.19 -3.20 113.70 105.21 1twc s SER 838 Ca 0.17 -1.29 -0.07 0.00 0.48 0.00 0.00 55.95 55.24 1twc s SER 838 Cb -0.03 0.15 0.01 0.00 0.10 0.00 0.00 66.02 66.25 1twc s SER 838 CO 0.76 -0.66 0.17 0.00 0.98 0.00 0.00 173.24 174.49 1twc s MET 839 N -3.98 0.36 -0.23 4.02 0.23 0.10 -4.50 119.30 115.29 1twc s MET 839 Ca 0.32 -0.06 -0.28 0.00 -1.03 0.00 0.00 55.69 54.63 1twc s MET 839 Cb 0.07 0.16 0.01 0.00 -1.53 0.00 0.00 34.83 33.53 1twc s MET 839 CO 0.09 -0.07 0.99 0.42 -2.03 0.00 0.00 175.02 174.42 1twc s ILE 840 N -0.64 4.71 0.16 3.16 1.01 -1.18 0.45 121.20 128.89 1twc s ILE 840 Ca -0.07 1.92 0.07 0.00 0.00 0.00 0.00 60.65 62.57 1twc s ILE 840 Cb -0.04 -4.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 1twc s ILE 840 CO 0.01 -0.16 -0.01 -0.32 0.00 0.00 0.00 174.94 174.46 1twc s MET 841 N 3.12 2.39 -0.38 2.79 1.75 -1.05 -0.09 119.30 127.82 1twc s MET 841 Ca 0.42 -1.09 -0.29 0.00 -1.25 0.00 0.00 55.69 53.48 1twc s MET 841 Cb -0.15 -2.36 0.02 0.00 2.84 0.00 0.00 34.83 35.18 1twc s MET 841 CO 0.06 0.46 1.09 1.21 -0.65 0.00 0.00 175.02 177.20 1twc s ASN 842 N -2.85 6.80 0.27 1.11 3.84 -0.31 -1.44 114.94 122.36 1twc s ASN 842 Ca 0.27 0.80 -0.02 0.00 0.21 0.00 0.00 52.86 54.12 1twc s ASN 842 Cb -0.10 -2.54 0.37 0.00 -0.55 0.00 0.00 41.25 38.43 1twc s ASN 842 CO 0.18 -1.03 1.80 -0.61 -2.79 0.00 0.00 177.10 174.65 1twc h GLN 843 N 8.56 0.81 -0.35 0.43 5.75 -1.44 -1.08 115.11 127.78 1twc h GLN 843 Ca -0.22 -0.19 0.00 0.00 -0.15 0.00 0.00 58.65 58.10 1twc h GLN 843 Cb 1.06 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 29.48 1twc h GLN 843 CO 1.07 0.77 0.23 0.77 -2.65 0.00 0.00 178.83 179.02 1twc h SER 844 N 0.77 0.41 -0.26 -0.69 0.02 -1.90 0.55 113.55 112.45 1twc h SER 844 Ca 0.16 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.03 1twc h SER 844 Cb 0.36 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1twc h SER 844 CO 0.01 0.31 -0.01 0.28 -1.14 0.00 0.00 176.83 176.27 1twc h SER 845 N 0.47 0.55 -0.04 3.07 0.02 -1.88 -1.37 113.55 114.38 1twc h SER 845 Ca 0.13 -0.12 -0.08 0.00 -0.84 0.00 0.00 61.79 60.88 1twc h SER 845 Cb -0.03 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1twc h SER 845 CO -0.03 0.63 -0.21 0.40 -1.14 0.00 0.00 176.83 176.49 1twc h ILE 846 N 0.56 1.25 -0.67 3.27 2.04 -0.47 0.10 117.51 123.59 1twc h ILE 846 Ca 0.12 -1.15 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 1twc h ILE 846 Cb 0.38 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 1twc h ILE 846 CO 0.01 0.36 0.39 0.44 0.00 0.00 0.00 178.15 179.36 1twc h ASP 847 N 0.38 0.81 -0.02 1.72 3.32 0.11 -2.54 116.42 120.20 1twc h ASP 847 Ca 0.06 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1twc h ASP 847 Cb 0.58 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1twc h ASP 847 CO 0.04 0.65 0.00 0.54 -1.72 0.00 0.00 179.24 178.75 1twc n ARG 848 N -4.55 1.07 0.00 3.56 1.74 -0.62 -4.86 116.66 113.00 1twc n ARG 848 Ca 0.05 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 1twc n ARG 848 Cb 0.07 -1.20 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 1twc n ARG 848 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1twc n GLY 849 N 0.72 1.19 3.72 -0.13 0.00 -0.95 -5.07 105.19 104.67 1twc n GLY 849 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1twc n GLY 849 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1twc n LEU 850 N 0.00 4.09 -1.08 0.99 7.94 0.32 -2.57 117.00 126.67 1twc n LEU 850 Ca 0.00 1.08 -0.11 0.00 -1.11 0.00 0.00 56.01 55.86 1twc n LEU 850 Cb 0.00 -1.58 -0.05 0.00 0.53 0.00 0.00 43.42 42.32 1twc n LEU 850 CO 0.00 0.19 -0.11 0.49 -1.11 0.00 0.00 177.39 176.85 1twc n PHE 851 N 3.65 -0.22 -2.23 1.96 0.99 -1.26 -4.65 117.46 115.69 1twc n PHE 851 Ca 0.15 0.00 -0.36 0.00 -0.00 0.00 0.00 57.45 57.23 1twc n PHE 851 Cb 0.35 -2.48 -0.00 0.00 -1.00 0.00 0.00 39.48 36.36 1twc n PHE 851 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.76 177.26 1twc s ARG 852 N -2.81 3.52 0.13 -1.08 3.52 -1.06 -4.51 118.95 116.66 1twc s ARG 852 Ca 0.00 1.72 -0.09 0.00 -0.13 0.00 0.00 55.73 57.23 1twc s ARG 852 Cb 0.00 -2.20 -0.00 0.00 -1.56 0.00 0.00 34.95 31.19 1twc s ARG 852 CO 0.00 -0.73 0.26 -1.54 -0.81 0.00 0.00 175.30 172.47 1twc s SER 853 N -1.54 0.05 -0.05 -2.12 1.04 -0.95 -1.61 113.70 108.52 1twc s SER 853 Ca 0.69 -0.74 -0.09 0.00 0.48 0.00 0.00 55.95 56.29 1twc s SER 853 Cb -0.27 0.40 -0.05 0.00 0.10 0.00 0.00 66.02 66.20 1twc s SER 853 CO 0.32 -0.83 0.25 -0.76 0.98 0.00 0.00 173.24 173.20 1twc s LEU 854 N -2.91 4.40 -0.05 2.42 1.43 0.19 -0.74 118.68 123.42 1twc s LEU 854 Ca 0.11 0.62 0.06 0.00 -1.03 0.00 0.00 54.13 53.89 1twc s LEU 854 Cb 0.04 -2.40 -0.01 0.00 0.03 0.00 0.00 46.19 43.84 1twc s LEU 854 CO -0.05 0.34 -0.24 0.12 0.23 0.00 0.00 176.35 176.75 1twc s PHE 855 N -1.14 2.46 -0.01 0.29 5.36 -0.08 -1.78 117.98 123.08 1twc s PHE 855 Ca 0.21 -0.59 0.08 0.00 -0.96 0.00 0.00 56.93 55.68 1twc s PHE 855 Cb -0.14 -1.59 -0.02 0.00 -0.34 0.00 0.00 43.02 40.93 1twc s PHE 855 CO 0.10 -0.13 -0.26 -0.06 -1.46 0.00 0.00 175.22 173.42 1twc s PHE 856 N -0.31 2.32 0.03 10.12 0.40 -0.60 -1.72 117.98 128.21 1twc s PHE 856 Ca 0.01 -0.43 0.08 0.00 -0.60 0.00 0.00 56.93 55.99 1twc s PHE 856 Cb -0.13 -1.48 -0.02 0.00 0.51 0.00 0.00 43.02 41.90 1twc s PHE 856 CO 0.02 -0.02 -0.24 0.50 0.70 0.00 0.00 175.22 176.19 1twc s ARG 857 N -0.70 1.73 -0.07 0.44 3.52 -0.17 -1.65 118.95 122.05 1twc s ARG 857 Ca 0.10 -0.98 0.02 0.00 -0.13 0.00 0.00 55.73 54.73 1twc s ARG 857 Cb -0.10 -1.81 -0.03 0.00 -1.56 0.00 0.00 34.95 31.45 1twc s ARG 857 CO -0.01 0.48 -0.11 -1.12 -0.81 0.00 0.00 175.30 173.73 1twc s SER 858 N -1.01 4.28 -0.06 -2.12 0.01 -0.36 -1.90 113.70 112.54 1twc s SER 858 Ca 0.10 -0.15 -0.00 0.00 1.31 0.00 0.00 55.95 57.20 1twc s SER 858 Cb -0.09 -1.13 -0.03 0.00 0.21 0.00 0.00 66.02 64.97 1twc s SER 858 CO 0.01 0.31 -0.02 -0.31 0.41 0.00 0.00 173.24 173.64 1twc s TYR 859 N -0.53 3.07 0.30 2.43 1.51 -0.09 -4.72 117.35 119.32 1twc s TYR 859 Ca 0.07 0.11 0.08 0.00 -1.01 0.00 0.00 57.07 56.32 1twc s TYR 859 Cb -0.12 -1.73 -0.04 0.00 -0.11 0.00 0.00 41.96 39.96 1twc s TYR 859 CO 0.02 0.43 0.17 1.41 -1.11 0.00 0.00 175.55 176.47 1twc s MET 860 N -1.04 2.62 -0.09 -0.62 1.75 -1.26 -1.05 119.30 119.61 1twc s MET 860 Ca 0.15 -1.30 -0.27 0.00 -1.25 0.00 0.00 55.69 53.01 1twc s MET 860 Cb -0.11 -2.37 0.06 0.00 2.84 0.00 0.00 34.83 35.25 1twc s MET 860 CO 0.04 0.24 0.63 0.34 -0.65 0.00 0.00 175.02 175.62 1twc s ASP 861 N -3.86 -0.61 0.68 1.11 -1.08 -0.61 -4.97 116.67 107.33 1twc s ASP 861 Ca 0.36 0.77 0.01 0.00 -0.52 0.00 0.00 52.55 53.17 1twc s ASP 861 Cb -0.06 0.68 0.11 0.00 -1.46 0.00 0.00 42.92 42.20 1twc s ASP 861 CO 0.24 -0.51 0.94 -1.10 0.52 0.00 0.00 175.17 175.26 1twc s GLN 862 N -0.89 1.85 0.00 4.34 -1.52 -1.26 -1.55 119.66 120.63 1twc s GLN 862 Ca -0.09 -1.15 0.00 0.00 -1.95 0.00 0.00 55.36 52.17 1twc s GLN 862 Cb -0.02 -2.39 0.00 0.00 -0.22 0.00 0.00 33.01 30.38 1twc s GLN 862 CO 0.07 -1.29 0.00 -1.91 -0.25 0.00 0.00 175.29 171.91 1twc n GLU 863 N -2.70 3.78 -0.68 2.91 2.13 -1.12 -4.93 120.64 120.03 1twc n GLU 863 Ca 0.14 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.84 1twc n GLU 863 Cb 0.61 0.00 0.01 0.00 0.27 0.00 0.00 31.44 32.33 1twc n GLU 863 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1twc n LYS 864 N 0.00 0.00 0.00 5.31 2.85 -1.26 -4.78 118.16 120.28 1twc n LYS 864 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1twc n LYS 864 Cb 0.00 -0.80 0.00 0.00 -0.65 0.00 0.00 35.03 33.58 1twc n LYS 864 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1twc n LYS 865 N 1.76 0.00 -0.48 -1.58 5.02 -1.26 -4.95 118.16 116.67 1twc n LYS 865 Ca -0.01 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.36 1twc n LYS 865 Cb 0.25 0.00 0.29 0.00 -0.02 0.00 0.00 35.03 35.54 1twc n LYS 865 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1twc n TYR 866 N 0.00 1.17 -3.06 2.13 0.53 -1.26 -4.96 117.16 111.71 1twc n TYR 866 Ca 0.00 -0.47 -0.34 0.00 -1.02 0.00 0.00 57.90 56.07 1twc n TYR 866 Cb 0.00 -0.19 -0.06 0.00 -1.03 0.00 0.00 39.34 38.06 1twc n TYR 866 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 1twc s GLY 867 N -0.83 2.46 -1.28 2.72 0.00 -1.26 -5.03 107.32 104.10 1twc s GLY 867 Ca 0.41 0.16 -0.19 0.00 0.00 0.00 0.00 44.72 45.10 1twc s GLY 867 CO 0.21 0.44 1.83 -0.13 0.00 0.00 0.00 173.10 175.44 1twc n MET 868 N 0.02 2.83 -1.64 2.90 1.56 -1.26 -3.61 117.12 117.92 1twc n MET 868 Ca 0.02 -3.03 -0.05 0.00 -0.27 0.00 0.00 57.70 54.37 1twc n MET 868 Cb 0.52 -3.51 -0.01 0.00 2.15 0.00 0.00 33.22 32.37 1twc n MET 868 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 1twc n SER 869 N 9.25 -1.56 -4.18 6.12 7.64 -1.26 -4.97 113.62 124.66 1twc n SER 869 Ca 0.49 0.22 -0.43 0.00 1.01 0.00 0.00 58.87 60.16 1twc n SER 869 Cb 0.45 -1.63 0.00 0.00 -1.01 0.00 0.00 64.21 62.03 1twc n SER 869 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1twc n ILE 870 N -1.89 3.82 -3.60 0.44 5.41 -1.24 -4.96 119.36 117.34 1twc n ILE 870 Ca -0.05 -3.76 -0.20 0.00 1.00 0.00 0.00 62.75 59.73 1twc n ILE 870 Cb 0.30 -2.46 -0.01 0.00 -0.71 0.00 0.00 39.64 36.76 1twc n ILE 870 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1twc s THR 871 N 3.29 4.57 0.22 1.39 2.01 -1.26 -4.30 115.64 121.55 1twc s THR 871 Ca 0.49 -0.92 0.11 0.00 0.31 0.00 0.00 61.69 61.69 1twc s THR 871 Cb 0.08 -3.61 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 1twc s THR 871 CO 0.00 -0.26 -0.20 -1.61 -0.69 0.00 0.00 174.62 171.86 1twc s GLU 872 N -4.15 1.66 -0.13 4.92 2.02 -1.26 -4.34 118.70 117.42 1twc s GLU 872 Ca 0.41 -1.56 -0.07 0.00 0.02 0.00 0.00 54.97 53.77 1twc s GLU 872 Cb -0.09 -1.88 0.05 0.00 0.10 0.00 0.00 34.13 32.31 1twc s GLU 872 CO 0.31 0.38 0.31 0.99 0.02 0.00 0.00 175.26 177.28 1twc s THR 873 N -1.93 -0.05 -0.29 3.63 2.01 -1.10 -4.15 115.64 113.76 1twc s THR 873 Ca 0.24 0.13 -0.29 0.00 0.31 0.00 0.00 61.69 62.08 1twc s THR 873 Cb -0.07 -0.47 -0.00 0.00 0.01 0.00 0.00 72.50 71.96 1twc s THR 873 CO 0.12 0.05 1.36 -0.36 -0.69 0.00 0.00 174.62 175.10 1twc s PHE 874 N 1.36 2.58 -0.23 4.92 2.99 -1.26 -2.35 117.98 125.99 1twc s PHE 874 Ca -0.09 0.81 -0.27 0.00 0.00 0.00 0.00 56.93 57.38 1twc s PHE 874 Cb -0.10 -3.94 0.10 0.00 0.00 0.00 0.00 43.02 39.08 1twc s PHE 874 CO -0.10 -1.92 0.91 -2.00 -0.00 0.00 0.00 175.22 172.11 1twc s GLU 875 N 4.29 0.67 -0.54 0.44 2.12 -1.11 -4.61 118.70 119.96 1twc s GLU 875 Ca 0.59 0.56 -0.29 0.00 0.36 0.00 0.00 54.97 56.19 1twc s GLU 875 Cb -0.18 0.32 -0.10 0.00 0.26 0.00 0.00 34.13 34.43 1twc s GLU 875 CO 0.25 -0.13 2.42 1.17 -0.54 0.00 0.00 175.26 178.43 1twc n LYS 876 N 1.87 0.94 -1.27 4.30 4.81 -1.25 -4.27 118.16 123.29 1twc n LYS 876 Ca -0.13 0.09 -0.30 0.00 -0.87 0.00 0.00 58.31 57.10 1twc n LYS 876 Cb 0.56 -2.91 0.24 0.00 0.02 0.00 0.00 35.03 32.95 1twc n LYS 876 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1twc s PRO 877 N 7.93 -1.15 0.00 1.64 0.04 -1.26 -5.05 135.00 137.15 1twc s PRO 877 Ca 1.07 -0.28 0.00 0.00 0.04 0.00 0.00 61.00 61.83 1twc s PRO 877 Cb -0.50 -1.62 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1twc s PRO 877 CO 0.35 -3.62 0.00 1.04 0.04 0.00 0.00 177.00 174.80 1twc n GLN 878 N -4.65 1.72 0.00 4.56 1.13 -1.26 -5.09 117.38 113.79 1twc n GLN 878 Ca 0.16 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.22 1twc n GLN 878 Cb 0.60 -0.35 0.00 0.00 0.11 0.00 0.00 30.24 30.60 1twc n GLN 878 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1twc n ARG 879 N -0.30 0.00 -3.11 -1.09 1.74 -1.26 -5.10 116.66 107.54 1twc n ARG 879 Ca 0.00 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.82 1twc n ARG 879 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1twc n ARG 879 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1twc n THR 880 N 0.00 2.45 -0.78 0.55 -1.04 -1.26 -5.00 114.28 109.21 1twc n THR 880 Ca 0.00 -5.33 0.00 0.00 -2.04 0.00 0.00 64.05 56.68 1twc n THR 880 Cb 0.00 -1.54 0.00 0.00 -1.82 0.00 0.00 70.33 66.97 1twc n THR 880 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1twc n ASN 881 N 0.19 -1.90 0.00 8.00 3.02 -1.26 -3.67 115.26 119.63 1twc n ASN 881 Ca 0.30 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.85 1twc n ASN 881 Cb 0.42 -0.32 0.00 0.00 -0.61 0.00 0.00 39.78 39.28 1twc n ASN 881 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1twc n THR 882 N -2.63 0.00 -3.24 3.41 -1.04 -1.26 -4.79 114.28 104.72 1twc n THR 882 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.78 1twc n THR 882 Cb 0.00 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.54 1twc n THR 882 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1twc n LEU 883 N -1.08 -2.55 -2.00 -4.42 -0.00 -1.08 -4.82 117.00 101.05 1twc n LEU 883 Ca 0.00 -0.38 -0.11 0.00 -0.00 0.00 0.00 56.01 55.52 1twc n LEU 883 Cb 0.00 -2.79 -0.16 0.00 -0.00 0.00 0.00 43.42 40.48 1twc n LEU 883 CO 0.00 0.30 1.56 -1.14 -0.00 0.00 0.00 177.39 178.11 1twc n ARG 884 N -4.17 1.90 -0.61 1.47 0.00 -1.19 -4.89 116.66 109.17 1twc n ARG 884 Ca -0.06 -0.93 0.00 0.00 -0.00 0.00 0.00 57.85 56.85 1twc n ARG 884 Cb 0.59 -1.95 0.00 0.00 0.00 0.00 0.00 32.46 31.10 1twc n ARG 884 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 1twc n MET 885 N 2.49 1.42 -4.77 -0.14 2.81 -1.26 -4.45 117.12 113.21 1twc n MET 885 Ca 0.40 0.00 -0.28 0.00 -1.81 0.00 0.00 57.70 56.01 1twc n MET 885 Cb 0.88 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 33.24 1twc n MET 885 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1twc s LYS 886 N -0.72 1.59 0.00 0.03 -0.14 -1.26 -5.01 119.74 114.23 1twc s LYS 886 Ca 0.00 -1.02 0.00 0.00 -1.36 0.00 0.00 55.97 53.59 1twc s LYS 886 Cb 0.00 -1.73 0.00 0.00 -1.68 0.00 0.00 37.83 34.42 1twc s LYS 886 CO 0.00 0.45 0.55 0.72 -0.76 0.00 0.00 175.35 176.30 1twc n HIS 887 N 1.83 0.00 -3.84 3.18 8.25 -1.26 -4.66 115.22 118.72 1twc n HIS 887 Ca -0.17 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.06 1twc n HIS 887 Cb 0.53 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.51 1twc n HIS 887 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1twc n GLY 888 N -1.05 2.79 3.77 -1.41 0.00 -1.26 -5.03 105.19 103.01 1twc n GLY 888 Ca 0.00 -2.28 -0.39 0.00 0.00 0.00 0.00 46.02 43.35 1twc n GLY 888 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1twc s THR 889 N -2.36 4.93 -2.29 2.61 2.01 -1.26 -4.90 115.64 114.38 1twc s THR 889 Ca 0.27 1.17 0.20 0.00 0.31 0.00 0.00 61.69 63.64 1twc s THR 889 Cb -0.02 -3.89 0.43 0.00 0.01 0.00 0.00 72.50 69.03 1twc s THR 889 CO 0.17 0.44 1.47 -1.22 -0.69 0.00 0.00 174.62 174.79 1twc n TYR 890 N 2.62 0.34 0.17 4.92 4.02 -1.26 -2.69 117.16 125.29 1twc n TYR 890 Ca -0.08 -0.17 0.02 0.00 -0.01 0.00 0.00 57.90 57.66 1twc n TYR 890 Cb 0.51 0.00 0.09 0.00 -0.02 0.00 0.00 39.34 39.92 1twc n TYR 890 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1twc n ASP 891 N 0.71 0.00 -0.00 7.72 10.43 -1.26 -2.09 116.55 132.05 1twc n ASP 891 Ca 0.17 0.22 0.08 0.00 2.57 0.00 0.00 54.79 57.82 1twc n ASP 891 Cb 0.41 -0.27 -0.10 0.00 1.84 0.00 0.00 41.12 43.00 1twc n ASP 891 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 1twc n LYS 892 N -1.27 1.47 -2.39 -1.24 5.02 -1.26 -4.98 118.16 113.51 1twc n LYS 892 Ca 0.02 -0.04 -0.33 0.00 -2.02 0.00 0.00 58.31 55.94 1twc n LYS 892 Cb 0.03 -1.28 -0.03 0.00 -0.02 0.00 0.00 35.03 33.73 1twc n LYS 892 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1twc s LEU 893 N -3.10 3.69 0.00 -0.35 1.43 -0.89 -4.56 118.68 114.90 1twc s LEU 893 Ca 0.03 1.77 -0.10 0.00 -1.03 0.00 0.00 54.13 54.80 1twc s LEU 893 Cb 0.12 -4.54 0.16 0.00 0.03 0.00 0.00 46.19 41.96 1twc s LEU 893 CO 0.65 -0.80 0.98 0.47 0.23 0.00 0.00 176.35 177.89 1twc n ASP 894 N -1.41 0.30 0.17 2.29 8.00 -1.11 -4.83 116.55 119.95 1twc n ASP 894 Ca 0.08 -1.49 0.13 0.00 0.71 0.00 0.00 54.79 54.23 1twc n ASP 894 Cb 0.53 -0.73 0.47 0.00 -0.02 0.00 0.00 41.12 41.37 1twc n ASP 894 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1twc h ASP 895 N -1.16 0.00 1.04 -2.24 5.19 -1.97 -1.17 116.42 116.10 1twc h ASP 895 Ca -0.32 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.04 1twc h ASP 895 Cb 0.93 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.43 1twc h ASP 895 CO 0.25 0.00 -0.99 -2.24 -3.12 0.00 0.00 179.24 173.13 1twc h ASP 896 N 0.00 0.00 0.00 6.45 3.04 -1.93 -3.33 116.42 120.66 1twc h ASP 896 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1twc h ASP 896 Cb 0.59 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.88 1twc h ASP 896 CO 0.00 0.19 0.00 0.61 -2.04 0.00 0.00 179.24 178.00 1twc n GLY 897 N 1.23 0.96 3.63 7.15 0.00 -0.44 -3.55 105.19 114.17 1twc n GLY 897 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 1twc n GLY 897 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1twc s LEU 898 N 0.00 -0.79 1.02 0.99 1.43 -1.26 -0.68 118.68 119.40 1twc s LEU 898 Ca 0.00 1.22 -0.15 0.00 -1.03 0.00 0.00 54.13 54.17 1twc s LEU 898 Cb 0.00 2.10 0.20 0.00 0.03 0.00 0.00 46.19 48.52 1twc s LEU 898 CO 0.00 -0.19 1.14 -0.63 0.23 0.00 0.00 176.35 176.91 1twc s ILE 899 N 1.72 1.89 0.02 -0.59 1.01 -1.23 -2.76 121.20 121.26 1twc s ILE 899 Ca -0.09 0.00 0.02 0.00 0.00 0.00 0.00 60.65 60.59 1twc s ILE 899 Cb -0.05 -2.65 -0.01 0.00 0.01 0.00 0.00 42.46 39.75 1twc s ILE 899 CO -0.18 0.00 -0.07 0.00 0.00 0.00 0.00 174.94 174.69 1twc s ALA 900 N -3.22 0.59 0.29 9.38 0.00 -1.26 -4.87 121.76 122.67 1twc s ALA 900 Ca 0.67 -0.51 -0.27 0.00 0.00 0.00 0.00 51.96 51.85 1twc s ALA 900 Cb -0.13 -0.07 -0.14 0.00 0.00 0.00 0.00 23.12 22.78 1twc s ALA 900 CO 0.55 0.08 0.88 -2.30 0.00 0.00 0.00 175.76 174.97 1twc n PRO 901 N 2.27 1.04 0.00 0.00 -0.02 -1.26 -2.55 135.00 134.48 1twc n PRO 901 Ca -0.17 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1twc n PRO 901 Cb 0.56 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 1twc n PRO 901 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1twc n GLY 902 N 1.41 2.21 3.71 -1.23 0.00 -0.97 -4.99 105.19 105.33 1twc n GLY 902 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1twc n GLY 902 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1twc s VAL 903 N -2.19 4.90 0.35 1.61 1.01 -1.06 -4.76 120.40 120.25 1twc s VAL 903 Ca 0.00 1.94 -0.28 0.00 0.00 0.00 0.00 61.98 63.63 1twc s VAL 903 Cb 0.00 -4.26 -0.12 0.00 0.00 0.00 0.00 36.38 32.00 1twc s VAL 903 CO 0.00 0.18 1.42 0.54 0.00 0.00 0.00 175.10 177.24 1twc n ARG 904 N 3.84 2.43 -4.31 2.72 1.74 -1.26 -2.07 116.66 119.75 1twc n ARG 904 Ca 0.04 0.86 -0.16 0.00 -0.77 0.00 0.00 57.85 57.82 1twc n ARG 904 Cb 0.51 -2.53 -0.10 0.00 -1.02 0.00 0.00 32.46 29.32 1twc n ARG 904 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1twc s VAL 905 N -0.95 0.44 -0.01 1.55 -7.23 -0.91 -4.90 120.40 108.40 1twc s VAL 905 Ca 0.56 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 58.51 1twc s VAL 905 Cb -0.52 -2.60 0.07 0.00 0.56 0.00 0.00 36.38 33.89 1twc s VAL 905 CO 0.61 0.00 0.98 -0.24 -0.31 0.00 0.00 175.10 176.14 1twc n SER 906 N -0.52 -0.95 0.00 4.85 2.88 -1.26 -1.97 113.62 116.65 1twc n SER 906 Ca 0.00 -1.23 0.00 0.00 -1.33 0.00 0.00 58.87 56.32 1twc n SER 906 Cb 0.66 1.49 0.00 0.00 -0.75 0.00 0.00 64.21 65.61 1twc n SER 906 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1twc n GLY 907 N -0.70 2.11 0.59 0.46 0.00 -1.23 -1.73 105.19 104.68 1twc n GLY 907 Ca 0.03 -0.14 0.06 0.00 0.00 0.00 0.00 46.02 45.97 1twc n GLY 907 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1twc n GLU 908 N 14.00 1.47 -1.01 1.61 1.02 -1.26 -4.35 120.64 132.12 1twc n GLU 908 Ca 0.00 -3.15 -0.39 0.00 -0.02 0.00 0.00 57.16 53.60 1twc n GLU 908 Cb 0.00 -1.52 -0.05 0.00 -0.02 0.00 0.00 31.44 29.85 1twc n GLU 908 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1twc n ASP 909 N -1.07 -0.17 -4.77 1.62 8.00 -0.71 -4.20 116.55 115.25 1twc n ASP 909 Ca 0.18 0.78 -0.38 0.00 0.71 0.00 0.00 54.79 56.08 1twc n ASP 909 Cb 0.71 -0.63 -0.02 0.00 -0.02 0.00 0.00 41.12 41.16 1twc n ASP 909 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1twc s VAL 910 N -0.13 3.10 0.00 2.53 1.01 -1.09 -1.80 120.40 124.01 1twc s VAL 910 Ca 0.58 0.90 0.00 0.00 0.00 0.00 0.00 61.98 63.46 1twc s VAL 910 Cb -0.82 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.07 1twc s VAL 910 CO 0.39 0.06 0.00 -0.38 0.00 0.00 0.00 175.10 175.16 1twc n ILE 911 N -0.10 0.00 -4.07 2.22 -0.00 -0.85 -4.72 119.36 111.85 1twc n ILE 911 Ca 0.05 0.00 -0.30 0.00 -0.00 0.00 0.00 62.75 62.51 1twc n ILE 911 Cb 0.47 -0.37 -0.17 0.00 -0.00 0.00 0.00 39.64 39.57 1twc n ILE 911 CO 0.00 0.00 0.00 -0.63 -0.00 0.00 0.00 176.55 175.92 1twc s ILE 912 N -1.53 1.51 -0.04 1.39 1.01 -1.15 -3.50 121.20 118.88 1twc s ILE 912 Ca 0.00 -0.60 -0.26 0.00 0.00 0.00 0.00 60.65 59.79 1twc s ILE 912 Cb 0.00 -1.42 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 1twc s ILE 912 CO 0.00 0.45 0.82 -0.83 0.00 0.00 0.00 174.94 175.38 1twc s GLY 913 N 1.44 2.74 0.10 6.18 0.00 0.15 -0.98 107.32 116.95 1twc s GLY 913 Ca 0.03 0.31 -0.22 0.00 0.00 0.00 0.00 44.72 44.84 1twc s GLY 913 CO -0.09 1.39 0.53 1.25 0.00 0.00 0.00 173.10 176.18 1twc s LYS 914 N 0.88 1.14 0.06 2.90 2.20 -1.26 -2.75 119.74 122.92 1twc s LYS 914 Ca 0.44 -0.41 -0.04 0.00 -0.36 0.00 0.00 55.97 55.60 1twc s LYS 914 Cb -0.19 0.52 -0.02 0.00 -1.51 0.00 0.00 37.83 36.63 1twc s LYS 914 CO 0.22 -0.45 0.06 0.95 -0.36 0.00 0.00 175.35 175.76 1twc s THR 915 N -3.21 0.18 0.00 3.43 -4.23 -0.99 -0.90 115.64 109.92 1twc s THR 915 Ca -0.01 -1.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 1twc s THR 915 Cb -0.00 -1.35 0.00 0.00 1.34 0.00 0.00 72.50 72.49 1twc s THR 915 CO -0.08 -0.83 0.00 0.41 -0.54 0.00 0.00 174.62 173.58 1twc n THR 916 N 0.18 0.00 -0.30 3.99 -1.04 1.10 -2.71 114.28 115.50 1twc n THR 916 Ca -0.15 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 61.98 1twc n THR 916 Cb 0.61 -0.55 0.30 0.00 -1.82 0.00 0.00 70.33 68.87 1twc n THR 916 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1twc h SER 933 N 0.00 0.28 -2.43 8.00 4.64 -1.87 -3.41 113.55 118.76 1twc h SER 933 Ca 0.00 0.16 -0.79 0.00 -0.47 0.00 0.00 61.79 60.69 1twc h SER 933 Cb 0.67 0.15 -0.23 0.00 -0.31 0.00 0.00 62.40 62.68 1twc h SER 933 CO 0.00 -0.02 1.19 0.29 -0.87 0.00 0.00 176.83 177.42 1twc n LYS 934 N -5.07 4.10 -2.61 4.77 4.76 -1.26 -4.96 118.16 117.90 1twc n LYS 934 Ca 0.21 -4.19 -0.42 0.00 -2.87 0.00 0.00 58.31 51.05 1twc n LYS 934 Cb 0.64 -2.67 -0.03 0.00 -1.84 0.00 0.00 35.03 31.14 1twc n LYS 934 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1twc s ARG 935 N -1.49 3.33 0.00 1.97 1.81 -1.26 -2.62 118.95 120.69 1twc s ARG 935 Ca 0.34 -0.08 -0.30 0.00 -1.72 0.00 0.00 55.73 53.97 1twc s ARG 935 Cb 0.05 -4.10 -0.07 0.00 -0.45 0.00 0.00 34.95 30.37 1twc s ARG 935 CO 0.06 -1.88 1.80 0.34 -0.68 0.00 0.00 175.30 174.94 1twc s ASP 936 N 3.34 6.56 -0.41 0.23 3.68 -1.26 0.35 116.67 129.16 1twc s ASP 936 Ca 0.37 2.47 0.05 0.00 2.13 0.00 0.00 52.55 57.58 1twc s ASP 936 Cb -0.09 -2.54 0.43 0.00 -1.45 0.00 0.00 42.92 39.28 1twc s ASP 936 CO 0.19 -0.98 1.21 0.00 0.13 0.00 0.00 175.17 175.72 1twc n ALA 937 N 7.14 5.15 -2.80 3.66 0.00 -0.08 -4.89 120.51 128.70 1twc n ALA 937 Ca 0.18 -4.10 -0.33 0.00 0.00 0.00 0.00 53.44 49.20 1twc n ALA 937 Cb 0.42 -0.56 -0.13 0.00 0.00 0.00 0.00 19.45 19.17 1twc n ALA 937 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1twc s SER 938 N -3.41 4.16 -0.01 0.00 0.15 -1.25 -4.48 113.70 108.86 1twc s SER 938 Ca 0.50 -0.23 -0.23 0.00 0.70 0.00 0.00 55.95 56.69 1twc s SER 938 Cb 0.41 -1.30 -0.05 0.00 -1.71 0.00 0.00 66.02 63.37 1twc s SER 938 CO -0.11 0.25 0.68 -0.89 1.20 0.00 0.00 173.24 174.37 1twc s THR 939 N -0.17 4.90 0.35 6.45 2.01 -0.16 -4.96 115.64 124.07 1twc s THR 939 Ca 0.00 1.42 0.08 0.00 0.31 0.00 0.00 61.69 63.51 1twc s THR 939 Cb -0.13 -4.02 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 1twc s THR 939 CO 0.03 0.35 0.14 -2.16 -0.69 0.00 0.00 174.62 172.29 1twc s PRO 940 N 0.19 2.34 0.14 4.92 0.05 -1.26 -2.00 135.00 139.38 1twc s PRO 940 Ca 0.35 -1.59 -0.33 0.00 0.05 0.00 0.00 61.00 59.48 1twc s PRO 940 Cb -0.19 -2.14 -0.12 0.00 0.05 0.00 0.00 34.50 32.10 1twc s PRO 940 CO 0.19 0.08 1.72 -0.11 0.05 0.00 0.00 177.00 178.94 1twc n LEU 941 N -1.15 3.65 -2.82 -3.56 7.94 -0.75 -4.86 117.00 115.45 1twc n LEU 941 Ca -0.03 1.04 -0.39 0.00 -1.11 0.00 0.00 56.01 55.52 1twc n LEU 941 Cb 0.62 -1.50 -0.06 0.00 0.53 0.00 0.00 43.42 43.01 1twc n LEU 941 CO 0.43 -0.00 0.56 0.54 -1.11 0.00 0.00 177.39 177.80 1twc n ARG 942 N 4.51 0.00 -0.25 1.96 5.12 -1.26 -4.49 116.66 122.24 1twc n ARG 942 Ca 0.18 0.00 0.17 0.00 -1.93 0.00 0.00 57.85 56.27 1twc n ARG 942 Cb 0.33 -0.91 0.32 0.00 -1.16 0.00 0.00 32.46 31.04 1twc n ARG 942 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1twc n SER 943 N 1.81 0.07 -0.29 0.55 3.41 -1.26 -2.62 113.62 115.29 1twc n SER 943 Ca 0.16 1.27 0.14 0.00 -0.26 0.00 0.00 58.87 60.18 1twc n SER 943 Cb -0.00 -0.53 0.47 0.00 -0.26 0.00 0.00 64.21 63.89 1twc n SER 943 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1twc n THR 944 N -4.90 0.00 -3.67 6.66 -2.24 -1.26 -4.72 114.28 104.15 1twc n THR 944 Ca 0.23 -0.15 -0.26 0.00 -2.27 0.00 0.00 64.05 61.60 1twc n THR 944 Cb 0.76 0.33 -0.03 0.00 -2.10 0.00 0.00 70.33 69.29 1twc n THR 944 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1twc s GLU 945 N -2.34 3.50 -0.03 -0.78 2.02 -1.08 -4.92 118.70 115.07 1twc s GLU 945 Ca 0.30 -0.40 -0.29 0.00 0.02 0.00 0.00 54.97 54.60 1twc s GLU 945 Cb 0.20 -2.81 0.09 0.00 0.10 0.00 0.00 34.13 31.71 1twc s GLU 945 CO 0.46 0.36 0.81 0.54 0.02 0.00 0.00 175.26 177.44 1twc s ASN 946 N -3.45 -0.48 0.00 -0.19 4.22 -1.26 -3.56 114.94 110.22 1twc s ASN 946 Ca 0.38 0.28 0.00 0.00 -2.14 0.00 0.00 52.86 51.38 1twc s ASN 946 Cb -0.10 0.44 0.00 0.00 1.28 0.00 0.00 41.25 42.87 1twc s ASN 946 CO 0.30 -0.61 0.00 0.61 -2.04 0.00 0.00 177.10 175.36 1twc n GLY 947 N 0.27 -0.73 3.41 0.45 0.00 -0.83 -4.68 105.19 103.08 1twc n GLY 947 Ca -0.13 -0.35 -0.03 0.00 0.00 0.00 0.00 46.02 45.51 1twc n GLY 947 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1twc s ILE 948 N -4.00 -0.86 0.22 -0.61 1.01 -0.30 -2.15 121.20 114.51 1twc s ILE 948 Ca 0.00 0.05 -0.32 0.00 0.00 0.00 0.00 60.65 60.38 1twc s ILE 948 Cb 0.00 -0.88 -0.14 0.00 0.01 0.00 0.00 42.46 41.45 1twc s ILE 948 CO 0.00 0.01 1.40 0.52 0.00 0.00 0.00 174.94 176.87 1twc n VAL 949 N 5.42 0.80 0.00 2.92 0.31 -0.88 -1.21 118.33 125.69 1twc n VAL 949 Ca -0.09 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 1twc n VAL 949 Cb 0.49 -1.38 0.00 0.00 -0.91 0.00 0.00 33.84 32.04 1twc n VAL 949 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1twc n ASP 950 N 2.30 4.95 -3.65 4.52 -0.08 -0.10 -2.28 116.55 122.21 1twc n ASP 950 Ca 0.13 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.26 1twc n ASP 950 Cb 0.30 0.54 -0.08 0.00 2.34 0.00 0.00 41.12 44.22 1twc n ASP 950 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 1twc s GLN 951 N -1.99 0.81 -0.03 -0.67 -0.21 -0.92 -4.92 119.66 111.73 1twc s GLN 951 Ca 0.00 0.24 0.01 0.00 0.02 0.00 0.00 55.36 55.63 1twc s GLN 951 Cb 0.00 0.38 0.01 0.00 1.00 0.00 0.00 33.01 34.40 1twc s GLN 951 CO 0.00 -0.21 -0.05 0.08 -2.12 0.00 0.00 175.29 172.99 1twc s VAL 952 N -0.84 0.52 -0.02 1.09 1.01 -1.26 -1.40 120.40 119.50 1twc s VAL 952 Ca -0.09 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1twc s VAL 952 Cb -0.03 -0.51 0.02 0.00 0.00 0.00 0.00 36.38 35.87 1twc s VAL 952 CO 0.06 0.19 0.02 -0.22 0.00 0.00 0.00 175.10 175.15 1twc s LEU 953 N 0.53 1.27 -0.02 3.92 0.20 -0.93 -5.02 118.68 118.63 1twc s LEU 953 Ca -0.07 0.03 0.02 0.00 0.69 0.00 0.00 54.13 54.80 1twc s LEU 953 Cb -0.10 -0.06 0.00 0.00 -0.43 0.00 0.00 46.19 45.60 1twc s LEU 953 CO 0.00 -0.10 -0.07 -0.69 -0.29 0.00 0.00 176.35 175.20 1twc s VAL 954 N 0.85 0.64 0.15 1.68 1.01 -1.26 -0.40 120.40 123.06 1twc s VAL 954 Ca -0.07 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 1twc s VAL 954 Cb -0.10 -0.58 0.02 0.00 0.00 0.00 0.00 36.38 35.72 1twc s VAL 954 CO -0.02 0.20 0.28 0.35 0.00 0.00 0.00 175.10 175.91 1twc n THR 955 N 3.27 0.00 -4.71 3.92 -2.24 -0.02 -4.98 114.28 109.51 1twc n THR 955 Ca -0.17 -0.43 -0.33 0.00 -2.27 0.00 0.00 64.05 60.84 1twc n THR 955 Cb 0.55 0.38 -0.13 0.00 -2.10 0.00 0.00 70.33 69.04 1twc n THR 955 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1twc s THR 956 N -2.65 3.39 0.56 4.28 2.01 -1.26 0.33 115.64 122.30 1twc s THR 956 Ca 0.07 -0.58 -0.04 0.00 0.31 0.00 0.00 61.69 61.45 1twc s THR 956 Cb -0.02 -2.39 -0.03 0.00 0.01 0.00 0.00 72.50 70.07 1twc s THR 956 CO 0.05 0.56 -0.23 -3.20 -0.69 0.00 0.00 174.62 171.11 1twc n ASN 957 N 2.75 -2.07 0.08 3.53 4.05 -0.02 -4.92 115.26 118.65 1twc n ASN 957 Ca -0.18 0.00 -0.19 0.00 0.45 0.00 0.00 54.58 54.66 1twc n ASN 957 Cb 0.53 -0.48 -0.10 0.00 1.23 0.00 0.00 39.78 40.95 1twc n ASN 957 CO 0.00 0.00 0.00 0.06 -3.05 0.00 0.00 177.26 174.27 1twc h GLN 958 N -1.77 0.55 -0.03 1.20 3.07 -1.88 -3.09 115.11 113.16 1twc h GLN 958 Ca -0.06 -0.68 0.00 0.00 0.09 0.00 0.00 58.65 58.00 1twc h GLN 958 Cb 0.21 0.22 0.00 0.00 0.08 0.00 0.00 27.48 27.98 1twc h GLN 958 CO 0.03 1.28 0.00 -0.25 0.09 0.00 0.00 178.83 179.99 1twc n ASP 959 N -3.76 0.61 0.00 0.06 8.00 -1.26 -2.28 116.55 117.91 1twc n ASP 959 Ca -0.11 -1.31 0.00 0.00 0.71 0.00 0.00 54.79 54.09 1twc n ASP 959 Cb 0.93 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 42.02 1twc n ASP 959 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1twc n GLY 960 N 1.02 1.45 3.77 0.44 0.00 -1.17 -4.96 105.19 105.75 1twc n GLY 960 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1twc n GLY 960 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1twc s LEU 961 N 0.00 4.34 0.21 0.99 1.02 -1.26 -4.68 118.68 119.29 1twc s LEU 961 Ca 0.00 2.86 -0.30 0.00 0.02 0.00 0.00 54.13 56.71 1twc s LEU 961 Cb 0.00 -3.70 -0.08 0.00 0.02 0.00 0.00 46.19 42.42 1twc s LEU 961 CO 0.00 -0.76 1.16 -0.54 0.02 0.00 0.00 176.35 176.23 1twc s LYS 962 N -2.02 4.54 0.13 1.70 3.01 -1.26 -0.84 119.74 125.01 1twc s LYS 962 Ca 0.52 1.84 0.11 0.00 -1.01 0.00 0.00 55.97 57.43 1twc s LYS 962 Cb -0.43 -3.23 -0.04 0.00 -1.01 0.00 0.00 37.83 33.12 1twc s LYS 962 CO 0.57 0.01 -0.26 -0.06 0.51 0.00 0.00 175.35 176.13 1twc s PHE 963 N -0.39 2.34 0.06 3.18 2.99 0.15 -2.81 117.98 123.50 1twc s PHE 963 Ca 0.50 -0.36 0.07 0.00 0.00 0.00 0.00 56.93 57.13 1twc s PHE 963 Cb -0.32 -1.26 -0.03 0.00 0.00 0.00 0.00 43.02 41.41 1twc s PHE 963 CO 0.38 0.35 -0.18 0.08 -0.00 0.00 0.00 175.22 175.84 1twc s VAL 964 N -1.08 1.46 -0.07 -0.44 1.01 -0.59 -0.84 120.40 119.85 1twc s VAL 964 Ca 0.15 -1.22 0.01 0.00 0.00 0.00 0.00 61.98 60.92 1twc s VAL 964 Cb -0.10 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.99 1twc s VAL 964 CO 0.07 0.05 -0.09 -0.54 0.00 0.00 0.00 175.10 174.58 1twc s LYS 965 N -1.37 1.46 -0.15 2.72 1.02 0.46 -1.58 119.74 122.30 1twc s LYS 965 Ca 0.05 -0.31 -0.01 0.00 0.02 0.00 0.00 55.97 55.73 1twc s LYS 965 Cb -0.09 -1.31 -0.01 0.00 -0.52 0.00 0.00 37.83 35.90 1twc s LYS 965 CO 0.02 -0.06 -0.13 0.08 -0.92 0.00 0.00 175.35 174.34 1twc s VAL 966 N 0.95 2.94 -0.14 3.17 1.01 -0.22 -2.19 120.40 125.93 1twc s VAL 966 Ca -0.10 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 1twc s VAL 966 Cb -0.15 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 1twc s VAL 966 CO 0.00 0.51 0.03 -0.60 0.00 0.00 0.00 175.10 175.04 1twc s ARG 967 N 0.70 3.51 0.03 2.72 3.52 -0.49 -0.91 118.95 128.03 1twc s ARG 967 Ca -0.06 -0.38 0.04 0.00 -0.13 0.00 0.00 55.73 55.19 1twc s ARG 967 Cb -0.15 -3.00 -0.04 0.00 -1.56 0.00 0.00 34.95 30.20 1twc s ARG 967 CO 0.02 0.47 -0.05 0.08 -0.81 0.00 0.00 175.30 175.01 1twc s VAL 968 N -0.21 3.77 -0.06 7.11 1.01 -0.80 -0.92 120.40 130.30 1twc s VAL 968 Ca 0.06 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.23 1twc s VAL 968 Cb -0.12 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 1twc s VAL 968 CO 0.02 0.32 -0.09 -0.60 0.00 0.00 0.00 175.10 174.74 1twc s ARG 969 N -1.67 2.68 0.02 2.72 3.52 -0.35 -1.00 118.95 124.88 1twc s ARG 969 Ca 0.19 -0.60 0.02 0.00 -0.13 0.00 0.00 55.73 55.21 1twc s ARG 969 Cb -0.11 -2.52 -0.01 0.00 -1.56 0.00 0.00 34.95 30.74 1twc s ARG 969 CO 0.10 0.64 -0.06 0.99 -0.81 0.00 0.00 175.30 176.16 1twc s THR 970 N -0.76 0.47 -0.10 4.11 2.01 -0.70 -1.15 115.64 119.52 1twc s THR 970 Ca 0.12 -0.64 -0.09 0.00 0.31 0.00 0.00 61.69 61.39 1twc s THR 970 Cb -0.11 -0.47 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 1twc s THR 970 CO 0.01 -0.13 0.19 -0.89 -0.69 0.00 0.00 174.62 173.11 1twc s THR 971 N -0.74 5.42 -0.30 -0.82 2.01 -1.26 -0.91 115.64 119.03 1twc s THR 971 Ca -0.04 0.33 -0.04 0.00 0.31 0.00 0.00 61.69 62.24 1twc s THR 971 Cb -0.06 -3.46 0.04 0.00 0.01 0.00 0.00 72.50 69.02 1twc s THR 971 CO 0.00 0.60 0.04 -0.54 -0.69 0.00 0.00 174.62 174.03 1twc s LYS 972 N -0.96 2.68 -0.10 4.92 1.02 0.08 -4.95 119.74 122.43 1twc s LYS 972 Ca 0.16 -1.12 -0.15 0.00 0.02 0.00 0.00 55.97 54.88 1twc s LYS 972 Cb -0.13 -3.28 -0.05 0.00 -0.52 0.00 0.00 37.83 33.86 1twc s LYS 972 CO 0.05 -0.57 0.39 0.42 -0.92 0.00 0.00 175.35 174.72 1twc s ILE 973 N 1.36 5.19 0.47 2.17 1.01 -1.26 -2.25 121.20 127.89 1twc s ILE 973 Ca -0.02 0.77 -0.23 0.00 0.00 0.00 0.00 60.65 61.17 1twc s ILE 973 Cb -0.19 -3.72 -0.09 0.00 0.01 0.00 0.00 42.46 38.48 1twc s ILE 973 CO 0.00 0.43 1.07 -2.65 0.00 0.00 0.00 174.94 173.79 1twc n PRO 974 N 3.07 1.40 -3.94 2.79 -0.02 -1.26 -5.01 135.00 132.03 1twc n PRO 974 Ca -0.11 0.51 -0.09 0.00 -2.02 0.00 0.00 63.50 61.79 1twc n PRO 974 Cb 0.52 -2.18 -0.08 0.00 -0.02 0.00 0.00 33.50 31.75 1twc n PRO 974 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1twc s GLN 975 N -2.27 0.95 0.07 -0.52 0.74 -1.26 -5.07 119.66 112.30 1twc s GLN 975 Ca 0.66 -1.10 -0.35 0.00 0.05 0.00 0.00 55.36 54.62 1twc s GLN 975 Cb -0.50 0.34 -0.14 0.00 1.10 0.00 0.00 33.01 33.80 1twc s GLN 975 CO 0.55 -0.32 1.63 -0.89 -0.55 0.00 0.00 175.29 175.71 1twc n ILE 976 N -0.11 0.16 0.00 -2.34 5.41 -1.26 -2.13 119.36 119.09 1twc n ILE 976 Ca -0.11 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.61 1twc n ILE 976 Cb 0.63 -1.50 0.00 0.00 -0.71 0.00 0.00 39.64 38.05 1twc n ILE 976 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1twc n GLY 977 N 3.57 2.36 3.84 7.39 0.00 0.16 -4.82 105.19 117.69 1twc n GLY 977 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1twc n GLY 977 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1twc s ASP 978 N -1.60 6.85 0.20 1.61 1.01 -0.91 -4.15 116.67 119.67 1twc s ASP 978 Ca 0.00 1.30 -0.03 0.00 0.71 0.00 0.00 52.55 54.53 1twc s ASP 978 Cb 0.00 -2.38 -0.05 0.00 1.01 0.00 0.00 42.92 41.50 1twc s ASP 978 CO 0.00 -0.13 0.42 -0.54 0.21 0.00 0.00 175.17 175.13 1twc s LYS 979 N -2.68 3.58 0.03 8.23 1.02 -1.26 -1.72 119.74 126.95 1twc s LYS 979 Ca 0.50 -0.17 -0.17 0.00 0.02 0.00 0.00 55.97 56.15 1twc s LYS 979 Cb -0.12 -2.80 0.03 0.00 -0.52 0.00 0.00 37.83 34.42 1twc s LYS 979 CO 0.19 0.39 0.38 -0.06 -0.92 0.00 0.00 175.35 175.32 1twc s PHE 980 N -1.83 -0.22 -0.13 3.18 0.08 -0.80 -1.11 117.98 117.15 1twc s PHE 980 Ca 0.41 0.20 -0.17 0.00 0.12 0.00 0.00 56.93 57.48 1twc s PHE 980 Cb -0.11 0.17 0.04 0.00 -0.57 0.00 0.00 43.02 42.55 1twc s PHE 980 CO 0.27 -0.52 0.44 0.00 -0.10 0.00 0.00 175.22 175.31 1twc s ALA 981 N -2.26 -1.10 1.26 5.36 0.00 -0.34 -1.15 121.76 123.53 1twc s ALA 981 Ca -0.07 1.08 -0.21 0.00 0.00 0.00 0.00 51.96 52.76 1twc s ALA 981 Cb -0.02 -0.51 0.31 0.00 0.00 0.00 0.00 23.12 22.91 1twc s ALA 981 CO -0.01 -0.24 1.08 -1.13 0.00 0.00 0.00 175.76 175.46 1twc n SER 982 N 2.34 -2.19 -1.99 0.00 3.41 -1.25 -0.71 113.62 113.24 1twc n SER 982 Ca -0.15 -1.16 -0.21 0.00 -0.26 0.00 0.00 58.87 57.09 1twc n SER 982 Cb 0.57 -1.00 0.11 0.00 -0.26 0.00 0.00 64.21 63.63 1twc n SER 982 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1twc n ARG 983 N -4.89 2.05 -0.40 4.33 3.00 -1.26 -4.28 116.66 115.21 1twc n ARG 983 Ca 0.15 -2.34 0.07 0.00 -0.01 0.00 0.00 57.85 55.72 1twc n ARG 983 Cb 0.59 -1.92 0.12 0.00 0.00 0.00 0.00 32.46 31.25 1twc n ARG 983 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1twc n HIS 984 N -0.61 0.00 -0.80 -1.55 8.25 -1.26 -4.75 115.22 114.50 1twc n HIS 984 Ca 0.46 -0.86 0.00 0.00 -0.26 0.00 0.00 57.72 57.06 1twc n HIS 984 Cb 1.14 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 32.10 1twc n HIS 984 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1twc n GLY 985 N -0.90 0.53 2.95 -1.41 0.00 -1.26 -4.78 105.19 100.32 1twc n GLY 985 Ca 0.12 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 1twc n GLY 985 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1twc s GLN 986 N -1.18 1.83 0.56 1.61 2.00 -1.26 -4.74 119.66 118.49 1twc s GLN 986 Ca 0.00 -0.54 0.04 0.00 -2.00 0.00 0.00 55.36 52.86 1twc s GLN 986 Cb 0.00 -2.03 0.06 0.00 0.80 0.00 0.00 33.01 31.84 1twc s GLN 986 CO 0.00 -0.34 0.78 -1.59 -0.50 0.00 0.00 175.29 173.64 1twc s LYS 987 N 1.56 2.37 0.24 1.67 -2.85 -1.26 -3.80 119.74 117.66 1twc s LYS 987 Ca 0.02 -1.13 -0.15 0.00 -1.00 0.00 0.00 55.97 53.71 1twc s LYS 987 Cb -0.14 -2.55 0.01 0.00 -2.06 0.00 0.00 37.83 33.09 1twc s LYS 987 CO -0.09 -0.81 0.54 0.20 0.10 0.00 0.00 175.35 175.29 1twc s GLY 988 N -4.53 0.29 0.24 0.59 0.00 -0.30 -4.77 107.32 98.84 1twc s GLY 988 Ca 0.60 -0.64 0.08 0.00 0.00 0.00 0.00 44.72 44.76 1twc s GLY 988 CO 0.39 -0.45 0.07 -0.51 0.00 0.00 0.00 173.10 172.60 1twc s THR 989 N -3.97 3.88 0.05 0.90 -4.23 -1.19 -1.91 115.64 109.16 1twc s THR 989 Ca 0.17 -1.62 -0.30 0.00 -1.18 0.00 0.00 61.69 58.77 1twc s THR 989 Cb -0.02 -3.06 -0.05 0.00 1.34 0.00 0.00 72.50 70.72 1twc s THR 989 CO 0.06 -0.31 1.09 -0.63 -0.54 0.00 0.00 174.62 174.30 1twc s ILE 990 N -2.13 4.38 -0.08 2.99 -1.09 -0.70 -0.72 121.20 123.85 1twc s ILE 990 Ca 0.31 1.74 0.17 0.00 -2.23 0.00 0.00 60.65 60.63 1twc s ILE 990 Cb -0.08 -4.11 -0.25 0.00 -1.58 0.00 0.00 42.46 36.45 1twc s ILE 990 CO 0.21 0.15 0.25 0.61 -1.23 0.00 0.00 174.94 174.94 1twc n GLY 991 N 2.96 -0.82 3.49 6.18 0.00 0.17 -0.66 105.19 116.51 1twc n GLY 991 Ca 0.07 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 1twc n GLY 991 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1twc s ILE 992 N -2.88 0.00 0.14 -0.61 2.07 -1.23 -4.89 121.20 113.79 1twc s ILE 992 Ca -0.07 -0.09 0.08 0.00 -1.41 0.00 0.00 60.65 59.16 1twc s ILE 992 Cb 0.09 -1.10 -0.04 0.00 0.13 0.00 0.00 42.46 41.54 1twc s ILE 992 CO 0.72 0.00 -0.11 0.42 -1.91 0.00 0.00 174.94 174.06 1twc s THR 993 N -3.52 3.22 -0.05 4.00 -4.23 -1.26 -2.53 115.64 111.27 1twc s THR 993 Ca 0.03 -1.49 0.02 0.00 -1.18 0.00 0.00 61.69 59.08 1twc s THR 993 Cb -0.01 -2.55 0.01 0.00 1.34 0.00 0.00 72.50 71.29 1twc s THR 993 CO -0.10 0.00 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.57 1twc s TYR 994 N -1.44 1.25 0.83 3.99 4.12 -0.52 -4.80 117.35 120.77 1twc s TYR 994 Ca 0.23 -0.42 -0.12 0.00 0.02 0.00 0.00 57.07 56.78 1twc s TYR 994 Cb -0.10 -0.93 0.10 0.00 -1.52 0.00 0.00 41.96 39.51 1twc s TYR 994 CO 0.14 -0.22 1.17 1.03 0.02 0.00 0.00 175.55 177.69 1twc s ARG 995 N 0.59 1.57 0.25 -0.62 0.52 -1.26 -1.14 118.95 118.85 1twc s ARG 995 Ca -0.11 1.61 -0.06 0.00 -0.52 0.00 0.00 55.73 56.64 1twc s ARG 995 Cb -0.14 -1.78 0.25 0.00 0.52 0.00 0.00 34.95 33.80 1twc s ARG 995 CO 0.02 -2.23 1.93 -0.09 0.02 0.00 0.00 175.30 174.94 1twc h ARG 996 N -1.18 1.32 -0.92 3.54 2.43 -1.95 -1.91 114.38 115.71 1twc h ARG 996 Ca -0.45 -0.08 0.26 0.00 -0.81 0.00 0.00 59.98 58.90 1twc h ARG 996 Cb 1.28 -0.30 -0.15 0.00 -0.42 0.00 0.00 29.97 30.39 1twc h ARG 996 CO 0.46 0.88 0.33 1.05 -1.51 0.00 0.00 179.97 181.18 1twc h GLU 997 N 1.36 0.23 0.00 0.20 4.11 -1.96 -2.91 114.58 115.61 1twc h GLU 997 Ca 0.37 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.78 1twc h GLU 997 Cb -0.15 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.05 1twc h GLU 997 CO -0.08 0.15 -0.37 -0.44 0.07 0.00 0.00 179.01 178.34 1twc h ASP 998 N 0.24 0.00 -4.23 3.06 3.32 -1.61 -3.42 116.42 113.78 1twc h ASP 998 Ca 0.61 -0.08 -0.51 0.00 0.02 0.00 0.00 57.03 57.07 1twc h ASP 998 Cb 1.29 0.00 0.11 0.00 0.22 0.00 0.00 39.33 40.96 1twc h ASP 998 CO -0.65 0.04 0.36 -0.04 -1.72 0.00 0.00 179.24 177.23 1twc s MET 999 N -3.18 2.58 0.52 3.56 -1.94 -1.10 -4.29 119.30 115.46 1twc s MET 999 Ca 0.07 1.36 -0.18 0.00 -1.71 0.00 0.00 55.69 55.22 1twc s MET 999 Cb 0.11 -1.93 -0.07 0.00 2.01 0.00 0.00 34.83 34.96 1twc s MET 999 CO 0.68 -1.42 1.02 -1.25 -0.01 0.00 0.00 175.02 174.05 1twc s PRO 1000N -4.31 3.73 0.06 2.03 0.04 -1.26 -3.66 135.00 131.63 1twc s PRO 1000Ca 0.66 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.89 1twc s PRO 1000Cb -0.20 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 1twc s PRO 1000CO 0.46 -0.47 -0.04 -0.59 0.04 0.00 0.00 177.00 176.40 1twc s PHE 1001N -2.29 0.59 0.26 0.56 -0.12 0.40 -4.30 117.98 113.07 1twc s PHE 1001Ca 0.64 -0.87 -0.15 0.00 -0.05 0.00 0.00 56.93 56.50 1twc s PHE 1001Cb -0.14 -0.39 -0.08 0.00 -0.63 0.00 0.00 43.02 41.78 1twc s PHE 1001CO 0.27 -0.25 0.68 -0.08 -0.05 0.00 0.00 175.22 175.78 1twc s THR 1002N -3.11 4.71 0.45 -4.49 -1.32 -0.00 -0.16 115.64 111.72 1twc s THR 1002Ca 0.02 0.95 0.28 0.00 -1.21 0.00 0.00 61.69 61.74 1twc s THR 1002Cb 0.02 -3.70 0.48 0.00 -1.51 0.00 0.00 72.50 67.79 1twc s THR 1002CO -0.06 0.00 1.70 0.00 -2.21 0.00 0.00 174.62 174.06 1twc h ALA 1003N 2.80 2.69 0.00 11.08 0.00 -1.91 2.17 119.26 136.09 1twc h ALA 1003Ca -0.48 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1twc h ALA 1003Cb 1.18 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1twc h ALA 1003CO 0.66 -1.18 0.00 0.39 0.00 0.00 0.00 179.25 179.11 1twc n GLU 1004N -4.54 0.58 -0.95 0.00 1.02 -1.26 -4.85 120.64 110.64 1twc n GLU 1004Ca 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.45 1twc n GLU 1004Cb 1.24 -1.14 0.00 0.00 -0.02 0.00 0.00 31.44 31.52 1twc n GLU 1004CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1twc n GLY 1005N 0.10 0.13 3.77 0.62 0.00 0.73 -5.00 105.19 105.54 1twc n GLY 1005Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1twc n GLY 1005CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1twc s ILE 1006N -1.28 2.39 0.03 -0.61 1.09 -1.26 -4.79 121.20 116.76 1twc s ILE 1006Ca 0.00 0.38 0.03 0.00 -1.10 0.00 0.00 60.65 59.96 1twc s ILE 1006Cb 0.00 -3.24 -0.02 0.00 -1.06 0.00 0.00 42.46 38.14 1twc s ILE 1006CO 0.00 0.08 -0.10 0.54 -0.10 0.00 0.00 174.94 175.37 1twc s VAL 1007N -0.87 0.74 0.35 2.92 0.11 -1.26 -0.82 120.40 121.56 1twc s VAL 1007Ca 0.53 -0.79 -0.26 0.00 -2.93 0.00 0.00 61.98 58.53 1twc s VAL 1007Cb -0.43 -0.70 -0.09 0.00 -1.53 0.00 0.00 36.38 33.63 1twc s VAL 1007CO 0.55 -0.07 1.03 -2.16 -3.33 0.00 0.00 175.10 171.12 1twc s PRO 1008N -0.96 4.41 0.14 1.54 0.04 -1.26 -4.91 135.00 134.01 1twc s PRO 1008Ca -0.02 1.52 0.25 0.00 0.04 0.00 0.00 61.00 62.80 1twc s PRO 1008Cb -0.07 -2.78 0.63 0.00 0.04 0.00 0.00 34.50 32.32 1twc s PRO 1008CO 0.01 0.08 1.58 -0.25 0.04 0.00 0.00 177.00 178.45 1twc n ASP 1009N 0.44 0.68 -3.61 6.66 8.00 0.69 -4.50 116.55 124.92 1twc n ASP 1009Ca 0.03 0.33 -0.14 0.00 0.71 0.00 0.00 54.79 55.71 1twc n ASP 1009Cb 0.49 -0.32 -0.07 0.00 -0.02 0.00 0.00 41.12 41.20 1twc n ASP 1009CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1twc s LEU 1010N -4.19 -0.69 -0.17 0.64 2.96 -0.90 -1.16 118.68 115.16 1twc s LEU 1010Ca 0.09 1.22 -0.01 0.00 -0.22 0.00 0.00 54.13 55.22 1twc s LEU 1010Cb 0.14 2.41 0.04 0.00 0.50 0.00 0.00 46.19 49.28 1twc s LEU 1010CO 0.65 -0.32 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.69 1twc s ILE 1011N 0.01 1.08 0.11 6.68 1.01 0.87 -1.47 121.20 129.50 1twc s ILE 1011Ca -0.02 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 60.04 1twc s ILE 1011Cb -0.04 -1.28 -0.04 0.00 0.01 0.00 0.00 42.46 41.11 1twc s ILE 1011CO 0.02 0.11 0.06 0.27 0.00 0.00 0.00 174.94 175.40 1twc s ILE 1012N 1.64 4.29 0.03 2.92 -5.25 -0.54 -3.10 121.20 121.20 1twc s ILE 1012Ca 0.00 -0.97 -0.20 0.00 -0.99 0.00 0.00 60.65 58.49 1twc s ILE 1012Cb -0.15 -3.10 -0.06 0.00 2.95 0.00 0.00 42.46 42.09 1twc s ILE 1012CO -0.08 0.04 0.59 0.21 -1.79 0.00 0.00 174.94 173.92 1twc s ASN 1013N -2.60 7.02 0.53 4.36 3.84 -1.26 -0.70 114.94 126.13 1twc s ASN 1013Ca 0.29 1.22 0.21 0.00 0.21 0.00 0.00 52.86 54.78 1twc s ASN 1013Cb -0.11 -2.37 1.43 0.00 -0.55 0.00 0.00 41.25 39.65 1twc s ASN 1013CO 0.21 0.17 2.16 1.55 -2.79 0.00 0.00 177.10 178.40 1twc h PRO 1014N 5.18 0.00 0.00 0.43 0.13 -1.86 -2.32 132.00 133.55 1twc h PRO 1014Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1twc h PRO 1014Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1twc h PRO 1014CO 0.67 0.03 0.00 0.72 -0.23 0.00 0.00 178.00 179.19 1twc n HIS 1015N -4.23 0.21 0.96 1.56 8.25 -1.26 -1.82 115.22 118.89 1twc n HIS 1015Ca -0.03 0.11 0.04 0.00 -0.26 0.00 0.00 57.72 57.58 1twc n HIS 1015Cb 0.11 -0.67 0.13 0.00 1.12 0.00 0.00 29.99 30.69 1twc n HIS 1015CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1twc n ALA 1016N -1.58 2.55 -0.05 -1.41 0.00 -0.87 -4.50 120.51 114.65 1twc n ALA 1016Ca 0.00 -0.54 -0.08 0.00 0.00 0.00 0.00 53.44 52.82 1twc n ALA 1016Cb 0.04 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.48 1twc n ALA 1016CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1twc n ILE 1017N 0.32 1.36 -0.04 0.00 5.41 -0.76 -4.50 119.36 121.16 1twc n ILE 1017Ca 0.10 0.16 -0.06 0.00 1.00 0.00 0.00 62.75 63.95 1twc n ILE 1017Cb 0.30 -2.05 0.14 0.00 -0.71 0.00 0.00 39.64 37.32 1twc n ILE 1017CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1twc h PRO 1018N -0.67 0.64 0.00 0.38 0.13 -1.79 -1.99 132.00 128.70 1twc h PRO 1018Ca -0.07 -0.25 -0.04 0.00 -0.87 0.00 0.00 66.00 64.78 1twc h PRO 1018Cb 0.77 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 1twc h PRO 1018CO -0.04 0.81 -0.20 0.77 -0.23 0.00 0.00 178.00 179.12 1twc h SER 1019N 0.57 0.00 1.01 1.44 0.02 -1.87 -3.24 113.55 111.48 1twc h SER 1019Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1twc h SER 1019Cb 0.69 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1twc h SER 1019CO 0.05 0.20 -0.13 0.54 -1.14 0.00 0.00 176.83 176.35 1twc n ARG 1020N -3.15 0.08 -3.77 3.45 5.12 -0.80 -4.90 116.66 112.68 1twc n ARG 1020Ca 0.03 0.05 -0.23 0.00 -1.93 0.00 0.00 57.85 55.78 1twc n ARG 1020Cb 0.61 -1.58 0.02 0.00 -1.16 0.00 0.00 32.46 30.35 1twc n ARG 1020CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1twc n MET 1021N -1.71 -4.13 -2.85 5.56 2.81 -0.92 -4.67 117.12 111.20 1twc n MET 1021Ca 0.06 0.54 -0.42 0.00 -1.81 0.00 0.00 57.70 56.07 1twc n MET 1021Cb 0.37 -4.91 0.01 0.00 -0.71 0.00 0.00 33.22 27.98 1twc n MET 1021CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1twc n THR 1022N -4.29 5.64 -0.29 2.03 5.66 -1.26 -3.68 114.28 118.09 1twc n THR 1022Ca -0.29 -5.94 0.03 0.00 -3.05 0.00 0.00 64.05 54.79 1twc n THR 1022Cb 0.68 -1.88 0.23 0.00 -1.55 0.00 0.00 70.33 67.81 1twc n THR 1022CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 1twc h VAL 1023N 2.96 1.11 -0.23 1.08 2.07 -1.88 -2.47 116.25 118.89 1twc h VAL 1023Ca 0.33 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.52 1twc h VAL 1023Cb 0.50 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 1twc h VAL 1023CO 1.28 0.19 0.15 0.00 0.02 0.00 0.00 177.57 179.22 1twc h ALA 1024N 1.50 2.00 -0.46 1.67 0.00 -1.82 0.19 119.26 122.34 1twc h ALA 1024Ca 0.36 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.29 1twc h ALA 1024Cb 0.10 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1twc h ALA 1024CO -0.12 -0.04 0.26 1.25 0.00 0.00 0.00 179.25 180.60 1twc h HIS 1025N 0.17 0.49 -0.24 0.00 6.17 -1.78 0.14 115.15 120.09 1twc h HIS 1025Ca 0.10 0.02 -0.19 0.00 0.71 0.00 0.00 60.37 61.00 1twc h HIS 1025Cb 0.18 -0.15 0.00 0.00 2.52 0.00 0.00 27.41 29.96 1twc h HIS 1025CO -0.00 0.27 -0.60 -0.07 0.71 0.00 0.00 177.93 178.23 1twc h LEU 1026N 0.52 0.92 -0.72 0.26 3.38 -0.72 -2.47 115.31 116.48 1twc h LEU 1026Ca 0.19 -0.52 -0.06 0.00 0.09 0.00 0.00 57.88 57.58 1twc h LEU 1026Cb 0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1twc h LEU 1026CO -0.10 1.31 -0.27 0.40 0.09 0.00 0.00 178.44 179.87 1twc h ILE 1027N 0.61 0.57 -0.11 1.22 2.04 -1.19 -2.18 117.51 118.47 1twc h ILE 1027Ca -0.00 -1.38 -0.20 0.00 1.00 0.00 0.00 64.86 64.28 1twc h ILE 1027Cb 1.21 1.95 0.00 0.00 -0.74 0.00 0.00 36.82 39.24 1twc h ILE 1027CO 0.13 0.26 -0.74 -0.08 0.00 0.00 0.00 178.15 177.72 1twc h GLU 1028N 0.00 0.56 -0.49 2.37 4.81 -0.46 -1.61 114.58 119.76 1twc h GLU 1028Ca -0.00 -0.45 -0.13 0.00 -0.13 0.00 0.00 59.36 58.64 1twc h GLU 1028Cb 0.93 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.39 1twc h GLU 1028CO 0.04 1.08 -0.21 0.00 -0.73 0.00 0.00 179.01 179.18 1twc h LEU 1030N 0.86 -0.43 -1.51 0.00 5.85 -1.40 -0.60 115.31 118.08 1twc h LEU 1030Ca 0.11 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.75 1twc h LEU 1030Cb 0.80 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 1twc h LEU 1030CO 0.07 -0.24 -0.23 0.25 -0.34 0.00 0.00 178.44 177.95 1twc h LEU 1031N -0.58 0.02 -0.29 2.25 5.85 -1.18 -2.61 115.31 118.76 1twc h LEU 1031Ca -0.05 -0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.48 1twc h LEU 1031Cb 0.43 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.46 1twc h LEU 1031CO 0.08 0.25 -0.55 0.28 -0.34 0.00 0.00 178.44 178.17 1twc h SER 1032N 0.02 0.98 -0.41 1.25 0.02 0.45 -2.69 113.55 113.17 1twc h SER 1032Ca 0.00 -0.53 0.08 0.00 -0.84 0.00 0.00 61.79 60.50 1twc h SER 1032Cb 0.42 -0.28 -0.08 0.00 0.14 0.00 0.00 62.40 62.60 1twc h SER 1032CO 0.03 1.33 -0.08 0.50 -1.14 0.00 0.00 176.83 177.48 1twc h LYS 1033N 0.67 0.03 -0.80 3.45 3.64 -0.74 0.87 116.57 123.69 1twc h LYS 1033Ca 0.01 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1twc h LYS 1033Cb 1.16 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.93 1twc h LYS 1033CO 0.12 0.02 0.52 0.28 -2.27 0.00 0.00 179.45 178.12 1twc h VAL 1034N 0.03 1.21 -0.43 2.00 2.07 -1.39 -0.86 116.25 118.88 1twc h VAL 1034Ca 0.20 -0.40 -0.07 0.00 0.82 0.00 0.00 66.70 67.25 1twc h VAL 1034Cb 0.30 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.09 1twc h VAL 1034CO -0.40 0.21 -0.02 0.00 0.02 0.00 0.00 177.57 177.37 1twc h ALA 1035N 1.29 1.16 -0.13 1.67 0.00 -1.15 -0.25 119.26 121.85 1twc h ALA 1035Ca 0.29 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1twc h ALA 1035Cb -0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1twc h ALA 1035CO -0.06 0.54 -0.57 0.00 0.00 0.00 0.00 179.25 179.16 1twc h ALA 1036N 1.32 0.78 -0.03 0.00 0.00 0.59 -1.10 119.26 120.81 1twc h ALA 1036Ca 0.13 -0.52 -0.24 0.00 0.00 0.00 0.00 54.91 54.28 1twc h ALA 1036Cb 0.44 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1twc h ALA 1036CO 0.02 0.70 -0.94 -0.07 0.00 0.00 0.00 179.25 178.96 1twc h LEU 1037N 0.31 0.76 -0.18 0.00 3.38 -0.79 -3.32 115.31 115.47 1twc h LEU 1037Ca 0.00 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.39 1twc h LEU 1037Cb 1.09 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1twc h LEU 1037CO 0.10 1.37 -0.61 -1.54 0.09 0.00 0.00 178.44 177.85 1twc n SER 1038N -3.83 0.89 0.00 -0.43 3.41 -0.18 -4.96 113.62 108.51 1twc n SER 1038Ca -0.08 -0.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.82 1twc n SER 1038Cb 0.83 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 65.26 1twc n SER 1038CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1twc n GLY 1039N 1.47 0.28 3.76 5.00 0.00 -0.42 -5.01 105.19 110.27 1twc n GLY 1039Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1twc n GLY 1039CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1twc s ASN 1040N -2.16 6.77 0.01 1.61 0.01 -1.21 -5.04 114.94 114.93 1twc s ASN 1040Ca 0.00 0.92 -0.38 0.00 -0.71 0.00 0.00 52.86 52.68 1twc s ASN 1040Cb 0.00 -2.29 -0.19 0.00 0.41 0.00 0.00 41.25 39.18 1twc s ASN 1040CO 0.00 0.12 1.02 -0.62 -1.51 0.00 0.00 177.10 176.11 1twc n GLU 1041N 2.92 0.00 -3.54 -0.60 1.02 -1.26 -4.37 120.64 114.80 1twc n GLU 1041Ca -0.09 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.68 1twc n GLU 1041Cb 0.52 -1.44 -0.07 0.00 -0.02 0.00 0.00 31.44 30.43 1twc n GLU 1041CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1twc s GLY 1042N -0.03 2.26 -0.61 0.62 0.00 -0.58 -5.01 107.32 103.97 1twc s GLY 1042Ca 0.87 -0.41 -0.24 0.00 0.00 0.00 0.00 44.72 44.94 1twc s GLY 1042CO 0.55 0.35 0.97 -0.35 0.00 0.00 0.00 173.10 174.62 1twc s ASP 1043N 0.12 6.25 -0.15 1.64 2.15 -1.26 -1.98 116.67 123.43 1twc s ASP 1043Ca 0.18 -0.66 0.16 0.00 0.43 0.00 0.00 52.55 52.66 1twc s ASP 1043Cb -0.14 -2.44 0.57 0.00 -0.30 0.00 0.00 42.92 40.62 1twc s ASP 1043CO 0.06 -1.37 1.48 0.00 -0.17 0.00 0.00 175.17 175.17 1twc n ALA 1044N 7.71 3.04 -1.33 3.66 0.00 -0.33 -4.94 120.51 128.31 1twc n ALA 1044Ca -0.01 -1.98 -0.33 0.00 0.00 0.00 0.00 53.44 51.13 1twc n ALA 1044Cb 0.47 -0.78 0.08 0.00 0.00 0.00 0.00 19.45 19.22 1twc n ALA 1044CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1twc s SER 1045N -1.46 4.50 0.47 0.00 0.01 -1.24 -0.34 113.70 115.65 1twc s SER 1045Ca 0.43 2.10 -0.20 0.00 1.31 0.00 0.00 55.95 59.58 1twc s SER 1045Cb 0.32 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.90 1twc s SER 1045CO 0.13 -2.05 1.00 -2.16 0.41 0.00 0.00 173.24 170.57 1twc s PRO 1046N -4.24 3.96 -1.12 12.44 0.04 -1.26 -4.28 135.00 140.55 1twc s PRO 1046Ca 0.68 1.21 -0.03 0.00 0.04 0.00 0.00 61.00 62.90 1twc s PRO 1046Cb -0.23 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.19 1twc s PRO 1046CO 0.47 -0.28 0.95 1.19 0.04 0.00 0.00 177.00 179.38 1twc n PHE 1047N -0.97 -2.19 -4.24 0.56 0.99 -1.26 -4.74 117.46 105.61 1twc n PHE 1047Ca 0.08 0.86 -0.10 0.00 -0.00 0.00 0.00 57.45 58.29 1twc n PHE 1047Cb 0.53 -4.68 -0.02 0.00 -1.00 0.00 0.00 39.48 34.31 1twc n PHE 1047CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1twc n THR 1048N -4.15 0.00 1.15 4.37 -2.24 -1.26 -4.99 114.28 107.15 1twc n THR 1048Ca -0.15 -0.77 0.12 0.00 -2.27 0.00 0.00 64.05 60.98 1twc n THR 1048Cb 0.61 0.16 0.21 0.00 -2.10 0.00 0.00 70.33 69.22 1twc n THR 1048CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1twc n ASP 1049N -1.14 2.24 -4.57 3.42 8.00 -1.26 -4.96 116.55 118.28 1twc n ASP 1049Ca -0.07 -1.67 -0.56 0.00 0.71 0.00 0.00 54.79 53.21 1twc n ASP 1049Cb 0.21 0.11 -0.07 0.00 -0.02 0.00 0.00 41.12 41.34 1twc n ASP 1049CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1twc n ILE 1050N 0.59 0.02 -4.18 0.53 2.08 -1.26 -4.97 119.36 112.17 1twc n ILE 1050Ca 0.14 -0.00 -0.17 0.00 0.56 0.00 0.00 62.75 63.28 1twc n ILE 1050Cb 0.49 -0.51 -0.11 0.00 -0.75 0.00 0.00 39.64 38.76 1twc n ILE 1050CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 1twc s THR 1051N 0.56 1.05 0.46 1.39 2.01 -1.26 -4.99 115.64 114.86 1twc s THR 1051Ca 0.89 -1.47 0.12 0.00 0.31 0.00 0.00 61.69 61.53 1twc s THR 1051Cb -1.11 -1.21 0.25 0.00 0.01 0.00 0.00 72.50 70.44 1twc s THR 1051CO 0.53 -0.38 2.08 0.58 -0.69 0.00 0.00 174.62 176.74 1twc h VAL 1052N 3.92 1.07 -0.16 3.82 2.07 -1.94 -2.41 116.25 122.62 1twc h VAL 1052Ca -0.39 -0.18 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 1twc h VAL 1052Cb 1.19 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1twc h VAL 1052CO 0.46 0.07 -0.03 -0.33 0.02 0.00 0.00 177.57 177.77 1twc h GLU 1053N 0.24 0.31 -0.66 1.57 4.39 -1.94 -1.17 114.58 117.32 1twc h GLU 1053Ca 0.06 -0.11 0.01 0.00 0.34 0.00 0.00 59.36 59.66 1twc h GLU 1053Cb 0.03 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.63 1twc h GLU 1053CO -0.01 0.57 0.44 0.78 -1.16 0.00 0.00 179.01 179.62 1twc h GLY 1054N 0.03 0.92 1.08 -3.84 0.00 -1.94 -1.71 103.07 97.61 1twc h GLY 1054Ca 0.04 -0.34 -0.09 0.00 0.00 0.00 0.00 47.33 46.94 1twc h GLY 1054CO 0.01 0.33 0.05 -2.22 0.00 0.00 0.00 176.54 174.72 1twc h ILE 1055N 0.88 1.27 -0.12 2.60 2.04 -1.08 -2.79 117.51 120.31 1twc h ILE 1055Ca 0.24 -1.10 -0.18 0.00 1.00 0.00 0.00 64.86 64.82 1twc h ILE 1055Cb -0.08 0.72 0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1twc h ILE 1055CO -0.05 0.41 -0.63 0.28 0.00 0.00 0.00 178.15 178.15 1twc h SER 1056N 1.01 0.77 -0.26 1.72 0.02 -0.72 -2.02 113.55 114.07 1twc h SER 1056Ca 0.19 -0.64 0.03 0.00 -0.84 0.00 0.00 61.79 60.52 1twc h SER 1056Cb 0.51 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 1twc h SER 1056CO 0.02 1.28 -0.25 0.11 -1.14 0.00 0.00 176.83 176.85 1twc h LYS 1057N 0.30 -0.12 -0.84 3.45 1.57 -1.29 -1.91 116.57 117.73 1twc h LYS 1057Ca -0.05 0.01 0.21 0.00 -1.87 0.00 0.00 60.65 58.95 1twc h LYS 1057Cb 1.28 0.03 -0.13 0.00 0.08 0.00 0.00 32.23 33.48 1twc h LYS 1057CO 0.13 -0.08 0.23 -0.07 -0.57 0.00 0.00 179.45 179.09 1twc h LEU 1058N -0.13 0.04 -1.08 2.94 3.38 -1.46 -1.29 115.31 117.71 1twc h LEU 1058Ca 0.04 0.18 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 1twc h LEU 1058Cb 0.24 0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1twc h LEU 1058CO -0.31 -0.10 -0.38 0.25 0.09 0.00 0.00 178.44 177.98 1twc h LEU 1059N 0.25 0.00 -0.24 1.67 5.85 -1.04 -2.61 115.31 119.19 1twc h LEU 1059Ca 0.51 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 59.19 1twc h LEU 1059Cb 0.98 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 1twc h LEU 1059CO -0.60 0.38 -0.02 -0.09 -0.34 0.00 0.00 178.44 177.78 1twc h ARG 1060N 0.00 0.44 -0.33 1.25 9.65 -0.46 -2.45 114.38 122.49 1twc h ARG 1060Ca -0.00 -0.15 0.10 0.00 -1.10 0.00 0.00 59.98 58.82 1twc h ARG 1060Cb 0.82 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.35 1twc h ARG 1060CO 0.05 0.64 0.39 0.93 2.80 0.00 0.00 179.97 184.77 1twc h GLU 1061N 0.21 0.00 -0.63 0.20 5.08 -1.11 0.92 114.58 119.25 1twc h GLU 1061Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1twc h GLU 1061Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1twc h GLU 1061CO 0.02 0.00 0.00 0.72 -1.00 0.00 0.00 179.01 178.75 1twc n HIS 1062N -3.65 1.49 -0.44 4.33 8.25 -0.93 -4.94 115.22 119.33 1twc n HIS 1062Ca 0.05 -0.63 0.00 0.00 -0.26 0.00 0.00 57.72 56.89 1twc n HIS 1062Cb 0.54 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.39 1twc n HIS 1062CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1twc n GLY 1063N 1.03 0.77 3.77 -1.41 0.00 0.32 -5.08 105.19 104.58 1twc n GLY 1063Ca 0.26 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.05 1twc n GLY 1063CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1twc s TYR 1064N -2.20 2.82 0.61 1.61 1.51 -1.14 -5.02 117.35 115.53 1twc s TYR 1064Ca 0.00 -0.30 -0.16 0.00 -1.01 0.00 0.00 57.07 55.60 1twc s TYR 1064Cb 0.00 -1.60 -0.02 0.00 -0.11 0.00 0.00 41.96 40.23 1twc s TYR 1064CO 0.00 0.35 1.09 1.14 -1.11 0.00 0.00 175.55 177.03 1twc s GLN 1065N -3.87 3.09 0.10 -0.62 1.03 -1.26 -4.22 119.66 113.92 1twc s GLN 1065Ca 0.37 1.36 0.25 0.00 0.04 0.00 0.00 55.36 57.38 1twc s GLN 1065Cb -0.05 -1.99 0.62 0.00 0.03 0.00 0.00 33.01 31.62 1twc s GLN 1065CO 0.24 -1.01 1.53 -1.13 -2.54 0.00 0.00 175.29 172.38 1twc n SER 1066N -2.07 0.58 -0.90 12.60 3.41 -1.26 -2.43 113.62 123.54 1twc n SER 1066Ca 0.10 0.21 0.08 0.00 -0.26 0.00 0.00 58.87 59.00 1twc n SER 1066Cb 0.52 -0.14 0.23 0.00 -0.26 0.00 0.00 64.21 64.56 1twc n SER 1066CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1twc n ARG 1067N -1.93 2.13 -0.71 4.33 5.12 -1.26 -4.41 116.66 119.93 1twc n ARG 1067Ca 0.05 -1.75 0.00 0.00 -1.93 0.00 0.00 57.85 54.22 1twc n ARG 1067Cb 0.40 -1.39 0.00 0.00 -1.16 0.00 0.00 32.46 30.31 1twc n ARG 1067CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1twc n GLY 1068N 1.28 0.70 3.77 -0.13 0.00 -1.02 -4.98 105.19 104.82 1twc n GLY 1068Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1twc n GLY 1068CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1twc s PHE 1069N -2.39 2.56 0.04 1.61 0.40 -1.26 -1.95 117.98 116.99 1twc s PHE 1069Ca 0.00 1.55 -0.03 0.00 -0.60 0.00 0.00 56.93 57.85 1twc s PHE 1069Cb 0.00 -3.29 -0.02 0.00 0.51 0.00 0.00 43.02 40.22 1twc s PHE 1069CO 0.00 -1.79 0.04 -1.21 0.70 0.00 0.00 175.22 172.96 1twc s GLU 1070N -3.65 0.53 0.26 0.44 2.02 -0.90 -4.10 118.70 113.30 1twc s GLU 1070Ca 0.71 -0.84 -0.30 0.00 0.02 0.00 0.00 54.97 54.57 1twc s GLU 1070Cb -0.24 0.20 -0.09 0.00 0.10 0.00 0.00 34.13 34.10 1twc s GLU 1070CO 0.35 -0.12 1.13 0.08 0.02 0.00 0.00 175.26 176.72 1twc s VAL 1071N -2.70 3.50 0.38 2.63 1.01 -1.26 -1.45 120.40 122.50 1twc s VAL 1071Ca -0.04 1.44 0.04 0.00 0.00 0.00 0.00 61.98 63.41 1twc s VAL 1071Cb -0.01 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 1twc s VAL 1071CO -0.05 0.32 0.13 -0.04 0.00 0.00 0.00 175.10 175.45 1twc s MET 1072N -1.16 1.83 -0.02 2.72 1.00 -1.26 -4.36 119.30 118.04 1twc s MET 1072Ca 0.46 -2.09 0.03 0.00 0.00 0.00 0.00 55.69 54.09 1twc s MET 1072Cb -0.32 -0.54 0.00 0.00 0.00 0.00 0.00 34.83 33.97 1twc s MET 1072CO 0.40 -0.43 -0.09 0.71 0.00 0.00 0.00 175.02 175.61 1twc s TYR 1073N -3.30 0.95 -0.01 -0.03 1.51 0.78 -2.21 117.35 115.05 1twc s TYR 1073Ca 0.28 -0.23 -0.30 0.00 -1.01 0.00 0.00 57.07 55.81 1twc s TYR 1073Cb 0.04 -0.67 -0.06 0.00 -0.11 0.00 0.00 41.96 41.16 1twc s TYR 1073CO 0.15 -0.09 1.56 1.21 -1.11 0.00 0.00 175.55 177.28 1twc s ASN 1074N 0.11 6.72 0.42 2.29 3.84 -0.16 -0.45 114.94 127.71 1twc s ASN 1074Ca -0.02 2.25 0.15 0.00 0.21 0.00 0.00 52.86 55.45 1twc s ASN 1074Cb -0.08 -2.55 1.03 0.00 -0.55 0.00 0.00 41.25 39.11 1twc s ASN 1074CO 0.00 -0.85 1.93 1.23 -2.79 0.00 0.00 177.10 176.62 1twc h GLY 1075N 9.17 0.71 2.00 1.21 0.00 -1.74 0.21 103.07 114.63 1twc h GLY 1075Ca -0.39 -0.18 -0.12 0.00 0.00 0.00 0.00 47.33 46.63 1twc h GLY 1075CO 0.93 0.07 -0.57 0.45 0.00 0.00 0.00 176.54 177.42 1twc h HIS 1076N 0.43 0.00 0.00 5.60 3.86 -1.80 -3.38 115.15 119.86 1twc h HIS 1076Ca 0.36 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.57 1twc h HIS 1076Cb 0.80 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.27 1twc h HIS 1076CO -0.00 0.57 -0.58 2.41 0.86 0.00 0.00 177.93 181.19 1twc n THR 1077N -3.41 0.00 0.00 2.45 -1.04 -1.08 -5.01 114.28 106.19 1twc n THR 1077Ca 0.01 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.87 1twc n THR 1077Cb 0.69 0.63 0.00 0.00 -1.82 0.00 0.00 70.33 69.83 1twc n THR 1077CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1twc n GLY 1078N 1.76 1.60 3.77 3.41 0.00 0.71 -4.95 105.19 111.49 1twc n GLY 1078Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1twc n GLY 1078CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1twc s LYS 1079N 0.00 4.12 0.59 1.61 2.20 -1.25 -4.52 119.74 122.49 1twc s LYS 1079Ca 0.00 1.97 -0.18 0.00 -0.36 0.00 0.00 55.97 57.40 1twc s LYS 1079Cb 0.00 -2.80 -0.07 0.00 -1.51 0.00 0.00 37.83 33.45 1twc s LYS 1079CO 0.00 -0.30 0.62 1.63 -0.36 0.00 0.00 175.35 176.94 1twc n LYS 1080N 0.28 0.57 -3.67 4.03 5.02 -1.26 -0.99 118.16 122.14 1twc n LYS 1080Ca 0.03 0.23 -0.36 0.00 -2.02 0.00 0.00 58.31 56.18 1twc n LYS 1080Cb 0.45 -1.81 -0.07 0.00 -0.02 0.00 0.00 35.03 33.58 1twc n LYS 1080CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1twc s LEU 1081N 0.05 4.28 0.36 -0.35 1.43 -0.94 -4.69 118.68 118.82 1twc s LEU 1081Ca 0.70 0.44 0.03 0.00 -1.03 0.00 0.00 54.13 54.27 1twc s LEU 1081Cb -0.43 -2.23 0.66 0.00 0.03 0.00 0.00 46.19 44.21 1twc s LEU 1081CO 0.53 0.21 2.02 -0.03 0.23 0.00 0.00 176.35 179.30 1twc h MET 1082N 6.18 0.81 -6.18 1.70 1.85 -1.94 -3.42 114.93 113.93 1twc h MET 1082Ca -0.45 -0.05 -0.55 0.00 -0.61 0.00 0.00 59.70 58.05 1twc h MET 1082Cb 1.18 -0.18 -0.06 0.00 0.43 0.00 0.00 31.60 32.97 1twc h MET 1082CO 0.71 0.54 -0.54 0.00 -0.40 0.00 0.00 176.91 177.22 1twc s ALA 1083N -5.71 3.64 0.50 0.39 0.00 -1.26 -5.09 121.76 114.22 1twc s ALA 1083Ca -0.10 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 50.66 1twc s ALA 1083Cb 0.18 -1.42 0.02 0.00 0.00 0.00 0.00 23.12 21.90 1twc s ALA 1083CO 0.76 0.44 0.70 -0.65 0.00 0.00 0.00 175.76 177.01 1twc s GLN 1084N -3.32 2.68 -0.07 0.00 1.11 -1.26 -4.61 119.66 114.19 1twc s GLN 1084Ca 0.32 -0.91 0.04 0.00 0.01 0.00 0.00 55.36 54.82 1twc s GLN 1084Cb -0.10 -2.59 -0.00 0.00 -1.01 0.00 0.00 33.01 29.32 1twc s GLN 1084CO 0.25 -0.52 -0.20 0.42 0.01 0.00 0.00 175.29 175.24 1twc s ILE 1085N -2.60 1.74 -0.05 1.08 1.09 -0.53 -4.86 121.20 117.07 1twc s ILE 1085Ca 0.56 -0.86 -0.30 0.00 -1.10 0.00 0.00 60.65 58.95 1twc s ILE 1085Cb -0.10 -1.51 -0.03 0.00 -1.06 0.00 0.00 42.46 39.76 1twc s ILE 1085CO 0.36 0.49 1.06 0.12 -0.10 0.00 0.00 174.94 176.88 1twc s PHE 1086N 0.23 3.47 -0.12 3.97 5.36 -1.26 -2.11 117.98 127.53 1twc s PHE 1086Ca -0.12 1.51 -0.07 0.00 -0.96 0.00 0.00 56.93 57.29 1twc s PHE 1086Cb -0.15 -3.25 0.04 0.00 -0.34 0.00 0.00 43.02 39.32 1twc s PHE 1086CO 0.05 -0.52 0.28 0.12 -1.46 0.00 0.00 175.22 173.69 1twc s PHE 1087N 1.69 -0.37 0.00 10.12 5.36 -0.82 -1.86 117.98 132.10 1twc s PHE 1087Ca 0.52 0.86 0.00 0.00 -0.96 0.00 0.00 56.93 57.35 1twc s PHE 1087Cb -0.22 0.09 0.00 0.00 -0.34 0.00 0.00 43.02 42.56 1twc s PHE 1087CO 0.23 -0.23 0.00 0.41 -1.46 0.00 0.00 175.22 174.16 1twc n GLY 1088N 3.98 0.98 3.79 13.12 0.00 -0.96 -4.87 105.19 121.23 1twc n GLY 1088Ca -0.23 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.61 1twc n GLY 1088CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1twc s PRO 1089N -2.00 4.17 0.03 1.61 0.02 -1.26 -0.05 135.00 137.52 1twc s PRO 1089Ca 0.00 1.42 -0.09 0.00 0.02 0.00 0.00 61.00 62.35 1twc s PRO 1089Cb 0.00 -2.46 0.00 0.00 0.02 0.00 0.00 34.50 32.06 1twc s PRO 1089CO 0.00 -0.12 0.19 0.99 -0.33 0.00 0.00 177.00 177.73 1twc s THR 1090N -1.76 0.10 -0.16 0.99 2.01 -0.34 -4.40 115.64 112.08 1twc s THR 1090Ca 0.59 -0.84 -0.20 0.00 0.31 0.00 0.00 61.69 61.55 1twc s THR 1090Cb -0.19 -0.82 -0.03 0.00 0.01 0.00 0.00 72.50 71.46 1twc s THR 1090CO 0.24 -0.47 0.55 -0.47 -0.69 0.00 0.00 174.62 173.79 1twc s TYR 1091N -2.31 3.44 0.01 4.92 5.04 -1.26 -2.16 117.35 125.02 1twc s TYR 1091Ca -0.07 0.90 0.08 0.00 -2.44 0.00 0.00 57.07 55.54 1twc s TYR 1091Cb -0.02 -2.68 -0.02 0.00 0.35 0.00 0.00 41.96 39.58 1twc s TYR 1091CO -0.03 -0.01 -0.24 0.71 -1.34 0.00 0.00 175.55 174.65 1twc s TYR 1092N 1.28 2.11 -0.02 4.97 1.51 -1.04 -4.18 117.35 121.99 1twc s TYR 1092Ca 0.27 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.97 1twc s TYR 1092Cb -0.16 -1.32 -0.03 0.00 -0.11 0.00 0.00 41.96 40.34 1twc s TYR 1092CO 0.11 0.02 -0.09 -0.65 -1.11 0.00 0.00 175.55 173.84 1twc s GLN 1093N -0.81 2.56 -0.21 -0.62 -0.21 0.12 -2.03 119.66 118.46 1twc s GLN 1093Ca 0.09 -0.69 -0.10 0.00 0.02 0.00 0.00 55.36 54.68 1twc s GLN 1093Cb -0.09 -2.49 -0.05 0.00 1.00 0.00 0.00 33.01 31.38 1twc s GLN 1093CO 0.00 0.62 0.13 0.50 -2.12 0.00 0.00 175.29 174.42 1twc s ARG 1094N -1.18 4.13 0.22 2.91 3.52 -1.26 -1.19 118.95 126.10 1twc s ARG 1094Ca 0.15 -0.25 0.05 0.00 -0.13 0.00 0.00 55.73 55.55 1twc s ARG 1094Cb -0.11 -3.42 -0.03 0.00 -1.56 0.00 0.00 34.95 29.83 1twc s ARG 1094CO 0.05 0.24 0.32 -0.51 -0.81 0.00 0.00 175.30 174.59 1twc s LEU 1095N 0.54 4.26 0.65 -0.88 1.43 -0.26 -1.52 118.68 122.89 1twc s LEU 1095Ca 0.07 0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 53.11 1twc s LEU 1095Cb -0.12 -2.80 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 1twc s LEU 1095CO -0.00 -0.04 1.05 0.00 0.23 0.00 0.00 176.35 177.59 1twc s ARG 1096N -3.81 3.37 0.00 1.70 1.70 -0.43 -4.57 118.95 116.92 1twc s ARG 1096Ca 0.34 0.66 0.00 0.00 -0.47 0.00 0.00 55.73 56.26 1twc s ARG 1096Cb -0.09 -2.06 0.00 0.00 -0.57 0.00 0.00 34.95 32.22 1twc s ARG 1096CO 0.28 -0.71 0.00 1.58 -1.08 0.00 0.00 175.30 175.37 1twc n HIS 1097N -2.83 0.00 -4.38 5.89 -0.00 -1.26 -4.93 115.22 107.71 1twc n HIS 1097Ca 0.06 0.00 -0.19 0.00 0.46 0.00 0.00 57.72 58.05 1twc n HIS 1097Cb 0.55 -0.59 -0.10 0.00 -0.12 0.00 0.00 29.99 29.73 1twc n HIS 1097CO 0.00 0.00 0.00 -1.64 0.46 0.00 0.00 176.34 175.16 1twc s MET 1098N -0.41 1.45 0.63 1.57 -1.94 -1.26 -4.61 119.30 114.72 1twc s MET 1098Ca 0.00 -1.73 0.19 0.00 -1.71 0.00 0.00 55.69 52.44 1twc s MET 1098Cb 0.00 -0.91 0.80 0.00 2.01 0.00 0.00 34.83 36.73 1twc s MET 1098CO 0.00 -0.02 1.37 0.28 -0.01 0.00 0.00 175.02 176.63 1twc h VAL 1099N 2.37 0.05 0.15 -6.03 2.07 -1.88 -2.35 116.25 110.64 1twc h VAL 1099Ca -0.39 0.00 -0.36 0.00 0.82 0.00 0.00 66.70 66.77 1twc h VAL 1099Cb 1.23 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1twc h VAL 1099CO 0.66 0.00 -1.87 0.44 0.02 0.00 0.00 177.57 176.82 1twc h ASP 1100N 0.00 0.51 -0.08 0.57 5.19 -1.96 -3.24 116.42 117.41 1twc h ASP 1100Ca 0.25 -0.95 0.02 0.00 -0.62 0.00 0.00 57.03 55.73 1twc h ASP 1100Cb 2.13 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 41.48 1twc h ASP 1100CO -0.00 1.82 0.23 0.44 -3.12 0.00 0.00 179.24 178.61 1twc h ASP 1101N 0.07 0.00 0.00 6.45 5.19 -1.78 -3.41 116.42 122.95 1twc h ASP 1101Ca -0.39 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.02 1twc h ASP 1101Cb 2.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.56 1twc h ASP 1101CO 0.13 0.00 -0.60 0.29 -3.12 0.00 0.00 179.24 175.94 1twc n LYS 1102N -3.22 0.00 -1.65 3.56 5.02 -1.25 -4.95 118.16 115.67 1twc n LYS 1102Ca -0.01 0.00 -0.60 0.00 -2.02 0.00 0.00 58.31 55.68 1twc n LYS 1102Cb 0.31 -0.49 -0.08 0.00 -0.02 0.00 0.00 35.03 34.75 1twc n LYS 1102CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1twc n ILE 1103N -3.18 0.18 -4.09 -0.18 5.41 -1.22 -5.01 119.36 111.27 1twc n ILE 1103Ca 0.00 -0.05 -0.14 0.00 1.00 0.00 0.00 62.75 63.55 1twc n ILE 1103Cb 0.30 -0.98 -0.04 0.00 -0.71 0.00 0.00 39.64 38.21 1twc n ILE 1103CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 1twc n HIS 1104N 5.60 -1.11 -2.65 1.39 8.25 -1.26 -4.94 115.22 120.49 1twc n HIS 1104Ca 0.32 -2.21 -0.03 0.00 -0.26 0.00 0.00 57.72 55.54 1twc n HIS 1104Cb 0.07 0.41 0.11 0.00 1.12 0.00 0.00 29.99 31.69 1twc n HIS 1104CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1twc n ALA 1105N -0.98 -3.55 -2.76 -1.41 0.00 -1.26 -5.15 120.51 105.41 1twc n ALA 1105Ca -0.11 -0.24 -0.43 0.00 0.00 0.00 0.00 53.44 52.65 1twc n ALA 1105Cb 0.52 -3.39 -0.02 0.00 0.00 0.00 0.00 19.45 16.56 1twc n ALA 1105CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1twc s ARG 1106N 0.02 3.73 -0.27 0.00 0.52 -1.26 -4.94 118.95 116.75 1twc s ARG 1106Ca 0.22 -1.72 0.12 0.00 -0.52 0.00 0.00 55.73 53.83 1twc s ARG 1106Cb 0.27 -5.17 0.71 0.00 0.52 0.00 0.00 34.95 31.28 1twc s ARG 1106CO -0.17 -1.98 1.69 0.00 0.02 0.00 0.00 175.30 174.86 1twc n ALA 1107N 7.41 4.03 0.00 2.13 0.00 -1.26 -5.11 120.51 127.71 1twc n ALA 1107Ca 0.32 -2.28 0.00 0.00 0.00 0.00 0.00 53.44 51.49 1twc n ALA 1107Cb 0.48 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1twc n ALA 1107CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1twc n ARG 1108N -0.08 0.00 0.00 0.00 0.63 -1.26 -5.16 116.66 110.79 1twc n ARG 1108Ca 0.33 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.26 1twc n ARG 1108Cb 1.21 0.00 0.00 0.00 0.45 0.00 0.00 32.46 34.12 1twc n ARG 1108CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1twc n GLY 1109N 0.00 -0.19 0.31 5.14 0.00 -1.26 -5.34 105.19 103.85 1twc n GLY 1109Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 1twc n GLY 1109CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1twc h PRO 1110N 0.00 0.75 0.00 1.61 0.11 -2.09 -3.58 132.00 128.80 1twc h PRO 1110Ca 0.00 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1twc h PRO 1110Cb 0.00 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 30.97 1twc h PRO 1110CO 0.00 0.62 0.00 0.41 -0.21 0.00 0.00 178.00 178.82 1twc n GLY 1127N -1.11 0.00 0.00 -0.55 0.00 -1.26 -5.28 105.19 97.00 1twc n GLY 1127Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1twc n GLY 1127CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1twc n LEU 1128N 0.00 0.00 0.00 0.99 7.94 -1.26 -5.16 117.00 119.51 1twc n LEU 1128Ca 0.00 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.80 1twc n LEU 1128Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 1twc n LEU 1128CO 0.00 0.00 -0.05 -2.11 -1.11 0.00 0.00 177.39 174.12 1twc n ARG 1129N 0.00 0.30 -3.12 1.96 1.85 -1.26 -5.09 116.66 111.31 1twc n ARG 1129Ca 0.00 -1.55 -0.18 0.00 -1.00 0.00 0.00 57.85 55.12 1twc n ARG 1129Cb 0.00 1.18 -0.05 0.00 -1.05 0.00 0.00 32.46 32.54 1twc n ARG 1129CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 1twc n PHE 1130N -0.32 -2.04 -2.17 2.89 7.35 -1.26 -5.01 117.46 116.90 1twc n PHE 1130Ca 0.02 -2.57 -0.02 0.00 -0.76 0.00 0.00 57.45 54.13 1twc n PHE 1130Cb 0.28 0.71 0.01 0.00 0.35 0.00 0.00 39.48 40.83 1twc n PHE 1130CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1twc n GLY 1131N 2.69 0.60 0.31 7.13 0.00 -1.26 -4.87 105.19 109.80 1twc n GLY 1131Ca 0.24 -1.94 0.14 0.00 0.00 0.00 0.00 46.02 44.46 1twc n GLY 1131CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1twc h GLU 1132N 0.00 0.24 0.00 1.61 5.08 -2.00 -0.56 114.58 118.95 1twc h GLU 1132Ca -0.03 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.15 1twc h GLU 1132Cb 0.10 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1twc h GLU 1132CO 0.03 0.16 -0.78 0.52 -1.00 0.00 0.00 179.01 177.94 1twc h MET 1133N 0.25 0.00 -0.03 2.33 2.86 -2.00 -1.73 114.93 116.60 1twc h MET 1133Ca 0.57 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 58.09 1twc h MET 1133Cb 1.16 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.81 1twc h MET 1133CO -0.63 0.78 -0.53 0.93 1.06 0.00 0.00 176.91 178.52 1twc h GLU 1134N 0.00 0.09 -0.10 1.72 3.07 -1.60 -1.71 114.58 116.06 1twc h GLU 1134Ca -0.01 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 58.77 1twc h GLU 1134Cb 1.46 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.37 1twc h GLU 1134CO 0.10 0.60 -0.05 -0.09 -1.40 0.00 0.00 179.01 178.17 1twc h ARG 1135N 0.07 0.20 -0.98 2.33 2.43 -0.32 -1.88 114.38 116.23 1twc h ARG 1135Ca -0.00 -0.09 0.15 0.00 -0.81 0.00 0.00 59.98 59.23 1twc h ARG 1135Cb 0.95 -0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.41 1twc h ARG 1135CO 0.07 0.57 0.62 -0.44 -1.51 0.00 0.00 179.97 179.28 1twc h ASP 1136N -0.17 0.81 -0.47 -3.80 3.32 -1.23 -0.45 116.42 114.44 1twc h ASP 1136Ca 0.02 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1twc h ASP 1136Cb 0.52 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1twc h ASP 1136CO 0.02 0.37 0.20 0.00 -1.72 0.00 0.00 179.24 178.11 1twc h MET 1138N 0.61 0.20 -0.53 0.00 2.86 -0.66 -2.38 114.93 115.02 1twc h MET 1138Ca 0.16 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 1twc h MET 1138Cb 0.16 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 1twc h MET 1138CO -0.02 0.46 0.11 0.82 1.06 0.00 0.00 176.91 179.35 1twc h ILE 1139N 0.18 1.25 -0.87 -1.22 2.04 -0.63 -1.84 117.51 116.42 1twc h ILE 1139Ca 0.03 -0.91 0.03 0.00 1.00 0.00 0.00 64.86 65.01 1twc h ILE 1139Cb 0.57 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 1twc h ILE 1139CO 0.04 0.33 0.57 0.00 0.00 0.00 0.00 178.15 179.09 1twc h ALA 1140N 1.00 1.45 0.00 1.87 0.00 -0.74 -1.75 119.26 121.09 1twc h ALA 1140Ca 0.17 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1twc h ALA 1140Cb 0.37 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1twc h ALA 1140CO 0.01 0.47 -0.00 0.45 0.00 0.00 0.00 179.25 180.17 1twc h HIS 1141N 1.10 0.00 0.00 0.00 3.86 -1.05 -3.47 115.15 115.58 1twc h HIS 1141Ca 0.34 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.55 1twc h HIS 1141Cb 0.01 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.48 1twc h HIS 1141CO -0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1twc n GLY 1142N 0.55 1.05 3.19 2.45 0.00 -0.66 -4.98 105.19 106.79 1twc n GLY 1142Ca 0.02 -0.46 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 1twc n GLY 1142CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1twc n ALA 1143N -0.86 4.58 0.10 4.61 0.00 -1.01 -4.75 120.51 123.18 1twc n ALA 1143Ca 0.00 -4.33 -0.05 0.00 0.00 0.00 0.00 53.44 49.06 1twc n ALA 1143Cb 0.16 -2.95 0.08 0.00 0.00 0.00 0.00 19.45 16.75 1twc n ALA 1143CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1twc h ALA 1144N 6.44 0.77 -0.23 0.00 0.00 -1.94 -2.64 119.26 121.67 1twc h ALA 1144Ca 0.33 -0.63 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 1twc h ALA 1144Cb 0.76 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1twc h ALA 1144CO 1.39 0.84 -0.43 0.77 0.00 0.00 0.00 179.25 181.82 1twc h SER 1145N 0.08 0.59 -0.50 0.00 0.02 -2.00 -0.66 113.55 111.08 1twc h SER 1145Ca -0.02 -0.27 -0.06 0.00 -0.84 0.00 0.00 61.79 60.60 1twc h SER 1145Cb 1.26 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.61 1twc h SER 1145CO 0.10 0.95 0.11 0.15 -1.14 0.00 0.00 176.83 177.00 1twc h PHE 1146N 0.45 0.90 -0.34 3.45 3.57 -1.93 -1.72 116.94 121.32 1twc h PHE 1146Ca 0.03 -0.09 -0.16 0.00 3.53 0.00 0.00 57.97 61.28 1twc h PHE 1146Cb 0.94 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.41 1twc h PHE 1146CO 0.04 0.76 -0.43 -0.07 -2.23 0.00 0.00 178.31 176.38 1twc h LEU 1147N 0.83 0.95 -0.97 0.59 3.38 -0.90 -2.16 115.31 117.02 1twc h LEU 1147Ca 0.18 -0.45 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 1twc h LEU 1147Cb 0.33 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1twc h LEU 1147CO 0.00 1.24 0.07 0.50 0.09 0.00 0.00 178.44 180.35 1twc h LYS 1148N 0.71 0.82 -0.22 1.13 3.64 -0.79 -2.44 116.57 119.41 1twc h LYS 1148Ca 0.05 -0.19 -0.10 0.00 -1.27 0.00 0.00 60.65 59.14 1twc h LYS 1148Cb 1.02 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.73 1twc h LYS 1148CO 0.10 0.77 -0.25 1.49 -2.27 0.00 0.00 179.45 179.30 1twc h GLU 1149N 0.78 0.56 0.00 1.90 4.81 -0.93 -2.71 114.58 118.99 1twc h GLU 1149Ca 0.16 -0.30 -0.14 0.00 -0.13 0.00 0.00 59.36 58.95 1twc h GLU 1149Cb 0.37 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1twc h GLU 1149CO 0.01 0.90 -0.65 -0.09 -0.73 0.00 0.00 179.01 178.45 1twc h ARG 1150N 0.25 0.00 -0.22 1.92 9.65 -1.43 -3.23 114.38 121.32 1twc h ARG 1150Ca 0.03 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.91 1twc h ARG 1150Cb 0.81 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.39 1twc h ARG 1150CO 0.06 0.65 0.00 1.28 2.80 0.00 0.00 179.97 184.76 1twc n LEU 1151N -3.63 2.83 -4.52 3.80 4.77 -0.92 -5.02 117.00 114.32 1twc n LEU 1151Ca -0.01 -1.39 -0.31 0.00 -0.03 0.00 0.00 56.01 54.28 1twc n LEU 1151Cb 0.67 -0.14 0.19 0.00 -2.33 0.00 0.00 43.42 41.81 1twc n LEU 1151CO 0.42 0.60 0.35 0.80 -1.33 0.00 0.00 177.39 178.23 1twc n MET 1152N 1.01 -1.19 -1.45 3.23 1.56 -1.02 -5.02 117.12 114.24 1twc n MET 1152Ca 0.13 -0.30 -0.32 0.00 -0.27 0.00 0.00 57.70 56.94 1twc n MET 1152Cb 0.47 -2.14 0.08 0.00 2.15 0.00 0.00 33.22 33.77 1twc n MET 1152CO 0.00 0.00 0.00 -1.21 -0.73 0.00 0.00 175.97 174.03 1twc s GLU 1153N -4.25 2.45 0.21 2.12 0.41 -1.26 -4.99 118.70 113.39 1twc s GLU 1153Ca 0.64 1.27 0.16 0.00 -0.41 0.00 0.00 54.97 56.63 1twc s GLU 1153Cb -0.22 -1.91 -0.00 0.00 -1.78 0.00 0.00 34.13 30.21 1twc s GLU 1153CO 0.63 -1.51 1.25 0.00 -0.49 0.00 0.00 175.26 175.14 1twc h ALA 1154N -0.67 0.66 0.00 5.21 0.00 -1.97 -3.48 119.26 119.01 1twc h ALA 1154Ca -0.45 -0.56 -0.10 0.00 0.00 0.00 0.00 54.91 53.80 1twc h ALA 1154Cb 1.24 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1twc h ALA 1154CO 0.52 0.70 0.22 0.45 0.00 0.00 0.00 179.25 181.14 1twc n SER 1155N -3.11 0.08 -4.86 0.00 2.88 -1.26 -4.66 113.62 102.69 1twc n SER 1155Ca -0.02 0.07 -0.31 0.00 -1.33 0.00 0.00 58.87 57.29 1twc n SER 1155Cb 0.76 -0.13 0.02 0.00 -0.75 0.00 0.00 64.21 64.11 1twc n SER 1155CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 1twc s ASP 1156N 1.04 6.12 -1.18 -3.46 1.01 -1.26 -4.45 116.67 114.50 1twc s ASP 1156Ca 0.18 1.44 -0.20 0.00 0.71 0.00 0.00 52.55 54.68 1twc s ASP 1156Cb -0.21 -2.46 -0.03 0.00 1.01 0.00 0.00 42.92 41.23 1twc s ASP 1156CO 0.09 -0.94 1.92 0.00 0.21 0.00 0.00 175.17 176.44 1twc n ALA 1157N -2.80 3.23 -1.24 5.23 0.00 -1.26 -2.99 120.51 120.69 1twc n ALA 1157Ca 0.06 -3.47 -0.45 0.00 0.00 0.00 0.00 53.44 49.58 1twc n ALA 1157Cb 0.54 -3.56 -0.04 0.00 0.00 0.00 0.00 19.45 16.39 1twc n ALA 1157CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1twc n PHE 1158N 9.89 -0.00 -4.23 0.00 7.35 -1.09 -4.71 117.46 124.66 1twc n PHE 1158Ca 0.48 0.86 -0.24 0.00 -0.76 0.00 0.00 57.45 57.80 1twc n PHE 1158Cb 0.44 -1.73 -0.07 0.00 0.35 0.00 0.00 39.48 38.47 1twc n PHE 1158CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1twc s ARG 1159N -0.49 2.45 -0.25 -4.13 3.00 -1.26 -1.77 118.95 116.50 1twc s ARG 1159Ca 0.65 -1.26 -0.22 0.00 -1.00 0.00 0.00 55.73 53.90 1twc s ARG 1159Cb -0.92 -2.30 0.07 0.00 0.00 0.00 0.00 34.95 31.80 1twc s ARG 1159CO 0.48 0.40 0.66 0.08 0.00 0.00 0.00 175.30 176.92 1twc s VAL 1160N -2.13 -0.00 0.36 7.11 1.01 -1.02 -5.00 120.40 120.73 1twc s VAL 1160Ca 0.31 0.00 -0.03 0.00 0.00 0.00 0.00 61.98 62.26 1twc s VAL 1160Cb -0.07 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1twc s VAL 1160CO 0.21 0.00 0.61 -1.00 0.00 0.00 0.00 175.10 174.92 1twc s HIS 1161N 0.56 3.51 -0.09 5.22 0.09 -1.26 -1.87 115.29 121.45 1twc s HIS 1161Ca -0.02 0.58 -0.04 0.00 -0.00 0.00 0.00 55.06 55.59 1twc s HIS 1161Cb -0.05 -2.08 0.05 0.00 -0.00 0.00 0.00 32.58 30.50 1twc s HIS 1161CO -0.02 0.04 0.17 0.42 -0.00 0.00 0.00 174.74 175.35 1twc s ILE 1162N -2.34 -0.25 0.37 0.60 1.09 -0.86 -4.24 121.20 115.56 1twc s ILE 1162Ca 0.43 0.32 -0.28 0.00 -1.10 0.00 0.00 60.65 60.02 1twc s ILE 1162Cb -0.10 -0.31 -0.11 0.00 -1.06 0.00 0.00 42.46 40.88 1twc s ILE 1162CO 0.36 0.13 1.50 0.00 -0.10 0.00 0.00 174.94 176.83 1twc n GLY 1164N 0.58 -0.17 0.33 0.00 0.00 -1.14 -2.83 105.19 101.95 1twc n GLY 1164Ca 0.01 -0.31 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 1twc n GLY 1164CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1twc n ILE 1165N -0.07 1.27 -2.08 -0.61 5.41 -1.26 -4.72 119.36 117.30 1twc n ILE 1165Ca 0.15 -0.10 -0.33 0.00 1.00 0.00 0.00 62.75 63.47 1twc n ILE 1165Cb 0.24 -1.94 0.03 0.00 -0.71 0.00 0.00 39.64 37.26 1twc n ILE 1165CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1twc n GLY 1167N -0.57 0.00 3.31 0.00 0.00 -1.13 -4.64 105.19 102.16 1twc n GLY 1167Ca 0.48 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.33 1twc n GLY 1167CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1twc s LEU 1168N 0.00 2.55 -1.20 0.99 1.43 -1.26 0.02 118.68 121.21 1twc s LEU 1168Ca 0.00 -1.02 -0.06 0.00 -1.03 0.00 0.00 54.13 52.02 1twc s LEU 1168Cb 0.00 -0.56 0.22 0.00 0.03 0.00 0.00 46.19 45.88 1twc s LEU 1168CO 0.00 -0.23 1.86 0.23 0.23 0.00 0.00 176.35 178.44 1twc n MET 1169N -0.32 4.32 0.00 1.70 2.81 -1.26 -3.05 117.12 121.32 1twc n MET 1169Ca -0.09 -3.98 0.09 0.00 -1.81 0.00 0.00 57.70 51.91 1twc n MET 1169Cb 0.60 -2.68 -0.01 0.00 -0.71 0.00 0.00 33.22 30.42 1twc n MET 1169CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1twc n THR 1170N 1.95 0.00 -2.31 2.03 -2.24 -1.26 -5.01 114.28 107.43 1twc n THR 1170Ca 0.41 -0.29 -0.42 0.00 -2.27 0.00 0.00 64.05 61.48 1twc n THR 1170Cb 0.32 1.18 -0.03 0.00 -2.10 0.00 0.00 70.33 69.70 1twc n THR 1170CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1twc s VAL 1171N -2.11 3.92 -0.35 2.28 1.01 -1.26 -4.74 120.40 119.14 1twc s VAL 1171Ca 0.13 1.27 -0.20 0.00 0.00 0.00 0.00 61.98 63.18 1twc s VAL 1171Cb 0.14 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1twc s VAL 1171CO 0.48 -0.01 0.63 -0.63 0.00 0.00 0.00 175.10 175.57 1twc s ILE 1172N 2.41 4.90 -0.62 2.22 1.01 -0.72 -4.74 121.20 125.66 1twc s ILE 1172Ca 0.61 0.57 -0.02 0.00 0.00 0.00 0.00 60.65 61.81 1twc s ILE 1172Cb -0.29 -4.07 0.16 0.00 0.01 0.00 0.00 42.46 38.27 1twc s ILE 1172CO 0.24 -0.31 0.42 0.00 0.00 0.00 0.00 174.94 175.30 1twc s ALA 1173N 2.69 3.56 -0.92 9.38 0.00 -1.25 -0.26 121.76 134.95 1twc s ALA 1173Ca 0.24 -3.29 -0.23 0.00 0.00 0.00 0.00 51.96 48.68 1twc s ALA 1173Cb -0.15 -2.60 0.06 0.00 0.00 0.00 0.00 23.12 20.44 1twc s ALA 1173CO 0.15 -2.10 1.31 0.15 0.00 0.00 0.00 175.76 175.26 1twc s LYS 1174N -0.14 3.48 -0.14 0.00 1.02 0.50 -4.91 119.74 119.56 1twc s LYS 1174Ca 0.17 -1.07 -0.26 0.00 0.02 0.00 0.00 55.97 54.83 1twc s LYS 1174Cb -0.21 -4.96 -0.26 0.00 -0.52 0.00 0.00 37.83 31.89 1twc s LYS 1174CO -0.03 -2.07 0.68 -0.07 -0.92 0.00 0.00 175.35 172.94 1twc h LEU 1175N 12.22 0.09 -0.75 3.17 3.38 -1.94 0.39 115.31 131.87 1twc h LEU 1175Ca 0.06 -0.90 0.12 0.00 0.09 0.00 0.00 57.88 57.24 1twc h LEU 1175Cb 1.03 -0.03 -0.13 0.00 0.09 0.00 0.00 40.66 41.62 1twc h LEU 1175CO 1.31 1.18 -0.39 0.78 0.09 0.00 0.00 178.44 181.41 1twc h ASN 1176N -0.87 -1.40 -0.29 -0.43 2.35 -1.98 -2.60 115.58 110.37 1twc h ASN 1176Ca -0.10 0.27 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 1twc h ASN 1176Cb 1.19 0.69 0.00 0.00 0.05 0.00 0.00 38.32 40.25 1twc h ASN 1176CO -0.01 -0.30 0.00 1.41 -1.65 0.00 0.00 177.43 176.88 1twc n HIS 1177N -5.43 0.41 -2.78 1.19 8.25 -1.25 -4.99 115.22 110.62 1twc n HIS 1177Ca 0.05 -0.20 -0.19 0.00 -0.26 0.00 0.00 57.72 57.13 1twc n HIS 1177Cb 0.36 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.46 1twc n HIS 1177CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1twc n ASN 1178N 0.35 -4.74 -4.47 0.41 3.02 0.88 -5.00 115.26 105.70 1twc n ASN 1178Ca 0.10 -0.09 -0.35 0.00 -0.03 0.00 0.00 54.58 54.21 1twc n ASN 1178Cb 0.27 -3.93 -0.12 0.00 -0.61 0.00 0.00 39.78 35.38 1twc n ASN 1178CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1twc s GLN 1179N -5.42 3.68 -0.19 3.52 -0.21 0.99 -4.99 119.66 117.05 1twc s GLN 1179Ca 0.16 -0.48 0.00 0.00 0.02 0.00 0.00 55.36 55.06 1twc s GLN 1179Cb -0.08 -3.17 0.05 0.00 1.00 0.00 0.00 33.01 30.81 1twc s GLN 1179CO 0.20 -0.00 -0.07 -0.06 -2.12 0.00 0.00 175.29 173.24 1twc s PHE 1180N 1.07 2.05 -0.06 0.91 2.99 -1.24 0.19 117.98 123.90 1twc s PHE 1180Ca 0.03 -1.38 0.03 0.00 0.00 0.00 0.00 56.93 55.61 1twc s PHE 1180Cb -0.14 -1.47 0.01 0.00 0.00 0.00 0.00 43.02 41.42 1twc s PHE 1180CO 0.02 -0.69 -0.15 -2.00 -0.00 0.00 0.00 175.22 172.40 1twc s GLU 1181N 1.51 1.88 -1.00 0.44 2.12 0.64 -4.32 118.70 119.97 1twc s GLU 1181Ca -0.01 -0.52 -0.23 0.00 0.36 0.00 0.00 54.97 54.57 1twc s GLU 1181Cb -0.16 -1.55 0.06 0.00 0.26 0.00 0.00 34.13 32.74 1twc s GLU 1181CO -0.08 0.11 1.41 0.00 -0.54 0.00 0.00 175.26 176.16 1twc n LYS 1183N 8.71 0.44 0.00 0.00 0.00 -1.26 -0.49 118.16 125.56 1twc n LYS 1183Ca 0.31 0.14 0.00 0.00 0.00 0.00 0.00 58.31 58.76 1twc n LYS 1183Cb 0.51 -1.81 0.00 0.00 0.00 0.00 0.00 35.03 33.73 1twc n LYS 1183CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1twc n GLY 1184N 5.80 2.00 0.00 3.14 0.00 -1.26 -4.62 105.19 110.26 1twc n GLY 1184Ca 0.41 -0.56 0.11 0.00 0.00 0.00 0.00 46.02 45.98 1twc n GLY 1184CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1twc n ASP 1186N -1.51 -3.84 -3.74 0.00 2.03 0.35 -4.98 116.55 104.86 1twc n ASP 1186Ca 0.05 -0.33 -0.12 0.00 0.52 0.00 0.00 54.79 54.90 1twc n ASP 1186Cb 0.34 -3.17 -0.13 0.00 -0.72 0.00 0.00 41.12 37.43 1twc n ASP 1186CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1twc s ASN 1187N -3.36 -0.27 0.00 1.67 2.47 -1.08 -4.98 114.94 109.39 1twc s ASN 1187Ca 0.25 0.52 0.00 0.00 0.42 0.00 0.00 52.86 54.05 1twc s ASN 1187Cb -0.11 0.43 0.00 0.00 -1.45 0.00 0.00 41.25 40.12 1twc s ASN 1187CO 0.43 -0.15 0.00 0.29 -3.72 0.00 0.00 177.10 173.95 1twc n LYS 1188N 3.99 3.12 0.00 0.43 5.02 -1.26 0.82 118.16 130.28 1twc n LYS 1188Ca -0.23 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 1twc n LYS 1188Cb 0.54 -0.59 0.00 0.00 -0.02 0.00 0.00 35.03 34.96 1twc n LYS 1188CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1twc n ILE 1189N -0.72 0.00 -1.54 -0.18 -0.00 -1.26 -4.79 119.36 110.87 1twc n ILE 1189Ca 0.00 0.43 -0.32 0.00 -0.00 0.00 0.00 62.75 62.86 1twc n ILE 1189Cb 0.00 -0.87 -0.07 0.00 -0.00 0.00 0.00 39.64 38.70 1twc n ILE 1189CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1twc n ASP 1190N -0.62 1.70 -3.69 4.38 -0.08 -1.26 -4.92 116.55 112.06 1twc n ASP 1190Ca 0.00 -0.58 -0.13 0.00 -1.51 0.00 0.00 54.79 52.57 1twc n ASP 1190Cb 0.00 -1.44 -0.07 0.00 2.34 0.00 0.00 41.12 41.95 1twc n ASP 1190CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1twc s ILE 1191N 11.61 0.05 0.22 5.18 1.01 -1.26 -2.89 121.20 135.13 1twc s ILE 1191Ca 1.05 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 61.27 1twc s ILE 1191Cb -0.38 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.21 1twc s ILE 1191CO 0.28 -0.24 0.14 -0.31 0.00 0.00 0.00 174.94 174.81 1twc s TYR 1192N -1.93 1.28 0.13 3.97 1.51 -1.08 -4.91 117.35 116.32 1twc s TYR 1192Ca -0.09 -1.38 0.11 0.00 -1.01 0.00 0.00 57.07 54.70 1twc s TYR 1192Cb -0.02 -0.63 -0.04 0.00 -0.11 0.00 0.00 41.96 41.16 1twc s TYR 1192CO 0.01 -0.62 -0.27 -1.14 -1.11 0.00 0.00 175.55 172.42 1twc s GLN 1193N -4.06 1.42 0.04 -0.62 0.74 -1.26 -2.03 119.66 113.88 1twc s GLN 1193Ca 0.39 -1.34 -0.04 0.00 0.05 0.00 0.00 55.36 54.42 1twc s GLN 1193Cb 0.07 -1.91 -0.02 0.00 1.10 0.00 0.00 33.01 32.25 1twc s GLN 1193CO 0.14 0.45 0.05 0.96 -0.55 0.00 0.00 175.29 176.34 1twc s ILE 1194N -1.05 0.15 -0.15 -2.34 -4.36 -0.78 -4.98 121.20 107.68 1twc s ILE 1194Ca 0.14 -1.22 -0.04 0.00 -0.26 0.00 0.00 60.65 59.27 1twc s ILE 1194Cb -0.10 -0.93 -0.03 0.00 1.25 0.00 0.00 42.46 42.65 1twc s ILE 1194CO 0.06 -0.67 -0.00 -1.00 0.24 0.00 0.00 174.94 173.57 1twc s HIS 1195N -2.73 3.12 0.02 1.37 3.76 -1.26 -2.44 115.29 117.12 1twc s HIS 1195Ca -0.04 -0.10 0.00 0.00 -0.15 0.00 0.00 55.06 54.78 1twc s HIS 1195Cb -0.01 -1.96 -0.02 0.00 1.11 0.00 0.00 32.58 31.71 1twc s HIS 1195CO -0.05 0.12 -0.02 0.96 -0.85 0.00 0.00 174.74 174.89 1twc s ILE 1196N 0.13 0.09 0.41 0.60 -4.36 -0.73 -5.01 121.20 112.34 1twc s ILE 1196Ca 0.01 -0.74 -0.24 0.00 -0.26 0.00 0.00 60.65 59.42 1twc s ILE 1196Cb -0.13 -0.21 -0.11 0.00 1.25 0.00 0.00 42.46 43.26 1twc s ILE 1196CO 0.02 -0.40 1.00 -2.65 0.24 0.00 0.00 174.94 173.14 1twc n PRO 1197N 1.88 1.33 -0.36 0.37 -0.02 -1.26 -2.66 135.00 134.27 1twc n PRO 1197Ca -0.22 0.48 -0.01 0.00 -2.02 0.00 0.00 63.50 61.72 1twc n PRO 1197Cb 0.56 -2.01 0.12 0.00 -0.02 0.00 0.00 33.50 32.15 1twc n PRO 1197CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1twc h TYR 1198N 1.55 1.21 -0.84 6.00 3.20 -1.75 0.42 116.97 126.76 1twc h TYR 1198Ca -0.44 0.03 0.13 0.00 3.14 0.00 0.00 58.73 61.59 1twc h TYR 1198Cb 1.34 -0.41 -0.06 0.00 1.54 0.00 0.00 36.73 39.14 1twc h TYR 1198CO 0.44 0.73 0.55 0.00 -1.64 0.00 0.00 178.16 178.24 1twc h ALA 1199N 1.38 1.86 -0.05 1.82 0.00 -1.89 0.70 119.26 123.08 1twc h ALA 1199Ca 0.37 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.23 1twc h ALA 1199Cb -0.09 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1twc h ALA 1199CO -0.10 -0.07 -0.20 0.00 0.00 0.00 0.00 179.25 178.88 1twc h ALA 1200N 1.61 0.09 -0.48 0.00 0.00 -0.53 0.14 119.26 120.10 1twc h ALA 1200Ca 0.41 -0.40 0.10 0.00 0.00 0.00 0.00 54.91 55.02 1twc h ALA 1200Cb 0.65 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.35 1twc h ALA 1200CO -0.17 0.06 -0.13 -0.22 0.00 0.00 0.00 179.25 178.79 1twc h LYS 1201N -0.32 -0.02 0.26 0.00 3.11 -0.53 -1.60 116.57 117.48 1twc h LYS 1201Ca -0.01 0.00 0.01 0.00 -2.81 0.00 0.00 60.65 57.84 1twc h LYS 1201Cb 0.85 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.05 1twc h LYS 1201CO 0.04 -0.01 -0.39 -0.07 -2.81 0.00 0.00 179.45 176.21 1twc h LEU 1202N -0.02 -1.11 -0.98 5.20 3.38 0.42 -2.21 115.31 120.00 1twc h LEU 1202Ca 0.23 0.11 0.27 0.00 0.09 0.00 0.00 57.88 58.58 1twc h LEU 1202Cb 0.37 0.39 -0.18 0.00 0.09 0.00 0.00 40.66 41.33 1twc h LEU 1202CO -0.50 -0.51 0.04 -0.11 0.09 0.00 0.00 178.44 177.45 1twc n LEU 1203N -5.47 -0.10 -0.02 1.67 7.94 0.50 0.28 117.00 121.79 1twc n LEU 1203Ca -0.09 1.66 -0.17 0.00 -1.11 0.00 0.00 56.01 56.30 1twc n LEU 1203Cb 0.38 -0.61 -0.07 0.00 0.53 0.00 0.00 43.42 43.65 1twc n LEU 1203CO 0.24 -1.68 0.28 -0.26 -1.11 0.00 0.00 177.39 174.85 1twc h PHE 1204N 0.00 1.05 -0.32 1.96 0.05 -1.17 -1.04 116.94 117.47 1twc h PHE 1204Ca 0.60 -0.46 -0.10 0.00 3.82 0.00 0.00 57.97 61.83 1twc h PHE 1204Cb 1.25 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 39.02 1twc h PHE 1204CO -0.48 1.29 -0.20 1.96 -0.18 0.00 0.00 178.31 180.70 1twc h GLN 1205N 0.50 0.60 -0.82 1.51 4.20 -0.43 -1.86 115.11 118.81 1twc h GLN 1205Ca -0.05 -0.22 0.12 0.00 0.06 0.00 0.00 58.65 58.56 1twc h GLN 1205Cb 1.38 -0.04 -0.08 0.00 0.30 0.00 0.00 27.48 29.04 1twc h GLN 1205CO 0.16 0.76 0.43 0.93 -0.67 0.00 0.00 178.83 180.44 1twc h GLU 1206N 0.53 0.66 -0.43 1.46 5.08 0.17 -1.65 114.58 120.40 1twc h GLU 1206Ca 0.08 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.26 1twc h GLU 1206Cb 0.65 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1twc h GLU 1206CO 0.05 0.43 -0.28 -0.07 -1.00 0.00 0.00 179.01 178.14 1twc h LEU 1207N 0.68 0.97 -0.84 1.33 3.38 -0.62 -2.80 115.31 117.41 1twc h LEU 1207Ca 0.42 -0.39 0.12 0.00 0.09 0.00 0.00 57.88 58.12 1twc h LEU 1207Cb 0.50 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 40.90 1twc h LEU 1207CO -0.31 1.18 0.46 0.24 0.09 0.00 0.00 178.44 180.11 1twc h MET 1208N 0.79 0.70 -0.98 1.13 2.86 -0.79 -0.06 114.93 118.58 1twc h MET 1208Ca 0.09 -0.04 0.19 0.00 -2.06 0.00 0.00 59.70 57.88 1twc h MET 1208Cb 0.85 -0.16 -0.09 0.00 0.06 0.00 0.00 31.60 32.26 1twc h MET 1208CO 0.08 0.46 0.61 0.00 1.06 0.00 0.00 176.91 179.12 1twc h ALA 1209N 1.51 1.83 -0.49 6.32 0.00 -1.05 0.32 119.26 127.71 1twc h ALA 1209Ca 0.43 0.06 -0.21 0.00 0.00 0.00 0.00 54.91 55.19 1twc h ALA 1209Cb 0.51 -0.07 -0.13 0.00 0.00 0.00 0.00 17.79 18.10 1twc h ALA 1209CO -0.30 -0.18 0.27 -1.33 0.00 0.00 0.00 179.25 177.71 1twc n MET 1210N -4.68 2.08 -0.97 0.00 2.00 -1.06 -4.93 117.12 109.56 1twc n MET 1210Ca 0.22 -1.69 0.00 0.00 0.00 0.00 0.00 57.70 56.23 1twc n MET 1210Cb 0.61 -1.73 0.00 0.00 0.00 0.00 0.00 33.22 32.10 1twc n MET 1210CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1twc n ASN 1211N -0.21 -5.56 -4.70 7.83 2.85 0.11 -4.97 115.26 110.61 1twc n ASN 1211Ca 0.29 0.00 -0.39 0.00 -0.11 0.00 0.00 54.58 54.37 1twc n ASN 1211Cb 1.06 -3.32 -0.06 0.00 1.24 0.00 0.00 39.78 38.70 1twc n ASN 1211CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1twc s ILE 1212N -1.05 5.12 -0.51 -1.44 1.01 -0.06 -4.99 121.20 119.28 1twc s ILE 1212Ca 0.00 1.10 -0.20 0.00 0.00 0.00 0.00 60.65 61.55 1twc s ILE 1212Cb 0.00 -3.89 0.05 0.00 0.01 0.00 0.00 42.46 38.63 1twc s ILE 1212CO 0.00 0.25 0.70 0.42 0.00 0.00 0.00 174.94 176.31 1twc s THR 1213N 1.04 4.75 -0.79 2.92 -4.23 -1.26 -2.09 115.64 115.98 1twc s THR 1213Ca 0.29 -0.27 -0.18 0.00 -1.18 0.00 0.00 61.69 60.34 1twc s THR 1213Cb -0.16 -4.35 0.14 0.00 1.34 0.00 0.00 72.50 69.47 1twc s THR 1213CO 0.12 -0.87 0.90 -2.16 -0.54 0.00 0.00 174.62 172.07 1twc s PRO 1214N 2.96 3.41 -0.20 3.99 0.04 -1.26 -5.03 135.00 138.91 1twc s PRO 1214Ca 0.19 -1.75 -0.17 0.00 0.04 0.00 0.00 61.00 59.30 1twc s PRO 1214Cb -0.17 -4.56 -0.04 0.00 0.04 0.00 0.00 34.50 29.77 1twc s PRO 1214CO 0.14 -1.59 0.46 1.03 0.04 0.00 0.00 177.00 177.09 1twc s ARG 1215N 2.14 4.18 -0.35 4.56 0.52 -1.26 -4.83 118.95 123.90 1twc s ARG 1215Ca 0.22 0.32 -0.14 0.00 -0.52 0.00 0.00 55.73 55.60 1twc s ARG 1215Cb -0.12 -3.55 -0.01 0.00 0.52 0.00 0.00 34.95 31.78 1twc s ARG 1215CO -0.04 -0.10 0.31 -0.51 0.02 0.00 0.00 175.30 174.98 1twc s LEU 1216N 1.50 4.58 -0.02 2.53 1.43 0.10 -4.86 118.68 123.95 1twc s LEU 1216Ca 0.22 -0.42 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 1twc s LEU 1216Cb -0.15 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.80 1twc s LEU 1216CO 0.09 -0.32 0.14 -0.31 0.23 0.00 0.00 176.35 176.18 1twc s TYR 1217N 1.86 3.46 -0.24 0.29 1.51 -1.26 -4.16 117.35 118.81 1twc s TYR 1217Ca 0.08 0.32 0.18 0.00 -1.01 0.00 0.00 57.07 56.65 1twc s TYR 1217Cb -0.17 -1.81 0.09 0.00 -0.11 0.00 0.00 41.96 39.96 1twc s TYR 1217CO 0.11 0.62 1.33 1.79 -1.11 0.00 0.00 175.55 178.30 1twc h THR 1218N 3.09 0.47 -3.25 -0.71 1.35 -1.95 -3.46 112.91 108.43 1twc h THR 1218Ca -0.50 -1.70 -0.66 0.00 -0.55 0.00 0.00 66.41 63.00 1twc h THR 1218Cb 1.19 2.13 -0.15 0.00 -1.73 0.00 0.00 68.15 69.59 1twc h THR 1218CO 0.65 0.27 -0.61 1.51 -0.25 0.00 0.00 175.52 177.09 1twc s ASP 1219N -6.14 5.35 0.00 5.36 3.84 -1.26 -5.09 116.67 118.72 1twc s ASP 1219Ca 0.03 0.13 0.00 0.00 -0.00 0.00 0.00 52.55 52.71 1twc s ASP 1219Cb 0.07 -1.64 0.00 0.00 -1.38 0.00 0.00 42.92 39.97 1twc s ASP 1219CO 0.74 0.32 0.04 -1.14 -0.00 0.00 0.00 175.17 175.13 1twc n ARG 1220N 2.53 0.00 -0.25 2.11 0.63 -1.26 -4.60 116.66 115.82 1twc n ARG 1220Ca -0.18 0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.77 1twc n ARG 1220Cb 0.53 -0.56 0.00 0.00 0.45 0.00 0.00 32.46 32.88 1twc n ARG 1220CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1twc n SER 1221N -0.58 3.28 -0.10 6.15 3.41 -1.26 -4.94 113.62 119.59 1twc n SER 1221Ca 0.00 -1.82 0.00 0.00 -0.26 0.00 0.00 58.87 56.79 1twc n SER 1221Cb 0.00 -0.67 -0.00 0.00 -0.26 0.00 0.00 64.21 63.28 1twc n SER 1221CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1twc n ARG 1222N 1.37 -0.06 0.00 4.33 3.00 -1.26 -3.46 116.66 120.58 1twc n ARG 1222Ca 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 57.85 57.88 1twc n ARG 1222Cb 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 32.46 32.74 1twc n ARG 1222CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1twc n ASP 1223N 0.22 0.00 0.00 0.55 8.00 -1.26 -5.13 116.55 118.93 1twc n ASP 1223Ca 0.00 0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.71 1twc n ASP 1223Cb 0.01 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 1twc n ASP 1223CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30