#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c1g n ALA 3 N 0.00 2.09 -2.74 0.55 0.00 -1.26 -5.00 120.51 114.15 3c1g n ALA 3 Ca 0.00 0.38 -0.30 0.00 0.00 0.00 0.00 53.44 53.53 3c1g n ALA 3 Cb 0.00 -2.40 -0.16 0.00 0.00 0.00 0.00 19.45 16.88 3c1g n ALA 3 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3c1g s VAL 4 N -0.03 1.85 0.23 0.00 1.01 -1.26 -4.76 120.40 117.44 3c1g s VAL 4 Ca 0.65 -0.96 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 3c1g s VAL 4 Cb -0.54 -1.56 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 3c1g s VAL 4 CO 0.49 0.52 1.15 0.00 0.00 0.00 0.00 175.10 177.26 3c1g s ALA 5 N -0.15 3.42 -0.36 5.51 0.00 -1.26 -4.82 121.76 124.10 3c1g s ALA 5 Ca -0.02 0.93 -0.14 0.00 0.00 0.00 0.00 51.96 52.73 3c1g s ALA 5 Cb -0.12 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 3c1g s ALA 5 CO 0.03 -0.28 0.27 0.34 0.00 0.00 0.00 175.76 176.12 3c1g s ASP 6 N -0.32 6.09 0.53 0.00 -1.08 0.49 -4.98 116.67 117.40 3c1g s ASP 6 Ca 0.49 -0.50 0.20 0.00 -0.52 0.00 0.00 52.55 52.21 3c1g s ASP 6 Cb -0.32 -2.15 1.34 0.00 -1.46 0.00 0.00 42.92 40.33 3c1g s ASP 6 CO 0.39 -0.30 2.11 0.11 0.52 0.00 0.00 175.17 178.00 3c1g h LYS 7 N 8.52 0.00 -0.63 4.34 1.57 -1.95 0.65 116.57 129.07 3c1g h LYS 7 Ca -0.30 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.43 3c1g h LYS 7 Cb 1.15 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.43 3c1g h LYS 7 CO 0.66 0.00 0.19 0.00 -0.57 0.00 0.00 179.45 179.73 3c1g h ALA 8 N 1.92 1.15 0.00 3.86 0.00 -1.94 -0.40 119.26 123.85 3c1g h ALA 8 Ca 0.07 -0.20 -0.23 0.00 0.00 0.00 0.00 54.91 54.55 3c1g h ALA 8 Cb 0.30 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 17.86 3c1g h ALA 8 CO -0.00 0.59 -0.89 -0.44 0.00 0.00 0.00 179.25 178.51 3c1g h ASP 9 N 0.92 0.78 -0.13 0.00 3.32 -1.25 -1.41 116.42 118.65 3c1g h ASP 9 Ca 0.20 -0.75 0.05 0.00 0.02 0.00 0.00 57.03 56.55 3c1g h ASP 9 Cb 0.28 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.53 3c1g h ASP 9 CO -0.01 1.43 -0.30 0.78 -1.72 0.00 0.00 179.24 179.42 3c1g h ASN 10 N 0.21 -0.93 -0.26 6.45 2.35 -0.95 0.45 115.58 122.90 3c1g h ASN 10 Ca -0.11 0.14 0.04 0.00 -0.55 0.00 0.00 56.30 55.82 3c1g h ASN 10 Cb 1.57 0.40 -0.04 0.00 0.05 0.00 0.00 38.32 40.29 3c1g h ASN 10 CO 0.18 -0.34 0.02 0.00 -1.65 0.00 0.00 177.43 175.63 3c1g h ALA 11 N 0.48 0.25 -0.32 -0.83 0.00 -1.05 0.11 119.26 117.89 3c1g h ALA 11 Ca 0.10 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3c1g h ALA 11 Cb 0.52 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3c1g h ALA 11 CO -0.34 -0.40 0.20 0.35 0.00 0.00 0.00 179.25 179.06 3c1g h PHE 12 N 0.10 0.37 -0.28 0.00 3.57 -0.50 -1.63 116.94 118.57 3c1g h PHE 12 Ca 0.12 0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.48 3c1g h PHE 12 Cb 0.15 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 3c1g h PHE 12 CO -0.19 0.23 -0.44 0.52 -2.23 0.00 0.00 178.31 176.20 3c1g h MET 13 N 0.41 0.72 -0.01 1.11 2.86 0.50 0.18 114.93 120.69 3c1g h MET 13 Ca 0.12 -0.39 -0.00 0.00 -2.06 0.00 0.00 59.70 57.37 3c1g h MET 13 Cb -0.02 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 3c1g h MET 13 CO -0.05 1.01 0.01 0.52 1.06 0.00 0.00 176.91 179.46 3c1g h MET 14 N 0.58 0.02 -0.87 1.72 2.86 -0.64 0.17 114.93 118.77 3c1g h MET 14 Ca 0.04 -0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 3c1g h MET 14 Cb 0.99 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.60 3c1g h MET 14 CO 0.09 0.19 0.58 0.82 1.06 0.00 0.00 176.91 179.64 3c1g h ILE 15 N -0.15 1.16 -0.57 -1.22 1.08 -1.10 -1.18 117.51 115.52 3c1g h ILE 15 Ca 0.00 -0.38 -0.08 0.00 -0.39 0.00 0.00 64.86 64.02 3c1g h ILE 15 Cb 0.17 -0.04 -0.02 0.00 -3.07 0.00 0.00 36.82 33.86 3c1g h ILE 15 CO -0.00 0.20 0.05 0.00 -0.69 0.00 0.00 178.15 177.71 3c1g h THR 17 N 0.88 1.26 -0.23 0.00 2.02 0.40 -0.96 112.91 116.28 3c1g h THR 17 Ca 0.17 -0.84 -0.00 0.00 0.77 0.00 0.00 66.41 66.50 3c1g h THR 17 Cb 0.45 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 3c1g h THR 17 CO 0.02 0.34 0.13 0.00 0.37 0.00 0.00 175.52 176.38 3c1g h ALA 18 N 1.16 0.29 -0.53 6.16 0.00 -0.89 -0.09 119.26 125.38 3c1g h ALA 18 Ca 0.26 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.19 3c1g h ALA 18 Cb 0.24 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 3c1g h ALA 18 CO -0.02 -0.18 0.18 -0.07 0.00 0.00 0.00 179.25 179.16 3c1g h LEU 19 N 0.26 0.16 -0.29 0.00 3.38 -1.12 0.13 115.31 117.83 3c1g h LEU 19 Ca 0.08 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3c1g h LEU 19 Cb 0.06 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3c1g h LEU 19 CO -0.01 0.11 0.12 0.58 0.09 0.00 0.00 178.44 179.33 3c1g h VAL 20 N 0.35 1.18 -0.60 1.22 2.07 -0.81 -1.84 116.25 117.81 3c1g h VAL 20 Ca 0.26 -0.54 0.12 0.00 0.82 0.00 0.00 66.70 67.36 3c1g h VAL 20 Cb 0.30 0.99 -0.09 0.00 -1.52 0.00 0.00 31.29 30.96 3c1g h VAL 20 CO -0.27 0.18 0.08 -0.07 0.02 0.00 0.00 177.57 177.51 3c1g h LEU 21 N 0.32 -0.11 -1.61 2.57 3.38 -0.49 -0.53 115.31 118.85 3c1g h LEU 21 Ca 0.10 0.13 0.06 0.00 0.09 0.00 0.00 57.88 58.26 3c1g h LEU 21 Cb 0.18 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3c1g h LEU 21 CO -0.01 -0.04 0.35 0.15 0.09 0.00 0.00 178.44 178.98 3c1g h PHE 22 N 0.20 0.48 -1.00 1.13 3.57 -0.02 0.43 116.94 121.73 3c1g h PHE 22 Ca 0.32 0.01 0.24 0.00 3.53 0.00 0.00 57.97 62.07 3c1g h PHE 22 Cb 0.49 -0.16 -0.09 0.00 2.79 0.00 0.00 35.95 38.98 3c1g h PHE 22 CO -0.29 0.26 0.64 0.52 -2.23 0.00 0.00 178.31 177.21 3c1g h MET 23 N 0.48 0.45 0.06 1.11 2.86 -0.31 -2.65 114.93 116.93 3c1g h MET 23 Ca 0.23 -0.03 -0.37 0.00 -2.06 0.00 0.00 59.70 57.48 3c1g h MET 23 Cb 0.30 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 3c1g h MET 23 CO -0.06 0.30 -2.11 2.41 1.06 0.00 0.00 176.91 178.51 3c1g n THR 24 N -4.63 1.64 -3.82 2.22 -1.04 -0.02 -0.49 114.28 108.13 3c1g n THR 24 Ca 0.24 -0.53 -0.35 0.00 -2.04 0.00 0.00 64.05 61.37 3c1g n THR 24 Cb 0.78 -1.69 -0.12 0.00 -1.82 0.00 0.00 70.33 67.49 3c1g n THR 24 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3c1g s ILE 25 N -2.52 3.13 -0.91 12.58 -1.09 -0.25 -3.27 121.20 128.88 3c1g s ILE 25 Ca -0.29 -2.20 0.15 0.00 -2.23 0.00 0.00 60.65 56.08 3c1g s ILE 25 Cb 0.08 -3.16 0.47 0.00 -1.58 0.00 0.00 42.46 38.26 3c1g s ILE 25 CO 0.67 -0.69 1.39 -0.81 -1.23 0.00 0.00 174.94 174.27 3c1g n PRO 26 N 4.42 3.04 -0.01 2.79 -0.04 -1.16 -4.16 135.00 139.88 3c1g n PRO 26 Ca -0.00 -2.44 -0.09 0.00 -0.04 0.00 0.00 63.50 60.92 3c1g n PRO 26 Cb 0.41 -1.54 -0.06 0.00 -0.04 0.00 0.00 33.50 32.27 3c1g n PRO 26 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3c1g h GLY 27 N 2.60 -1.29 1.56 0.55 0.00 -1.38 0.32 103.07 105.43 3c1g h GLY 27 Ca 0.00 0.69 -0.11 0.00 0.00 0.00 0.00 47.33 47.91 3c1g h GLY 27 CO 0.09 -0.35 -0.31 1.19 0.00 0.00 0.00 176.54 177.16 3c1g h ILE 28 N -0.35 1.28 -0.46 2.60 6.09 -0.91 -0.52 117.51 125.24 3c1g h ILE 28 Ca 0.02 -1.39 0.02 0.00 -1.37 0.00 0.00 64.86 62.14 3c1g h ILE 28 Cb 0.41 1.44 -0.03 0.00 0.47 0.00 0.00 36.82 39.11 3c1g h ILE 28 CO -0.28 0.44 0.27 0.00 -3.07 0.00 0.00 178.15 175.51 3c1g h ALA 29 N 1.24 0.59 -0.08 0.18 0.00 -1.45 -1.83 119.26 117.90 3c1g h ALA 29 Ca 0.05 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 3c1g h ALA 29 Cb 0.76 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3c1g h ALA 29 CO 0.06 -0.05 -0.70 -0.07 0.00 0.00 0.00 179.25 178.49 3c1g h LEU 30 N 0.54 0.45 0.44 0.00 3.38 -0.15 0.18 115.31 120.13 3c1g h LEU 30 Ca 0.19 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3c1g h LEU 30 Cb 0.03 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3c1g h LEU 30 CO -0.09 1.01 -0.29 0.15 0.09 0.00 0.00 178.44 179.30 3c1g h PHE 31 N 0.26 -0.78 -0.26 1.13 3.57 -0.76 -2.26 116.94 117.84 3c1g h PHE 31 Ca -0.02 -0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.36 3c1g h PHE 31 Cb 1.26 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 40.27 3c1g h PHE 31 CO 0.04 -0.44 -0.32 1.88 -2.23 0.00 0.00 178.31 177.24 3c1g h TYR 32 N -0.71 0.64 -0.96 0.41 0.05 -1.37 -3.09 116.97 111.95 3c1g h TYR 32 Ca -0.05 -0.16 0.20 0.00 0.05 0.00 0.00 58.73 58.77 3c1g h TYR 32 Cb 0.59 -0.15 -0.11 0.00 1.01 0.00 0.00 36.73 38.07 3c1g h TYR 32 CO -0.12 0.81 0.54 0.78 -1.05 0.00 0.00 178.16 179.13 3c1g h GLY 33 N 1.04 1.70 1.93 3.88 0.00 -0.57 0.36 103.07 111.40 3c1g h GLY 33 Ca 0.06 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3c1g h GLY 33 CO 0.06 -0.13 -0.05 0.61 0.00 0.00 0.00 176.54 177.03 3c1g n GLY 34 N -1.32 -1.69 0.13 4.60 0.00 -0.88 -4.18 105.19 101.84 3c1g n GLY 34 Ca 0.23 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 46.03 3c1g n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3c1g n LEU 35 N -2.26 2.36 -4.87 0.99 4.77 0.11 -1.63 117.00 116.45 3c1g n LEU 35 Ca 0.05 0.03 -0.30 0.00 -0.03 0.00 0.00 56.01 55.76 3c1g n LEU 35 Cb 0.43 -0.73 -0.02 0.00 -2.33 0.00 0.00 43.42 40.78 3c1g n LEU 35 CO 0.31 0.82 0.56 0.27 -1.33 0.00 0.00 177.39 178.02 3c1g s ILE 36 N -2.53 4.73 0.24 -0.08 -4.36 -0.10 -3.41 121.20 115.69 3c1g s ILE 36 Ca -0.26 0.74 -0.29 0.00 -0.26 0.00 0.00 60.65 60.58 3c1g s ILE 36 Cb 0.08 -3.79 -0.15 0.00 1.25 0.00 0.00 42.46 39.85 3c1g s ILE 36 CO 0.70 -0.78 0.95 -1.14 0.24 0.00 0.00 174.94 174.91 3c1g n ARG 37 N -1.90 1.03 -0.05 0.37 3.00 -1.26 -4.65 116.66 113.20 3c1g n ARG 37 Ca 0.04 0.36 0.16 0.00 -0.00 0.00 0.00 57.85 58.41 3c1g n ARG 37 Cb 0.54 -1.69 0.59 0.00 0.00 0.00 0.00 32.46 31.91 3c1g n ARG 37 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 3c1g h GLY 38 N 2.11 0.32 1.81 5.14 0.00 -1.91 -1.24 103.07 109.29 3c1g h GLY 38 Ca -0.38 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3c1g h GLY 38 CO 0.62 0.04 0.00 0.58 0.00 0.00 0.00 176.54 177.78 3c1g n LYS 39 N -4.43 0.12 0.00 4.80 2.85 -1.26 -3.18 118.16 117.05 3c1g n LYS 39 Ca 0.10 0.16 0.03 0.00 -1.05 0.00 0.00 58.31 57.56 3c1g n LYS 39 Cb 0.50 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 33.37 3c1g n LYS 39 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3c1g n ASN 40 N -1.40 0.87 0.07 -5.58 3.02 -0.47 -4.74 115.26 107.02 3c1g n ASN 40 Ca 0.06 -0.94 -0.13 0.00 -0.03 0.00 0.00 54.58 53.55 3c1g n ASN 40 Cb 0.18 0.58 -0.08 0.00 -0.61 0.00 0.00 39.78 39.85 3c1g n ASN 40 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3c1g h VAL 41 N 0.63 0.99 -0.59 2.41 2.07 -1.57 -1.24 116.25 118.96 3c1g h VAL 41 Ca 0.00 -0.29 0.07 0.00 0.82 0.00 0.00 66.70 67.29 3c1g h VAL 41 Cb 0.23 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 3c1g h VAL 41 CO 0.00 0.07 0.28 -0.07 0.02 0.00 0.00 177.57 177.87 3c1g h LEU 42 N -0.25 0.36 -0.49 2.57 3.38 -1.85 0.40 115.31 119.43 3c1g h LEU 42 Ca -0.01 0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 3c1g h LEU 42 Cb 0.21 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3c1g h LEU 42 CO 0.02 0.23 -0.30 -1.28 0.09 0.00 0.00 178.44 177.21 3c1g h SER 43 N 0.51 0.96 -0.07 -0.43 0.87 -1.87 -0.45 113.55 113.08 3c1g h SER 43 Ca 0.28 -0.40 -0.01 0.00 -1.23 0.00 0.00 61.79 60.43 3c1g h SER 43 Cb 0.24 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 3c1g h SER 43 CO -0.22 1.18 0.02 -0.03 -0.53 0.00 0.00 176.83 177.25 3c1g h MET 44 N 0.77 0.10 -0.71 2.24 1.85 -0.36 0.08 114.93 118.90 3c1g h MET 44 Ca 0.08 -0.02 0.07 0.00 -0.61 0.00 0.00 59.70 59.22 3c1g h MET 44 Cb 0.87 -0.02 -0.06 0.00 0.43 0.00 0.00 31.60 32.83 3c1g h MET 44 CO 0.08 0.26 0.40 -0.07 -0.40 0.00 0.00 176.91 177.18 3c1g h LEU 45 N -0.08 0.58 -0.43 3.39 3.38 -0.12 -1.32 115.31 120.71 3c1g h LEU 45 Ca 0.02 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3c1g h LEU 45 Cb 0.20 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3c1g h LEU 45 CO -0.00 0.37 0.29 0.74 0.09 0.00 0.00 178.44 179.92 3c1g h THR 46 N 0.72 1.11 -0.02 0.22 2.02 -0.85 -2.42 112.91 113.70 3c1g h THR 46 Ca 0.32 -0.21 -0.07 0.00 0.77 0.00 0.00 66.41 67.22 3c1g h THR 46 Cb 0.22 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 3c1g h THR 46 CO -0.20 0.11 -0.34 1.56 0.37 0.00 0.00 175.52 177.03 3c1g h GLN 47 N 0.59 0.03 -0.09 6.66 4.20 -0.44 -1.86 115.11 124.19 3c1g h GLN 47 Ca 0.16 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 3c1g h GLN 47 Cb -0.06 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.71 3c1g h GLN 47 CO -0.03 0.37 -0.11 0.28 -0.67 0.00 0.00 178.83 178.66 3c1g h VAL 48 N 0.03 1.37 -0.56 -0.54 2.07 -1.15 -2.26 116.25 115.22 3c1g h VAL 48 Ca 0.00 -1.31 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 3c1g h VAL 48 Cb 0.61 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.38 3c1g h VAL 48 CO 0.04 0.37 0.27 0.74 0.02 0.00 0.00 177.57 179.01 3c1g h THR 49 N -0.18 1.21 -0.11 2.57 2.02 -1.33 0.19 112.91 117.27 3c1g h THR 49 Ca 0.01 -0.58 -0.18 0.00 0.77 0.00 0.00 66.41 66.43 3c1g h THR 49 Cb 0.65 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 67.60 3c1g h THR 49 CO 0.03 0.23 -0.67 0.58 0.37 0.00 0.00 175.52 176.06 3c1g h VAL 50 N 0.76 1.35 0.01 3.16 2.07 -1.42 -1.70 116.25 120.48 3c1g h VAL 50 Ca 0.19 -2.02 -0.21 0.00 0.82 0.00 0.00 66.70 65.49 3c1g h VAL 50 Cb 0.12 2.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 3c1g h VAL 50 CO -0.02 0.61 -0.98 0.71 0.02 0.00 0.00 177.57 177.91 3c1g h THR 51 N 0.33 1.68 0.49 2.57 1.35 -1.25 -1.52 112.91 116.55 3c1g h THR 51 Ca -0.02 -3.27 -0.01 0.00 -0.55 0.00 0.00 66.41 62.55 3c1g h THR 51 Cb 1.24 2.79 -0.02 0.00 -1.73 0.00 0.00 68.15 70.42 3c1g h THR 51 CO 0.12 0.94 -0.51 0.15 -0.25 0.00 0.00 175.52 175.96 3c1g h PHE 52 N 0.01 -1.43 -0.79 4.73 3.57 -0.56 0.13 116.94 122.60 3c1g h PHE 52 Ca -0.02 0.01 0.17 0.00 3.53 0.00 0.00 57.97 61.66 3c1g h PHE 52 Cb 1.72 0.56 -0.15 0.00 2.79 0.00 0.00 35.95 40.87 3c1g h PHE 52 CO 0.01 -0.68 -0.15 0.00 -2.23 0.00 0.00 178.31 175.26 3c1g h ALA 53 N -0.89 0.60 -0.55 2.41 0.00 -1.28 0.15 119.26 119.70 3c1g h ALA 53 Ca -0.06 0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3c1g h ALA 53 Cb 0.88 0.56 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 3c1g h ALA 53 CO -0.07 -0.42 0.31 1.25 0.00 0.00 0.00 179.25 180.32 3c1g h LEU 54 N 0.02 0.68 -0.80 0.00 5.85 -0.98 -1.55 115.31 118.53 3c1g h LEU 54 Ca 0.39 -0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.96 3c1g h LEU 54 Cb 0.63 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 3c1g h LEU 54 CO -0.79 0.56 0.07 0.58 -0.34 0.00 0.00 178.44 178.53 3c1g h VAL 55 N 0.74 1.25 -0.35 1.05 2.07 0.75 -0.15 116.25 121.61 3c1g h VAL 55 Ca 0.19 -1.01 0.04 0.00 0.82 0.00 0.00 66.70 66.74 3c1g h VAL 55 Cb 0.03 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 3c1g h VAL 55 CO -0.03 0.37 0.12 0.00 0.02 0.00 0.00 177.57 178.05 3c1g h ILE 57 N 0.27 1.31 -0.88 0.00 1.08 -0.77 -2.47 117.51 116.05 3c1g h ILE 57 Ca 0.16 -0.99 0.15 0.00 -0.39 0.00 0.00 64.86 63.79 3c1g h ILE 57 Cb 0.13 1.87 -0.07 0.00 -3.07 0.00 0.00 36.82 35.68 3c1g h ILE 57 CO -0.16 0.27 0.57 -0.07 -0.69 0.00 0.00 178.15 178.07 3c1g h LEU 58 N -0.26 0.61 0.11 1.44 3.38 -1.06 -1.00 115.31 118.53 3c1g h LEU 58 Ca 0.01 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3c1g h LEU 58 Cb 0.44 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3c1g h LEU 58 CO 0.01 0.30 -0.05 -0.25 0.09 0.00 0.00 178.44 178.54 3c1g h TRP 59 N 0.64 -0.13 0.00 1.13 2.91 -1.27 0.11 115.95 119.34 3c1g h TRP 59 Ca 0.45 -0.00 -0.06 0.00 1.13 0.00 0.00 58.89 60.40 3c1g h TRP 59 Cb 0.77 0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 29.46 3c1g h TRP 59 CO -0.00 0.14 -0.29 -0.24 -1.03 0.00 0.00 178.44 177.01 3c1g h VAL 60 N -0.41 1.12 -0.01 2.65 3.04 -1.08 -1.10 116.25 120.46 3c1g h VAL 60 Ca -0.01 -1.03 -0.09 0.00 -1.01 0.00 0.00 66.70 64.55 3c1g h VAL 60 Cb 0.33 1.57 0.01 0.00 -2.01 0.00 0.00 31.29 31.19 3c1g h VAL 60 CO 0.02 0.29 -0.33 0.58 -1.01 0.00 0.00 177.57 177.12 3c1g h VAL 61 N 0.00 1.50 0.00 1.51 2.07 -0.96 -2.29 116.25 118.07 3c1g h VAL 61 Ca -0.00 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.60 3c1g h VAL 61 Cb 0.55 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.96 3c1g h VAL 61 CO 0.04 0.54 0.00 0.00 0.02 0.00 0.00 177.57 178.16 3c1g n TYR 62 N -4.44 0.00 -0.02 1.57 0.18 -0.41 -1.78 117.16 112.26 3c1g n TYR 62 Ca -0.10 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.59 3c1g n TYR 62 Cb 0.53 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.46 3c1g n TYR 62 CO 0.00 0.00 0.00 0.78 -2.08 0.00 0.00 176.86 175.56 3c1g h GLY 63 N 0.00 0.11 0.76 -7.48 0.00 -0.20 -0.87 103.07 95.39 3c1g h GLY 63 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 3c1g h GLY 63 CO 0.00 -0.07 0.01 -1.82 0.00 0.00 0.00 176.54 174.66 3c1g h TYR 64 N -0.02 0.13 -1.00 5.60 3.20 -1.49 -1.33 116.97 122.06 3c1g h TYR 64 Ca 0.08 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.98 3c1g h TYR 64 Cb 0.14 -0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.31 3c1g h TYR 64 CO -0.20 0.36 0.65 1.03 -1.64 0.00 0.00 178.16 178.36 3c1g h SER 65 N -0.14 1.07 1.26 -2.11 0.87 -1.75 0.51 113.55 113.27 3c1g h SER 65 Ca 0.02 -0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.48 3c1g h SER 65 Cb 0.31 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3c1g h SER 65 CO 0.00 0.72 -0.46 0.25 -0.53 0.00 0.00 176.83 176.81 3c1g h LEU 66 N 1.24 0.00 0.17 2.23 5.85 -0.94 0.17 115.31 124.02 3c1g h LEU 66 Ca 0.41 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.80 3c1g h LEU 66 Cb 0.05 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.09 3c1g h LEU 66 CO -0.14 0.46 -1.67 0.00 -0.34 0.00 0.00 178.44 176.75 3c1g h ALA 67 N 1.54 0.17 -0.01 1.25 0.00 -0.77 0.53 119.26 121.97 3c1g h ALA 67 Ca -0.00 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.77 3c1g h ALA 67 Cb 1.22 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.48 3c1g h ALA 67 CO 0.06 0.98 0.00 1.19 0.00 0.00 0.00 179.25 181.48 3c1g n PHE 68 N -3.68 0.01 -2.05 0.00 3.72 0.18 -3.86 117.46 111.77 3c1g n PHE 68 Ca -0.25 -0.16 -0.28 0.00 -0.05 0.00 0.00 57.45 56.71 3c1g n PHE 68 Cb 1.03 -0.02 0.07 0.00 -0.94 0.00 0.00 39.48 39.62 3c1g n PHE 68 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3c1g s GLY 69 N -0.37 1.63 0.02 1.37 0.00 0.59 -4.97 107.32 105.58 3c1g s GLY 69 Ca 0.01 -0.67 -0.33 0.00 0.00 0.00 0.00 44.72 43.73 3c1g s GLY 69 CO 0.01 -0.26 1.80 -2.21 0.00 0.00 0.00 173.10 172.44 3c1g n GLU 70 N -3.04 2.31 0.00 2.90 4.07 -1.26 -4.28 120.64 121.33 3c1g n GLU 70 Ca 0.07 0.84 0.00 0.00 -0.06 0.00 0.00 57.16 58.01 3c1g n GLU 70 Cb 0.60 -2.68 0.00 0.00 -0.06 0.00 0.00 31.44 29.29 3c1g n GLU 70 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3c1g n GLY 71 N 4.13 4.43 0.00 8.31 0.00 -1.26 -3.09 105.19 117.70 3c1g n GLY 71 Ca 0.20 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3c1g n GLY 71 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3c1g n ASN 72 N 0.00 1.09 0.23 1.61 0.23 0.03 -4.97 115.26 113.49 3c1g n ASN 72 Ca 0.00 -0.31 0.16 0.00 -0.53 0.00 0.00 54.58 53.90 3c1g n ASN 72 Cb 0.00 0.00 0.79 0.00 -2.08 0.00 0.00 39.78 38.49 3c1g n ASN 72 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 3c1g h ASN 73 N 0.00 0.00 0.00 0.53 2.35 -1.94 -3.35 115.58 113.17 3c1g h ASN 73 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 3c1g h ASN 73 Cb 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.37 3c1g h ASN 73 CO 0.00 0.00 -1.02 0.49 -1.65 0.00 0.00 177.43 175.25 3c1g n PHE 74 N -2.64 0.00 -3.85 1.19 3.72 -1.26 -0.47 117.46 114.14 3c1g n PHE 74 Ca -0.01 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.30 3c1g n PHE 74 Cb 0.12 -0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 38.57 3c1g n PHE 74 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 176.76 176.12 3c1g s PHE 75 N -2.01 0.12 0.00 1.38 -0.12 -1.26 -4.19 117.98 111.90 3c1g s PHE 75 Ca -0.00 -0.48 0.00 0.00 -0.05 0.00 0.00 56.93 56.40 3c1g s PHE 75 Cb 0.00 -0.05 0.00 0.00 -0.63 0.00 0.00 43.02 42.34 3c1g s PHE 75 CO 0.01 -0.51 0.00 0.41 -0.05 0.00 0.00 175.22 175.08 3c1g n GLY 76 N 0.18 0.82 3.27 1.99 0.00 0.18 -0.79 105.19 110.85 3c1g n GLY 76 Ca -0.16 -0.01 -0.17 0.00 0.00 0.00 0.00 46.02 45.68 3c1g n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c1g s ASN 77 N -1.01 1.22 -0.55 1.61 2.20 -1.05 -4.21 114.94 113.15 3c1g s ASN 77 Ca 0.00 -1.64 0.02 0.00 -0.94 0.00 0.00 52.86 50.30 3c1g s ASN 77 Cb 0.00 0.51 0.42 0.00 -2.00 0.00 0.00 41.25 40.18 3c1g s ASN 77 CO 0.00 -1.01 1.55 2.30 -2.94 0.00 0.00 177.10 177.00 3c1g n ILE 78 N -0.52 2.98 0.11 0.54 -6.64 -1.26 -2.71 119.36 111.86 3c1g n ILE 78 Ca 0.06 -4.17 0.04 0.00 -1.77 0.00 0.00 62.75 56.91 3c1g n ILE 78 Cb 0.63 -1.21 0.07 0.00 -1.44 0.00 0.00 39.64 37.69 3c1g n ILE 78 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 3c1g n ASN 79 N -0.65 2.13 -2.33 7.28 5.03 -1.26 -4.40 115.26 121.06 3c1g n ASN 79 Ca 0.49 -1.65 -0.25 0.00 0.87 0.00 0.00 54.58 54.04 3c1g n ASN 79 Cb 0.63 -0.08 0.01 0.00 -1.02 0.00 0.00 39.78 39.32 3c1g n ASN 79 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 3c1g n TRP 80 N 0.32 3.10 -2.09 3.10 8.01 -1.26 -4.57 117.44 124.05 3c1g n TRP 80 Ca 0.06 -2.78 -0.42 0.00 -1.31 0.00 0.00 57.50 53.05 3c1g n TRP 80 Cb 0.28 -0.18 -0.03 0.00 -2.01 0.00 0.00 31.31 29.37 3c1g n TRP 80 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.69 175.51 3c1g s LEU 81 N -3.56 4.32 -1.54 -0.99 2.96 -1.26 -2.13 118.68 116.49 3c1g s LEU 81 Ca 0.48 2.22 0.00 0.00 -0.22 0.00 0.00 54.13 56.61 3c1g s LEU 81 Cb 0.40 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.54 3c1g s LEU 81 CO -0.10 -0.84 0.00 0.23 -1.32 0.00 0.00 176.35 174.32 3c1g n MET 82 N 6.15 -1.87 -1.88 1.98 2.81 -0.73 -1.53 117.12 122.05 3c1g n MET 82 Ca 0.15 0.87 -0.18 0.00 -1.81 0.00 0.00 57.70 56.73 3c1g n MET 82 Cb 0.43 -5.51 -0.05 0.00 -0.71 0.00 0.00 33.22 27.38 3c1g n MET 82 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3c1g n LEU 83 N -2.92 -1.54 -4.67 4.03 4.77 -0.91 -4.98 117.00 110.78 3c1g n LEU 83 Ca -0.21 0.25 -0.39 0.00 -0.03 0.00 0.00 56.01 55.64 3c1g n LEU 83 Cb 0.66 -2.60 0.04 0.00 -2.33 0.00 0.00 43.42 39.20 3c1g n LEU 83 CO 0.25 -0.63 0.74 2.29 -1.33 0.00 0.00 177.39 178.70 3c1g n LYS 84 N -2.59 1.27 -1.30 3.23 2.85 -0.58 -2.28 118.16 118.75 3c1g n LYS 84 Ca -0.20 0.48 -0.10 0.00 -1.05 0.00 0.00 58.31 57.43 3c1g n LYS 84 Cb 0.63 -2.32 -0.04 0.00 -0.65 0.00 0.00 35.03 32.64 3c1g n LYS 84 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3c1g n ASN 85 N -0.74 -5.47 -4.21 -5.58 3.02 -1.26 -4.23 115.26 96.78 3c1g n ASN 85 Ca 0.12 0.26 -0.41 0.00 -0.03 0.00 0.00 54.58 54.52 3c1g n ASN 85 Cb 0.45 -3.89 -0.08 0.00 -0.61 0.00 0.00 39.78 35.65 3c1g n ASN 85 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3c1g s ILE 86 N -1.98 4.24 0.31 2.41 1.01 -0.97 -5.05 121.20 121.17 3c1g s ILE 86 Ca 0.00 -1.86 -0.27 0.00 0.00 0.00 0.00 60.65 58.52 3c1g s ILE 86 Cb 0.00 -3.79 -0.14 0.00 0.01 0.00 0.00 42.46 38.54 3c1g s ILE 86 CO 0.00 -0.79 0.94 -0.62 0.00 0.00 0.00 174.94 174.46 3c1g n GLU 87 N 4.82 1.19 0.03 2.79 -0.58 -1.26 -4.86 120.64 122.77 3c1g n GLU 87 Ca -0.07 0.42 0.11 0.00 -0.42 0.00 0.00 57.16 57.20 3c1g n GLU 87 Cb 0.41 -1.77 0.55 0.00 -0.57 0.00 0.00 31.44 30.05 3c1g n GLU 87 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 3c1g h LEU 88 N 1.77 0.24 -1.30 -4.62 5.85 -1.98 -1.06 115.31 114.21 3c1g h LEU 88 Ca -0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.33 3c1g h LEU 88 Cb 1.35 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.33 3c1g h LEU 88 CO 0.59 0.16 -0.10 0.35 -0.34 0.00 0.00 178.44 179.10 3c1g n THR 89 N -4.47 0.00 -1.60 1.05 -2.24 -1.26 -4.79 114.28 100.96 3c1g n THR 89 Ca 0.05 -0.34 -0.50 0.00 -2.27 0.00 0.00 64.05 60.99 3c1g n THR 89 Cb 0.27 1.00 -0.05 0.00 -2.10 0.00 0.00 70.33 69.45 3c1g n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3c1g n ALA 90 N 0.52 -0.57 -2.81 6.98 0.00 -0.41 -4.86 120.51 119.36 3c1g n ALA 90 Ca 0.15 0.49 -0.32 0.00 0.00 0.00 0.00 53.44 53.77 3c1g n ALA 90 Cb 0.47 -2.11 -0.06 0.00 0.00 0.00 0.00 19.45 17.75 3c1g n ALA 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3c1g s VAL 91 N 0.37 4.83 -0.10 0.00 1.01 -1.26 -0.35 120.40 124.90 3c1g s VAL 91 Ca 0.81 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 3c1g s VAL 91 Cb -0.89 -3.29 0.05 0.00 0.00 0.00 0.00 36.38 32.25 3c1g s VAL 91 CO 0.47 0.21 0.10 -0.32 0.00 0.00 0.00 175.10 175.56 3c1g s MET 92 N -2.18 0.01 6.32 2.72 0.00 0.11 -4.65 119.30 121.64 3c1g s MET 92 Ca 0.28 0.26 0.00 0.00 0.00 0.00 0.00 55.69 56.24 3c1g s MET 92 Cb -0.12 -0.92 0.00 0.00 0.00 0.00 0.00 34.83 33.79 3c1g s MET 92 CO 0.21 -0.46 0.00 0.41 0.00 0.00 0.00 175.02 175.18 3c1g n GLY 93 N 5.30 1.78 0.11 2.11 0.00 -1.26 -2.32 105.19 110.90 3c1g n GLY 93 Ca -0.05 -0.15 0.03 0.00 0.00 0.00 0.00 46.02 45.85 3c1g n GLY 93 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3c1g n SER 94 N 10.23 1.32 -4.45 1.61 3.41 -1.26 -4.86 113.62 119.61 3c1g n SER 94 Ca 0.00 -2.08 -0.22 0.00 -0.26 0.00 0.00 58.87 56.31 3c1g n SER 94 Cb 0.00 -0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 63.69 3c1g n SER 94 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3c1g s ILE 95 N -1.12 1.88 0.32 -1.33 -4.36 -0.98 -0.38 121.20 115.23 3c1g s ILE 95 Ca 0.09 -2.19 -0.29 0.00 -0.26 0.00 0.00 60.65 58.00 3c1g s ILE 95 Cb 0.08 -2.42 -0.10 0.00 1.25 0.00 0.00 42.46 41.27 3c1g s ILE 95 CO 0.01 -0.33 1.24 -0.31 0.24 0.00 0.00 174.94 175.79 3c1g s TYR 96 N -2.86 3.19 0.35 1.37 2.02 -1.26 0.10 117.35 120.26 3c1g s TYR 96 Ca 0.29 1.50 0.07 0.00 -0.37 0.00 0.00 57.07 58.56 3c1g s TYR 96 Cb 0.02 -3.56 0.76 0.00 -0.40 0.00 0.00 41.96 38.78 3c1g s TYR 96 CO 0.13 -1.47 1.92 0.37 -1.57 0.00 0.00 175.55 174.92 3c1g h GLN 97 N 3.44 0.73 -1.01 -0.62 4.15 -0.95 -0.43 115.11 120.41 3c1g h GLN 97 Ca -0.48 -0.04 0.25 0.00 0.77 0.00 0.00 58.65 59.15 3c1g h GLN 97 Cb 1.22 -0.16 -0.08 0.00 0.21 0.00 0.00 27.48 28.66 3c1g h GLN 97 CO 0.66 0.48 0.66 1.88 -1.93 0.00 0.00 178.83 180.58 3c1g h TYR 98 N 0.75 0.59 -0.04 3.99 -1.99 -1.87 0.14 116.97 118.55 3c1g h TYR 98 Ca 0.38 0.02 -0.18 0.00 2.00 0.00 0.00 58.73 60.95 3c1g h TYR 98 Cb 0.46 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 39.00 3c1g h TYR 98 CO -0.00 0.08 -0.76 0.82 -0.00 0.00 0.00 178.16 178.30 3c1g h ILE 99 N 0.38 1.43 -0.71 -2.88 2.04 -1.45 -1.99 117.51 114.33 3c1g h ILE 99 Ca 0.56 -2.30 -0.05 0.00 1.00 0.00 0.00 64.86 64.07 3c1g h ILE 99 Cb 1.46 2.23 -0.03 0.00 -0.74 0.00 0.00 36.82 39.74 3c1g h ILE 99 CO -0.25 0.68 0.24 -0.74 0.00 0.00 0.00 178.15 178.08 3c1g h HIS 100 N 0.17 1.12 -0.12 1.37 2.76 -0.83 -0.65 115.15 118.97 3c1g h HIS 100 Ca -0.03 -0.10 0.02 0.00 -2.20 0.00 0.00 60.37 58.06 3c1g h HIS 100 Cb 1.34 -0.33 -0.02 0.00 1.55 0.00 0.00 27.41 29.95 3c1g h HIS 100 CO 0.03 0.88 -0.03 0.28 -1.30 0.00 0.00 177.93 177.79 3c1g h VAL 101 N 1.03 0.88 0.04 5.26 2.07 -0.54 -2.19 116.25 122.80 3c1g h VAL 101 Ca 0.23 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.75 3c1g h VAL 101 Cb 0.27 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 3c1g h VAL 101 CO -0.01 0.00 -0.02 0.00 0.02 0.00 0.00 177.57 177.56 3c1g h ALA 102 N 1.11 -0.06 0.16 1.67 0.00 -1.21 -1.22 119.26 119.71 3c1g h ALA 102 Ca 0.06 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.77 3c1g h ALA 102 Cb 0.09 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3c1g h ALA 102 CO -0.12 -0.32 -0.48 0.35 0.00 0.00 0.00 179.25 178.68 3c1g h PHE 103 N -0.49 -1.36 -0.48 0.00 3.57 -1.12 0.27 116.94 117.33 3c1g h PHE 103 Ca -0.01 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.59 3c1g h PHE 103 Cb 0.45 0.57 -0.05 0.00 2.79 0.00 0.00 35.95 39.71 3c1g h PHE 103 CO 0.07 -0.57 0.17 1.96 -2.23 0.00 0.00 178.31 177.71 3c1g h GLN 104 N -0.74 0.33 -0.59 1.11 1.08 -1.48 -2.04 115.11 112.78 3c1g h GLN 104 Ca 0.00 -0.02 0.12 0.00 -1.45 0.00 0.00 58.65 57.30 3c1g h GLN 104 Cb 0.74 -0.08 -0.09 0.00 -0.05 0.00 0.00 27.48 28.00 3c1g h GLN 104 CO -0.25 0.22 0.07 0.78 -0.95 0.00 0.00 178.83 178.71 3c1g h GLY 105 N 0.34 0.70 0.83 3.46 0.00 -0.57 -1.58 103.07 106.24 3c1g h GLY 105 Ca 0.23 0.02 0.08 0.00 0.00 0.00 0.00 47.33 47.66 3c1g h GLY 105 CO -0.23 -0.15 0.56 1.48 0.00 0.00 0.00 176.54 178.20 3c1g h SER 106 N 0.19 0.79 -0.66 0.19 4.64 0.22 -0.39 113.55 118.53 3c1g h SER 106 Ca 0.31 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.63 3c1g h SER 106 Cb 0.48 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.38 3c1g h SER 106 CO -0.44 0.49 0.37 -0.26 -0.87 0.00 0.00 176.83 176.12 3c1g h PHE 107 N 0.89 0.92 -0.39 4.77 -1.00 -0.95 -2.37 116.94 118.82 3c1g h PHE 107 Ca 0.38 -0.01 -0.05 0.00 2.81 0.00 0.00 57.97 61.10 3c1g h PHE 107 Cb 0.32 -0.30 -0.02 0.00 3.61 0.00 0.00 35.95 39.57 3c1g h PHE 107 CO -0.00 0.64 0.02 0.00 -1.61 0.00 0.00 178.31 177.36 3c1g h ALA 108 N 1.46 1.31 -0.05 2.45 0.00 -0.45 -2.50 119.26 121.47 3c1g h ALA 108 Ca 0.24 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3c1g h ALA 108 Cb 0.03 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3c1g h ALA 108 CO -0.04 0.47 -0.03 0.00 0.00 0.00 0.00 179.25 179.66 3c1g h ILE 110 N -0.27 1.28 -0.13 0.00 6.09 -1.31 0.65 117.51 123.82 3c1g h ILE 110 Ca 0.01 -1.34 0.03 0.00 -1.37 0.00 0.00 64.86 62.20 3c1g h ILE 110 Cb 0.46 1.42 -0.04 0.00 0.47 0.00 0.00 36.82 39.14 3c1g h ILE 110 CO 0.01 0.42 -0.09 0.74 -3.07 0.00 0.00 178.15 176.16 3c1g h THR 111 N 0.40 0.73 -0.31 2.19 2.02 -1.42 -1.10 112.91 115.43 3c1g h THR 111 Ca 0.05 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.19 3c1g h THR 111 Cb 0.72 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 3c1g h THR 111 CO 0.06 0.00 0.04 0.58 0.37 0.00 0.00 175.52 176.56 3c1g h VAL 112 N -0.09 1.24 0.00 3.16 2.07 -0.75 -2.87 116.25 119.01 3c1g h VAL 112 Ca 0.08 -0.85 -0.02 0.00 0.82 0.00 0.00 66.70 66.73 3c1g h VAL 112 Cb 0.21 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3c1g h VAL 112 CO -0.19 0.28 -0.10 1.23 0.02 0.00 0.00 177.57 178.81 3c1g h GLY 113 N 0.34 0.00 1.54 2.17 0.00 -0.69 0.17 103.07 106.60 3c1g h GLY 113 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.33 3c1g h GLY 113 CO 0.01 0.00 -0.23 -2.00 0.00 0.00 0.00 176.54 174.32 3c1g h LEU 114 N 0.00 0.54 0.01 3.11 6.46 -0.97 -0.90 115.31 123.56 3c1g h LEU 114 Ca -0.00 -0.18 -0.08 0.00 -0.12 0.00 0.00 57.88 57.50 3c1g h LEU 114 Cb 0.23 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.00 3c1g h LEU 114 CO 0.01 0.77 -0.45 0.40 -0.62 0.00 0.00 178.44 178.55 3c1g h ILE 115 N 0.47 1.51 -0.41 4.05 2.04 -0.98 -3.28 117.51 120.92 3c1g h ILE 115 Ca 0.07 -2.32 0.00 0.00 1.00 0.00 0.00 64.86 63.62 3c1g h ILE 115 Cb 0.66 3.04 -0.02 0.00 -0.74 0.00 0.00 36.82 39.76 3c1g h ILE 115 CO 0.05 0.54 0.26 0.58 0.00 0.00 0.00 178.15 179.58 3c1g h VAL 116 N -0.93 1.12 -0.71 1.67 2.07 -0.75 -1.60 116.25 117.11 3c1g h VAL 116 Ca -0.12 -0.25 0.13 0.00 0.82 0.00 0.00 66.70 67.28 3c1g h VAL 116 Cb 1.15 0.55 -0.09 0.00 -1.52 0.00 0.00 31.29 31.38 3c1g h VAL 116 CO -0.05 0.12 0.27 1.23 0.02 0.00 0.00 177.57 179.16 3c1g h GLY 117 N 0.55 1.04 1.70 2.17 0.00 -1.32 0.16 103.07 107.37 3c1g h GLY 117 Ca 0.15 -0.13 -0.15 0.00 0.00 0.00 0.00 47.33 47.20 3c1g h GLY 117 CO -0.03 -0.07 -0.58 0.00 0.00 0.00 0.00 176.54 175.86 3c1g h ALA 118 N 1.51 0.83 -0.02 3.60 0.00 -1.45 -3.33 119.26 120.40 3c1g h ALA 118 Ca 0.38 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3c1g h ALA 118 Cb 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3c1g h ALA 118 CO -0.37 0.71 -0.03 1.28 0.00 0.00 0.00 179.25 180.83 3c1g n LEU 119 N -3.91 2.33 0.20 0.00 4.77 -0.67 -4.45 117.00 115.27 3c1g n LEU 119 Ca -0.03 -0.98 0.06 0.00 -0.03 0.00 0.00 56.01 55.04 3c1g n LEU 119 Cb 0.60 0.00 0.54 0.00 -2.33 0.00 0.00 43.42 42.24 3c1g n LEU 119 CO 0.45 0.41 1.01 0.00 -1.33 0.00 0.00 177.39 177.93 3c1g h ALA 120 N 3.26 1.81 0.37 -1.18 0.00 -0.82 -2.56 119.26 120.15 3c1g h ALA 120 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3c1g h ALA 120 Cb 0.69 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 3c1g h ALA 120 CO 0.00 0.14 -0.51 0.93 0.00 0.00 0.00 179.25 179.81 3c1g h GLU 121 N 0.09 -0.88 -0.29 0.00 5.08 -1.82 -3.33 114.58 113.42 3c1g h GLU 121 Ca 0.02 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3c1g h GLU 121 Cb 0.14 0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3c1g h GLU 121 CO 0.01 -0.59 0.00 -2.13 -1.00 0.00 0.00 179.01 175.30 3c1g n ARG 122 N -5.47 2.99 -4.84 2.33 0.63 -1.17 -4.93 116.66 106.19 3c1g n ARG 122 Ca -0.11 -2.69 -0.33 0.00 -0.92 0.00 0.00 57.85 53.80 3c1g n ARG 122 Cb 0.44 -1.74 -0.14 0.00 0.45 0.00 0.00 32.46 31.47 3c1g n ARG 122 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 3c1g s ILE 123 N -2.44 3.04 0.39 5.15 2.07 -0.97 -3.87 121.20 124.58 3c1g s ILE 123 Ca 0.39 -0.70 -0.25 0.00 -1.41 0.00 0.00 60.65 58.68 3c1g s ILE 123 Cb 0.30 -2.23 -0.11 0.00 0.13 0.00 0.00 42.46 40.54 3c1g s ILE 123 CO 0.11 0.56 1.08 -1.14 -1.91 0.00 0.00 174.94 173.64 3c1g n ARG 124 N 2.93 1.53 0.47 3.50 0.63 0.60 -4.70 116.66 121.62 3c1g n ARG 124 Ca -0.18 0.54 -0.20 0.00 -0.92 0.00 0.00 57.85 57.10 3c1g n ARG 124 Cb 0.52 -2.09 -0.10 0.00 0.45 0.00 0.00 32.46 31.24 3c1g n ARG 124 CO 0.00 0.00 0.00 0.35 -2.51 0.00 0.00 177.63 175.47 3c1g h PHE 125 N 1.81 -1.25 -0.31 -0.14 3.04 -1.94 -1.01 116.94 117.15 3c1g h PHE 125 Ca -0.44 -0.02 0.07 0.00 3.98 0.00 0.00 57.97 61.56 3c1g h PHE 125 Cb 1.33 0.43 -0.01 0.00 2.56 0.00 0.00 35.95 40.25 3c1g h PHE 125 CO 0.46 -0.74 0.22 0.66 -2.02 0.00 0.00 178.31 176.89 3c1g h SER 126 N -1.24 0.08 -0.07 0.41 4.64 -1.95 0.84 113.55 116.26 3c1g h SER 126 Ca -0.12 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.20 3c1g h SER 126 Cb 0.98 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.05 3c1g h SER 126 CO 0.16 0.05 0.02 0.00 -0.87 0.00 0.00 176.83 176.20 3c1g h ALA 127 N 1.84 0.09 -0.75 5.18 0.00 -1.72 0.32 119.26 124.22 3c1g h ALA 127 Ca 0.14 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3c1g h ALA 127 Cb 0.46 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3c1g h ALA 127 CO -0.01 -0.30 0.28 -0.24 0.00 0.00 0.00 179.25 178.98 3c1g h VAL 128 N -0.07 1.26 0.24 0.00 3.04 0.28 0.69 116.25 121.69 3c1g h VAL 128 Ca 0.02 -0.83 -0.01 0.00 -1.01 0.00 0.00 66.70 64.88 3c1g h VAL 128 Cb 0.20 0.39 -0.00 0.00 -2.01 0.00 0.00 31.29 29.87 3c1g h VAL 128 CO -0.00 0.33 -0.14 -0.07 -1.01 0.00 0.00 177.57 176.68 3c1g h LEU 129 N 1.09 -0.36 -0.51 3.16 3.38 -0.86 0.22 115.31 121.44 3c1g h LEU 129 Ca 0.25 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.34 3c1g h LEU 129 Cb 0.24 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.01 3c1g h LEU 129 CO -0.02 -0.24 0.01 0.40 0.09 0.00 0.00 178.44 178.69 3c1g h ILE 130 N -0.37 0.61 0.06 1.22 2.04 -0.71 -1.67 117.51 118.69 3c1g h ILE 130 Ca -0.03 -0.04 0.02 0.00 1.00 0.00 0.00 64.86 65.81 3c1g h ILE 130 Cb 0.31 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 3c1g h ILE 130 CO 0.03 0.02 -0.17 0.15 0.00 0.00 0.00 178.15 178.19 3c1g h PHE 131 N 0.13 -0.44 -0.22 1.37 3.57 -0.13 -1.98 116.94 119.24 3c1g h PHE 131 Ca 0.26 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.82 3c1g h PHE 131 Cb 0.39 0.19 -0.07 0.00 2.79 0.00 0.00 35.95 39.24 3c1g h PHE 131 CO -0.31 -0.25 -0.36 0.28 -2.23 0.00 0.00 178.31 175.44 3c1g h VAL 132 N -0.31 0.21 -0.24 1.41 2.07 0.31 0.85 116.25 120.55 3c1g h VAL 132 Ca 0.04 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.60 3c1g h VAL 132 Cb 0.34 0.21 -0.07 0.00 -1.52 0.00 0.00 31.29 30.25 3c1g h VAL 132 CO -0.12 0.00 -0.46 0.58 0.02 0.00 0.00 177.57 177.59 3c1g h VAL 133 N -0.39 0.09 0.04 2.57 2.07 -1.18 0.79 116.25 120.24 3c1g h VAL 133 Ca 0.11 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.66 3c1g h VAL 133 Cb 0.57 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.39 3c1g h VAL 133 CO -0.43 0.00 -0.24 0.58 0.02 0.00 0.00 177.57 177.49 3c1g h VAL 134 N -0.46 0.45 -0.03 2.57 2.07 -0.52 -2.30 116.25 118.04 3c1g h VAL 134 Ca 0.08 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.42 3c1g h VAL 134 Cb 0.63 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3c1g h VAL 134 CO -0.48 0.00 -0.77 -0.25 0.02 0.00 0.00 177.57 176.09 3c1g h TRP 135 N -0.40 0.35 -0.42 1.57 7.01 -0.62 -0.36 115.95 123.08 3c1g h TRP 135 Ca 0.05 -0.17 -0.05 0.00 2.11 0.00 0.00 58.89 60.84 3c1g h TRP 135 Cb 0.46 -0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 27.46 3c1g h TRP 135 CO -0.26 0.92 0.08 1.25 -2.79 0.00 0.00 178.44 177.64 3c1g h LEU 136 N 0.16 0.67 -0.20 0.65 5.85 -0.81 -0.52 115.31 121.11 3c1g h LEU 136 Ca -0.03 -0.25 -0.21 0.00 0.84 0.00 0.00 57.88 58.22 3c1g h LEU 136 Cb 1.35 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 42.21 3c1g h LEU 136 CO 0.12 0.75 -0.70 0.74 -0.34 0.00 0.00 178.44 179.01 3c1g h THR 137 N 0.55 1.28 -0.01 1.05 2.02 -1.27 -1.34 112.91 115.19 3c1g h THR 137 Ca 0.13 -1.89 0.00 0.00 0.77 0.00 0.00 66.41 65.42 3c1g h THR 137 Cb 0.36 1.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 3c1g h THR 137 CO 0.01 0.61 -0.62 0.18 0.37 0.00 0.00 175.52 176.06 3c1g n LEU 138 N -3.97 1.22 0.08 2.58 4.77 -0.16 -4.41 117.00 117.12 3c1g n LEU 138 Ca -0.07 -0.62 0.00 0.00 -0.03 0.00 0.00 56.01 55.30 3c1g n LEU 138 Cb 0.71 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 3c1g n LEU 138 CO 0.52 0.26 -0.05 -0.24 -1.33 0.00 0.00 177.39 176.55 3c1g n SER 139 N -0.83 0.40 -0.22 -1.43 2.88 -0.29 -4.66 113.62 109.47 3c1g n SER 139 Ca 0.05 0.26 -0.06 0.00 -1.33 0.00 0.00 58.87 57.78 3c1g n SER 139 Cb 0.32 0.02 0.04 0.00 -0.75 0.00 0.00 64.21 63.84 3c1g n SER 139 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 3c1g h TYR 140 N 0.00 0.83 0.02 0.66 3.20 -1.24 -2.30 116.97 118.14 3c1g h TYR 140 Ca 0.00 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 3c1g h TYR 140 Cb 0.10 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.10 3c1g h TYR 140 CO 0.00 0.59 -0.01 0.82 -1.64 0.00 0.00 178.16 177.92 3c1g h ILE 141 N 0.83 1.24 -0.54 1.81 2.04 -1.45 0.71 117.51 122.15 3c1g h ILE 141 Ca 0.22 -0.78 -0.04 0.00 1.00 0.00 0.00 64.86 65.26 3c1g h ILE 141 Cb 0.02 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 3c1g h ILE 141 CO -0.04 0.20 0.18 -0.65 0.00 0.00 0.00 178.15 177.85 3c1g h PRO 142 N -0.36 0.83 -0.48 2.37 0.11 -1.72 0.17 132.00 132.91 3c1g h PRO 142 Ca -0.00 -0.17 -0.01 0.00 0.11 0.00 0.00 66.00 65.93 3c1g h PRO 142 Cb 0.35 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 3c1g h PRO 142 CO 0.00 0.75 0.25 0.82 -0.21 0.00 0.00 178.00 179.61 3c1g h ILE 143 N 0.74 1.18 -0.85 4.15 2.04 -1.42 0.51 117.51 123.86 3c1g h ILE 143 Ca 0.18 -0.49 0.06 0.00 1.00 0.00 0.00 64.86 65.60 3c1g h ILE 143 Cb 0.25 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 36.90 3c1g h ILE 143 CO -0.01 0.19 0.53 0.00 0.00 0.00 0.00 178.15 178.87 3c1g h ALA 144 N 1.09 1.16 -0.62 1.87 0.00 -0.68 0.51 119.26 122.59 3c1g h ALA 144 Ca 0.17 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3c1g h ALA 144 Cb 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3c1g h ALA 144 CO -0.02 0.29 0.18 1.25 0.00 0.00 0.00 179.25 180.96 3c1g h HIS 145 N 0.98 1.00 -0.42 0.00 -0.00 0.06 -0.14 115.15 116.63 3c1g h HIS 145 Ca 0.36 -0.10 -0.09 0.00 -0.00 0.00 0.00 60.37 60.54 3c1g h HIS 145 Cb 0.14 -0.29 -0.01 0.00 -0.00 0.00 0.00 27.41 27.24 3c1g h HIS 145 CO -0.03 0.83 -0.09 0.52 -0.00 0.00 0.00 177.93 179.16 3c1g h MET 146 N 0.89 0.81 0.09 5.26 2.07 0.66 -0.44 114.93 124.26 3c1g h MET 146 Ca 0.20 -0.30 -0.21 0.00 -2.07 0.00 0.00 59.70 57.31 3c1g h MET 146 Cb 0.30 -0.05 -0.00 0.00 -1.87 0.00 0.00 31.60 29.98 3c1g h MET 146 CO -0.00 0.92 -1.07 0.28 1.07 0.00 0.00 176.91 178.11 3c1g h VAL 147 N 0.64 1.22 -0.00 -2.22 2.07 -0.92 0.26 116.25 117.30 3c1g h VAL 147 Ca 0.11 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.24 3c1g h VAL 147 Cb 0.62 2.85 0.00 0.00 -1.52 0.00 0.00 31.29 33.23 3c1g h VAL 147 CO 0.04 0.64 -0.24 0.79 0.02 0.00 0.00 177.57 178.82 3c1g n TRP 148 N -4.13 0.00 -1.12 1.57 8.01 -0.11 -4.17 117.44 117.50 3c1g n TRP 148 Ca -0.21 0.00 -0.03 0.00 -1.31 0.00 0.00 57.50 55.95 3c1g n TRP 148 Cb 0.80 0.00 0.27 0.00 -2.01 0.00 0.00 31.31 30.37 3c1g n TRP 148 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3c1g n GLY 149 N 1.06 4.01 2.99 6.99 0.00 -0.30 -4.92 105.19 115.04 3c1g n GLY 149 Ca 0.01 -1.06 -0.22 0.00 0.00 0.00 0.00 46.02 44.76 3c1g n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c1g n GLY 150 N -0.46 -0.50 0.00 -0.02 0.00 -1.19 -4.87 105.19 98.15 3c1g n GLY 150 Ca 0.36 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.49 3c1g n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3c1g n GLY 151 N -1.52 0.57 0.27 -0.02 0.00 -0.47 -4.66 105.19 99.35 3c1g n GLY 151 Ca -0.11 -1.90 -0.00 0.00 0.00 0.00 0.00 46.02 44.01 3c1g n GLY 151 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3c1g n LEU 152 N 0.00 -0.43 0.02 0.99 7.94 0.37 -1.50 117.00 124.40 3c1g n LEU 152 Ca 0.00 1.23 -0.19 0.00 -1.11 0.00 0.00 56.01 55.94 3c1g n LEU 152 Cb 0.00 -0.30 -0.10 0.00 0.53 0.00 0.00 43.42 43.55 3c1g n LEU 152 CO 0.00 -1.12 0.15 -0.07 -1.11 0.00 0.00 177.39 175.24 3c1g h LEU 153 N 0.00 0.83 -0.24 -1.96 3.38 -1.76 -2.82 115.31 112.74 3c1g h LEU 153 Ca 0.26 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3c1g h LEU 153 Cb 0.44 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3c1g h LEU 153 CO -0.71 1.44 0.15 0.00 0.09 0.00 0.00 178.44 179.42 3c1g h ALA 154 N 0.40 0.30 0.00 1.53 0.00 -0.33 -2.28 119.26 118.88 3c1g h ALA 154 Ca -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3c1g h ALA 154 Cb 1.56 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3c1g h ALA 154 CO 0.18 -0.22 0.00 -1.13 0.00 0.00 0.00 179.25 178.08 3c1g n SER 155 N -4.92 0.00 -0.42 0.00 3.41 -0.56 -0.62 113.62 110.52 3c1g n SER 155 Ca -0.03 -0.62 0.05 0.00 -0.26 0.00 0.00 58.87 58.01 3c1g n SER 155 Cb 0.03 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.04 3c1g n SER 155 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3c1g n HIS 156 N -0.93 0.08 -1.73 7.33 -0.00 -0.90 -5.02 115.22 114.05 3c1g n HIS 156 Ca 0.11 -0.10 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 3c1g n HIS 156 Cb 0.05 -0.01 0.00 0.00 -0.00 0.00 0.00 29.99 30.04 3c1g n HIS 156 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3c1g n GLY 157 N 0.50 0.95 3.69 -1.41 0.00 0.21 -4.99 105.19 104.15 3c1g n GLY 157 Ca 0.06 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 3c1g n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c1g s ALA 158 N -2.59 3.38 -0.53 4.61 0.00 -0.93 -4.97 121.76 120.73 3c1g s ALA 158 Ca 0.00 0.37 -0.23 0.00 0.00 0.00 0.00 51.96 52.10 3c1g s ALA 158 Cb 0.00 -3.41 0.04 0.00 0.00 0.00 0.00 23.12 19.76 3c1g s ALA 158 CO 0.00 -0.56 0.85 -0.51 0.00 0.00 0.00 175.76 175.54 3c1g s LEU 159 N 1.90 4.34 -0.37 0.00 1.43 -1.26 -4.83 118.68 119.89 3c1g s LEU 159 Ca 0.48 -0.48 0.03 0.00 -1.03 0.00 0.00 54.13 53.12 3c1g s LEU 159 Cb -0.18 -2.74 0.15 0.00 0.03 0.00 0.00 46.19 43.45 3c1g s LEU 159 CO 0.19 -1.12 0.35 -0.62 0.23 0.00 0.00 176.35 175.38 3c1g s ASP 160 N 2.76 1.41 0.09 2.29 -1.08 -1.26 -4.87 116.67 116.02 3c1g s ASP 160 Ca 0.26 -1.63 -0.29 0.00 -0.52 0.00 0.00 52.55 50.37 3c1g s ASP 160 Cb -0.14 0.44 -0.15 0.00 -1.46 0.00 0.00 42.92 41.60 3c1g s ASP 160 CO 0.17 -0.27 1.66 0.15 0.52 0.00 0.00 175.17 177.40 3c1g h PHE 161 N 7.09 -0.61 0.00 -5.34 3.57 -1.18 -3.36 116.94 117.12 3c1g h PHE 161 Ca 0.04 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.54 3c1g h PHE 161 Cb 1.05 0.22 0.00 0.00 2.79 0.00 0.00 35.95 40.01 3c1g h PHE 161 CO 0.34 -0.36 -0.07 0.00 -2.23 0.00 0.00 178.31 175.99 3c1g n ALA 162 N -2.43 1.88 0.00 2.41 0.00 -0.87 -4.93 120.51 116.56 3c1g n ALA 162 Ca -0.10 -1.36 0.00 0.00 0.00 0.00 0.00 53.44 51.98 3c1g n ALA 162 Cb 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.54 3c1g n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c1g n GLY 163 N -0.60 1.15 0.31 0.00 0.00 -1.26 -4.83 105.19 99.96 3c1g n GLY 163 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.10 3c1g n GLY 163 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3c1g h GLY 164 N 0.00 1.31 0.29 -0.02 0.00 -1.87 -0.12 103.07 102.66 3c1g h GLY 164 Ca 0.00 -0.32 -0.24 0.00 0.00 0.00 0.00 47.33 46.76 3c1g h GLY 164 CO 0.00 0.13 -1.28 -0.91 0.00 0.00 0.00 176.54 174.48 3c1g h THR 165 N 0.81 1.01 -0.22 4.70 1.35 -1.95 -1.31 112.91 117.30 3c1g h THR 165 Ca 0.41 -2.30 -0.04 0.00 -0.55 0.00 0.00 66.41 63.93 3c1g h THR 165 Cb 0.37 2.57 -0.01 0.00 -1.73 0.00 0.00 68.15 69.35 3c1g h THR 165 CO -0.25 0.57 -0.01 0.58 -0.25 0.00 0.00 175.52 176.16 3c1g h VAL 166 N -0.60 1.26 0.00 6.82 2.07 -1.90 -1.92 116.25 121.98 3c1g h VAL 166 Ca -0.31 -0.93 -0.09 0.00 0.82 0.00 0.00 66.70 66.19 3c1g h VAL 166 Cb 1.54 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.73 3c1g h VAL 166 CO -0.05 0.29 -0.71 0.58 0.02 0.00 0.00 177.57 177.70 3c1g h VAL 167 N 0.15 0.55 0.00 2.57 2.07 -1.28 -3.41 116.25 116.90 3c1g h VAL 167 Ca 0.06 -1.61 0.00 0.00 0.82 0.00 0.00 66.70 65.97 3c1g h VAL 167 Cb 0.43 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3c1g h VAL 167 CO 0.01 0.19 -0.01 0.45 0.02 0.00 0.00 177.57 178.23 3c1g h HIS 168 N -1.00 0.00 -0.56 1.57 3.86 -1.34 -2.08 115.15 115.60 3c1g h HIS 168 Ca -0.14 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.10 3c1g h HIS 168 Cb 0.83 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.26 3c1g h HIS 168 CO -0.02 0.00 0.32 0.82 0.86 0.00 0.00 177.93 179.92 3c1g h ILE 169 N -0.29 1.03 -0.33 2.45 2.04 -1.30 0.49 117.51 121.60 3c1g h ILE 169 Ca 0.00 -0.22 0.04 0.00 1.00 0.00 0.00 64.86 65.69 3c1g h ILE 169 Cb 0.01 0.34 -0.08 0.00 -0.74 0.00 0.00 36.82 36.35 3c1g h ILE 169 CO 0.00 0.12 -0.55 -1.13 0.00 0.00 0.00 178.15 176.58 3c1g h ASN 170 N 0.64 -1.82 -0.58 1.72 -1.24 -1.49 -0.21 115.58 112.60 3c1g h ASN 170 Ca 0.23 0.23 -0.10 0.00 0.71 0.00 0.00 56.30 57.38 3c1g h ASN 170 Cb 0.06 0.73 -0.02 0.00 0.73 0.00 0.00 38.32 39.83 3c1g h ASN 170 CO -0.12 -0.42 -0.02 0.00 -1.29 0.00 0.00 177.43 175.58 3c1g h ALA 171 N -0.13 0.78 -0.98 1.57 0.00 -1.10 -2.62 119.26 116.79 3c1g h ALA 171 Ca 0.06 -0.32 0.04 0.00 0.00 0.00 0.00 54.91 54.70 3c1g h ALA 171 Cb 0.61 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 3c1g h ALA 171 CO -0.55 0.64 0.63 0.00 0.00 0.00 0.00 179.25 179.97 3c1g h ALA 172 N 0.97 1.31 -0.02 0.00 0.00 -0.50 0.19 119.26 121.20 3c1g h ALA 172 Ca 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3c1g h ALA 172 Cb 0.58 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3c1g h ALA 172 CO 0.03 0.50 -0.02 0.82 0.00 0.00 0.00 179.25 180.58 3c1g h ILE 173 N 1.21 1.37 -0.99 0.00 1.08 -0.95 -1.56 117.51 117.68 3c1g h ILE 173 Ca 0.40 -1.12 0.15 0.00 -0.39 0.00 0.00 64.86 63.89 3c1g h ILE 173 Cb 0.04 2.08 -0.09 0.00 -3.07 0.00 0.00 36.82 35.79 3c1g h ILE 173 CO -0.14 0.30 0.61 0.00 -0.69 0.00 0.00 178.15 178.23 3c1g h ALA 174 N 0.54 1.55 -0.50 1.87 0.00 -1.08 -0.85 119.26 120.79 3c1g h ALA 174 Ca 0.00 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 3c1g h ALA 174 Cb 0.49 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3c1g h ALA 174 CO 0.00 0.10 -0.11 0.78 0.00 0.00 0.00 179.25 180.03 3c1g h GLY 175 N 0.88 1.04 2.00 0.00 0.00 -0.54 -2.72 103.07 103.73 3c1g h GLY 175 Ca 0.52 -0.85 -0.10 0.00 0.00 0.00 0.00 47.33 46.91 3c1g h GLY 175 CO -0.32 0.77 -0.46 1.41 0.00 0.00 0.00 176.54 177.95 3c1g h LEU 176 N 0.82 0.00 -0.36 3.11 3.38 -0.45 -1.31 115.31 120.51 3c1g h LEU 176 Ca 0.13 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 3c1g h LEU 176 Cb 0.67 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 3c1g h LEU 176 CO 0.05 0.46 -0.18 0.58 0.09 0.00 0.00 178.44 179.44 3c1g h VAL 177 N 0.00 1.29 -0.06 1.22 2.07 -1.22 -0.03 116.25 119.52 3c1g h VAL 177 Ca -0.00 -1.30 0.01 0.00 0.82 0.00 0.00 66.70 66.22 3c1g h VAL 177 Cb 1.18 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 3c1g h VAL 177 CO 0.06 0.43 -0.11 1.23 0.02 0.00 0.00 177.57 179.20 3c1g h GLY 178 N 0.53 -1.62 -0.84 2.17 0.00 -1.13 0.51 103.07 102.70 3c1g h GLY 178 Ca 0.08 0.75 0.20 0.00 0.00 0.00 0.00 47.33 48.35 3c1g h GLY 178 CO 0.05 -0.57 -0.17 0.00 0.00 0.00 0.00 176.54 175.86 3c1g h ALA 179 N -1.12 0.73 -0.04 3.60 0.00 -1.24 0.29 119.26 121.48 3c1g h ALA 179 Ca 0.01 0.35 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 3c1g h ALA 179 Cb 0.13 0.66 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3c1g h ALA 179 CO -0.11 -0.43 -0.11 -0.92 0.00 0.00 0.00 179.25 177.69 3c1g h TYR 180 N 0.01 0.06 -0.38 0.00 3.20 -0.08 -3.51 116.97 116.28 3c1g h TYR 180 Ca 0.47 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.34 3c1g h TYR 180 Cb 0.78 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.03 3c1g h TYR 180 CO -0.66 0.18 0.00 1.28 -1.64 0.00 0.00 178.16 177.32 3c1g n LEU 181 N -4.37 3.01 -4.60 2.82 4.77 0.17 -5.06 117.00 113.74 3c1g n LEU 181 Ca -0.02 -1.90 -0.34 0.00 -0.03 0.00 0.00 56.01 53.71 3c1g n LEU 181 Cb 0.20 -0.25 -0.11 0.00 -2.33 0.00 0.00 43.42 40.94 3c1g n LEU 181 CO 0.36 0.74 -0.31 -0.75 -1.33 0.00 0.00 177.39 176.10 3c1g s LYS 194 N -1.01 3.47 -0.61 3.23 2.36 -1.26 -5.04 119.74 120.88 3c1g s LYS 194 Ca 0.27 -0.44 -0.29 0.00 -2.55 0.00 0.00 55.97 52.96 3c1g s LYS 194 Cb 0.14 -2.93 -0.12 0.00 -1.05 0.00 0.00 37.83 33.88 3c1g s LYS 194 CO 0.19 0.43 2.47 -2.30 1.55 0.00 0.00 175.35 177.68 3c1g n PRO 195 N 2.99 0.78 -0.02 4.03 -0.02 -1.22 -4.38 135.00 137.15 3c1g n PRO 195 Ca -0.18 0.05 0.07 0.00 -2.02 0.00 0.00 63.50 61.43 3c1g n PRO 195 Cb 0.53 -2.78 -0.16 0.00 -0.02 0.00 0.00 33.50 31.06 3c1g n PRO 195 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 3c1g n HIS 196 N 13.58 0.00 -3.43 6.00 1.44 -0.65 -4.70 115.22 127.46 3c1g n HIS 196 Ca 0.45 0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.89 3c1g n HIS 196 Cb 0.36 -0.57 -0.11 0.00 0.12 0.00 0.00 29.99 29.80 3c1g n HIS 196 CO 0.00 0.00 0.00 1.21 -2.81 0.00 0.00 176.34 174.74 3c1g s ASN 197 N -4.62 1.87 0.17 4.39 3.84 -0.96 -5.01 114.94 114.63 3c1g s ASN 197 Ca -0.08 -2.93 -0.13 0.00 0.21 0.00 0.00 52.86 49.93 3c1g s ASN 197 Cb 0.12 -0.48 0.08 0.00 -0.55 0.00 0.00 41.25 40.42 3c1g s ASN 197 CO 0.88 -0.19 1.77 -0.07 -2.79 0.00 0.00 177.10 176.69 3c1g h LEU 198 N 5.90 0.74 -0.87 3.21 3.38 -1.84 -1.29 115.31 124.54 3c1g h LEU 198 Ca 0.22 -0.11 0.23 0.00 0.09 0.00 0.00 57.88 58.31 3c1g h LEU 198 Cb 0.92 -0.19 -0.14 0.00 0.09 0.00 0.00 40.66 41.34 3c1g h LEU 198 CO 0.37 0.64 0.23 -0.65 0.09 0.00 0.00 178.44 179.12 3c1g h PRO 199 N 0.79 0.21 -0.67 1.13 0.11 -1.96 1.36 132.00 132.96 3c1g h PRO 199 Ca 0.20 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.26 3c1g h PRO 199 Cb 0.08 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.11 3c1g h PRO 199 CO -0.03 0.14 0.25 1.98 -0.21 0.00 0.00 178.00 180.13 3c1g h MET 200 N 0.22 1.02 -0.55 1.05 1.85 -1.70 0.13 114.93 116.94 3c1g h MET 200 Ca 0.54 -0.20 0.01 0.00 -0.61 0.00 0.00 59.70 59.45 3c1g h MET 200 Cb 1.07 -0.16 -0.03 0.00 0.43 0.00 0.00 31.60 32.91 3c1g h MET 200 CO -0.64 0.86 0.35 0.28 -0.40 0.00 0.00 176.91 177.36 3c1g h VAL 201 N 0.96 1.11 -0.30 -5.77 2.07 0.38 -0.43 116.25 114.26 3c1g h VAL 201 Ca 0.22 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.53 3c1g h VAL 201 Cb 0.24 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 3c1g h VAL 201 CO -0.01 0.13 0.12 0.15 0.02 0.00 0.00 177.57 177.97 3c1g h PHE 202 N 0.71 0.22 0.06 1.57 3.57 0.22 -0.68 116.94 122.60 3c1g h PHE 202 Ca 0.21 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.73 3c1g h PHE 202 Cb -0.04 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 3c1g h PHE 202 CO -0.05 0.10 -0.08 1.15 -2.23 0.00 0.00 178.31 177.21 3c1g h THR 203 N 0.26 0.81 -0.60 4.41 2.02 -0.33 0.16 112.91 119.65 3c1g h THR 203 Ca 0.13 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.35 3c1g h THR 203 Cb 0.09 0.81 -0.05 0.00 -1.74 0.00 0.00 68.15 67.26 3c1g h THR 203 CO -0.12 0.00 0.34 1.23 0.37 0.00 0.00 175.52 177.34 3c1g h GLY 204 N -0.17 0.85 0.74 2.16 0.00 -0.93 -0.09 103.07 105.64 3c1g h GLY 204 Ca 0.01 -0.24 0.01 0.00 0.00 0.00 0.00 47.33 47.11 3c1g h GLY 204 CO -0.04 0.18 -0.16 -0.84 0.00 0.00 0.00 176.54 175.68 3c1g h THR 205 N 0.65 0.64 -0.61 4.70 2.02 -0.72 0.65 112.91 120.25 3c1g h THR 205 Ca 0.25 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.56 3c1g h THR 205 Cb 0.10 0.64 -0.11 0.00 -1.74 0.00 0.00 68.15 67.05 3c1g h THR 205 CO -0.14 0.00 -0.08 0.00 0.37 0.00 0.00 175.52 175.67 3c1g h ALA 206 N 0.54 0.51 -0.68 6.16 0.00 -0.27 -0.42 119.26 125.10 3c1g h ALA 206 Ca 0.02 0.21 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 3c1g h ALA 206 Cb 0.32 0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 3c1g h ALA 206 CO -0.08 -0.42 0.12 0.82 0.00 0.00 0.00 179.25 179.70 3c1g h ILE 207 N 0.05 1.26 -0.90 0.00 2.04 -0.38 -1.38 117.51 118.20 3c1g h ILE 207 Ca 0.31 -1.03 0.03 0.00 1.00 0.00 0.00 64.86 65.17 3c1g h ILE 207 Cb 0.49 0.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.13 3c1g h ILE 207 CO -0.58 0.39 0.59 -0.07 0.00 0.00 0.00 178.15 178.48 3c1g h LEU 208 N 1.05 0.97 -0.15 1.44 3.38 0.17 0.28 115.31 122.45 3c1g h LEU 208 Ca 0.21 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 3c1g h LEU 208 Cb 0.43 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 3c1g h LEU 208 CO 0.01 0.67 -0.12 0.22 0.09 0.00 0.00 178.44 179.31 3c1g h TYR 209 N 1.13 0.42 0.27 1.13 3.20 -0.58 0.18 116.97 122.72 3c1g h TYR 209 Ca 0.36 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 3c1g h TYR 209 Cb 0.01 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.20 3c1g h TYR 209 CO -0.00 0.72 -0.13 0.82 -1.64 0.00 0.00 178.16 177.93 3c1g h ILE 210 N -0.01 0.75 -0.88 1.81 1.08 -0.93 -2.10 117.51 117.23 3c1g h ILE 210 Ca 0.03 -0.12 0.12 0.00 -0.39 0.00 0.00 64.86 64.50 3c1g h ILE 210 Cb 0.64 0.81 -0.08 0.00 -3.07 0.00 0.00 36.82 35.12 3c1g h ILE 210 CO 0.03 0.03 0.50 1.23 -0.69 0.00 0.00 178.15 179.25 3c1g h GLY 211 N -0.43 1.41 1.09 5.37 0.00 -0.98 -2.61 103.07 106.92 3c1g h GLY 211 Ca -0.04 -0.32 0.10 0.00 0.00 0.00 0.00 47.33 47.07 3c1g h GLY 211 CO 0.06 0.07 0.36 -0.25 0.00 0.00 0.00 176.54 176.78 3c1g h TRP 212 N 0.77 0.00 -0.63 5.60 2.91 0.09 0.48 115.95 125.18 3c1g h TRP 212 Ca 0.45 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.46 3c1g h TRP 212 Cb 0.51 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 29.13 3c1g h TRP 212 CO -0.06 0.00 0.37 0.74 -1.03 0.00 0.00 178.44 178.46 3c1g h PHE 213 N 0.00 0.83 -0.72 2.65 0.04 -1.43 0.27 116.94 118.58 3c1g h PHE 213 Ca 0.16 -0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.98 3c1g h PHE 213 Cb 0.88 -0.27 -0.04 0.00 2.20 0.00 0.00 35.95 38.72 3c1g h PHE 213 CO 0.00 0.57 0.47 0.78 -0.60 0.00 0.00 178.31 179.54 3c1g h GLY 214 N 0.85 0.97 0.38 -1.45 0.00 -0.20 -0.96 103.07 102.65 3c1g h GLY 214 Ca 0.22 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.22 3c1g h GLY 214 CO -0.04 0.25 -0.18 -2.75 0.00 0.00 0.00 176.54 173.81 3c1g h PHE 215 N 0.79 -0.47 -0.21 5.60 3.04 -0.81 -0.01 116.94 124.87 3c1g h PHE 215 Ca 0.30 -0.01 -0.12 0.00 3.98 0.00 0.00 57.97 62.12 3c1g h PHE 215 Cb 0.19 0.16 -0.00 0.00 2.56 0.00 0.00 35.95 38.86 3c1g h PHE 215 CO -0.00 -0.29 -0.34 -0.91 -2.02 0.00 0.00 178.31 174.75 3c1g h ASN 216 N -1.09 0.66 0.06 0.41 2.35 -0.61 -3.23 115.58 114.12 3c1g h ASN 216 Ca -0.05 -0.53 -0.12 0.00 -0.55 0.00 0.00 56.30 55.05 3c1g h ASN 216 Cb 0.39 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 38.59 3c1g h ASN 216 CO 0.09 1.06 -0.51 0.00 -1.65 0.00 0.00 177.43 176.41 3c1g h ALA 217 N 0.62 -0.01 -0.27 -0.83 0.00 -1.28 -2.91 119.26 114.57 3c1g h ALA 217 Ca 0.02 -0.59 0.08 0.00 0.00 0.00 0.00 54.91 54.42 3c1g h ALA 217 Cb 0.92 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 3c1g h ALA 217 CO 0.08 0.25 0.53 0.78 0.00 0.00 0.00 179.25 180.89 3c1g h GLY 218 N -0.44 0.00 1.41 0.00 0.00 -1.06 0.48 103.07 103.46 3c1g h GLY 218 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.25 3c1g h GLY 218 CO 0.10 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.08 3c1g n SER 219 N -3.23 0.00 0.23 0.19 7.64 -1.10 -0.94 113.62 116.41 3c1g n SER 219 Ca 0.05 -0.04 0.13 0.00 1.01 0.00 0.00 58.87 60.02 3c1g n SER 219 Cb 0.65 -0.20 0.30 0.00 -1.01 0.00 0.00 64.21 63.95 3c1g n SER 219 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3c1g h ALA 220 N 2.65 1.00 0.00 -0.43 0.00 -1.07 -3.47 119.26 117.93 3c1g h ALA 220 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3c1g h ALA 220 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3c1g h ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3c1g n GLY 221 N 0.86 0.49 3.56 0.00 0.00 -0.11 -4.93 105.19 105.05 3c1g n GLY 221 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 3c1g n GLY 221 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3c1g s THR 222 N -2.35 0.00 -1.47 2.61 -1.32 -1.26 -4.59 115.64 107.25 3c1g s THR 222 Ca 0.00 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.38 3c1g s THR 222 Cb 0.00 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 70.01 3c1g s THR 222 CO 0.00 0.00 2.53 0.00 -2.21 0.00 0.00 174.62 174.94 3c1g n ALA 223 N 0.75 6.68 -3.05 11.08 0.00 -1.26 -4.49 120.51 130.22 3c1g n ALA 223 Ca -0.13 -3.84 0.00 0.00 0.00 0.00 0.00 53.44 49.47 3c1g n ALA 223 Cb 0.58 -3.21 0.00 0.00 0.00 0.00 0.00 19.45 16.82 3c1g n ALA 223 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3c1g n ASN 224 N 3.67 1.01 0.22 0.00 6.94 -1.26 -4.98 115.26 120.86 3c1g n ASN 224 Ca 0.64 -0.55 0.09 0.00 -0.02 0.00 0.00 54.58 54.74 3c1g n ASN 224 Cb 0.28 0.00 0.51 0.00 -2.36 0.00 0.00 39.78 38.22 3c1g n ASN 224 CO 0.00 0.00 0.00 1.05 -1.03 0.00 0.00 177.26 177.28 3c1g h GLU 225 N 0.00 0.00 -0.14 -3.83 9.09 -1.99 -2.03 114.58 115.69 3c1g h GLU 225 Ca 0.00 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.23 3c1g h GLU 225 Cb 0.00 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.11 3c1g h GLU 225 CO 0.00 0.24 -0.61 0.82 0.05 0.00 0.00 179.01 179.51 3c1g h ILE 226 N 0.00 1.32 -0.48 -1.06 1.08 -1.94 0.12 117.51 116.55 3c1g h ILE 226 Ca -0.00 -1.87 -0.01 0.00 -0.39 0.00 0.00 64.86 62.58 3c1g h ILE 226 Cb 0.62 2.07 -0.02 0.00 -3.07 0.00 0.00 36.82 36.42 3c1g h ILE 226 CO 0.03 0.58 0.25 0.00 -0.69 0.00 0.00 178.15 178.32 3c1g h ALA 227 N 0.52 1.54 -0.11 1.87 0.00 -1.73 0.23 119.26 121.58 3c1g h ALA 227 Ca -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3c1g h ALA 227 Cb 1.25 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 3c1g h ALA 227 CO 0.13 0.38 0.03 0.00 0.00 0.00 0.00 179.25 179.78 3c1g h ALA 228 N 1.62 0.15 -0.08 0.00 0.00 -1.13 -1.38 119.26 118.43 3c1g h ALA 228 Ca 0.17 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.96 3c1g h ALA 228 Cb 0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3c1g h ALA 228 CO -0.03 -0.22 -0.04 1.25 0.00 0.00 0.00 179.25 180.22 3c1g h LEU 229 N -0.03 -0.13 -1.17 0.00 5.85 -0.40 -0.94 115.31 118.49 3c1g h LEU 229 Ca 0.03 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.73 3c1g h LEU 229 Cb 0.26 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 3c1g h LEU 229 CO 0.00 -0.06 -0.01 0.00 -0.34 0.00 0.00 178.44 178.03 3c1g h ALA 230 N 1.05 1.32 0.62 1.25 0.00 -0.48 -0.06 119.26 122.95 3c1g h ALA 230 Ca 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 3c1g h ALA 230 Cb 0.11 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.75 3c1g h ALA 230 CO -0.11 0.47 -0.30 0.35 0.00 0.00 0.00 179.25 179.66 3c1g h PHE 231 N 0.53 -0.78 -0.36 0.00 3.04 -1.02 -0.97 116.94 117.38 3c1g h PHE 231 Ca 0.11 -0.02 0.07 0.00 3.98 0.00 0.00 57.97 62.11 3c1g h PHE 231 Cb 0.37 0.26 -0.09 0.00 2.56 0.00 0.00 35.95 39.05 3c1g h PHE 231 CO 0.01 -0.48 -0.37 0.28 -2.02 0.00 0.00 178.31 175.73 3c1g h VAL 232 N -1.00 0.18 -0.85 1.41 2.07 -0.99 0.51 116.25 117.60 3c1g h VAL 232 Ca -0.09 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.61 3c1g h VAL 232 Cb 0.64 0.18 -0.06 0.00 -1.52 0.00 0.00 31.29 30.54 3c1g h VAL 232 CO 0.14 0.00 0.56 0.78 0.02 0.00 0.00 177.57 179.07 3c1g h ASN 233 N -0.31 0.43 -0.08 0.57 2.35 -1.04 0.36 115.58 117.87 3c1g h ASN 233 Ca 0.15 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.93 3c1g h ASN 233 Cb 0.56 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.88 3c1g h ASN 233 CO -0.53 0.20 0.05 0.74 -1.65 0.00 0.00 177.43 176.24 3c1g h THR 234 N 0.45 1.05 -0.39 2.81 2.02 0.52 0.36 112.91 119.72 3c1g h THR 234 Ca 0.43 -0.13 0.04 0.00 0.77 0.00 0.00 66.41 67.52 3c1g h THR 234 Cb 0.99 1.00 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 3c1g h THR 234 CO -0.16 0.05 0.15 0.58 0.37 0.00 0.00 175.52 176.51 3c1g h VAL 235 N 0.07 0.91 0.02 3.16 2.07 -0.46 -2.19 116.25 119.84 3c1g h VAL 235 Ca 0.03 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.44 3c1g h VAL 235 Cb 0.03 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3c1g h VAL 235 CO -0.01 0.06 -0.01 0.58 0.02 0.00 0.00 177.57 178.21 3c1g h VAL 236 N 0.33 1.11 -0.48 2.57 2.07 -0.40 -2.03 116.25 119.42 3c1g h VAL 236 Ca 0.18 -0.41 -0.10 0.00 0.82 0.00 0.00 66.70 67.19 3c1g h VAL 236 Cb 0.14 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3c1g h VAL 236 CO -0.16 0.11 -0.08 0.00 0.02 0.00 0.00 177.57 177.45 3c1g h ALA 237 N 0.77 0.65 0.11 1.67 0.00 -0.21 0.12 119.26 122.36 3c1g h ALA 237 Ca -0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 3c1g h ALA 237 Cb 0.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3c1g h ALA 237 CO 0.01 0.53 -0.05 1.15 0.00 0.00 0.00 179.25 180.88 3c1g h THR 238 N 0.75 0.90 -0.37 0.00 2.02 -1.40 0.17 112.91 114.97 3c1g h THR 238 Ca 0.12 -0.03 0.07 0.00 0.77 0.00 0.00 66.41 67.35 3c1g h THR 238 Cb 0.63 0.92 -0.07 0.00 -1.74 0.00 0.00 68.15 67.89 3c1g h THR 238 CO 0.04 0.01 -0.09 0.00 0.37 0.00 0.00 175.52 175.85 3c1g h ALA 239 N 0.74 0.25 -0.05 6.16 0.00 -1.07 -0.53 119.26 124.76 3c1g h ALA 239 Ca -0.01 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3c1g h ALA 239 Cb 0.12 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3c1g h ALA 239 CO 0.02 -0.45 -0.01 0.00 0.00 0.00 0.00 179.25 178.81 3c1g h ALA 240 N 1.37 0.03 -0.22 0.00 0.00 -0.27 -2.63 119.26 117.55 3c1g h ALA 240 Ca 0.18 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.14 3c1g h ALA 240 Cb 0.27 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 3c1g h ALA 240 CO -0.38 -0.49 -0.02 0.00 0.00 0.00 0.00 179.25 178.36 3c1g h ALA 241 N 1.04 0.17 -0.36 0.00 0.00 -0.45 0.36 119.26 120.02 3c1g h ALA 241 Ca 0.02 0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.05 3c1g h ALA 241 Cb 0.03 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 3c1g h ALA 241 CO -0.04 -0.44 -0.52 0.82 0.00 0.00 0.00 179.25 179.06 3c1g h ILE 242 N 0.04 0.03 -0.77 0.00 2.04 -0.94 0.65 117.51 118.56 3c1g h ILE 242 Ca 0.10 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 3c1g h ILE 242 Cb 0.14 0.03 -0.04 0.00 -0.74 0.00 0.00 36.82 36.22 3c1g h ILE 242 CO -0.19 0.00 0.42 -0.07 0.00 0.00 0.00 178.15 178.31 3c1g h LEU 243 N -0.41 0.97 -0.92 1.44 3.38 -1.07 0.24 115.31 118.94 3c1g h LEU 243 Ca 0.09 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3c1g h LEU 243 Cb 0.61 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 3c1g h LEU 243 CO -0.57 0.79 0.41 1.23 0.09 0.00 0.00 178.44 180.39 3c1g h GLY 244 N 1.07 1.26 0.51 0.83 0.00 -0.62 0.13 103.07 106.25 3c1g h GLY 244 Ca 0.27 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 3c1g h GLY 244 CO -0.04 0.58 -0.06 -0.25 0.00 0.00 0.00 176.54 176.77 3c1g h TRP 245 N 1.17 -0.17 -0.74 5.60 2.91 -0.17 -2.32 115.95 122.24 3c1g h TRP 245 Ca 0.29 -0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.28 3c1g h TRP 245 Cb 0.10 0.05 -0.04 0.00 -0.51 0.00 0.00 29.16 28.77 3c1g h TRP 245 CO 0.01 0.26 0.39 0.82 -1.03 0.00 0.00 178.44 178.89 3c1g h ILE 246 N -0.67 1.22 -0.30 2.65 1.08 -0.42 0.41 117.51 121.49 3c1g h ILE 246 Ca -0.02 -0.58 -0.11 0.00 -0.39 0.00 0.00 64.86 63.76 3c1g h ILE 246 Cb 0.50 0.24 -0.01 0.00 -3.07 0.00 0.00 36.82 34.48 3c1g h ILE 246 CO 0.03 0.26 -0.27 0.15 -0.69 0.00 0.00 178.15 177.62 3c1g h PHE 247 N 1.04 0.69 -0.40 1.37 3.57 -0.81 0.35 116.94 122.75 3c1g h PHE 247 Ca 0.26 -0.16 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 3c1g h PHE 247 Cb 0.05 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 3c1g h PHE 247 CO 0.01 0.82 0.02 0.78 -2.23 0.00 0.00 178.31 177.70 3c1g h GLY 248 N 1.01 0.74 0.95 2.40 0.00 -0.65 0.67 103.07 108.19 3c1g h GLY 248 Ca 0.07 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 3c1g h GLY 248 CO 0.06 0.49 0.15 -2.09 0.00 0.00 0.00 176.54 175.15 3c1g h GLU 249 N 0.52 0.65 -0.44 4.80 4.81 0.17 0.27 114.58 125.35 3c1g h GLU 249 Ca 0.11 -0.13 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 3c1g h GLU 249 Cb 0.45 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 3c1g h GLU 249 CO 0.02 0.62 0.27 2.35 -0.73 0.00 0.00 179.01 181.54 3c1g h TRP 250 N 0.55 0.52 -0.55 0.92 7.01 -0.24 0.48 115.95 124.63 3c1g h TRP 250 Ca 0.14 0.01 -0.09 0.00 2.11 0.00 0.00 58.89 61.06 3c1g h TRP 250 Cb 0.23 -0.17 -0.02 0.00 -2.10 0.00 0.00 29.16 27.09 3c1g h TRP 250 CO 0.01 0.31 -0.02 0.00 -2.79 0.00 0.00 178.44 175.95 3c1g h ALA 251 N 1.18 0.92 0.00 2.65 0.00 -0.21 0.23 119.26 124.03 3c1g h ALA 251 Ca 0.17 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3c1g h ALA 251 Cb -0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3c1g h ALA 251 CO -0.06 0.64 -0.05 -0.07 0.00 0.00 0.00 179.25 179.71 3c1g h LEU 252 N 0.89 0.00 -1.68 0.00 3.38 -0.76 -3.39 115.31 113.75 3c1g h LEU 252 Ca 0.16 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.24 3c1g h LEU 252 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 3c1g h LEU 252 CO 0.03 0.97 -0.08 0.54 0.09 0.00 0.00 178.44 179.99 3c1g n ARG 253 N -4.62 1.89 0.00 1.13 1.74 0.17 -4.99 116.66 111.98 3c1g n ARG 253 Ca -0.10 -1.63 0.00 0.00 -0.77 0.00 0.00 57.85 55.35 3c1g n ARG 253 Cb 0.44 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 3c1g n ARG 253 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3c1g n GLY 254 N 1.24 2.59 3.51 -0.13 0.00 0.79 -4.96 105.19 108.24 3c1g n GLY 254 Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 3c1g n GLY 254 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3c1g s LYS 255 N -0.21 0.96 0.70 1.61 -2.85 -1.23 -4.88 119.74 113.84 3c1g s LYS 255 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 55.97 54.86 3c1g s LYS 255 Cb 0.00 0.45 0.01 0.00 -2.06 0.00 0.00 37.83 36.23 3c1g s LYS 255 CO 0.00 -0.35 1.07 -2.14 0.10 0.00 0.00 175.35 174.04 3c1g s PRO 256 N -1.97 2.80 0.20 1.78 0.02 -1.26 -3.85 135.00 132.72 3c1g s PRO 256 Ca -0.04 1.08 0.08 0.00 0.02 0.00 0.00 61.00 62.14 3c1g s PRO 256 Cb -0.00 -1.97 -0.05 0.00 0.02 0.00 0.00 34.50 32.50 3c1g s PRO 256 CO 0.01 -1.21 -0.15 -1.54 -0.33 0.00 0.00 177.00 173.78 3c1g s SER 257 N -3.46 2.57 0.21 2.53 1.04 -1.26 -5.02 113.70 110.31 3c1g s SER 257 Ca 0.60 -1.01 -0.10 0.00 0.48 0.00 0.00 55.95 55.92 3c1g s SER 257 Cb -0.16 -0.14 0.16 0.00 0.10 0.00 0.00 66.02 65.99 3c1g s SER 257 CO 0.52 -0.16 1.87 0.25 0.98 0.00 0.00 173.24 176.69 3c1g h LEU 258 N 2.59 0.90 -1.27 2.42 5.85 -1.99 -1.76 115.31 122.06 3c1g h LEU 258 Ca -0.38 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.27 3c1g h LEU 258 Cb 1.22 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 3c1g h LEU 258 CO 0.61 0.68 0.18 0.25 -0.34 0.00 0.00 178.44 179.82 3c1g h LEU 259 N 1.05 0.61 -0.13 2.25 5.85 -1.97 -1.13 115.31 121.84 3c1g h LEU 259 Ca 0.28 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 3c1g h LEU 259 Cb -0.08 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.79 3c1g h LEU 259 CO -0.06 0.57 -0.00 1.23 -0.34 0.00 0.00 178.44 179.84 3c1g h GLY 260 N 0.83 0.25 0.50 3.75 0.00 -1.87 -0.15 103.07 106.37 3c1g h GLY 260 Ca 0.16 -0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.33 3c1g h GLY 260 CO -0.01 0.17 -0.24 0.00 0.00 0.00 0.00 176.54 176.46 3c1g h ALA 261 N 0.75 -0.36 -0.29 3.60 0.00 -0.98 0.24 119.26 122.22 3c1g h ALA 261 Ca 0.04 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3c1g h ALA 261 Cb 0.38 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3c1g h ALA 261 CO 0.01 -0.76 0.16 0.00 0.00 0.00 0.00 179.25 178.66 3c1g h SER 263 N 0.34 0.50 -0.26 0.00 0.02 -0.56 -1.90 113.55 111.68 3c1g h SER 263 Ca 0.11 0.03 0.06 0.00 -0.84 0.00 0.00 61.79 61.15 3c1g h SER 263 Cb 0.00 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.42 3c1g h SER 263 CO -0.06 0.33 -0.11 1.23 -1.14 0.00 0.00 176.83 177.09 3c1g h GLY 264 N 0.63 0.12 -0.26 -3.77 0.00 -0.02 0.85 103.07 100.62 3c1g h GLY 264 Ca 0.27 0.14 0.15 0.00 0.00 0.00 0.00 47.33 47.88 3c1g h GLY 264 CO -0.16 -0.13 -0.03 0.00 0.00 0.00 0.00 176.54 176.21 3c1g h ALA 265 N 1.16 0.66 -0.36 3.60 0.00 -0.60 -1.05 119.26 122.67 3c1g h ALA 265 Ca 0.13 0.23 -0.16 0.00 0.00 0.00 0.00 54.91 55.12 3c1g h ALA 265 Cb 0.27 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3c1g h ALA 265 CO -0.30 -0.41 -0.40 0.82 0.00 0.00 0.00 179.25 178.96 3c1g h ILE 266 N 0.09 1.28 -0.37 0.00 1.08 -0.50 -1.53 117.51 117.55 3c1g h ILE 266 Ca 0.36 -1.57 0.07 0.00 -0.39 0.00 0.00 64.86 63.34 3c1g h ILE 266 Cb 0.61 1.42 -0.07 0.00 -3.07 0.00 0.00 36.82 35.71 3c1g h ILE 266 CO -0.62 0.52 -0.05 0.00 -0.69 0.00 0.00 178.15 177.31 3c1g h ALA 267 N 0.84 0.29 -0.53 1.87 0.00 0.17 0.97 119.26 122.86 3c1g h ALA 267 Ca 0.06 0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 3c1g h ALA 267 Cb 0.97 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3c1g h ALA 267 CO 0.09 -0.43 -0.08 0.78 0.00 0.00 0.00 179.25 179.61 3c1g h GLY 268 N 0.05 1.06 0.69 0.00 0.00 -0.97 0.28 103.07 104.17 3c1g h GLY 268 Ca 0.18 -0.82 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 3c1g h GLY 268 CO -0.35 0.76 -0.01 1.41 0.00 0.00 0.00 176.54 178.35 3c1g h LEU 269 N 0.88 -0.01 0.40 3.11 3.38 -0.90 0.11 115.31 122.28 3c1g h LEU 269 Ca 0.14 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 3c1g h LEU 269 Cb 0.63 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3c1g h LEU 269 CO 0.04 0.30 -0.27 0.58 0.09 0.00 0.00 178.44 179.19 3c1g h VAL 270 N -0.33 0.45 -0.75 1.22 2.07 -0.72 -1.88 116.25 116.30 3c1g h VAL 270 Ca -0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 3c1g h VAL 270 Cb 0.32 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.48 3c1g h VAL 270 CO 0.00 0.00 0.50 1.23 0.02 0.00 0.00 177.57 179.32 3c1g h GLY 271 N -0.65 0.79 1.28 2.17 0.00 -0.26 -1.34 103.07 105.06 3c1g h GLY 271 Ca -0.04 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3c1g h GLY 271 CO 0.03 0.08 -0.64 -0.24 0.00 0.00 0.00 176.54 175.77 3c1g h VAL 272 N 0.49 0.00 -0.79 4.60 3.04 -0.60 -3.37 116.25 119.61 3c1g h VAL 272 Ca 0.37 -0.79 0.12 0.00 -1.01 0.00 0.00 66.70 65.39 3c1g h VAL 272 Cb 0.74 1.43 -0.13 0.00 -2.01 0.00 0.00 31.29 31.32 3c1g h VAL 272 CO -0.13 0.00 -0.41 0.74 -1.01 0.00 0.00 177.57 176.76 3c1g h THR 273 N 0.00 0.06 0.00 3.17 2.02 -0.39 0.74 112.91 118.50 3c1g h THR 273 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 3c1g h THR 273 Cb 0.89 0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 3c1g h THR 273 CO 0.00 0.00 -0.12 1.55 0.37 0.00 0.00 175.52 177.32 3c1g h PRO 274 N -0.10 0.00 0.00 6.66 0.13 -1.77 -2.32 132.00 134.60 3c1g h PRO 274 Ca 0.25 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.34 3c1g h PRO 274 Cb 0.56 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.68 3c1g h PRO 274 CO -0.83 0.12 -1.76 0.00 -0.23 0.00 0.00 178.00 175.29 3c1g n ALA 275 N -2.15 2.57 -0.34 -0.56 0.00 0.17 -0.89 120.51 119.31 3c1g n ALA 275 Ca 0.01 -0.53 0.23 0.00 0.00 0.00 0.00 53.44 53.16 3c1g n ALA 275 Cb 0.44 -0.80 0.50 0.00 0.00 0.00 0.00 19.45 19.59 3c1g n ALA 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3c1g n GLY 277 N -1.43 -0.55 0.02 0.00 0.00 -1.26 -3.53 105.19 98.42 3c1g n GLY 277 Ca 0.27 -0.38 0.01 0.00 0.00 0.00 0.00 46.02 45.93 3c1g n GLY 277 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3c1g n TYR 278 N -0.53 0.00 -4.44 1.61 4.01 0.08 -4.88 117.16 113.01 3c1g n TYR 278 Ca 0.15 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.63 3c1g n TYR 278 Cb 0.33 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.25 3c1g n TYR 278 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 3c1g s ILE 279 N -1.06 2.37 0.63 -0.72 -4.36 -1.16 -0.75 121.20 116.15 3c1g s ILE 279 Ca 0.01 -2.18 -0.13 0.00 -0.26 0.00 0.00 60.65 58.10 3c1g s ILE 279 Cb 0.02 -2.18 -0.02 0.00 1.25 0.00 0.00 42.46 41.52 3c1g s ILE 279 CO 0.09 -0.24 1.04 -0.83 0.24 0.00 0.00 174.94 175.24 3c1g s GLY 280 N -3.00 1.81 0.47 6.27 0.00 -0.65 -4.82 107.32 107.40 3c1g s GLY 280 Ca 0.24 0.11 0.24 0.00 0.00 0.00 0.00 44.72 45.32 3c1g s GLY 280 CO 0.12 0.41 1.86 -0.39 0.00 0.00 0.00 173.10 175.10 3c1g h VAL 281 N -0.17 0.61 0.55 1.40 -1.51 -1.94 0.34 116.25 115.52 3c1g h VAL 281 Ca -0.45 -0.07 -0.02 0.00 -1.23 0.00 0.00 66.70 64.93 3c1g h VAL 281 Cb 1.20 0.37 -0.02 0.00 -2.13 0.00 0.00 31.29 30.72 3c1g h VAL 281 CO 0.59 0.04 -0.46 1.23 -1.23 0.00 0.00 177.57 177.74 3c1g h GLY 282 N 0.22 -1.24 -0.29 5.19 0.00 -1.93 -1.00 103.07 104.01 3c1g h GLY 282 Ca 0.46 0.55 0.19 0.00 0.00 0.00 0.00 47.33 48.53 3c1g h GLY 282 CO -0.11 -0.38 0.15 -1.33 0.00 0.00 0.00 176.54 174.87 3c1g h GLY 283 N -0.98 1.11 0.61 4.60 0.00 -0.87 -1.58 103.07 105.96 3c1g h GLY 283 Ca -0.07 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.31 3c1g h GLY 283 CO -0.01 -0.29 0.06 0.00 0.00 0.00 0.00 176.54 176.31 3c1g h ALA 284 N 1.70 0.34 0.50 3.60 0.00 -0.22 -1.33 119.26 123.85 3c1g h ALA 284 Ca 0.47 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.42 3c1g h ALA 284 Cb 0.87 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3c1g h ALA 284 CO -0.61 -0.34 -0.24 1.25 0.00 0.00 0.00 179.25 179.31 3c1g h LEU 285 N 0.18 -0.57 -0.87 0.00 6.46 -0.23 -0.95 115.31 119.33 3c1g h LEU 285 Ca 0.15 -0.06 0.20 0.00 -0.12 0.00 0.00 57.88 58.05 3c1g h LEU 285 Cb 0.17 0.15 -0.12 0.00 -0.73 0.00 0.00 40.66 40.13 3c1g h LEU 285 CO -0.20 -0.25 0.38 0.40 -0.62 0.00 0.00 178.44 178.14 3c1g h ILE 286 N -0.89 0.52 -0.43 4.05 2.04 -1.41 -0.55 117.51 120.84 3c1g h ILE 286 Ca -0.07 -0.14 -0.11 0.00 1.00 0.00 0.00 64.86 65.54 3c1g h ILE 286 Cb 0.60 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 3c1g h ILE 286 CO 0.11 0.08 -0.16 0.40 0.00 0.00 0.00 178.15 178.57 3c1g h ILE 287 N 0.42 1.27 0.55 -0.67 2.04 -1.13 -1.96 117.51 118.03 3c1g h ILE 287 Ca 0.53 -1.27 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 3c1g h ILE 287 Cb 0.96 1.11 0.01 0.00 -0.74 0.00 0.00 36.82 38.15 3c1g h ILE 287 CO -0.50 0.43 -0.26 1.23 0.00 0.00 0.00 178.15 179.05 3c1g h GLY 288 N 0.96 -0.77 0.29 5.37 0.00 -0.06 -0.76 103.07 108.10 3c1g h GLY 288 Ca 0.11 0.29 0.06 0.00 0.00 0.00 0.00 47.33 47.79 3c1g h GLY 288 CO 0.05 -0.28 -0.14 -2.08 0.00 0.00 0.00 176.54 174.09 3c1g h VAL 289 N -0.83 0.57 -0.39 4.60 2.07 -1.13 0.23 116.25 121.37 3c1g h VAL 289 Ca -0.08 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 3c1g h VAL 289 Cb 0.60 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 3c1g h VAL 289 CO 0.12 0.00 0.06 0.58 0.02 0.00 0.00 177.57 178.35 3c1g h VAL 290 N -0.10 1.20 -0.16 2.57 2.07 -1.34 -1.77 116.25 118.71 3c1g h VAL 290 Ca 0.15 -0.74 -0.20 0.00 0.82 0.00 0.00 66.70 66.73 3c1g h VAL 290 Cb 0.33 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3c1g h VAL 290 CO -0.35 0.26 -0.70 0.00 0.02 0.00 0.00 177.57 176.81 3c1g h ALA 291 N 1.48 0.46 0.34 1.67 0.00 -0.40 -1.29 119.26 121.53 3c1g h ALA 291 Ca 0.13 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 3c1g h ALA 291 Cb 0.29 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3c1g h ALA 291 CO 0.00 0.70 -0.17 0.78 0.00 0.00 0.00 179.25 180.57 3c1g h GLY 292 N 0.83 -0.49 0.95 0.00 0.00 -0.62 -0.02 103.07 103.72 3c1g h GLY 292 Ca -0.03 0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.45 3c1g h GLY 292 CO 0.14 -0.18 0.14 1.41 0.00 0.00 0.00 176.54 178.04 3c1g h LEU 293 N -0.47 0.63 -0.64 3.11 3.38 -1.34 -0.09 115.31 119.88 3c1g h LEU 293 Ca -0.05 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.62 3c1g h LEU 293 Cb 0.37 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3c1g h LEU 293 CO 0.07 0.67 -0.02 0.00 0.09 0.00 0.00 178.44 179.24 3c1g h ALA 294 N 0.99 0.85 0.19 1.53 0.00 -1.21 0.73 119.26 122.34 3c1g h ALA 294 Ca 0.14 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.75 3c1g h ALA 294 Cb 0.26 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3c1g h ALA 294 CO -0.00 0.66 -0.40 0.78 0.00 0.00 0.00 179.25 180.29 3c1g h GLY 295 N 0.98 -0.85 0.83 0.00 0.00 -0.83 0.77 103.07 103.98 3c1g h GLY 295 Ca 0.16 0.48 0.03 0.00 0.00 0.00 0.00 47.33 48.00 3c1g h GLY 295 CO 0.03 -0.28 0.27 -2.00 0.00 0.00 0.00 176.54 174.56 3c1g h LEU 296 N -0.68 0.41 -0.60 3.11 5.85 -0.55 0.43 115.31 123.29 3c1g h LEU 296 Ca 0.01 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.81 3c1g h LEU 296 Cb 0.68 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.58 3c1g h LEU 296 CO -0.20 0.29 0.30 -0.25 -0.34 0.00 0.00 178.44 178.24 3c1g h TRP 297 N 0.53 0.53 0.42 1.25 7.01 0.61 -2.57 115.95 123.73 3c1g h TRP 297 Ca 0.20 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.21 3c1g h TRP 297 Cb 0.05 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 3c1g h TRP 297 CO -0.08 0.23 -0.27 0.78 -2.79 0.00 0.00 178.44 176.31 3c1g h GLY 298 N 0.55 -0.70 1.87 2.65 0.00 0.24 -0.96 103.07 106.70 3c1g h GLY 298 Ca 0.28 0.30 0.01 0.00 0.00 0.00 0.00 47.33 47.92 3c1g h GLY 298 CO -0.21 -0.27 0.07 -0.39 0.00 0.00 0.00 176.54 175.74 3c1g h VAL 299 N -0.67 1.00 -0.04 4.60 -1.51 -1.01 -1.89 116.25 116.73 3c1g h VAL 299 Ca -0.04 -0.03 -0.01 0.00 -1.23 0.00 0.00 66.70 65.39 3c1g h VAL 299 Cb 0.55 0.89 -0.00 0.00 -2.13 0.00 0.00 31.29 30.61 3c1g h VAL 299 CO 0.04 0.02 0.01 0.74 -1.23 0.00 0.00 177.57 177.14 3c1g h THR 300 N 0.10 1.21 -0.17 7.19 2.02 -1.01 -3.51 112.91 118.74 3c1g h THR 300 Ca 0.04 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.59 3c1g h THR 300 Cb 0.04 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.01 3c1g h THR 300 CO -0.01 0.17 0.00 0.23 0.37 0.00 0.00 175.52 176.28 3c1g n MET 301 N -4.92 1.46 0.00 6.66 2.81 -0.41 -5.12 117.12 117.60 3c1g n MET 301 Ca -0.07 -0.70 0.00 0.00 -1.81 0.00 0.00 57.70 55.12 3c1g n MET 301 Cb 0.15 -1.22 0.00 0.00 -0.71 0.00 0.00 33.22 31.44 3c1g n MET 301 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 3c1g n PRO 311 N 0.02 0.00 0.00 0.03 -0.02 -1.26 -5.06 135.00 128.71 3c1g n PRO 311 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 3c1g n PRO 311 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.67 3c1g n PRO 311 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3c1g h ASP 313 N 0.00 0.96 -0.94 0.00 5.19 -1.99 -2.63 116.42 117.01 3c1g h ASP 313 Ca 0.00 -0.11 0.19 0.00 -0.62 0.00 0.00 57.03 56.49 3c1g h ASP 313 Cb 0.00 -0.25 -0.11 0.00 0.18 0.00 0.00 39.33 39.16 3c1g h ASP 313 CO 0.00 0.80 0.52 0.58 -3.12 0.00 0.00 179.24 178.02 3c1g h VAL 314 N 1.05 0.64 0.00 -1.35 2.07 -2.01 0.21 116.25 116.86 3c1g h VAL 314 Ca 0.26 -0.22 -0.08 0.00 0.82 0.00 0.00 66.70 67.48 3c1g h VAL 314 Cb 0.07 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.79 3c1g h VAL 314 CO -0.04 0.12 -0.39 -0.26 0.02 0.00 0.00 177.57 177.02 3c1g h PHE 315 N 0.63 0.00 -0.10 1.57 0.04 -1.81 -0.15 116.94 117.12 3c1g h PHE 315 Ca 0.56 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 61.24 3c1g h PHE 315 Cb 0.91 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 3c1g h PHE 315 CO -0.05 0.39 -0.34 0.78 -0.60 0.00 0.00 178.31 178.49 3c1g h GLY 316 N 2.32 0.21 0.06 -1.45 0.00 -0.45 0.93 103.07 104.69 3c1g h GLY 316 Ca -0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 3c1g h GLY 316 CO 0.05 0.16 -0.01 -2.08 0.00 0.00 0.00 176.54 174.66 3c1g h VAL 317 N 0.17 1.35 -0.87 4.60 2.07 -0.58 -1.88 116.25 121.11 3c1g h VAL 317 Ca 0.02 -1.91 0.06 0.00 0.82 0.00 0.00 66.70 65.69 3c1g h VAL 317 Cb 0.68 2.50 -0.05 0.00 -1.52 0.00 0.00 31.29 32.90 3c1g h VAL 317 CO 0.05 0.44 0.57 0.45 0.02 0.00 0.00 177.57 179.10 3c1g h HIS 318 N -0.96 1.01 0.24 1.57 -0.00 -1.13 -0.45 115.15 115.44 3c1g h HIS 318 Ca -0.00 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.38 3c1g h HIS 318 Cb 0.74 -0.33 0.00 0.00 -0.00 0.00 0.00 27.41 27.82 3c1g h HIS 318 CO 0.20 0.55 -0.11 0.78 -0.00 0.00 0.00 177.93 179.34 3c1g h GLY 319 N 1.01 -0.33 0.82 2.45 0.00 -0.91 -0.02 103.07 106.09 3c1g h GLY 319 Ca 0.37 0.12 -0.03 0.00 0.00 0.00 0.00 47.33 47.79 3c1g h GLY 319 CO -0.13 -0.12 -0.48 -2.08 0.00 0.00 0.00 176.54 173.73 3c1g h VAL 320 N -1.07 0.04 -0.06 4.60 2.07 -1.39 -0.28 116.25 120.16 3c1g h VAL 320 Ca -0.03 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 3c1g h VAL 320 Cb 0.30 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 3c1g h VAL 320 CO 0.05 0.00 -0.06 0.00 0.02 0.00 0.00 177.57 177.59 3c1g h GLY 322 N 0.35 0.05 0.88 0.00 0.00 -0.63 -1.77 103.07 101.95 3c1g h GLY 322 Ca 0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3c1g h GLY 322 CO 0.01 0.02 0.07 -2.22 0.00 0.00 0.00 176.54 174.41 3c1g h ILE 323 N 0.05 1.21 -0.45 2.60 2.04 0.19 -2.09 117.51 121.06 3c1g h ILE 323 Ca 0.01 -0.69 0.02 0.00 1.00 0.00 0.00 64.86 65.21 3c1g h ILE 323 Cb -0.00 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 3c1g h ILE 323 CO -0.00 0.22 0.26 0.58 0.00 0.00 0.00 178.15 179.21 3c1g h VAL 324 N 0.25 1.04 -0.36 1.67 2.07 -0.89 -0.24 116.25 119.79 3c1g h VAL 324 Ca 0.08 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.45 3c1g h VAL 324 Cb 0.28 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 3c1g h VAL 324 CO 0.00 0.10 0.16 1.23 0.02 0.00 0.00 177.57 179.08 3c1g h GLY 325 N 0.53 0.47 1.44 2.17 0.00 -1.25 -0.80 103.07 105.64 3c1g h GLY 325 Ca 0.18 -0.11 -0.08 0.00 0.00 0.00 0.00 47.33 47.32 3c1g h GLY 325 CO -0.09 0.08 -0.11 0.00 0.00 0.00 0.00 176.54 176.42 3c1g h ILE 327 N 0.61 1.32 0.00 0.00 2.04 -0.85 -3.19 117.51 117.43 3c1g h ILE 327 Ca 0.11 -1.24 -0.08 0.00 1.00 0.00 0.00 64.86 64.65 3c1g h ILE 327 Cb 0.55 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 3c1g h ILE 327 CO 0.03 0.38 -0.40 0.24 0.00 0.00 0.00 178.15 178.40 3c1g h MET 328 N 0.14 0.00 -0.25 2.37 2.86 -0.88 -1.55 114.93 117.61 3c1g h MET 328 Ca 0.04 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.73 3c1g h MET 328 Cb 0.64 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.26 3c1g h MET 328 CO 0.04 0.40 -0.05 1.15 1.06 0.00 0.00 176.91 179.50 3c1g h THR 329 N 0.00 0.76 0.00 2.22 2.02 -0.78 0.06 112.91 117.19 3c1g h THR 329 Ca -0.00 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 3c1g h THR 329 Cb 1.01 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 3c1g h THR 329 CO 0.05 0.00 0.15 0.61 0.37 0.00 0.00 175.52 176.70 3c1g n GLY 330 N -1.22 -0.38 0.44 2.16 0.00 -0.59 -2.12 105.19 103.48 3c1g n GLY 330 Ca -0.01 0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.96 3c1g n GLY 330 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3c1g n ILE 331 N -1.41 1.30 1.32 -0.61 5.41 -0.68 -4.39 119.36 120.29 3c1g n ILE 331 Ca -0.00 0.25 0.12 0.00 1.00 0.00 0.00 62.75 64.12 3c1g n ILE 331 Cb 0.15 -2.01 0.67 0.00 -0.71 0.00 0.00 39.64 37.73 3c1g n ILE 331 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 3c1g n PHE 332 N -3.98 0.00 0.25 1.39 3.72 -0.08 -1.66 117.46 117.10 3c1g n PHE 332 Ca -0.08 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.42 3c1g n PHE 332 Cb 0.30 -0.18 0.65 0.00 -0.94 0.00 0.00 39.48 39.31 3c1g n PHE 332 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3c1g h ALA 333 N 3.32 1.34 -2.14 4.37 0.00 -1.58 -3.15 119.26 121.42 3c1g h ALA 333 Ca 0.00 -0.14 -0.61 0.00 0.00 0.00 0.00 54.91 54.16 3c1g h ALA 333 Cb 0.14 -0.03 0.07 0.00 0.00 0.00 0.00 17.79 17.97 3c1g h ALA 333 CO 0.00 0.20 0.62 0.00 0.00 0.00 0.00 179.25 180.07 3c1g n ALA 334 N -2.33 0.68 -0.31 0.00 0.00 -0.66 0.20 120.51 118.08 3c1g n ALA 334 Ca -0.02 0.45 0.08 0.00 0.00 0.00 0.00 53.44 53.95 3c1g n ALA 334 Cb 0.26 -2.25 0.30 0.00 0.00 0.00 0.00 19.45 17.76 3c1g n ALA 334 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3c1g h SER 335 N 4.83 0.81 -0.83 0.00 0.02 -1.87 0.39 113.55 116.89 3c1g h SER 335 Ca -0.45 0.04 0.20 0.00 -0.84 0.00 0.00 61.79 60.74 3c1g h SER 335 Cb 1.28 -0.13 -0.13 0.00 0.14 0.00 0.00 62.40 63.57 3c1g h SER 335 CO 0.80 0.44 0.25 0.28 -1.14 0.00 0.00 176.83 177.47 3c1g h SER 336 N 0.88 0.09 -0.64 3.07 0.02 -1.88 -1.59 113.55 113.49 3c1g h SER 336 Ca 0.45 0.17 -0.14 0.00 -0.84 0.00 0.00 61.79 61.43 3c1g h SER 336 Cb 0.52 0.21 -0.09 0.00 0.14 0.00 0.00 62.40 63.18 3c1g h SER 336 CO -0.22 -0.07 0.17 0.18 -1.14 0.00 0.00 176.83 175.75 3c1g n LEU 337 N -5.15 5.76 0.00 5.07 4.77 -0.55 -4.87 117.00 122.02 3c1g n LEU 337 Ca 0.19 -3.16 0.00 0.00 -0.03 0.00 0.00 56.01 53.01 3c1g n LEU 337 Cb 0.59 -0.71 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 3c1g n LEU 337 CO 0.10 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 3c1g n GLY 338 N -0.03 0.66 3.92 -0.72 0.00 -0.60 -4.45 105.19 103.97 3c1g n GLY 338 Ca 0.36 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 46.02 3c1g n GLY 338 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3c1g s GLY 339 N -2.06 1.70 0.29 -0.02 0.00 0.13 -1.64 107.32 105.72 3c1g s GLY 339 Ca 0.00 -0.99 0.25 0.00 0.00 0.00 0.00 44.72 43.98 3c1g s GLY 339 CO 0.00 -0.36 1.75 -0.39 0.00 0.00 0.00 173.10 174.10 3c1g h VAL 340 N -1.32 0.00 0.00 1.40 -1.51 -0.76 -3.34 116.25 110.72 3c1g h VAL 340 Ca -0.45 -0.30 0.00 0.00 -1.23 0.00 0.00 66.70 64.73 3c1g h VAL 340 Cb 1.28 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 3c1g h VAL 340 CO 0.50 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.45 3c1g n GLY 341 N 0.13 2.50 3.88 5.19 0.00 0.13 -4.80 105.19 112.23 3c1g n GLY 341 Ca 0.02 -1.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.02 3c1g n GLY 341 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3c1g s PHE 342 N -1.93 3.12 1.01 1.61 0.08 -1.26 -4.82 117.98 115.78 3c1g s PHE 342 Ca 0.00 0.92 -0.12 0.00 0.12 0.00 0.00 56.93 57.85 3c1g s PHE 342 Cb 0.00 -3.26 0.15 0.00 -0.57 0.00 0.00 43.02 39.33 3c1g s PHE 342 CO 0.00 -1.50 0.80 0.00 -0.10 0.00 0.00 175.22 174.42 3c1g n ALA 343 N -3.18 -2.10 -1.75 5.36 0.00 -1.26 -4.89 120.51 112.69 3c1g n ALA 343 Ca 0.07 -0.79 -0.42 0.00 0.00 0.00 0.00 53.44 52.31 3c1g n ALA 343 Cb 0.59 -1.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.04 3c1g n ALA 343 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3c1g n GLU 344 N -3.51 2.75 -1.11 0.00 1.02 -1.26 -2.37 120.64 116.15 3c1g n GLU 344 Ca 0.07 0.98 -0.04 0.00 -0.02 0.00 0.00 57.16 58.15 3c1g n GLU 344 Cb 0.54 -2.77 -0.02 0.00 -0.02 0.00 0.00 31.44 29.17 3c1g n GLU 344 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3c1g n GLY 345 N 2.32 0.60 3.31 0.62 0.00 -1.26 -4.99 105.19 105.79 3c1g n GLY 345 Ca 0.09 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 3c1g n GLY 345 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c1g s VAL 346 N -1.86 3.81 0.95 1.61 1.01 -1.00 -5.10 120.40 119.82 3c1g s VAL 346 Ca 0.00 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 60.99 3c1g s VAL 346 Cb 0.00 -3.03 0.16 0.00 0.00 0.00 0.00 36.38 33.51 3c1g s VAL 346 CO 0.00 0.00 1.09 0.42 0.00 0.00 0.00 175.10 176.62 3c1g s THR 347 N 1.45 2.35 0.20 3.92 -4.23 -1.26 -4.69 115.64 113.38 3c1g s THR 347 Ca 0.01 0.11 0.07 0.00 -1.18 0.00 0.00 61.69 60.70 3c1g s THR 347 Cb -0.18 -2.61 -0.11 0.00 1.34 0.00 0.00 72.50 70.94 3c1g s THR 347 CO 0.02 -0.15 1.46 -0.03 -0.54 0.00 0.00 174.62 175.38 3c1g h MET 348 N -1.72 0.09 0.50 3.99 4.05 -1.99 -1.94 114.93 117.91 3c1g h MET 348 Ca -0.52 -0.08 -0.01 0.00 -0.28 0.00 0.00 59.70 58.80 3c1g h MET 348 Cb 1.31 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 32.11 3c1g h MET 348 CO 0.56 0.82 -0.42 0.78 0.23 0.00 0.00 176.91 178.89 3c1g h GLY 349 N 2.06 -1.05 0.46 1.39 0.00 -1.93 -1.22 103.07 102.79 3c1g h GLY 349 Ca -0.02 0.48 0.08 0.00 0.00 0.00 0.00 47.33 47.87 3c1g h GLY 349 CO 0.11 -0.35 0.20 0.84 0.00 0.00 0.00 176.54 177.34 3c1g h HIS 350 N -0.91 0.35 -0.36 5.60 6.17 -1.93 -0.80 115.15 123.27 3c1g h HIS 350 Ca -0.05 0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.06 3c1g h HIS 350 Cb 0.78 -0.07 -0.02 0.00 2.52 0.00 0.00 27.41 30.62 3c1g h HIS 350 CO -0.19 0.10 0.23 0.37 0.71 0.00 0.00 177.93 179.16 3c1g h GLN 351 N 0.38 0.47 -0.33 5.26 5.75 -1.25 -0.81 115.11 124.58 3c1g h GLN 351 Ca 0.27 -0.03 -0.16 0.00 -0.15 0.00 0.00 58.65 58.58 3c1g h GLN 351 Cb 0.31 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.75 3c1g h GLN 351 CO -0.27 0.31 -0.42 -0.07 -2.65 0.00 0.00 178.83 175.73 3c1g h LEU 352 N 0.49 0.89 -0.36 -2.39 3.38 0.08 -0.96 115.31 116.43 3c1g h LEU 352 Ca 0.13 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.70 3c1g h LEU 352 Cb -0.05 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 3c1g h LEU 352 CO -0.03 1.19 0.21 0.25 0.09 0.00 0.00 178.44 180.15 3c1g h LEU 353 N 0.67 0.35 -0.16 1.67 6.46 -0.72 -2.29 115.31 121.28 3c1g h LEU 353 Ca 0.05 0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.82 3c1g h LEU 353 Cb 1.00 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.84 3c1g h LEU 353 CO 0.10 0.25 0.08 0.58 -0.62 0.00 0.00 178.44 178.82 3c1g h VAL 354 N 0.44 0.99 -0.34 1.05 2.07 -0.81 -0.99 116.25 118.67 3c1g h VAL 354 Ca 0.14 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.61 3c1g h VAL 354 Cb -0.00 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3c1g h VAL 354 CO -0.06 0.03 0.22 1.56 0.02 0.00 0.00 177.57 179.34 3c1g h GLN 355 N 0.17 0.44 -0.95 1.57 1.08 -1.14 -1.54 115.11 114.74 3c1g h GLN 355 Ca 0.06 -0.03 0.09 0.00 -1.45 0.00 0.00 58.65 57.33 3c1g h GLN 355 Cb 0.02 -0.10 -0.07 0.00 -0.05 0.00 0.00 27.48 27.27 3c1g h GLN 355 CO -0.05 0.29 0.59 -0.07 -0.95 0.00 0.00 178.83 178.65 3c1g h LEU 356 N 0.45 0.90 -0.81 1.46 3.38 -0.97 -1.18 115.31 118.55 3c1g h LEU 356 Ca 0.12 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 3c1g h LEU 356 Cb -0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3c1g h LEU 356 CO -0.03 0.53 -0.33 -0.33 0.09 0.00 0.00 178.44 178.36 3c1g h GLU 357 N 1.00 0.51 -0.32 1.13 5.08 -0.67 -1.50 114.58 119.82 3c1g h GLU 357 Ca 0.44 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.53 3c1g h GLU 357 Cb 0.33 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3c1g h GLU 357 CO -0.22 0.78 0.00 0.77 -1.00 0.00 0.00 179.01 179.33 3c1g h SER 358 N 0.43 0.55 0.19 1.42 0.02 -0.27 -1.28 113.55 114.60 3c1g h SER 358 Ca 0.05 -0.31 0.01 0.00 -0.84 0.00 0.00 61.79 60.70 3c1g h SER 358 Cb 0.79 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.16 3c1g h SER 358 CO 0.06 0.72 -0.27 0.40 -1.14 0.00 0.00 176.83 176.61 3c1g h ILE 359 N 0.36 0.42 -0.83 3.27 2.04 -1.20 -0.69 117.51 120.87 3c1g h ILE 359 Ca 0.09 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.05 3c1g h ILE 359 Cb 0.44 0.42 -0.06 0.00 -0.74 0.00 0.00 36.82 36.88 3c1g h ILE 359 CO 0.02 0.00 0.54 0.00 0.00 0.00 0.00 178.15 178.70 3c1g h ALA 360 N 0.15 1.72 0.23 1.87 0.00 -1.15 0.60 119.26 122.69 3c1g h ALA 360 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3c1g h ALA 360 Cb 0.52 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3c1g h ALA 360 CO -0.11 0.11 -0.11 0.82 0.00 0.00 0.00 179.25 179.96 3c1g h ILE 361 N 0.78 0.78 -0.15 0.00 2.04 -1.06 -2.35 117.51 117.55 3c1g h ILE 361 Ca 0.38 -0.85 0.05 0.00 1.00 0.00 0.00 64.86 65.44 3c1g h ILE 361 Cb 0.44 1.21 -0.07 0.00 -0.74 0.00 0.00 36.82 37.66 3c1g h ILE 361 CO -0.15 0.16 -0.38 0.74 0.00 0.00 0.00 178.15 178.52 3c1g h THR 362 N -0.79 0.19 -0.51 -0.27 2.02 -0.51 0.57 112.91 113.61 3c1g h THR 362 Ca -0.03 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.25 3c1g h THR 362 Cb 0.51 0.19 -0.10 0.00 -1.74 0.00 0.00 68.15 67.01 3c1g h THR 362 CO 0.05 0.00 -0.22 0.40 0.37 0.00 0.00 175.52 176.12 3c1g h ILE 363 N -0.44 0.34 -0.17 3.11 2.04 -1.00 -1.31 117.51 120.07 3c1g h ILE 363 Ca 0.09 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.83 3c1g h ILE 363 Cb 0.60 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 3c1g h ILE 363 CO -0.40 0.00 -0.37 0.58 0.00 0.00 0.00 178.15 177.96 3c1g h VAL 364 N -0.10 1.34 0.29 1.67 2.07 -0.71 -2.40 116.25 118.41 3c1g h VAL 364 Ca 0.24 -1.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.12 3c1g h VAL 364 Cb 0.47 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 3c1g h VAL 364 CO -0.58 0.50 -0.14 -0.25 0.02 0.00 0.00 177.57 177.12 3c1g h TRP 365 N 0.21 -0.36 -0.85 1.57 2.91 0.25 -2.36 115.95 117.31 3c1g h TRP 365 Ca 0.00 -0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.08 3c1g h TRP 365 Cb 0.98 0.12 -0.05 0.00 -0.51 0.00 0.00 29.16 29.69 3c1g h TRP 365 CO 0.09 -0.16 0.56 1.03 -1.03 0.00 0.00 178.44 178.93 3c1g h SER 366 N -0.50 0.84 0.00 2.65 0.87 -1.34 -2.47 113.55 113.60 3c1g h SER 366 Ca -0.04 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 3c1g h SER 366 Cb 0.37 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.16 3c1g h SER 366 CO 0.07 0.54 -0.00 1.23 -0.53 0.00 0.00 176.83 178.13 3c1g h GLY 367 N 0.95 -1.22 0.11 5.77 0.00 -1.06 0.94 103.07 108.55 3c1g h GLY 367 Ca 0.37 0.53 0.16 0.00 0.00 0.00 0.00 47.33 48.38 3c1g h GLY 367 CO -0.13 -0.46 0.37 -2.08 0.00 0.00 0.00 176.54 174.24 3c1g h VAL 368 N -0.01 0.65 0.06 4.60 2.07 -1.37 0.11 116.25 122.36 3c1g h VAL 368 Ca -0.00 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 3c1g h VAL 368 Cb 0.01 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 3c1g h VAL 368 CO -0.00 0.09 -0.03 0.58 0.02 0.00 0.00 177.57 178.23 3c1g h VAL 369 N 0.51 1.20 -0.53 2.57 2.07 -1.32 -0.30 116.25 120.44 3c1g h VAL 369 Ca 0.46 -0.91 0.05 0.00 0.82 0.00 0.00 66.70 67.12 3c1g h VAL 369 Cb 0.73 1.80 -0.05 0.00 -1.52 0.00 0.00 31.29 32.25 3c1g h VAL 369 CO -0.41 0.23 0.27 0.00 0.02 0.00 0.00 177.57 177.67 3c1g h ALA 370 N 0.42 0.69 -0.48 1.67 0.00 -0.51 0.47 119.26 121.52 3c1g h ALA 370 Ca -0.01 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.01 3c1g h ALA 370 Cb 0.43 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 3c1g h ALA 370 CO 0.01 -0.08 0.07 0.35 0.00 0.00 0.00 179.25 179.61 3c1g h PHE 371 N 0.52 0.11 -0.36 0.00 3.57 -0.82 0.94 116.94 120.89 3c1g h PHE 371 Ca 0.24 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.78 3c1g h PHE 371 Cb 0.15 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 3c1g h PHE 371 CO -0.10 -0.03 0.23 0.82 -2.23 0.00 0.00 178.31 176.99 3c1g h ILE 372 N 0.20 1.07 -0.34 1.41 2.04 -0.42 -1.75 117.51 119.71 3c1g h ILE 372 Ca 0.24 -0.16 0.08 0.00 1.00 0.00 0.00 64.86 66.02 3c1g h ILE 372 Cb 0.33 0.56 -0.08 0.00 -0.74 0.00 0.00 36.82 36.89 3c1g h ILE 372 CO -0.34 0.08 -0.23 1.23 0.00 0.00 0.00 178.15 178.90 3c1g h GLY 373 N 0.46 -0.05 1.51 5.37 0.00 0.15 -0.60 103.07 109.91 3c1g h GLY 373 Ca 0.14 0.29 -0.11 0.00 0.00 0.00 0.00 47.33 47.64 3c1g h GLY 373 CO -0.05 -0.20 -0.31 -0.97 0.00 0.00 0.00 176.54 175.01 3c1g h TYR 374 N -0.19 0.64 -0.16 5.60 0.05 -0.79 -2.52 116.97 119.60 3c1g h TYR 374 Ca 0.17 -0.16 -0.05 0.00 0.05 0.00 0.00 58.73 58.74 3c1g h TYR 374 Cb 0.45 -0.15 -0.00 0.00 1.01 0.00 0.00 36.73 38.04 3c1g h TYR 374 CO -0.43 0.81 -0.09 0.87 -1.05 0.00 0.00 178.16 178.27 3c1g h LYS 375 N 0.48 0.35 0.19 4.88 1.79 -0.90 0.20 116.57 123.56 3c1g h LYS 375 Ca 0.06 -0.15 0.01 0.00 -2.18 0.00 0.00 60.65 58.38 3c1g h LYS 375 Cb 0.78 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.39 3c1g h LYS 375 CO 0.06 0.67 -0.28 1.25 -1.08 0.00 0.00 179.45 180.07 3c1g h LEU 376 N 0.02 -0.78 -0.30 2.94 5.85 -1.12 0.18 115.31 122.10 3c1g h LEU 376 Ca 0.04 0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.91 3c1g h LEU 376 Cb 0.57 0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.80 3c1g h LEU 376 CO 0.03 -0.39 -0.22 0.00 -0.34 0.00 0.00 178.44 177.52 3c1g h ALA 377 N 0.12 -0.04 -0.73 1.25 0.00 -1.44 0.62 119.26 119.04 3c1g h ALA 377 Ca 0.01 0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.12 3c1g h ALA 377 Cb 0.53 0.49 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 3c1g h ALA 377 CO -0.12 -0.62 0.37 0.22 0.00 0.00 0.00 179.25 179.10 3c1g h ASP 378 N -0.20 0.49 0.77 0.00 3.58 -0.15 0.37 116.42 121.28 3c1g h ASP 378 Ca 0.16 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.67 3c1g h ASP 378 Cb 0.44 -0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.47 3c1g h ASP 378 CO -0.42 0.27 -0.05 0.18 -2.88 0.00 0.00 179.24 176.35 3c1g n LEU 379 N -4.85 0.08 -0.10 2.28 4.77 0.60 -2.26 117.00 117.53 3c1g n LEU 379 Ca 0.12 0.35 -0.18 0.00 -0.03 0.00 0.00 56.01 56.27 3c1g n LEU 379 Cb 0.29 -0.38 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 3c1g n LEU 379 CO 0.25 0.02 -0.99 0.41 -1.33 0.00 0.00 177.39 175.74 3c1g n THR 380 N -1.38 1.36 0.00 -5.08 -1.04 0.15 -4.87 114.28 103.42 3c1g n THR 380 Ca 0.10 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 3c1g n THR 380 Cb 0.30 -2.00 0.00 0.00 -1.82 0.00 0.00 70.33 66.82 3c1g n THR 380 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 3c1g n VAL 381 N -4.16 0.00 0.00 12.58 0.24 0.11 -5.08 118.33 122.02 3c1g n VAL 381 Ca -0.31 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 61.77 3c1g n VAL 381 Cb 0.66 0.71 0.00 0.00 -1.47 0.00 0.00 33.84 33.74 3c1g n VAL 381 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3c1g n GLY 382 N 1.54 -0.60 0.09 7.63 0.00 -0.78 -4.97 105.19 108.10 3c1g n GLY 382 Ca 0.00 -1.46 -0.14 0.00 0.00 0.00 0.00 46.02 44.42 3c1g n GLY 382 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3c1g h LEU 383 N 0.00 0.00 -9.87 0.99 3.38 -1.81 -3.42 115.31 104.57 3c1g h LEU 383 Ca 0.00 -0.35 -0.49 0.00 0.09 0.00 0.00 57.88 57.13 3c1g h LEU 383 Cb 0.00 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.76 3c1g h LEU 383 CO 0.00 1.16 0.43 0.00 0.09 0.00 0.00 178.44 180.12 3c1g s ARG 384 N -2.27 4.46 0.24 1.13 1.70 -1.26 -0.29 118.95 122.66 3c1g s ARG 384 Ca -0.22 1.62 -0.31 0.00 -0.47 0.00 0.00 55.73 56.35 3c1g s ARG 384 Cb 0.04 -2.91 -0.14 0.00 -0.57 0.00 0.00 34.95 31.37 3c1g s ARG 384 CO 0.45 0.10 1.36 0.28 -1.08 0.00 0.00 175.30 176.41 3c1g n VAL 385 N 0.66 1.01 1.36 4.99 0.31 -1.25 -4.52 118.33 120.89 3c1g n VAL 385 Ca 0.01 -0.25 0.11 0.00 -0.01 0.00 0.00 64.34 64.20 3c1g n VAL 385 Cb 0.47 -1.39 0.65 0.00 -0.91 0.00 0.00 33.84 32.66 3c1g n VAL 385 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70