#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sui n SER 22 N 0.00 3.29 -0.76 3.14 2.88 -1.26 -5.05 113.62 115.86 1sui n SER 22 Ca 0.00 -3.08 0.07 0.00 -1.33 0.00 0.00 58.87 54.52 1sui n SER 22 Cb 0.00 0.32 0.18 0.00 -0.75 0.00 0.00 64.21 63.96 1sui n SER 22 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1sui n LEU 23 N 0.00 3.13 0.00 2.46 4.77 -1.26 -5.00 117.00 121.09 1sui n LEU 23 Ca -0.19 -2.04 0.00 0.00 -0.03 0.00 0.00 56.01 53.75 1sui n LEU 23 Cb 0.60 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 1sui n LEU 23 CO 0.33 0.77 0.00 0.18 -1.33 0.00 0.00 177.39 177.33 1sui n LEU 24 N 0.64 0.00 -0.05 2.23 4.77 -1.26 -5.05 117.00 118.28 1sui n LEU 24 Ca 0.14 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 56.03 1sui n LEU 24 Cb 0.48 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.42 1sui n LEU 24 CO 0.10 0.00 -0.80 0.00 -1.33 0.00 0.00 177.39 175.36 1sui n GLN 25 N 0.00 0.66 -3.71 3.23 6.02 -1.26 -4.99 117.38 117.33 1sui n GLN 25 Ca 0.00 0.16 -0.14 0.00 -0.01 0.00 0.00 57.00 57.01 1sui n GLN 25 Cb 0.00 -1.67 -0.08 0.00 1.02 0.00 0.00 30.24 29.50 1sui n GLN 25 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1sui s SER 26 N -5.82 -0.32 0.62 1.08 1.04 -1.26 -4.98 113.70 104.07 1sui s SER 26 Ca -0.07 0.32 0.29 0.00 0.48 0.00 0.00 55.95 56.97 1sui s SER 26 Cb 0.07 0.43 1.59 0.00 0.10 0.00 0.00 66.02 68.21 1sui s SER 26 CO 0.83 -0.44 1.96 0.44 0.98 0.00 0.00 173.24 177.01 1sui h ASP 27 N 3.92 0.00 0.48 7.02 3.32 -1.98 -1.61 116.42 127.57 1sui h ASP 27 Ca -0.29 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.46 1sui h ASP 27 Cb 1.17 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.74 1sui h ASP 27 CO 0.38 0.00 -1.34 0.00 -1.72 0.00 0.00 179.24 176.55 1sui h ALA 28 N 1.49 -0.01 -0.29 3.45 0.00 -1.95 0.13 119.26 122.08 1sui h ALA 28 Ca 0.11 -0.88 -0.02 0.00 0.00 0.00 0.00 54.91 54.12 1sui h ALA 28 Cb 0.83 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1sui h ALA 28 CO -0.00 0.86 0.09 1.25 0.00 0.00 0.00 179.25 181.45 1sui h LEU 29 N 0.10 0.42 -0.54 0.00 6.46 -1.68 0.20 115.31 120.26 1sui h LEU 29 Ca -0.19 -0.20 -0.06 0.00 -0.12 0.00 0.00 57.88 57.31 1sui h LEU 29 Cb 2.06 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 41.86 1sui h LEU 29 CO 0.23 0.51 0.11 0.22 -0.62 0.00 0.00 178.44 178.89 1sui h TYR 30 N 0.30 0.93 -0.49 1.25 5.03 -1.63 -2.34 116.97 120.02 1sui h TYR 30 Ca 0.09 -0.12 0.11 0.00 2.58 0.00 0.00 58.73 61.39 1sui h TYR 30 Cb 0.24 -0.26 -0.03 0.00 1.55 0.00 0.00 36.73 38.23 1sui h TYR 30 CO 0.00 0.82 0.34 0.37 -1.32 0.00 0.00 178.16 178.37 1sui h GLN 31 N 0.78 0.19 0.12 1.82 5.75 -0.01 -1.65 115.11 122.10 1sui h GLN 31 Ca 0.17 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.65 1sui h GLN 31 Cb 0.37 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.88 1sui h GLN 31 CO 0.01 0.13 -0.06 -0.92 -2.65 0.00 0.00 178.83 175.34 1sui h TYR 32 N 0.20 -0.14 -0.64 3.99 3.20 -0.12 -2.62 116.97 120.84 1sui h TYR 32 Ca 0.23 -0.00 0.19 0.00 3.14 0.00 0.00 58.73 62.28 1sui h TYR 32 Cb 0.64 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.94 1sui h TYR 32 CO -0.00 0.35 0.55 0.82 -1.64 0.00 0.00 178.16 178.24 1sui h ILE 33 N -0.79 0.45 0.01 1.81 2.04 -1.00 -0.64 117.51 119.40 1sui h ILE 33 Ca -0.02 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 1sui h ILE 33 Cb 0.56 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 1sui h ILE 33 CO 0.03 0.00 -0.09 -0.07 0.00 0.00 0.00 178.15 178.01 1sui h LEU 34 N 0.00 0.06 0.77 1.44 3.38 -1.29 -3.17 115.31 116.50 1sui h LEU 34 Ca 0.30 -0.92 -0.04 0.00 0.09 0.00 0.00 57.88 57.31 1sui h LEU 34 Cb 1.41 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 42.15 1sui h LEU 34 CO -0.00 0.98 -0.37 -0.33 0.09 0.00 0.00 178.44 178.80 1sui h GLU 35 N -0.85 -1.00 -2.17 1.13 4.39 -0.77 -2.50 114.58 112.82 1sui h GLU 35 Ca -0.02 0.07 -0.66 0.00 0.34 0.00 0.00 59.36 59.09 1sui h GLU 35 Cb 1.00 0.23 -0.20 0.00 -0.10 0.00 0.00 28.75 29.68 1sui h GLU 35 CO 0.02 -0.67 1.08 0.25 -1.16 0.00 0.00 179.01 178.53 1sui n THR 36 N -4.84 4.21 0.00 1.13 -2.24 -0.57 -4.38 114.28 107.59 1sui n THR 36 Ca -0.13 -4.05 0.00 0.00 -2.27 0.00 0.00 64.05 57.60 1sui n THR 36 Cb 0.41 -1.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 1sui n THR 36 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1sui n SER 37 N 0.56 0.00 0.00 3.42 2.88 -1.25 -4.90 113.62 114.33 1sui n SER 37 Ca 0.53 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1sui n SER 37 Cb 0.36 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 1sui n SER 37 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1sui n VAL 38 N -0.06 0.00 -0.26 2.46 0.24 -1.20 -3.40 118.33 116.11 1sui n VAL 38 Ca 0.00 1.47 0.17 0.00 -2.04 0.00 0.00 64.34 63.94 1sui n VAL 38 Cb 0.00 -2.45 0.33 0.00 -1.47 0.00 0.00 33.84 30.24 1sui n VAL 38 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1sui n PHE 39 N -1.92 0.68 -2.13 6.34 3.01 -0.94 -4.06 117.46 118.44 1sui n PHE 39 Ca 0.00 0.94 -0.40 0.00 1.01 0.00 0.00 57.45 58.99 1sui n PHE 39 Cb 0.00 -1.20 -0.03 0.00 -0.01 0.00 0.00 39.48 38.25 1sui n PHE 39 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 1sui s PRO 40 N -5.49 2.94 0.03 -1.08 0.02 -1.22 -4.55 135.00 125.66 1sui s PRO 40 Ca -0.09 0.72 0.00 0.00 0.02 0.00 0.00 61.00 61.66 1sui s PRO 40 Cb 0.25 -4.28 0.00 0.00 0.02 0.00 0.00 34.50 30.48 1sui s PRO 40 CO 0.61 -2.35 0.00 0.54 -0.33 0.00 0.00 177.00 175.47 1sui n ARG 41 N 8.91 -4.21 -2.68 5.54 3.00 -1.26 -4.91 116.66 121.04 1sui n ARG 41 Ca 0.19 3.15 -0.05 0.00 -0.01 0.00 0.00 57.85 61.12 1sui n ARG 41 Cb 0.50 -3.87 0.08 0.00 0.00 0.00 0.00 32.46 29.17 1sui n ARG 41 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1sui n GLU 42 N 1.48 0.54 0.00 5.56 -0.00 -1.26 -4.97 120.64 121.99 1sui n GLU 42 Ca 0.00 -1.18 0.00 0.00 -0.00 0.00 0.00 57.16 55.98 1sui n GLU 42 Cb 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 31.44 31.14 1sui n GLU 42 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.13 174.74 1sui n HIS 43 N 0.01 0.00 0.00 -1.84 -0.00 -1.26 -4.44 115.22 107.69 1sui n HIS 43 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.64 1sui n HIS 43 Cb 0.73 -0.34 0.00 0.00 -0.00 0.00 0.00 29.99 30.38 1sui n HIS 43 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 1sui n GLU 44 N -1.83 0.00 -0.34 -1.40 2.13 -1.26 -4.58 120.64 113.36 1sui n GLU 44 Ca 0.00 0.00 0.20 0.00 0.66 0.00 0.00 57.16 58.02 1sui n GLU 44 Cb 0.00 -0.18 0.42 0.00 0.27 0.00 0.00 31.44 31.95 1sui n GLU 44 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1sui h ALA 45 N 0.00 1.86 -0.91 4.31 0.00 -1.95 0.93 119.26 123.51 1sui h ALA 45 Ca 0.00 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1sui h ALA 45 Cb 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 1sui h ALA 45 CO 0.00 -0.39 0.60 0.52 0.00 0.00 0.00 179.25 179.98 1sui h MET 46 N 0.48 1.18 0.08 0.00 2.86 -1.81 0.11 114.93 117.84 1sui h MET 46 Ca 0.68 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 58.24 1sui h MET 46 Cb 1.40 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 32.79 1sui h MET 46 CO -0.52 0.78 -0.04 0.87 1.06 0.00 0.00 176.91 179.06 1sui h LYS 47 N 1.21 -0.11 -0.16 1.72 1.79 0.45 -2.49 116.57 118.99 1sui h LYS 47 Ca 0.34 0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.86 1sui h LYS 47 Cb -0.12 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 30.51 1sui h LYS 47 CO -0.08 0.25 -0.15 1.49 -1.08 0.00 0.00 179.45 179.88 1sui h GLU 48 N -0.48 -0.16 -0.44 3.15 4.81 -0.55 -2.10 114.58 118.80 1sui h GLU 48 Ca -0.01 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 1sui h GLU 48 Cb 0.41 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.74 1sui h GLU 48 CO 0.02 -0.11 -0.09 1.25 -0.73 0.00 0.00 179.01 179.35 1sui h LEU 49 N -0.17 -0.38 -2.10 1.64 5.85 -0.81 -1.36 115.31 117.99 1sui h LEU 49 Ca 0.10 0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 1sui h LEU 49 Cb 0.32 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 1sui h LEU 49 CO -0.26 -0.13 -0.08 0.03 -0.34 0.00 0.00 178.44 177.66 1sui h ARG 50 N 0.01 0.00 -0.87 1.25 3.08 -0.96 0.16 114.38 117.06 1sui h ARG 50 Ca 0.21 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.34 1sui h ARG 50 Cb 0.33 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.31 1sui h ARG 50 CO -0.44 0.08 0.54 0.93 -1.07 0.00 0.00 179.97 180.00 1sui h GLU 51 N 0.00 0.92 0.07 0.04 5.08 -0.59 -2.96 114.58 117.14 1sui h GLU 51 Ca -0.00 -0.06 -0.35 0.00 -1.00 0.00 0.00 59.36 57.96 1sui h GLU 51 Cb 0.21 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1sui h GLU 51 CO 0.01 0.61 -1.98 0.28 -1.00 0.00 0.00 179.01 176.93 1sui n VAL 52 N -4.64 1.69 0.00 3.13 0.31 -0.82 -4.11 118.33 113.89 1sui n VAL 52 Ca 0.13 -0.70 0.00 0.00 -0.01 0.00 0.00 64.34 63.77 1sui n VAL 52 Cb 0.22 -1.44 0.00 0.00 -0.91 0.00 0.00 33.84 31.70 1sui n VAL 52 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1sui n THR 53 N -3.30 0.00 1.10 2.52 -1.04 0.52 0.57 114.28 114.65 1sui n THR 53 Ca -0.29 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 61.84 1sui n THR 53 Cb 1.05 -0.98 0.15 0.00 -1.82 0.00 0.00 70.33 68.73 1sui n THR 53 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1sui n ALA 54 N -0.95 3.21 -0.11 2.41 0.00 -1.14 -4.34 120.51 119.59 1sui n ALA 54 Ca 0.00 -0.58 -0.21 0.00 0.00 0.00 0.00 53.44 52.65 1sui n ALA 54 Cb 0.00 -0.91 -0.10 0.00 0.00 0.00 0.00 19.45 18.44 1sui n ALA 54 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1sui n LYS 55 N 0.03 0.56 -1.55 0.00 0.00 0.19 -4.86 118.16 112.53 1sui n LYS 55 Ca 0.11 0.47 -0.52 0.00 -0.00 0.00 0.00 58.31 58.37 1sui n LYS 55 Cb 0.45 -1.66 -0.07 0.00 -0.00 0.00 0.00 35.03 33.75 1sui n LYS 55 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 1sui n HIS 56 N -4.41 1.84 -0.18 5.58 1.44 -1.25 -4.78 115.22 113.47 1sui n HIS 56 Ca -0.34 0.31 0.17 0.00 -2.01 0.00 0.00 57.72 55.84 1sui n HIS 56 Cb 0.68 -2.53 0.31 0.00 0.12 0.00 0.00 29.99 28.57 1sui n HIS 56 CO 0.00 0.00 0.00 -2.30 -2.81 0.00 0.00 176.34 171.23 1sui n PRO 57 N 7.18 -0.04 -1.86 -1.40 -0.02 -1.26 -1.55 135.00 136.05 1sui n PRO 57 Ca 0.34 0.80 -0.35 0.00 -2.02 0.00 0.00 63.50 62.27 1sui n PRO 57 Cb 0.21 -1.40 -0.01 0.00 -0.02 0.00 0.00 33.50 32.28 1sui n PRO 57 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1sui n TRP 58 N -4.35 2.36 0.46 6.00 8.01 -1.26 -4.54 117.44 124.12 1sui n TRP 58 Ca 0.20 -2.28 0.13 0.00 -1.31 0.00 0.00 57.50 54.25 1sui n TRP 58 Cb 0.69 -1.36 0.42 0.00 -2.01 0.00 0.00 31.31 29.05 1sui n TRP 58 CO 0.00 0.00 0.00 -2.95 -1.01 0.00 0.00 177.69 173.73 1sui h ASN 59 N 3.40 0.00 0.00 -0.99 7.08 -1.52 -3.18 115.58 120.36 1sui h ASN 59 Ca 0.52 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.74 1sui h ASN 59 Cb 0.37 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.61 1sui h ASN 59 CO 1.19 0.00 0.00 0.00 -2.08 0.00 0.00 177.43 176.54 1sui n ILE 60 N -2.49 0.00 -0.02 6.14 0.13 -1.26 -1.67 119.36 120.19 1sui n ILE 60 Ca 0.04 0.00 -0.02 0.00 -1.10 0.00 0.00 62.75 61.67 1sui n ILE 60 Cb 0.38 -0.47 -0.04 0.00 -0.84 0.00 0.00 39.64 38.68 1sui n ILE 60 CO 0.00 0.00 0.00 0.23 2.80 0.00 0.00 176.55 179.58 1sui n MET 61 N -0.61 3.09 -1.50 9.51 2.81 -1.20 -5.03 117.12 124.19 1sui n MET 61 Ca 0.02 -0.00 -0.53 0.00 -1.81 0.00 0.00 57.70 55.37 1sui n MET 61 Cb 0.01 -1.12 -0.05 0.00 -0.71 0.00 0.00 33.22 31.34 1sui n MET 61 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1sui n THR 62 N -2.16 0.82 -2.22 2.03 -1.04 -0.67 -4.84 114.28 106.20 1sui n THR 62 Ca -0.08 -0.21 -0.41 0.00 -2.04 0.00 0.00 64.05 61.32 1sui n THR 62 Cb 0.64 -0.28 -0.03 0.00 -1.82 0.00 0.00 70.33 68.84 1sui n THR 62 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1sui s THR 63 N -0.32 2.94 0.32 12.58 -1.32 -1.26 -4.98 115.64 123.60 1sui s THR 63 Ca 0.78 0.95 -0.28 0.00 -1.21 0.00 0.00 61.69 61.93 1sui s THR 63 Cb -1.04 -3.60 -0.09 0.00 -1.51 0.00 0.00 72.50 66.26 1sui s THR 63 CO 0.55 0.22 1.12 -0.94 -2.21 0.00 0.00 174.62 173.37 1sui s SER 64 N -0.58 7.03 0.45 8.08 1.04 -1.26 -4.84 113.70 123.62 1sui s SER 64 Ca 0.48 2.28 0.24 0.00 0.48 0.00 0.00 55.95 59.43 1sui s SER 64 Cb -0.37 -2.62 1.24 0.00 0.10 0.00 0.00 66.02 64.36 1sui s SER 64 CO 0.49 -0.32 1.82 0.00 0.98 0.00 0.00 173.24 176.21 1sui h ALA 65 N 3.38 2.48 -0.50 5.32 0.00 -1.98 0.68 119.26 128.65 1sui h ALA 65 Ca -0.47 0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.55 1sui h ALA 65 Cb 1.22 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1sui h ALA 65 CO 0.65 -0.82 -0.30 0.22 0.00 0.00 0.00 179.25 179.01 1sui h ASP 66 N 0.26 -1.01 0.35 0.00 1.82 -1.98 -0.18 116.42 115.69 1sui h ASP 66 Ca 0.53 0.20 -0.22 0.00 -0.39 0.00 0.00 57.03 57.15 1sui h ASP 66 Cb 1.59 0.50 0.00 0.00 0.68 0.00 0.00 39.33 42.10 1sui h ASP 66 CO -0.17 -0.29 -0.92 -0.08 -1.61 0.00 0.00 179.24 176.17 1sui h GLU 67 N -0.18 0.39 -1.00 0.28 4.81 -0.12 -3.23 114.58 115.53 1sui h GLU 67 Ca 0.21 -0.41 0.15 0.00 -0.13 0.00 0.00 59.36 59.18 1sui h GLU 67 Cb 0.52 0.12 -0.09 0.00 0.63 0.00 0.00 28.75 29.93 1sui h GLU 67 CO -0.60 1.08 0.62 0.78 -0.73 0.00 0.00 179.01 180.17 1sui h GLY 68 N 1.30 1.67 0.74 1.92 0.00 0.48 -1.92 103.07 107.26 1sui h GLY 68 Ca -0.07 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 1sui h GLY 68 CO 0.16 0.06 -0.02 -1.61 0.00 0.00 0.00 176.54 175.13 1sui h GLN 69 N 0.88 -0.06 -0.93 4.80 4.15 -1.10 -2.74 115.11 120.11 1sui h GLN 69 Ca 0.53 0.00 0.20 0.00 0.77 0.00 0.00 58.65 60.15 1sui h GLN 69 Cb 0.68 0.01 -0.11 0.00 0.21 0.00 0.00 27.48 28.27 1sui h GLN 69 CO -0.31 0.21 0.49 0.35 -1.93 0.00 0.00 178.83 177.64 1sui h PHE 70 N -0.32 0.85 0.42 3.99 3.57 -1.42 -1.68 116.94 122.35 1sui h PHE 70 Ca -0.01 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 1sui h PHE 70 Cb 0.29 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.80 1sui h PHE 70 CO 0.01 0.11 -0.20 -0.07 -2.23 0.00 0.00 178.31 175.93 1sui h LEU 71 N 0.58 -0.48 -0.89 0.59 3.38 -1.40 -2.12 115.31 114.97 1sui h LEU 71 Ca 0.55 -0.10 0.24 0.00 0.09 0.00 0.00 57.88 58.66 1sui h LEU 71 Cb 0.93 0.12 -0.15 0.00 0.09 0.00 0.00 40.66 41.65 1sui h LEU 71 CO -0.44 -0.14 0.21 0.28 0.09 0.00 0.00 178.44 178.45 1sui h SER 72 N -0.86 -0.06 -0.25 -0.43 0.02 -1.09 0.16 113.55 111.04 1sui h SER 72 Ca -0.06 0.21 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1sui h SER 72 Cb 0.56 0.30 -0.01 0.00 0.14 0.00 0.00 62.40 63.38 1sui h SER 72 CO 0.10 -0.19 0.11 -0.03 -1.14 0.00 0.00 176.83 175.67 1sui h MET 73 N 0.17 0.36 -0.30 3.45 -1.53 -1.27 -3.06 114.93 112.76 1sui h MET 73 Ca 0.56 -0.06 -0.05 0.00 -3.44 0.00 0.00 59.70 56.71 1sui h MET 73 Cb 1.15 -0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 32.13 1sui h MET 73 CO -0.69 0.39 -0.05 1.25 0.14 0.00 0.00 176.91 177.95 1sui h LEU 74 N 0.25 0.45 -0.87 3.39 5.85 -0.04 -1.07 115.31 123.27 1sui h LEU 74 Ca 0.08 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.62 1sui h LEU 74 Cb 0.16 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1sui h LEU 74 CO -0.01 0.55 -0.42 -0.07 -0.34 0.00 0.00 178.44 178.16 1sui h LEU 75 N 0.46 0.00 0.04 2.25 4.07 -1.18 -2.97 115.31 117.97 1sui h LEU 75 Ca 0.09 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.77 1sui h LEU 75 Cb 0.37 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.08 1sui h LEU 75 CO 0.02 0.42 -1.54 0.11 -1.08 0.00 0.00 178.44 176.37 1sui h LYS 76 N 0.00 0.09 0.00 1.13 1.79 -1.39 -0.99 116.57 117.21 1sui h LYS 76 Ca -0.00 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 58.31 1sui h LYS 76 Cb 0.95 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.66 1sui h LYS 76 CO 0.05 0.83 0.00 1.28 -1.08 0.00 0.00 179.45 180.53 1sui n LEU 77 N -3.26 0.00 0.00 2.94 4.77 -0.43 -3.51 117.00 117.51 1sui n LEU 77 Ca -0.14 0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1sui n LEU 77 Cb 1.03 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 42.02 1sui n LEU 77 CO 0.47 -0.02 -0.02 2.30 -1.33 0.00 0.00 177.39 178.78 1sui n ILE 78 N -1.10 0.00 -2.57 -0.08 -5.35 -1.13 -5.06 119.36 104.07 1sui n ILE 78 Ca 0.16 -0.07 -0.04 0.00 -0.27 0.00 0.00 62.75 62.54 1sui n ILE 78 Cb 0.12 0.78 -0.03 0.00 -1.74 0.00 0.00 39.64 38.77 1sui n ILE 78 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1sui n ASN 79 N -0.19 -2.87 -4.27 7.28 3.02 -0.39 -4.96 115.26 112.88 1sui n ASN 79 Ca 0.00 1.31 -0.44 0.00 -0.03 0.00 0.00 54.58 55.42 1sui n ASN 79 Cb 0.00 -5.07 -0.06 0.00 -0.61 0.00 0.00 39.78 34.04 1sui n ASN 79 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sui s ALA 80 N -0.95 3.57 0.00 5.41 0.00 -1.10 -4.96 121.76 123.73 1sui s ALA 80 Ca -0.18 -2.60 -0.01 0.00 0.00 0.00 0.00 51.96 49.17 1sui s ALA 80 Cb 0.01 -3.10 -0.01 0.00 0.00 0.00 0.00 23.12 20.03 1sui s ALA 80 CO 0.75 -1.99 0.74 0.87 0.00 0.00 0.00 175.76 176.13 1sui h LYS 81 N 8.63 -0.03 -5.38 0.00 1.79 -1.94 -3.43 116.57 116.21 1sui h LYS 81 Ca -0.24 0.00 -0.64 0.00 -2.18 0.00 0.00 60.65 57.59 1sui h LYS 81 Cb 1.08 0.01 -0.21 0.00 -1.58 0.00 0.00 32.23 31.53 1sui h LYS 81 CO 0.95 -0.02 -0.66 1.21 -1.08 0.00 0.00 179.45 179.85 1sui s ASN 82 N -2.35 4.87 0.00 0.86 2.47 -1.26 -3.12 114.94 116.41 1sui s ASN 82 Ca -0.00 -0.09 0.00 0.00 0.42 0.00 0.00 52.86 53.18 1sui s ASN 82 Cb 0.00 -1.75 0.00 0.00 -1.45 0.00 0.00 41.25 38.05 1sui s ASN 82 CO 0.01 0.19 0.00 0.35 -3.72 0.00 0.00 177.10 173.94 1sui n THR 83 N 3.38 0.00 -3.63 -5.21 -2.24 -0.98 -1.34 114.28 104.26 1sui n THR 83 Ca -0.17 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.57 1sui n THR 83 Cb 0.53 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.72 1sui n THR 83 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1sui s MET 84 N 0.05 0.15 -0.13 -0.78 1.75 -0.66 -3.52 119.30 116.16 1sui s MET 84 Ca 0.00 -0.01 -0.04 0.00 -1.25 0.00 0.00 55.69 54.38 1sui s MET 84 Cb 0.00 0.07 0.06 0.00 2.84 0.00 0.00 34.83 37.80 1sui s MET 84 CO 0.00 -0.06 0.23 -2.00 -0.65 0.00 0.00 175.02 172.55 1sui s GLU 85 N -1.62 0.13 -0.46 4.11 2.12 -1.23 -1.98 118.70 119.77 1sui s GLU 85 Ca 0.09 0.65 -0.23 0.00 0.36 0.00 0.00 54.97 55.84 1sui s GLU 85 Cb -0.01 -0.22 0.03 0.00 0.26 0.00 0.00 34.13 34.19 1sui s GLU 85 CO -0.05 -0.33 0.79 0.42 -0.54 0.00 0.00 175.26 175.54 1sui s ILE 86 N 2.38 4.64 0.00 -3.70 1.01 -0.55 -2.08 121.20 122.90 1sui s ILE 86 Ca 0.02 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.06 1sui s ILE 86 Cb -0.12 -4.33 0.00 0.00 0.01 0.00 0.00 42.46 38.01 1sui s ILE 86 CO -0.08 -0.74 0.00 0.61 0.00 0.00 0.00 174.94 174.72 1sui n GLY 87 N 5.00 0.58 0.00 6.18 0.00 0.33 -1.12 105.19 116.16 1sui n GLY 87 Ca 0.02 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1sui n GLY 87 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1sui n VAL 88 N 2.56 0.00 -1.91 1.61 0.31 -1.22 -4.72 118.33 114.95 1sui n VAL 88 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1sui n VAL 88 Cb 0.00 -0.44 0.00 0.00 -0.91 0.00 0.00 33.84 32.49 1sui n VAL 88 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1sui n TYR 89 N -0.93 -3.68 0.00 3.52 9.36 -1.26 -4.11 117.16 120.06 1sui n TYR 89 Ca 0.00 2.20 0.00 0.00 3.32 0.00 0.00 57.90 63.42 1sui n TYR 89 Cb 0.00 -3.36 0.00 0.00 -0.63 0.00 0.00 39.34 35.35 1sui n TYR 89 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1sui n THR 90 N 1.40 0.00 0.00 2.97 -1.04 -1.23 -4.06 114.28 112.31 1sui n THR 90 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1sui n THR 90 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1sui n THR 90 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1sui n GLY 91 N 0.00 1.18 0.45 3.41 0.00 -1.26 -3.89 105.19 105.08 1sui n GLY 91 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1sui n GLY 91 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1sui h TYR 92 N 0.00 -1.05 0.00 1.61 5.03 -1.86 1.42 116.97 122.12 1sui h TYR 92 Ca 0.00 -0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.29 1sui h TYR 92 Cb 0.00 0.36 0.00 0.00 1.55 0.00 0.00 36.73 38.64 1sui h TYR 92 CO 0.00 -0.63 0.05 0.66 -1.32 0.00 0.00 178.16 176.92 1sui h SER 93 N -1.08 0.00 0.04 -2.11 4.64 -1.88 -2.23 113.55 110.93 1sui h SER 93 Ca -0.10 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.84 1sui h SER 93 Cb 0.84 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.88 1sui h SER 93 CO 0.15 0.00 -2.20 -0.11 -0.87 0.00 0.00 176.83 173.80 1sui n LEU 94 N -2.49 2.60 -0.29 5.97 -0.00 -0.65 -3.96 117.00 118.18 1sui n LEU 94 Ca -0.02 0.11 0.22 0.00 -0.00 0.00 0.00 56.01 56.32 1sui n LEU 94 Cb 0.10 -0.97 0.53 0.00 -0.00 0.00 0.00 43.42 43.07 1sui n LEU 94 CO 0.12 0.79 1.23 0.25 -0.00 0.00 0.00 177.39 179.78 1sui h LEU 95 N -0.23 0.40 0.41 -1.96 6.46 0.25 0.96 115.31 121.60 1sui h LEU 95 Ca -0.52 0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.28 1sui h LEU 95 Cb 1.84 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 41.76 1sui h LEU 95 CO -0.09 0.12 -0.20 0.00 -0.62 0.00 0.00 178.44 177.65 1sui h ALA 96 N 1.60 -0.55 -0.99 1.25 0.00 -1.70 0.86 119.26 119.73 1sui h ALA 96 Ca 0.54 -0.19 0.25 0.00 0.00 0.00 0.00 54.91 55.51 1sui h ALA 96 Cb 1.41 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 19.34 1sui h ALA 96 CO -0.22 -0.65 0.66 1.15 0.00 0.00 0.00 179.25 180.19 1sui h THR 97 N -0.88 0.58 0.23 0.00 2.02 -1.08 -0.53 112.91 113.26 1sui h THR 97 Ca -0.06 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.00 1sui h THR 97 Cb 0.55 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1sui h THR 97 CO 0.09 0.06 -0.11 0.00 0.37 0.00 0.00 175.52 175.93 1sui h ALA 98 N 1.59 -0.31 0.00 6.16 0.00 -0.62 -2.92 119.26 123.15 1sui h ALA 98 Ca 0.52 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.23 1sui h ALA 98 Cb 1.47 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.38 1sui h ALA 98 CO -0.19 -0.34 -0.12 -0.07 0.00 0.00 0.00 179.25 178.53 1sui h LEU 99 N -0.98 0.00 0.09 0.00 3.38 -0.38 -3.21 115.31 114.21 1sui h LEU 99 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1sui h LEU 99 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1sui h LEU 99 CO 0.05 0.12 -0.04 0.00 0.09 0.00 0.00 178.44 178.66 1sui h ALA 100 N 1.88 -0.12 -2.34 1.53 0.00 -1.21 -3.46 119.26 115.54 1sui h ALA 100 Ca -0.00 -0.22 -0.55 0.00 0.00 0.00 0.00 54.91 54.14 1sui h ALA 100 Cb 0.29 0.05 0.20 0.00 0.00 0.00 0.00 17.79 18.33 1sui h ALA 100 CO 0.02 -0.15 -0.43 0.44 0.00 0.00 0.00 179.25 179.13 1sui n ILE 101 N -4.82 1.04 0.00 0.00 -5.35 -1.10 -4.91 119.36 104.22 1sui n ILE 101 Ca -0.06 -0.30 0.00 0.00 -0.27 0.00 0.00 62.75 62.13 1sui n ILE 101 Cb 0.23 -0.72 0.00 0.00 -1.74 0.00 0.00 39.64 37.41 1sui n ILE 101 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1sui n PRO 102 N -1.30 2.96 -0.00 6.28 -0.04 -1.26 -4.96 135.00 136.68 1sui n PRO 102 Ca 0.09 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.59 1sui n PRO 102 Cb 0.52 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.92 1sui n PRO 102 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1sui n GLU 103 N 0.00 2.61 0.01 0.54 4.07 -1.26 -4.54 120.64 122.06 1sui n GLU 103 Ca 0.00 -0.03 0.11 0.00 -0.06 0.00 0.00 57.16 57.18 1sui n GLU 103 Cb 0.00 -1.02 -0.00 0.00 -0.06 0.00 0.00 31.44 30.36 1sui n GLU 103 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 1sui n ASP 104 N -1.44 0.73 -4.79 4.31 5.75 -1.26 -4.97 116.55 114.88 1sui n ASP 104 Ca 0.00 -0.57 -0.33 0.00 -0.01 0.00 0.00 54.79 53.88 1sui n ASP 104 Cb 0.17 0.83 0.03 0.00 -1.03 0.00 0.00 41.12 41.12 1sui n ASP 104 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1sui s GLY 105 N -3.25 2.13 -0.04 6.12 0.00 -1.25 -4.93 107.32 106.09 1sui s GLY 105 Ca 0.07 0.45 -0.02 0.00 0.00 0.00 0.00 44.72 45.22 1sui s GLY 105 CO 0.82 0.79 0.10 0.54 0.00 0.00 0.00 173.10 175.34 1sui s LYS 106 N -4.11 0.06 0.20 2.90 3.01 -1.18 -4.56 119.74 116.06 1sui s LYS 106 Ca 0.65 0.24 0.04 0.00 -1.01 0.00 0.00 55.97 55.89 1sui s LYS 106 Cb -0.18 -0.11 -0.03 0.00 -1.01 0.00 0.00 37.83 36.50 1sui s LYS 106 CO 0.39 -0.11 0.30 0.42 0.51 0.00 0.00 175.35 176.86 1sui s ILE 107 N 0.73 5.15 -0.57 2.17 1.01 0.53 -2.33 121.20 127.89 1sui s ILE 107 Ca -0.06 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.74 1sui s ILE 107 Cb -0.08 -3.73 0.24 0.00 0.01 0.00 0.00 42.46 38.90 1sui s ILE 107 CO -0.03 -0.22 0.63 0.18 0.00 0.00 0.00 174.94 175.50 1sui n LEU 108 N -0.97 2.49 -4.76 2.97 7.99 -1.23 0.26 117.00 123.75 1sui n LEU 108 Ca -0.08 -5.16 -0.35 0.00 -0.01 0.00 0.00 56.01 50.41 1sui n LEU 108 Cb 0.56 -0.26 0.03 0.00 -0.11 0.00 0.00 43.42 43.64 1sui n LEU 108 CO 0.46 2.01 0.81 0.00 -1.51 0.00 0.00 177.39 179.16 1sui s ALA 109 N -1.87 2.53 -0.12 -1.18 0.00 -0.83 -3.56 121.76 116.73 1sui s ALA 109 Ca 0.36 0.89 -0.09 0.00 0.00 0.00 0.00 51.96 53.13 1sui s ALA 109 Cb 0.13 -3.41 0.04 0.00 0.00 0.00 0.00 23.12 19.87 1sui s ALA 109 CO -0.07 -1.14 0.31 -1.64 0.00 0.00 0.00 175.76 173.22 1sui s MET 110 N -3.47 0.32 -0.28 0.00 -1.94 -0.88 -2.19 119.30 110.85 1sui s MET 110 Ca 0.75 0.53 -0.20 0.00 -1.71 0.00 0.00 55.69 55.06 1sui s MET 110 Cb -0.27 0.05 0.11 0.00 2.01 0.00 0.00 34.83 36.73 1sui s MET 110 CO 0.34 -0.10 0.88 0.34 -0.01 0.00 0.00 175.02 176.47 1sui s ASP 111 N 0.74 -0.64 0.05 3.03 -1.08 -1.26 0.12 116.67 117.64 1sui s ASP 111 Ca -0.05 1.09 -0.15 0.00 -0.52 0.00 0.00 52.55 52.93 1sui s ASP 111 Cb -0.06 1.20 -0.06 0.00 -1.46 0.00 0.00 42.92 42.55 1sui s ASP 111 CO -0.05 -0.18 1.25 0.40 0.52 0.00 0.00 175.17 177.11 1sui h ILE 112 N 4.49 0.00 -2.00 4.11 2.04 -1.89 -3.25 117.51 121.01 1sui h ILE 112 Ca -0.29 0.00 -0.51 0.00 1.00 0.00 0.00 64.86 65.06 1sui h ILE 112 Cb 1.19 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.21 1sui h ILE 112 CO 0.14 0.00 1.19 0.21 0.00 0.00 0.00 178.15 179.70 1sui s ASN 113 N -3.60 5.75 0.16 1.72 3.84 -1.26 -3.78 114.94 117.76 1sui s ASN 113 Ca -0.07 -0.21 -0.08 0.00 0.21 0.00 0.00 52.86 52.71 1sui s ASN 113 Cb 0.03 -2.55 0.01 0.00 -0.55 0.00 0.00 41.25 38.20 1sui s ASN 113 CO 0.27 -2.10 1.47 0.50 -2.79 0.00 0.00 177.10 174.45 1sui h LYS 114 N 12.15 0.78 -0.95 0.43 3.64 -1.93 -3.23 116.57 127.46 1sui h LYS 114 Ca -0.21 -0.46 0.13 0.00 -1.27 0.00 0.00 60.65 58.84 1sui h LYS 114 Cb 1.09 0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.86 1sui h LYS 114 CO 1.26 1.09 0.57 0.93 -2.27 0.00 0.00 179.45 181.03 1sui h GLU 115 N 0.62 0.85 0.63 1.90 5.08 -1.94 -2.52 114.58 119.20 1sui h GLU 115 Ca 0.03 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1sui h GLU 115 Cb 1.06 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 30.12 1sui h GLU 115 CO 0.10 0.56 -0.30 -0.91 -1.00 0.00 0.00 179.01 177.46 1sui h ASN 116 N 0.88 -0.72 -0.75 1.42 -0.26 -1.97 -1.16 115.58 113.02 1sui h ASN 116 Ca 0.48 -0.01 0.14 0.00 -0.56 0.00 0.00 56.30 56.36 1sui h ASN 116 Cb 0.54 0.19 -0.14 0.00 -1.06 0.00 0.00 38.32 37.85 1sui h ASN 116 CO -0.29 -0.44 -0.25 0.22 -1.06 0.00 0.00 177.43 175.61 1sui h TYR 117 N -0.96 -0.61 0.00 1.19 3.20 -1.58 1.52 116.97 119.73 1sui h TYR 117 Ca -0.09 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1sui h TYR 117 Cb 0.68 0.38 0.00 0.00 1.54 0.00 0.00 36.73 39.34 1sui h TYR 117 CO -0.01 -0.35 0.00 0.39 -1.64 0.00 0.00 178.16 176.54 1sui n GLU 118 N -5.49 0.09 0.17 1.82 1.02 -0.97 -2.17 120.64 115.11 1sui n GLU 118 Ca 0.09 0.37 0.02 0.00 -0.02 0.00 0.00 57.16 57.62 1sui n GLU 118 Cb 0.39 -1.69 0.34 0.00 -0.02 0.00 0.00 31.44 30.45 1sui n GLU 118 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1sui h LEU 119 N 0.00 0.04 -2.97 -4.62 5.85 0.35 -2.55 115.31 111.41 1sui h LEU 119 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1sui h LEU 119 Cb 0.26 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1sui h LEU 119 CO 0.00 0.41 0.00 0.61 -0.34 0.00 0.00 178.44 179.12 1sui n GLY 120 N -0.44 2.94 0.26 3.75 0.00 -0.92 -4.55 105.19 106.23 1sui n GLY 120 Ca -0.02 -0.61 -0.08 0.00 0.00 0.00 0.00 46.02 45.31 1sui n GLY 120 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1sui h LEU 121 N 2.59 0.80 -2.10 0.99 5.85 -1.35 -2.48 115.31 119.60 1sui h LEU 121 Ca 0.00 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1sui h LEU 121 Cb 0.99 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.80 1sui h LEU 121 CO 0.07 1.02 0.16 -0.65 -0.34 0.00 0.00 178.44 178.70 1sui h PRO 122 N 0.67 0.00 -1.00 5.25 0.11 -1.80 0.36 132.00 135.59 1sui h PRO 122 Ca 0.09 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.56 1sui h PRO 122 Cb 0.78 0.00 -0.34 0.00 0.11 0.00 0.00 31.00 31.55 1sui h PRO 122 CO 0.06 0.00 0.25 0.28 -0.21 0.00 0.00 178.00 178.38 1sui n VAL 123 N -2.74 3.21 0.00 3.15 0.31 -0.93 -3.02 118.33 118.30 1sui n VAL 123 Ca -0.02 -3.54 0.00 0.00 -0.01 0.00 0.00 64.34 60.77 1sui n VAL 123 Cb 0.21 -1.16 0.00 0.00 -0.91 0.00 0.00 33.84 31.97 1sui n VAL 123 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1sui n ILE 124 N -0.81 0.00 0.08 2.52 5.41 0.92 -4.69 119.36 122.79 1sui n ILE 124 Ca 0.55 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 64.11 1sui n ILE 124 Cb 0.74 0.00 -0.14 0.00 -0.71 0.00 0.00 39.64 39.52 1sui n ILE 124 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1sui h LYS 125 N 0.00 0.31 0.07 0.38 1.63 -0.69 -2.63 116.57 115.63 1sui h LYS 125 Ca 0.00 -0.54 -0.00 0.00 -0.85 0.00 0.00 60.65 59.26 1sui h LYS 125 Cb 0.00 0.20 0.00 0.00 -0.60 0.00 0.00 32.23 31.83 1sui h LYS 125 CO 0.00 1.21 -0.03 -0.22 -3.45 0.00 0.00 179.45 176.95 1sui h LYS 126 N 0.09 -0.09 0.00 1.90 3.64 -1.75 -3.03 116.57 117.33 1sui h LYS 126 Ca -0.24 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1sui h LYS 126 Cb 2.04 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.88 1sui h LYS 126 CO 0.19 0.32 0.00 0.00 -2.27 0.00 0.00 179.45 177.69 1sui n ALA 127 N -2.36 2.56 -0.60 5.00 0.00 -1.25 -5.00 120.51 118.85 1sui n ALA 127 Ca -0.08 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1sui n ALA 127 Cb 0.23 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.47 1sui n ALA 127 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sui n GLY 128 N 0.68 1.08 2.06 0.00 0.00 -0.99 -4.84 105.19 103.18 1sui n GLY 128 Ca 0.10 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.36 1sui n GLY 128 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1sui n VAL 129 N 0.00 0.00 1.47 1.61 3.14 -1.26 -4.46 118.33 118.83 1sui n VAL 129 Ca 0.00 0.00 0.11 0.00 -2.96 0.00 0.00 64.34 61.49 1sui n VAL 129 Cb 0.00 -0.59 0.46 0.00 -1.06 0.00 0.00 33.84 32.65 1sui n VAL 129 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 1sui n ASP 130 N 0.76 1.19 -1.00 6.55 5.75 -1.25 -3.45 116.55 125.10 1sui n ASP 130 Ca -0.04 -1.58 0.09 0.00 -0.01 0.00 0.00 54.79 53.25 1sui n ASP 130 Cb 0.24 -0.06 0.24 0.00 -1.03 0.00 0.00 41.12 40.50 1sui n ASP 130 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1sui n HIS 131 N -0.01 0.72 -0.05 2.11 1.44 -1.26 -3.92 115.22 114.25 1sui n HIS 131 Ca 0.16 -0.36 -0.06 0.00 -2.01 0.00 0.00 57.72 55.46 1sui n HIS 131 Cb 0.26 -0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.29 1sui n HIS 131 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1sui n LYS 132 N 1.08 2.09 -2.19 -1.40 5.02 -1.22 -4.90 118.16 116.62 1sui n LYS 132 Ca 0.18 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.15 1sui n LYS 132 Cb 0.46 -1.26 -0.04 0.00 -0.02 0.00 0.00 35.03 34.16 1sui n LYS 132 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1sui s ILE 133 N -2.25 3.56 -0.88 -0.18 1.01 -1.25 0.20 121.20 121.40 1sui s ILE 133 Ca -0.07 -0.35 -0.19 0.00 0.00 0.00 0.00 60.65 60.05 1sui s ILE 133 Cb 0.03 -4.29 0.13 0.00 0.01 0.00 0.00 42.46 38.34 1sui s ILE 133 CO 0.40 -1.22 1.07 -0.62 0.00 0.00 0.00 174.94 174.58 1sui s ASP 134 N 7.11 6.57 0.71 3.58 2.15 0.14 -4.90 116.67 132.02 1sui s ASP 134 Ca 0.62 -1.94 -0.11 0.00 0.43 0.00 0.00 52.55 51.55 1sui s ASP 134 Cb -0.06 -2.39 0.01 0.00 -0.30 0.00 0.00 42.92 40.19 1sui s ASP 134 CO 0.01 -1.08 1.06 0.12 -0.17 0.00 0.00 175.17 175.11 1sui s PHE 135 N 2.70 3.13 0.00 -5.34 5.36 -1.26 -1.96 117.98 120.61 1sui s PHE 135 Ca 0.30 1.34 0.00 0.00 -0.96 0.00 0.00 56.93 57.61 1sui s PHE 135 Cb -0.07 -2.91 0.00 0.00 -0.34 0.00 0.00 43.02 39.70 1sui s PHE 135 CO -0.07 -1.27 0.00 0.54 -1.46 0.00 0.00 175.22 172.96 1sui n ARG 136 N -3.14 0.37 -3.69 10.12 3.00 -0.93 -4.90 116.66 117.50 1sui n ARG 136 Ca 0.07 0.00 -0.10 0.00 -0.01 0.00 0.00 57.85 57.81 1sui n ARG 136 Cb 0.54 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 32.96 1sui n ARG 136 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1sui s GLU 137 N 4.61 1.17 0.00 5.56 0.41 -1.26 -4.72 118.70 124.46 1sui s GLU 137 Ca 0.00 -0.79 0.00 0.00 -0.41 0.00 0.00 54.97 53.77 1sui s GLU 137 Cb 0.00 0.48 0.00 0.00 -1.78 0.00 0.00 34.13 32.83 1sui s GLU 137 CO 0.00 -0.47 0.00 0.41 -0.49 0.00 0.00 175.26 174.71 1sui n GLY 138 N -0.26 0.78 3.19 -1.39 0.00 -1.23 -4.65 105.19 101.64 1sui n GLY 138 Ca -0.14 -0.18 -0.45 0.00 0.00 0.00 0.00 46.02 45.25 1sui n GLY 138 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1sui n PRO 139 N 8.73 0.00 -0.08 1.61 -0.02 -1.26 -3.90 135.00 140.08 1sui n PRO 139 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.38 1sui n PRO 139 Cb 0.00 -0.96 -0.10 0.00 -0.02 0.00 0.00 33.50 32.43 1sui n PRO 139 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1sui n ALA 140 N 0.06 1.64 -0.03 3.55 0.00 -1.26 -4.26 120.51 120.20 1sui n ALA 140 Ca 0.17 -0.84 -0.09 0.00 0.00 0.00 0.00 53.44 52.68 1sui n ALA 140 Cb 0.23 0.02 -0.03 0.00 0.00 0.00 0.00 19.45 19.67 1sui n ALA 140 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1sui h LEU 141 N 0.00 -0.13 -0.47 0.00 6.46 -1.98 -1.45 115.31 117.74 1sui h LEU 141 Ca -0.39 0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 57.40 1sui h LEU 141 Cb 1.74 0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 41.74 1sui h LEU 141 CO -0.02 -0.04 0.19 -0.65 -0.62 0.00 0.00 178.44 177.30 1sui h PRO 142 N 0.02 0.70 0.00 5.25 0.11 -1.99 -1.62 132.00 134.48 1sui h PRO 142 Ca 0.09 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1sui h PRO 142 Cb 0.12 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.12 1sui h PRO 142 CO -0.17 0.63 0.00 0.28 -0.21 0.00 0.00 178.00 178.53 1sui n VAL 143 N -4.59 1.36 0.60 3.15 0.31 -1.07 -0.63 118.33 117.46 1sui n VAL 143 Ca 0.01 0.42 0.11 0.00 -0.01 0.00 0.00 64.34 64.88 1sui n VAL 143 Cb 0.15 -1.33 0.07 0.00 -0.91 0.00 0.00 33.84 31.81 1sui n VAL 143 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1sui n LEU 144 N -1.74 0.63 -0.16 7.52 7.94 -0.57 -3.85 117.00 126.78 1sui n LEU 144 Ca 0.01 0.04 0.14 0.00 -1.11 0.00 0.00 56.01 55.09 1sui n LEU 144 Cb 0.09 -0.13 0.66 0.00 0.53 0.00 0.00 43.42 44.57 1sui n LEU 144 CO 0.09 0.03 0.91 0.47 -1.11 0.00 0.00 177.39 177.78 1sui n ASP 145 N -1.97 0.57 0.00 1.96 8.00 0.20 -3.52 116.55 121.79 1sui n ASP 145 Ca 0.02 -0.82 -0.13 0.00 0.71 0.00 0.00 54.79 54.57 1sui n ASP 145 Cb 0.43 -0.04 -0.10 0.00 -0.02 0.00 0.00 41.12 41.39 1sui n ASP 145 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1sui h GLU 146 N 0.78 -0.04 -0.19 -1.24 4.11 -1.67 -3.23 114.58 113.11 1sui h GLU 146 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.29 1sui h GLU 146 Cb 0.32 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1sui h GLU 146 CO 0.00 0.41 -0.49 0.52 0.07 0.00 0.00 179.01 179.52 1sui h MET 147 N -0.49 0.50 -0.13 1.06 2.86 -1.82 -2.92 114.93 114.00 1sui h MET 147 Ca -0.00 -0.29 0.04 0.00 -2.06 0.00 0.00 59.70 57.39 1sui h MET 147 Cb 0.46 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 1sui h MET 147 CO 0.01 0.88 0.38 0.82 1.06 0.00 0.00 176.91 180.05 1sui h ILE 148 N 0.40 0.12 0.00 -1.22 1.08 -1.60 -2.93 117.51 113.37 1sui h ILE 148 Ca 0.02 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1sui h ILE 148 Cb 1.00 0.65 0.00 0.00 -3.07 0.00 0.00 36.82 35.40 1sui h ILE 148 CO 0.09 0.00 -0.00 0.11 -0.69 0.00 0.00 178.15 177.66 1sui h LYS 149 N 0.00 -0.00 -5.86 2.37 1.57 -1.56 -3.44 116.57 109.64 1sui h LYS 149 Ca 0.06 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.16 1sui h LYS 149 Cb 0.81 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.09 1sui h LYS 149 CO -0.00 -0.00 1.43 -0.25 -0.57 0.00 0.00 179.45 180.06 1sui n ASP 150 N -2.07 1.39 0.03 0.86 8.00 -1.11 -4.73 116.55 118.92 1sui n ASP 150 Ca -0.00 0.44 0.22 0.00 0.71 0.00 0.00 54.79 56.16 1sui n ASP 150 Cb 0.00 -1.10 0.70 0.00 -0.02 0.00 0.00 41.12 40.70 1sui n ASP 150 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1sui h GLU 151 N 11.38 0.00 -3.76 -1.24 4.11 -1.86 -3.08 114.58 120.13 1sui h GLU 151 Ca -0.18 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 58.58 1sui h GLU 151 Cb 1.36 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 30.23 1sui h GLU 151 CO 1.10 0.00 -0.53 0.15 0.07 0.00 0.00 179.01 179.79 1sui s LYS 152 N -4.59 2.14 0.00 1.06 -0.14 -1.26 -4.29 119.74 112.66 1sui s LYS 152 Ca -0.04 -2.40 0.00 0.00 -1.36 0.00 0.00 55.97 52.17 1sui s LYS 152 Cb 0.15 -3.49 0.00 0.00 -1.68 0.00 0.00 37.83 32.81 1sui s LYS 152 CO 0.54 -1.11 0.00 -1.71 -0.76 0.00 0.00 175.35 172.31 1sui n ASN 153 N 3.57 0.00 -4.58 2.83 4.05 -1.16 -5.07 115.26 114.90 1sui n ASN 153 Ca 0.05 0.00 -0.40 0.00 0.45 0.00 0.00 54.58 54.68 1sui n ASN 153 Cb 0.37 0.00 -0.02 0.00 1.23 0.00 0.00 39.78 41.36 1sui n ASN 153 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 1sui s HIS 154 N 0.00 2.58 0.00 1.20 3.76 -1.26 -3.46 115.29 118.11 1sui s HIS 154 Ca 0.00 -1.12 0.00 0.00 -0.15 0.00 0.00 55.06 53.79 1sui s HIS 154 Cb 0.00 -4.60 0.00 0.00 1.11 0.00 0.00 32.58 29.09 1sui s HIS 154 CO 0.00 -1.70 0.00 0.41 -0.85 0.00 0.00 174.74 172.60 1sui n GLY 155 N 5.64 0.39 0.09 -2.22 0.00 -0.98 -4.74 105.19 103.37 1sui n GLY 155 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1sui n GLY 155 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1sui n SER 156 N 0.00 0.02 -4.23 1.61 3.41 -1.09 -4.53 113.62 108.81 1sui n SER 156 Ca 0.00 -0.27 -0.30 0.00 -0.26 0.00 0.00 58.87 58.05 1sui n SER 156 Cb 0.00 -0.01 -0.16 0.00 -0.26 0.00 0.00 64.21 63.78 1sui n SER 156 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1sui s TYR 157 N -1.82 2.17 -0.22 7.33 1.51 -0.47 -4.67 117.35 121.18 1sui s TYR 157 Ca 0.00 -0.58 0.06 0.00 -1.01 0.00 0.00 57.07 55.54 1sui s TYR 157 Cb 0.00 -1.42 -0.17 0.00 -0.11 0.00 0.00 41.96 40.26 1sui s TYR 157 CO 0.00 -0.16 -0.14 -0.25 -1.11 0.00 0.00 175.55 173.90 1sui n ASP 158 N 2.87 1.74 -3.84 2.29 8.00 -0.45 -3.98 116.55 123.18 1sui n ASP 158 Ca -0.17 -0.09 -0.25 0.00 0.71 0.00 0.00 54.79 54.99 1sui n ASP 158 Cb 0.52 -0.03 -0.17 0.00 -0.02 0.00 0.00 41.12 41.42 1sui n ASP 158 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1sui s PHE 159 N -2.46 1.07 -0.10 1.24 5.36 -1.24 -4.39 117.98 117.45 1sui s PHE 159 Ca -0.26 -0.44 0.01 0.00 -0.96 0.00 0.00 56.93 55.28 1sui s PHE 159 Cb 0.07 -1.00 0.02 0.00 -0.34 0.00 0.00 43.02 41.77 1sui s PHE 159 CO 0.60 -0.41 -0.09 0.42 -1.46 0.00 0.00 175.22 174.28 1sui s ILE 160 N 1.77 1.06 -0.43 3.12 1.01 -1.26 -1.65 121.20 124.82 1sui s ILE 160 Ca 0.04 -0.35 -0.08 0.00 0.00 0.00 0.00 60.65 60.25 1sui s ILE 160 Cb -0.13 -1.04 0.09 0.00 0.01 0.00 0.00 42.46 41.40 1sui s ILE 160 CO -0.06 0.36 0.27 0.12 0.00 0.00 0.00 174.94 175.63 1sui s PHE 161 N 1.34 3.38 -0.58 3.97 5.36 -0.84 -1.07 117.98 129.53 1sui s PHE 161 Ca -0.02 -1.69 -0.25 0.00 -0.96 0.00 0.00 56.93 54.01 1sui s PHE 161 Cb -0.14 -3.09 0.04 0.00 -0.34 0.00 0.00 43.02 39.50 1sui s PHE 161 CO -0.04 -0.89 1.04 0.08 -1.46 0.00 0.00 175.22 173.95 1sui s VAL 162 N 1.38 4.23 -0.38 3.12 1.01 -0.81 -1.49 120.40 127.47 1sui s VAL 162 Ca 0.04 0.42 0.05 0.00 0.00 0.00 0.00 61.98 62.48 1sui s VAL 162 Cb -0.24 -4.63 0.16 0.00 0.00 0.00 0.00 36.38 31.67 1sui s VAL 162 CO 0.01 -1.26 0.47 -0.62 0.00 0.00 0.00 175.10 173.69 1sui s ASP 163 N 3.01 0.18 0.00 3.32 2.15 -0.28 -1.33 116.67 123.72 1sui s ASP 163 Ca 0.34 -1.20 0.00 0.00 0.43 0.00 0.00 52.55 52.11 1sui s ASP 163 Cb -0.11 1.09 0.00 0.00 -0.30 0.00 0.00 42.92 43.60 1sui s ASP 163 CO 0.20 -0.24 0.00 0.00 -0.17 0.00 0.00 175.17 174.96 1sui n ALA 164 N 4.40 0.00 -1.00 3.66 0.00 -1.24 -3.93 120.51 122.40 1sui n ALA 164 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1sui n ALA 164 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1sui n ALA 164 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1sui n ASP 165 N 0.00 0.00 0.00 0.00 5.68 -1.26 -5.05 116.55 115.92 1sui n ASP 165 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1sui n ASP 165 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1sui n ASP 165 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1sui n LYS 166 N 0.00 0.00 -0.03 0.11 4.01 -1.26 -4.91 118.16 116.08 1sui n LYS 166 Ca 0.00 0.00 -0.07 0.00 -0.51 0.00 0.00 58.31 57.73 1sui n LYS 166 Cb 0.00 -0.34 0.12 0.00 -0.51 0.00 0.00 35.03 34.30 1sui n LYS 166 CO 0.00 0.00 0.00 0.38 -1.11 0.00 0.00 177.40 176.67 1sui h ASP 167 N 0.00 0.65 0.00 4.39 3.04 -1.94 -2.76 116.42 119.80 1sui h ASP 167 Ca 0.00 -0.25 0.00 0.00 -3.24 0.00 0.00 57.03 53.54 1sui h ASP 167 Cb 0.00 -0.18 0.00 0.00 -1.04 0.00 0.00 39.33 38.11 1sui h ASP 167 CO 0.00 0.91 0.00 0.59 -2.04 0.00 0.00 179.24 178.70 1sui n ASN 168 N -4.08 0.00 0.17 4.15 3.02 -1.26 -3.82 115.26 113.44 1sui n ASN 168 Ca -0.01 -1.05 -0.14 0.00 -0.03 0.00 0.00 54.58 53.35 1sui n ASN 168 Cb 0.46 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.56 1sui n ASN 168 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1sui h TYR 169 N 0.00 -0.38 0.00 3.10 -1.99 -1.84 1.42 116.97 117.28 1sui h TYR 169 Ca 0.00 -0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.72 1sui h TYR 169 Cb 0.00 0.13 -0.00 0.00 2.00 0.00 0.00 36.73 38.86 1sui h TYR 169 CO 0.00 -0.23 -0.01 1.25 -0.00 0.00 0.00 178.16 179.17 1sui h LEU 170 N -0.39 0.00 0.00 3.88 6.46 -1.79 -1.63 115.31 121.85 1sui h LEU 170 Ca -0.03 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 1sui h LEU 170 Cb 0.31 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.24 1sui h LEU 170 CO 0.04 0.01 -0.07 0.78 -0.62 0.00 0.00 178.44 178.58 1sui h ASN 171 N 0.00 0.00 -0.90 1.25 2.35 -1.33 -3.35 115.58 113.60 1sui h ASN 171 Ca -0.00 0.00 0.24 0.00 -0.55 0.00 0.00 56.30 55.99 1sui h ASN 171 Cb 0.02 0.00 -0.17 0.00 0.05 0.00 0.00 38.32 38.22 1sui h ASN 171 CO 0.00 0.31 -0.01 -1.22 -1.65 0.00 0.00 177.43 174.87 1sui n TYR 172 N -3.54 0.55 -0.36 1.19 4.01 0.47 -0.86 117.16 118.62 1sui n TYR 172 Ca -0.01 1.09 -0.09 0.00 -0.16 0.00 0.00 57.90 58.73 1sui n TYR 172 Cb 0.04 -1.16 -0.09 0.00 -0.31 0.00 0.00 39.34 37.82 1sui n TYR 172 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1sui n HIS 173 N -5.34 -0.38 -0.35 -0.72 -0.00 -0.62 0.26 115.22 108.08 1sui n HIS 173 Ca 0.21 1.07 0.02 0.00 0.46 0.00 0.00 57.72 59.47 1sui n HIS 173 Cb 0.67 -0.57 0.18 0.00 -0.12 0.00 0.00 29.99 30.15 1sui n HIS 173 CO 0.00 0.00 0.00 -0.22 0.46 0.00 0.00 176.34 176.58 1sui h LYS 174 N 0.00 1.15 -0.66 1.57 1.63 -1.13 0.55 116.57 119.69 1sui h LYS 174 Ca 0.14 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 1sui h LYS 174 Cb 0.35 -0.26 0.00 0.00 -0.60 0.00 0.00 32.23 31.72 1sui h LYS 174 CO -0.80 0.76 0.00 0.54 -3.45 0.00 0.00 179.45 176.50 1sui n ARG 175 N -4.46 3.64 0.00 1.90 1.74 -0.26 -3.93 116.66 115.29 1sui n ARG 175 Ca 0.14 -2.34 0.00 0.00 -0.77 0.00 0.00 57.85 54.87 1sui n ARG 175 Cb 0.13 -1.95 0.00 0.00 -1.02 0.00 0.00 32.46 29.62 1sui n ARG 175 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1sui n LEU 176 N 0.63 0.00 0.20 0.55 7.94 0.14 -4.72 117.00 121.74 1sui n LEU 176 Ca 0.21 -0.13 0.08 0.00 -1.11 0.00 0.00 56.01 55.05 1sui n LEU 176 Cb 0.87 0.00 0.34 0.00 0.53 0.00 0.00 43.42 45.16 1sui n LEU 176 CO 0.22 0.00 0.71 -0.29 -1.11 0.00 0.00 177.39 176.93 1sui h ILE 177 N 0.01 0.67 -0.58 1.96 -0.00 -0.07 -3.06 117.51 116.44 1sui h ILE 177 Ca 0.00 -1.42 0.00 0.00 -0.00 0.00 0.00 64.86 63.44 1sui h ILE 177 Cb 0.00 1.93 0.00 0.00 -0.00 0.00 0.00 36.82 38.76 1sui h ILE 177 CO 0.00 0.30 0.00 0.47 -0.00 0.00 0.00 178.15 178.92 1sui n ASP 178 N -3.38 4.97 -0.00 2.19 8.00 -1.26 -3.76 116.55 123.30 1sui n ASP 178 Ca 0.01 -2.63 0.04 0.00 0.71 0.00 0.00 54.79 52.91 1sui n ASP 178 Cb 0.51 -0.62 -0.06 0.00 -0.02 0.00 0.00 41.12 40.93 1sui n ASP 178 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1sui n LEU 179 N 0.85 0.04 -0.10 0.64 7.99 -1.15 -2.72 117.00 122.55 1sui n LEU 179 Ca 0.25 -0.06 -0.24 0.00 -0.01 0.00 0.00 56.01 55.95 1sui n LEU 179 Cb 0.99 0.00 -0.12 0.00 -0.11 0.00 0.00 43.42 44.18 1sui n LEU 179 CO 0.27 0.01 -0.95 1.33 -1.51 0.00 0.00 177.39 176.54 1sui n VAL 180 N -1.69 1.58 -1.25 4.08 0.24 -1.25 -1.36 118.33 118.68 1sui n VAL 180 Ca -0.01 -0.32 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 1sui n VAL 180 Cb 0.19 -1.86 0.00 0.00 -1.47 0.00 0.00 33.84 30.70 1sui n VAL 180 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1sui n LYS 181 N -4.04 -1.69 0.00 7.34 4.76 -1.25 -4.39 118.16 118.89 1sui n LYS 181 Ca -0.40 1.31 0.00 0.00 -2.87 0.00 0.00 58.31 56.34 1sui n LYS 181 Cb 0.85 -1.92 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 1sui n LYS 181 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1sui n VAL 182 N -2.08 0.00 -0.32 -0.18 0.31 -1.26 -3.25 118.33 111.54 1sui n VAL 182 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 1sui n VAL 182 Cb 0.17 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.07 1sui n VAL 182 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1sui n GLY 183 N 0.00 -1.89 0.00 2.92 0.00 -1.26 -4.08 105.19 100.88 1sui n GLY 183 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 46.02 46.95 1sui n GLY 183 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sui n GLY 184 N -1.28 0.59 0.00 -0.02 0.00 -1.20 -4.27 105.19 99.00 1sui n GLY 184 Ca 0.05 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1sui n GLY 184 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1sui n VAL 185 N 0.55 0.00 -2.99 1.61 3.14 -0.95 -4.62 118.33 115.07 1sui n VAL 185 Ca 0.00 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.37 1sui n VAL 185 Cb 0.00 0.00 -0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1sui n VAL 185 CO 0.00 0.00 0.00 -0.38 -6.46 0.00 0.00 176.83 169.99 1sui n ILE 186 N 0.00 -2.10 -3.87 1.55 5.41 -1.20 -2.16 119.36 117.00 1sui n ILE 186 Ca 0.00 0.27 -0.36 0.00 1.00 0.00 0.00 62.75 63.66 1sui n ILE 186 Cb 0.00 -2.84 -0.13 0.00 -0.71 0.00 0.00 39.64 35.96 1sui n ILE 186 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1sui s GLY 187 N -0.06 1.79 -0.50 7.39 0.00 -0.24 -2.92 107.32 112.78 1sui s GLY 187 Ca -0.03 -1.83 -0.26 0.00 0.00 0.00 0.00 44.72 42.60 1sui s GLY 187 CO 0.07 0.74 1.01 -0.19 0.00 0.00 0.00 173.10 174.73 1sui s TYR 188 N 1.27 2.83 0.57 1.90 1.51 -0.94 -1.93 117.35 122.56 1sui s TYR 188 Ca -0.03 0.38 -0.17 0.00 -1.01 0.00 0.00 57.07 56.23 1sui s TYR 188 Cb -0.20 -4.16 -0.04 0.00 -0.11 0.00 0.00 41.96 37.44 1sui s TYR 188 CO -0.01 -1.25 1.08 0.34 -1.11 0.00 0.00 175.55 174.60 1sui s ASP 189 N 2.51 5.77 -1.01 2.29 2.15 -0.44 -2.13 116.67 125.81 1sui s ASP 189 Ca 0.39 1.94 0.00 0.00 0.43 0.00 0.00 52.55 55.31 1sui s ASP 189 Cb -0.10 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 1sui s ASP 189 CO 0.26 -1.17 0.00 0.59 -0.17 0.00 0.00 175.17 174.68 1sui n ASN 190 N -1.72 -4.39 -0.11 -0.34 5.03 0.17 -4.87 115.26 109.03 1sui n ASN 190 Ca 0.10 0.23 0.00 0.00 0.87 0.00 0.00 54.58 55.78 1sui n ASN 190 Cb 0.52 -2.73 0.00 0.00 -1.02 0.00 0.00 39.78 36.56 1sui n ASN 190 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1sui n THR 191 N -2.64 0.00 0.05 3.41 -2.24 -1.25 0.89 114.28 112.50 1sui n THR 191 Ca -0.09 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.69 1sui n THR 191 Cb 0.35 -0.33 -0.00 0.00 -2.10 0.00 0.00 70.33 68.25 1sui n THR 191 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1sui n LEU 192 N -0.31 0.44 -1.44 3.22 4.77 -1.11 -4.95 117.00 117.63 1sui n LEU 192 Ca 0.00 -0.68 0.00 0.00 -0.03 0.00 0.00 56.01 55.30 1sui n LEU 192 Cb 0.01 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1sui n LEU 192 CO 0.00 0.11 0.00 1.87 -1.33 0.00 0.00 177.39 178.04 1sui n TRP 193 N -0.62 0.00 0.00 -1.77 -0.00 0.26 -3.65 117.44 111.65 1sui n TRP 193 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1sui n TRP 193 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.33 1sui n TRP 193 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1sui n ASN 194 N 0.50 0.00 -4.54 5.87 2.85 -1.26 -3.46 115.26 115.22 1sui n ASN 194 Ca 0.00 0.00 -0.43 0.00 -0.11 0.00 0.00 54.58 54.04 1sui n ASN 194 Cb 0.00 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.01 1sui n ASN 194 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1sui s GLY 195 N 0.00 1.64 0.01 8.20 0.00 -1.26 -4.84 107.32 111.07 1sui s GLY 195 Ca 0.00 -2.71 -0.06 0.00 0.00 0.00 0.00 44.72 41.95 1sui s GLY 195 CO 0.00 2.52 0.87 0.23 0.00 0.00 0.00 173.10 176.72 1sui h SER 196 N 8.53 -0.19 -1.05 1.64 0.87 -1.62 -3.31 113.55 118.41 1sui h SER 196 Ca 0.30 0.01 -0.69 0.00 -1.23 0.00 0.00 61.79 60.17 1sui h SER 196 Cb 0.95 0.05 -0.12 0.00 -0.44 0.00 0.00 62.40 62.83 1sui h SER 196 CO 1.37 -0.12 2.17 0.55 -0.53 0.00 0.00 176.83 180.28 1sui n VAL 197 N -2.75 4.89 -2.12 2.23 3.14 -1.26 -4.97 118.33 117.49 1sui n VAL 197 Ca -0.03 -3.99 -0.27 0.00 -2.96 0.00 0.00 64.34 57.09 1sui n VAL 197 Cb 0.09 -2.04 0.07 0.00 -1.06 0.00 0.00 33.84 30.91 1sui n VAL 197 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1sui s VAL 198 N -1.08 2.27 1.04 1.55 0.11 -1.25 -5.04 120.40 117.99 1sui s VAL 198 Ca 0.56 -0.17 -0.25 0.00 -2.93 0.00 0.00 61.98 59.19 1sui s VAL 198 Cb 0.21 -3.02 -0.11 0.00 -1.53 0.00 0.00 36.38 31.93 1sui s VAL 198 CO -0.11 -0.03 -1.08 0.00 -3.33 0.00 0.00 175.10 170.55 1sui n ALA 199 N -3.02 -5.33 -0.57 1.54 0.00 -1.26 -4.95 120.51 106.92 1sui n ALA 199 Ca 0.08 -1.35 -0.10 0.00 0.00 0.00 0.00 53.44 52.07 1sui n ALA 199 Cb 0.60 -1.02 0.16 0.00 0.00 0.00 0.00 19.45 19.20 1sui n ALA 199 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1sui n PRO 200 N 1.12 -3.29 0.00 0.00 -0.02 -1.26 -4.27 135.00 127.28 1sui n PRO 200 Ca -0.01 -0.80 0.00 0.00 -2.02 0.00 0.00 63.50 60.67 1sui n PRO 200 Cb 0.71 -1.09 0.00 0.00 -0.02 0.00 0.00 33.50 33.11 1sui n PRO 200 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1sui n PRO 201 N -3.81 0.00 0.00 0.52 -0.02 -1.26 0.21 135.00 130.64 1sui n PRO 201 Ca 0.08 0.15 0.08 0.00 -2.02 0.00 0.00 63.50 61.79 1sui n PRO 201 Cb 0.33 -1.66 0.48 0.00 -0.02 0.00 0.00 33.50 32.63 1sui n PRO 201 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1sui n ASP 202 N -1.06 0.00 -4.18 2.55 8.00 -1.26 -4.33 116.55 116.27 1sui n ASP 202 Ca 0.00 -1.26 -0.40 0.00 0.71 0.00 0.00 54.79 53.83 1sui n ASP 202 Cb 0.16 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.19 1sui n ASP 202 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1sui s ALA 203 N -2.00 3.78 -0.74 2.24 0.00 0.55 -5.01 121.76 120.58 1sui s ALA 203 Ca 0.24 -3.31 -0.18 0.00 0.00 0.00 0.00 51.96 48.71 1sui s ALA 203 Cb 0.11 -2.97 -0.17 0.00 0.00 0.00 0.00 23.12 20.10 1sui s ALA 203 CO 0.19 -2.17 1.84 -2.30 0.00 0.00 0.00 175.76 173.32 1sui n PRO 204 N 3.60 0.12 -3.91 0.00 -0.02 -1.26 -4.92 135.00 128.60 1sui n PRO 204 Ca 0.10 -1.00 -0.24 0.00 -2.02 0.00 0.00 63.50 60.35 1sui n PRO 204 Cb 0.41 -2.88 -0.02 0.00 -0.02 0.00 0.00 33.50 30.98 1sui n PRO 204 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 1sui s LEU 205 N 11.03 4.31 1.35 2.45 2.34 -1.26 -5.10 118.68 133.79 1sui s LEU 205 Ca 0.64 0.16 -0.20 0.00 0.06 0.00 0.00 54.13 54.79 1sui s LEU 205 Cb -0.10 -2.93 0.34 0.00 -0.56 0.00 0.00 46.19 42.95 1sui s LEU 205 CO 0.15 -0.02 0.96 -0.13 -1.06 0.00 0.00 176.35 176.24 1sui s ARG 206 N -3.62 -2.34 0.00 1.48 0.52 -1.26 -4.75 118.95 108.98 1sui s ARG 206 Ca 0.35 0.34 0.00 0.00 -0.52 0.00 0.00 55.73 55.89 1sui s ARG 206 Cb -0.10 -1.43 0.00 0.00 0.52 0.00 0.00 34.95 33.94 1sui s ARG 206 CO 0.29 -4.54 0.00 1.17 0.02 0.00 0.00 175.30 172.24 1sui n LYS 207 N -5.42 0.00 -0.32 3.54 3.00 -1.26 -1.41 118.16 116.28 1sui n LYS 207 Ca 0.09 0.00 0.30 0.00 -0.00 0.00 0.00 58.31 58.71 1sui n LYS 207 Cb 0.58 -0.45 0.56 0.00 0.00 0.00 0.00 35.03 35.72 1sui n LYS 207 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.40 177.50 1sui h TYR 208 N 0.00 0.76 -0.30 5.64 -0.00 -1.98 0.29 116.97 121.38 1sui h TYR 208 Ca 0.00 0.04 -0.02 0.00 -0.00 0.00 0.00 58.73 58.75 1sui h TYR 208 Cb 0.00 -0.16 -0.01 0.00 -0.00 0.00 0.00 36.73 36.56 1sui h TYR 208 CO 0.00 -0.46 0.10 -0.24 -0.00 0.00 0.00 178.16 177.56 1sui h VAL 209 N 0.01 1.20 0.00 -0.90 3.04 -1.95 0.36 116.25 118.01 1sui h VAL 209 Ca 0.83 -0.63 -0.03 0.00 -1.01 0.00 0.00 66.70 65.86 1sui h VAL 209 Cb 2.14 1.04 -0.00 0.00 -2.01 0.00 0.00 31.29 32.46 1sui h VAL 209 CO -0.78 0.21 -0.15 -0.09 -1.01 0.00 0.00 177.57 175.75 1sui h ARG 210 N 0.33 0.00 0.00 4.17 2.43 0.74 -1.46 114.38 120.60 1sui h ARG 210 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1sui h ARG 210 Cb 0.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1sui h ARG 210 CO -0.00 0.15 0.00 0.98 -1.51 0.00 0.00 179.97 179.59 1sui n TYR 211 N -4.26 0.00 -0.17 2.20 9.36 -0.55 -4.02 117.16 119.72 1sui n TYR 211 Ca -0.02 0.00 0.22 0.00 3.32 0.00 0.00 57.90 61.42 1sui n TYR 211 Cb 0.22 -0.47 0.62 0.00 -0.63 0.00 0.00 39.34 39.08 1sui n TYR 211 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 1sui h TYR 212 N 0.00 0.24 -0.99 2.98 0.05 -0.32 -2.96 116.97 115.98 1sui h TYR 212 Ca 0.00 0.01 0.12 0.00 0.05 0.00 0.00 58.73 58.91 1sui h TYR 212 Cb 0.00 -0.08 -0.14 0.00 1.01 0.00 0.00 36.73 37.52 1sui h TYR 212 CO 0.09 0.07 -0.48 -2.13 -1.05 0.00 0.00 178.16 174.67 1sui n ARG 213 N -4.40 -0.32 -0.34 4.88 0.63 -0.55 -0.92 116.66 115.63 1sui n ARG 213 Ca 0.17 1.51 0.21 0.00 -0.92 0.00 0.00 57.85 58.82 1sui n ARG 213 Cb 0.76 -2.23 0.45 0.00 0.45 0.00 0.00 32.46 31.89 1sui n ARG 213 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1sui h ASP 214 N 0.00 0.56 0.20 6.15 5.19 -1.71 -0.02 116.42 126.79 1sui h ASP 214 Ca 0.26 0.13 -0.27 0.00 -0.62 0.00 0.00 57.03 56.54 1sui h ASP 214 Cb 0.51 0.05 0.03 0.00 0.18 0.00 0.00 39.33 40.10 1sui h ASP 214 CO -0.96 0.04 -1.18 -0.26 -3.12 0.00 0.00 179.24 173.76 1sui h PHE 215 N 0.45 0.77 0.14 4.55 0.04 -1.23 -2.82 116.94 118.84 1sui h PHE 215 Ca 0.66 -0.56 0.02 0.00 2.80 0.00 0.00 57.97 60.88 1sui h PHE 215 Cb 1.47 -0.03 -0.04 0.00 2.20 0.00 0.00 35.95 39.55 1sui h PHE 215 CO -0.01 1.45 -0.32 0.28 -0.60 0.00 0.00 178.31 179.11 1sui h VAL 216 N -0.10 0.32 -1.00 -0.55 2.07 -0.45 2.44 116.25 118.97 1sui h VAL 216 Ca -0.21 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.57 1sui h VAL 216 Cb 1.92 0.32 -0.08 0.00 -1.52 0.00 0.00 31.29 31.93 1sui h VAL 216 CO 0.21 0.00 0.66 -0.07 0.02 0.00 0.00 177.57 178.40 1sui h LEU 217 N -0.56 0.37 0.05 2.57 3.38 -1.14 0.33 115.31 120.31 1sui h LEU 217 Ca 0.03 0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.89 1sui h LEU 217 Cb 0.58 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 41.34 1sui h LEU 217 CO -0.18 0.10 -0.68 -0.08 0.09 0.00 0.00 178.44 177.69 1sui h GLU 218 N 0.34 0.37 0.11 1.13 4.81 -0.29 -1.60 114.58 119.44 1sui h GLU 218 Ca 0.54 -0.46 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1sui h GLU 218 Cb 1.48 0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.97 1sui h GLU 218 CO -0.21 1.15 -0.29 1.25 -0.73 0.00 0.00 179.01 180.18 1sui h LEU 219 N -0.20 -0.82 0.19 1.64 7.12 0.69 -2.24 115.31 121.69 1sui h LEU 219 Ca -0.10 0.10 -0.01 0.00 0.13 0.00 0.00 57.88 58.00 1sui h LEU 219 Cb 1.43 0.31 0.00 0.00 -0.53 0.00 0.00 40.66 41.88 1sui h LEU 219 CO 0.13 -0.37 -0.09 0.78 -0.13 0.00 0.00 178.44 178.75 1sui h ASN 220 N -0.49 -0.22 -0.67 1.25 2.35 -0.61 1.03 115.58 118.21 1sui h ASN 220 Ca 0.03 -0.08 0.20 0.00 -0.55 0.00 0.00 56.30 55.90 1sui h ASN 220 Cb 0.53 0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.93 1sui h ASN 220 CO -0.18 -0.06 0.65 0.11 -1.65 0.00 0.00 177.43 176.30 1sui h LYS 221 N -0.37 0.00 0.00 0.81 1.79 -1.16 -2.06 116.57 115.59 1sui h LYS 221 Ca -0.03 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.25 1sui h LYS 221 Cb 0.28 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 1sui h LYS 221 CO 0.04 0.00 -1.72 0.00 -1.08 0.00 0.00 179.45 176.69 1sui n ALA 222 N -2.43 1.73 0.16 3.86 0.00 -0.85 -4.46 120.51 118.52 1sui n ALA 222 Ca 0.14 -0.58 0.09 0.00 0.00 0.00 0.00 53.44 53.09 1sui n ALA 222 Cb 0.89 0.16 0.47 0.00 0.00 0.00 0.00 19.45 20.97 1sui n ALA 222 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1sui n LEU 223 N -2.75 0.46 -1.27 0.00 7.94 0.35 -0.46 117.00 121.27 1sui n LEU 223 Ca -0.21 0.70 0.01 0.00 -1.11 0.00 0.00 56.01 55.40 1sui n LEU 223 Cb 0.76 -0.74 0.26 0.00 0.53 0.00 0.00 43.42 44.23 1sui n LEU 223 CO 0.15 -0.82 0.80 0.00 -1.11 0.00 0.00 177.39 176.41 1sui n ALA 224 N -1.72 3.76 0.00 1.96 0.00 -0.80 -4.31 120.51 119.40 1sui n ALA 224 Ca -0.01 -2.52 0.00 0.00 0.00 0.00 0.00 53.44 50.91 1sui n ALA 224 Cb 0.05 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1sui n ALA 224 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1sui n VAL 225 N -0.56 0.00 -2.20 0.00 0.31 0.40 -5.03 118.33 111.24 1sui n VAL 225 Ca 0.30 -0.19 -0.43 0.00 -0.01 0.00 0.00 64.34 64.01 1sui n VAL 225 Cb 1.07 0.94 -0.02 0.00 -0.91 0.00 0.00 33.84 34.92 1sui n VAL 225 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1sui s ASP 226 N -0.43 6.14 0.00 4.52 2.15 -1.12 -4.86 116.67 123.08 1sui s ASP 226 Ca 0.00 1.01 0.00 0.00 0.43 0.00 0.00 52.55 54.00 1sui s ASP 226 Cb 0.00 -2.53 0.02 0.00 -0.30 0.00 0.00 42.92 40.11 1sui s ASP 226 CO 0.00 -1.56 0.17 -2.65 -0.17 0.00 0.00 175.17 170.97 1sui n PRO 227 N 8.24 0.10 -0.17 4.34 -0.02 -1.26 -1.77 135.00 144.46 1sui n PRO 227 Ca 0.19 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.77 1sui n PRO 227 Cb 0.47 -1.06 0.18 0.00 -0.02 0.00 0.00 33.50 33.07 1sui n PRO 227 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1sui n ARG 228 N -0.56 2.29 -3.79 -0.52 1.74 -1.26 -4.46 116.66 110.09 1sui n ARG 228 Ca 0.00 -2.09 -0.09 0.00 -0.77 0.00 0.00 57.85 54.90 1sui n ARG 228 Cb 0.00 -1.42 -0.07 0.00 -1.02 0.00 0.00 32.46 29.96 1sui n ARG 228 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1sui s ILE 229 N -1.25 0.12 -0.14 0.55 -4.36 -0.73 -2.10 121.20 113.28 1sui s ILE 229 Ca 0.32 -0.97 0.18 0.00 -0.26 0.00 0.00 60.65 59.91 1sui s ILE 229 Cb 0.18 -1.25 -0.25 0.00 1.25 0.00 0.00 42.46 42.39 1sui s ILE 229 CO 0.25 -0.54 0.17 -0.62 0.24 0.00 0.00 174.94 174.44 1sui n GLU 230 N -0.04 0.85 -0.91 0.37 1.02 -1.18 -4.85 120.64 115.90 1sui n GLU 230 Ca -0.16 -0.06 0.08 0.00 -0.02 0.00 0.00 57.16 57.01 1sui n GLU 230 Cb 0.62 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.53 1sui n GLU 230 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1sui n ILE 231 N -2.56 -0.01 0.00 -3.67 -5.35 -1.22 -4.91 119.36 101.64 1sui n ILE 231 Ca -0.23 0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 1sui n ILE 231 Cb 0.95 -0.42 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 1sui n ILE 231 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1sui s MET 233 N 0.00 3.44 -0.37 0.00 -1.94 -1.26 -1.57 119.30 117.61 1sui s MET 233 Ca 0.00 0.06 -0.11 0.00 -1.71 0.00 0.00 55.69 53.93 1sui s MET 233 Cb 0.00 -4.03 0.02 0.00 2.01 0.00 0.00 34.83 32.83 1sui s MET 233 CO 0.00 -1.61 0.20 -0.51 -0.01 0.00 0.00 175.02 173.09 1sui s LEU 234 N 4.59 4.64 0.00 -0.03 1.43 -1.12 -4.97 118.68 123.23 1sui s LEU 234 Ca 0.38 -0.93 -0.00 0.00 -1.03 0.00 0.00 54.13 52.55 1sui s LEU 234 Cb -0.09 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 1sui s LEU 234 CO 0.23 -0.36 0.56 -0.81 0.23 0.00 0.00 176.35 176.20 1sui n PRO 235 N 5.00 0.11 -3.44 1.29 -0.04 -1.26 -3.07 135.00 133.59 1sui n PRO 235 Ca -0.12 -0.05 -0.38 0.00 -0.04 0.00 0.00 63.50 62.91 1sui n PRO 235 Cb 0.46 -1.52 -0.08 0.00 -0.04 0.00 0.00 33.50 32.33 1sui n PRO 235 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1sui s VAL 236 N 2.67 5.23 0.00 0.52 1.01 -1.26 -4.78 120.40 123.78 1sui s VAL 236 Ca 0.03 0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.62 1sui s VAL 236 Cb 0.01 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.71 1sui s VAL 236 CO 0.00 0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.98 1sui n GLY 237 N 4.01 1.01 0.00 4.51 0.00 -1.26 -0.94 105.19 112.51 1sui n GLY 237 Ca -0.10 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1sui n GLY 237 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1sui n ASP 238 N 7.68 1.39 0.00 1.61 2.03 -1.26 -4.44 116.55 123.56 1sui n ASP 238 Ca 0.00 -1.68 0.00 0.00 0.52 0.00 0.00 54.79 53.63 1sui n ASP 238 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1sui n ASP 238 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1sui n GLY 239 N -0.34 2.98 3.15 0.27 0.00 -0.12 -2.75 105.19 108.38 1sui n GLY 239 Ca 0.00 -1.77 0.04 0.00 0.00 0.00 0.00 46.02 44.30 1sui n GLY 239 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sui s ILE 240 N -2.09 -0.82 -0.44 -0.61 1.01 -1.17 0.46 121.20 117.53 1sui s ILE 240 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 60.65 60.38 1sui s ILE 240 Cb 0.00 -0.89 0.03 0.00 0.01 0.00 0.00 42.46 41.61 1sui s ILE 240 CO 0.00 0.00 1.01 -0.89 0.00 0.00 0.00 174.94 175.06 1sui s THR 241 N 2.87 4.40 -0.16 2.92 2.01 -0.91 -2.78 115.64 124.00 1sui s THR 241 Ca 0.15 1.06 -0.14 0.00 0.31 0.00 0.00 61.69 63.07 1sui s THR 241 Cb -0.10 -4.47 -0.05 0.00 0.01 0.00 0.00 72.50 67.89 1sui s THR 241 CO -0.23 -0.82 0.32 0.27 -0.69 0.00 0.00 174.62 173.48 1sui s ILE 242 N 3.94 5.29 0.43 1.82 -4.36 -0.61 -2.23 121.20 125.49 1sui s ILE 242 Ca 0.42 0.60 0.06 0.00 -0.26 0.00 0.00 60.65 61.46 1sui s ILE 242 Cb -0.10 -3.66 -0.06 0.00 1.25 0.00 0.00 42.46 39.89 1sui s ILE 242 CO 0.26 0.37 0.02 0.00 0.24 0.00 0.00 174.94 175.83 1sui s ARG 244 N -3.76 0.02 -0.47 0.00 3.52 -1.26 -2.25 118.95 114.75 1sui s ARG 244 Ca 0.29 0.13 -0.28 0.00 -0.13 0.00 0.00 55.73 55.75 1sui s ARG 244 Cb 0.08 -0.24 -0.01 0.00 -1.56 0.00 0.00 34.95 33.22 1sui s ARG 244 CO 0.15 -0.13 1.66 0.50 -0.81 0.00 0.00 175.30 176.67 1sui s ARG 245 N 0.86 3.18 -0.20 5.12 3.00 -1.26 -3.13 118.95 126.53 1sui s ARG 245 Ca -0.07 0.91 -0.03 0.00 -1.00 0.00 0.00 55.73 55.53 1sui s ARG 245 Cb -0.11 -4.20 -0.11 0.00 0.00 0.00 0.00 34.95 30.53 1sui s ARG 245 CO -0.02 -2.06 -0.21 0.44 0.00 0.00 0.00 175.30 173.45 1sui n ILE 246 N 7.18 1.12 -0.04 4.11 -5.35 -0.89 -4.43 119.36 121.06 1sui n ILE 246 Ca 0.19 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 1sui n ILE 246 Cb 0.49 -1.41 0.00 0.00 -1.74 0.00 0.00 39.64 36.98 1sui n ILE 246 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08