#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rpx h ARG 2 N 0.00 0.00 0.00 -1.46 3.08 -1.96 -2.74 114.38 111.30 1rpx h ARG 2 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1rpx h ARG 2 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1rpx h ARG 2 CO 0.00 0.02 -0.41 0.28 -1.07 0.00 0.00 179.97 178.79 1rpx h VAL 3 N 0.00 0.35 0.00 2.04 2.07 -1.97 -3.29 116.25 115.44 1rpx h VAL 3 Ca -0.00 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.01 1rpx h VAL 3 Cb 0.10 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1rpx h VAL 3 CO 0.00 0.20 0.00 0.47 0.02 0.00 0.00 177.57 178.26 1rpx n ASP 4 N -3.08 0.00 0.19 0.57 8.00 -1.03 -1.83 116.55 119.37 1rpx n ASP 4 Ca 0.02 0.49 0.13 0.00 0.71 0.00 0.00 54.79 56.14 1rpx n ASP 4 Cb 0.63 -0.49 0.34 0.00 -0.02 0.00 0.00 41.12 41.58 1rpx n ASP 4 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1rpx h LYS 5 N 0.00 0.00 -6.29 -1.24 1.79 -1.75 -3.44 116.57 105.64 1rpx h LYS 5 Ca 0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 1rpx h LYS 5 Cb 0.21 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.82 1rpx h LYS 5 CO 0.00 0.00 -0.11 -0.06 -1.08 0.00 0.00 179.45 178.20 1rpx s PHE 6 N -3.26 3.60 -0.18 -1.35 0.40 -0.76 -5.08 117.98 111.35 1rpx s PHE 6 Ca 0.07 1.01 -0.09 0.00 -0.60 0.00 0.00 56.93 57.32 1rpx s PHE 6 Cb 0.08 -2.33 -0.05 0.00 0.51 0.00 0.00 43.02 41.23 1rpx s PHE 6 CO 0.61 0.44 0.11 0.45 0.70 0.00 0.00 175.22 177.53 1rpx s SER 7 N -1.73 6.10 0.00 1.36 0.15 -1.26 -4.96 113.70 113.36 1rpx s SER 7 Ca 0.37 0.24 0.13 0.00 0.70 0.00 0.00 55.95 57.38 1rpx s SER 7 Cb -0.15 -2.05 0.75 0.00 -1.71 0.00 0.00 66.02 62.86 1rpx s SER 7 CO 0.19 0.22 1.18 0.29 1.20 0.00 0.00 173.24 176.32 1rpx n LYS 8 N 3.24 0.51 0.06 5.44 5.02 -1.26 -2.21 118.16 128.96 1rpx n LYS 8 Ca -0.17 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.12 1rpx n LYS 8 Cb 0.53 -1.38 -0.06 0.00 -0.02 0.00 0.00 35.03 34.10 1rpx n LYS 8 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1rpx h SER 9 N 0.00 0.00 -1.79 4.39 0.02 -1.96 -3.47 113.55 110.73 1rpx h SER 9 Ca 0.00 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.47 1rpx h SER 9 Cb 0.00 0.00 0.08 0.00 0.14 0.00 0.00 62.40 62.62 1rpx h SER 9 CO 0.00 0.60 0.09 -1.81 -1.14 0.00 0.00 176.83 174.57 1rpx s ASP 10 N -6.01 4.29 -0.37 3.07 1.01 -0.94 -5.07 116.67 112.64 1rpx s ASP 10 Ca -0.01 -0.54 -0.06 0.00 0.71 0.00 0.00 52.55 52.65 1rpx s ASP 10 Cb 0.08 0.24 0.06 0.00 1.01 0.00 0.00 42.92 44.31 1rpx s ASP 10 CO 0.80 -1.92 0.16 -0.63 0.21 0.00 0.00 175.17 173.78 1rpx s ILE 11 N -3.13 3.77 0.15 0.77 1.01 -1.26 -4.84 121.20 117.67 1rpx s ILE 11 Ca 0.67 -1.37 -0.30 0.00 0.00 0.00 0.00 60.65 59.65 1rpx s ILE 11 Cb -0.04 -3.25 -0.07 0.00 0.01 0.00 0.00 42.46 39.11 1rpx s ILE 11 CO 0.45 -0.35 1.03 -0.63 0.00 0.00 0.00 174.94 175.44 1rpx s ILE 12 N 1.36 4.16 -0.20 2.92 1.09 0.24 -4.90 121.20 125.86 1rpx s ILE 12 Ca 0.01 1.85 -0.02 0.00 -1.10 0.00 0.00 60.65 61.39 1rpx s ILE 12 Cb -0.21 -4.18 -0.00 0.00 -1.06 0.00 0.00 42.46 37.01 1rpx s ILE 12 CO 0.01 0.31 -0.10 -0.69 -0.10 0.00 0.00 174.94 174.38 1rpx s VAL 13 N -0.21 2.97 -0.58 2.92 1.01 -1.26 -0.39 120.40 124.86 1rpx s VAL 13 Ca 0.48 -0.63 0.04 0.00 0.00 0.00 0.00 61.98 61.86 1rpx s VAL 13 Cb -0.26 -2.32 0.14 0.00 0.00 0.00 0.00 36.38 33.94 1rpx s VAL 13 CO 0.32 0.47 0.34 -0.55 0.00 0.00 0.00 175.10 175.68 1rpx s SER 14 N 1.33 4.49 0.34 3.32 0.15 0.70 -0.99 113.70 123.04 1rpx s SER 14 Ca 0.04 -3.31 -0.28 0.00 0.70 0.00 0.00 55.95 53.09 1rpx s SER 14 Cb -0.14 -1.63 -0.10 0.00 -1.71 0.00 0.00 66.02 62.43 1rpx s SER 14 CO -0.05 -0.18 1.32 -2.16 1.20 0.00 0.00 173.24 173.37 1rpx s PRO 15 N -0.70 4.31 -0.35 5.44 0.04 -1.21 -3.40 135.00 139.13 1rpx s PRO 15 Ca 0.20 2.23 -0.26 0.00 0.04 0.00 0.00 61.00 63.21 1rpx s PRO 15 Cb -0.18 -3.04 0.01 0.00 0.04 0.00 0.00 34.50 31.33 1rpx s PRO 15 CO -0.06 -0.23 0.91 0.45 0.04 0.00 0.00 177.00 178.11 1rpx s SER 16 N -0.49 6.69 0.00 6.66 0.15 0.21 -0.83 113.70 126.09 1rpx s SER 16 Ca 0.50 0.62 0.10 0.00 0.70 0.00 0.00 55.95 57.87 1rpx s SER 16 Cb -0.40 -2.46 0.52 0.00 -1.71 0.00 0.00 66.02 61.97 1rpx s SER 16 CO 0.53 -0.81 1.22 2.30 1.20 0.00 0.00 173.24 177.68 1rpx n ILE 17 N 5.88 0.77 0.26 6.45 -5.35 -0.87 -2.83 119.36 123.67 1rpx n ILE 17 Ca 0.07 0.19 0.09 0.00 -0.27 0.00 0.00 62.75 62.83 1rpx n ILE 17 Cb 0.48 -1.02 0.68 0.00 -1.74 0.00 0.00 39.64 38.03 1rpx n ILE 17 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 1rpx h LEU 18 N 0.00 0.00 -0.53 7.28 3.38 -1.92 -1.18 115.31 122.33 1rpx h LEU 18 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rpx h LEU 18 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1rpx h LEU 18 CO 0.00 0.07 -0.07 -1.20 0.09 0.00 0.00 178.44 177.34 1rpx n SER 19 N -4.18 0.89 -4.72 -0.43 7.64 -1.13 -4.91 113.62 106.78 1rpx n SER 19 Ca -0.03 -1.08 -0.29 0.00 1.01 0.00 0.00 58.87 58.48 1rpx n SER 19 Cb 0.16 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.47 1rpx n SER 19 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rpx s ALA 20 N -2.20 2.62 -0.46 -0.43 0.00 -0.45 -4.83 121.76 116.01 1rpx s ALA 20 Ca 0.35 -0.82 -0.20 0.00 0.00 0.00 0.00 51.96 51.29 1rpx s ALA 20 Cb 0.21 -2.87 0.03 0.00 0.00 0.00 0.00 23.12 20.49 1rpx s ALA 20 CO 0.41 -1.82 0.65 1.21 0.00 0.00 0.00 175.76 176.21 1rpx s ASN 21 N -4.65 6.30 0.30 0.00 3.84 -1.26 -4.95 114.94 114.52 1rpx s ASN 21 Ca 0.65 -0.48 0.23 0.00 0.21 0.00 0.00 52.86 53.46 1rpx s ASN 21 Cb -0.09 -2.32 1.11 0.00 -0.55 0.00 0.00 41.25 39.40 1rpx s ASN 21 CO 0.49 -0.83 1.70 0.49 -2.79 0.00 0.00 177.10 176.17 1rpx n PHE 22 N 6.30 0.80 0.22 0.43 3.01 -1.26 -2.23 117.46 124.74 1rpx n PHE 22 Ca -0.03 0.37 0.12 0.00 1.01 0.00 0.00 57.45 58.92 1rpx n PHE 22 Cb 0.47 -1.09 0.26 0.00 -0.01 0.00 0.00 39.48 39.12 1rpx n PHE 22 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1rpx h SER 23 N 0.00 0.00 -1.25 4.37 4.64 -2.04 -3.33 113.55 115.94 1rpx h SER 23 Ca 0.00 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.92 1rpx h SER 23 Cb 0.18 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 61.87 1rpx h SER 23 CO 0.00 0.06 -1.17 2.29 -0.87 0.00 0.00 176.83 177.15 1rpx n LYS 24 N -3.12 1.26 -0.16 4.77 2.85 -0.95 -4.96 118.16 117.86 1rpx n LYS 24 Ca 0.03 -3.37 -0.04 0.00 -1.05 0.00 0.00 58.31 53.88 1rpx n LYS 24 Cb 0.51 -1.41 0.05 0.00 -0.65 0.00 0.00 35.03 33.53 1rpx n LYS 24 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1rpx h LEU 25 N 2.98 0.24 -0.32 -5.58 5.85 -1.64 -1.11 115.31 115.72 1rpx h LEU 25 Ca -0.03 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.75 1rpx h LEU 25 Cb 1.11 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 1rpx h LEU 25 CO 0.52 0.17 0.17 1.23 -0.34 0.00 0.00 178.44 180.19 1rpx h GLY 26 N 0.39 0.44 1.03 3.75 0.00 -1.93 -0.39 103.07 106.37 1rpx h GLY 26 Ca 0.23 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.39 1rpx h GLY 26 CO -0.21 0.10 0.30 -2.09 0.00 0.00 0.00 176.54 174.64 1rpx h GLU 27 N 0.35 1.11 -0.72 4.80 4.81 -1.92 -0.97 114.58 122.04 1rpx h GLU 27 Ca 0.13 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 1rpx h GLU 27 Cb 0.04 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1rpx h GLU 27 CO -0.08 0.90 0.32 0.37 -0.73 0.00 0.00 179.01 179.79 1rpx h GLN 28 N 1.06 1.04 -0.07 1.92 5.75 -0.80 -1.39 115.11 122.63 1rpx h GLN 28 Ca 0.25 -0.16 -0.10 0.00 -0.15 0.00 0.00 58.65 58.49 1rpx h GLN 28 Cb 0.21 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 28.58 1rpx h GLN 28 CO -0.02 0.82 -0.36 0.28 -2.65 0.00 0.00 178.83 176.90 1rpx h VAL 29 N 1.03 1.42 -0.46 2.39 2.07 -0.66 -2.78 116.25 119.26 1rpx h VAL 29 Ca 0.25 -1.76 0.03 0.00 0.82 0.00 0.00 66.70 66.03 1rpx h VAL 29 Cb 0.14 2.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.22 1rpx h VAL 29 CO -0.03 0.51 0.31 0.11 0.02 0.00 0.00 177.57 178.49 1rpx h LYS 30 N -0.12 0.51 0.61 1.57 1.57 -1.07 -1.25 116.57 118.38 1rpx h LYS 30 Ca -0.03 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 1rpx h LYS 30 Cb 1.01 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 33.22 1rpx h LYS 30 CO 0.07 0.34 -0.29 0.00 -0.57 0.00 0.00 179.45 179.00 1rpx h ALA 31 N 1.73 -0.81 0.00 3.86 0.00 -1.16 -1.81 119.26 121.06 1rpx h ALA 31 Ca 0.18 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1rpx h ALA 31 Cb 0.09 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1rpx h ALA 31 CO -0.05 -0.91 -0.10 -0.84 0.00 0.00 0.00 179.25 177.36 1rpx h ILE 32 N -0.92 0.40 -0.30 0.00 3.07 -1.21 -0.97 117.51 117.58 1rpx h ILE 32 Ca -0.08 -0.54 -0.13 0.00 1.55 0.00 0.00 64.86 65.65 1rpx h ILE 32 Cb 0.66 1.38 -0.01 0.00 -0.27 0.00 0.00 36.82 38.58 1rpx h ILE 32 CO 0.14 0.10 -0.36 -0.08 -1.05 0.00 0.00 178.15 176.89 1rpx h GLU 33 N 0.00 0.68 -0.26 0.16 4.81 -0.97 -1.84 114.58 117.17 1rpx h GLU 33 Ca -0.00 -0.34 -0.09 0.00 -0.13 0.00 0.00 59.36 58.80 1rpx h GLU 33 Cb 0.37 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1rpx h GLU 33 CO 0.01 0.94 -0.19 1.96 -0.73 0.00 0.00 179.01 181.00 1rpx h GLN 34 N 0.57 0.59 0.00 1.92 1.08 -0.42 -2.78 115.11 116.07 1rpx h GLN 34 Ca 0.06 -0.29 0.00 0.00 -1.45 0.00 0.00 58.65 56.97 1rpx h GLN 34 Cb 0.89 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.31 1rpx h GLN 34 CO 0.08 0.87 0.00 0.00 -0.95 0.00 0.00 178.83 178.83 1rpx n ALA 35 N -2.45 1.69 -1.36 3.87 0.00 -0.47 -4.81 120.51 116.98 1rpx n ALA 35 Ca -0.04 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1rpx n ALA 35 Cb 0.41 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1rpx n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rpx n GLY 36 N -0.58 0.66 3.82 0.00 0.00 -1.05 -4.13 105.19 103.91 1rpx n GLY 36 Ca 0.03 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 1rpx n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rpx n ASP 38 N -3.14 1.94 -4.56 0.00 8.00 -0.16 -4.84 116.55 113.79 1rpx n ASP 38 Ca 0.07 0.35 -0.26 0.00 0.71 0.00 0.00 54.79 55.67 1rpx n ASP 38 Cb 0.54 -0.79 -0.11 0.00 -0.02 0.00 0.00 41.12 40.74 1rpx n ASP 38 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1rpx s TRP 39 N -2.66 2.37 -0.20 1.24 0.51 -0.87 -4.27 118.94 115.05 1rpx s TRP 39 Ca -0.33 -0.66 0.00 0.00 -2.12 0.00 0.00 56.10 52.99 1rpx s TRP 39 Cb 0.09 -1.55 0.02 0.00 -0.81 0.00 0.00 33.47 31.23 1rpx s TRP 39 CO 0.46 0.42 -0.15 0.42 -0.51 0.00 0.00 176.95 177.59 1rpx s ILE 40 N -2.78 2.36 -0.19 2.03 1.01 -0.51 -3.29 121.20 119.83 1rpx s ILE 40 Ca 0.34 -0.98 -0.19 0.00 0.00 0.00 0.00 60.65 59.82 1rpx s ILE 40 Cb 0.07 -2.08 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 1rpx s ILE 40 CO 0.17 0.41 0.54 -2.28 0.00 0.00 0.00 174.94 173.78 1rpx s HIS 41 N 1.30 3.38 -0.29 3.97 2.46 -0.01 0.07 115.29 126.16 1rpx s HIS 41 Ca 0.03 0.82 -0.04 0.00 0.47 0.00 0.00 55.06 56.33 1rpx s HIS 41 Cb -0.14 -2.69 0.03 0.00 -0.13 0.00 0.00 32.58 29.64 1rpx s HIS 41 CO -0.10 -0.10 0.02 0.08 -2.47 0.00 0.00 174.74 172.18 1rpx s VAL 42 N 1.63 3.36 -0.46 0.89 1.01 0.15 -2.04 120.40 124.94 1rpx s VAL 42 Ca 0.25 -1.07 -0.20 0.00 0.00 0.00 0.00 61.98 60.97 1rpx s VAL 42 Cb -0.16 -2.82 0.03 0.00 0.00 0.00 0.00 36.38 33.44 1rpx s VAL 42 CO 0.10 0.01 0.62 -1.81 0.00 0.00 0.00 175.10 174.02 1rpx s ASP 43 N 1.36 6.28 -0.31 3.32 1.01 -1.26 -0.91 116.67 126.16 1rpx s ASP 43 Ca -0.01 -0.54 -0.14 0.00 0.71 0.00 0.00 52.55 52.56 1rpx s ASP 43 Cb -0.18 -2.30 -0.03 0.00 1.01 0.00 0.00 42.92 41.42 1rpx s ASP 43 CO -0.00 -0.80 0.33 -0.69 0.21 0.00 0.00 175.17 174.21 1rpx s VAL 44 N 2.72 5.20 -0.03 -1.27 1.01 -0.44 -4.31 120.40 123.28 1rpx s VAL 44 Ca 0.19 0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.44 1rpx s VAL 44 Cb -0.16 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 1rpx s VAL 44 CO 0.16 0.05 -0.20 -0.04 0.00 0.00 0.00 175.10 175.07 1rpx s MET 45 N 1.97 1.88 0.00 2.72 -1.94 -1.26 -0.19 119.30 122.48 1rpx s MET 45 Ca 0.11 -0.73 0.13 0.00 -1.71 0.00 0.00 55.69 53.50 1rpx s MET 45 Cb -0.16 -1.70 0.17 0.00 2.01 0.00 0.00 34.83 35.15 1rpx s MET 45 CO 0.11 0.36 1.01 -0.40 -0.01 0.00 0.00 175.02 176.09 1rpx n ASP 46 N 2.85 2.34 0.00 3.03 5.75 -1.20 -1.81 116.55 127.50 1rpx n ASP 46 Ca -0.17 -1.66 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 1rpx n ASP 46 Cb 0.53 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.54 1rpx n ASP 46 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rpx n GLY 47 N 0.71 1.95 0.41 6.12 0.00 0.22 -4.81 105.19 109.79 1rpx n GLY 47 Ca 0.09 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 1rpx n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rpx n ARG 48 N -2.00 0.39 -0.06 1.61 5.12 -1.26 -4.57 116.66 115.89 1rpx n ARG 48 Ca 0.00 0.17 -0.13 0.00 -1.93 0.00 0.00 57.85 55.95 1rpx n ARG 48 Cb 0.00 -1.17 -0.01 0.00 -1.16 0.00 0.00 32.46 30.12 1rpx n ARG 48 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 1rpx h PHE 49 N -0.68 1.00 -3.95 -1.55 3.57 -1.87 -3.44 116.94 110.01 1rpx h PHE 49 Ca -0.35 -0.36 -0.46 0.00 3.53 0.00 0.00 57.97 60.33 1rpx h PHE 49 Cb 1.22 -0.19 -0.22 0.00 2.79 0.00 0.00 35.95 39.56 1rpx h PHE 49 CO -0.12 1.16 -0.79 0.14 -2.23 0.00 0.00 178.31 176.46 1rpx s VAL 50 N -4.09 1.29 -0.09 1.41 -7.23 -1.26 -5.02 120.40 105.42 1rpx s VAL 50 Ca -0.10 -1.37 -0.05 0.00 -1.81 0.00 0.00 61.98 58.66 1rpx s VAL 50 Cb 0.10 -1.21 -0.19 0.00 0.56 0.00 0.00 36.38 35.64 1rpx s VAL 50 CO 0.88 -0.17 2.75 -0.81 -0.31 0.00 0.00 175.10 177.44 1rpx n PRO 51 N 1.24 1.55 -3.57 4.82 -0.04 -1.26 -2.76 135.00 134.99 1rpx n PRO 51 Ca -0.21 -0.81 -0.13 0.00 -0.04 0.00 0.00 63.50 62.31 1rpx n PRO 51 Cb 0.54 -1.92 -0.06 0.00 -0.04 0.00 0.00 33.50 32.02 1rpx n PRO 51 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1rpx s ASN 52 N 2.32 -0.52 -0.08 3.54 2.47 -1.26 -4.95 114.94 116.47 1rpx s ASN 52 Ca 0.49 0.67 0.03 0.00 0.42 0.00 0.00 52.86 54.47 1rpx s ASN 52 Cb 0.23 0.57 -0.02 0.00 -1.45 0.00 0.00 41.25 40.58 1rpx s ASN 52 CO -0.00 -0.40 -0.16 -0.63 -3.72 0.00 0.00 177.10 172.19 1rpx s ILE 53 N -0.81 2.90 0.00 -5.21 1.01 -1.26 -0.61 121.20 117.22 1rpx s ILE 53 Ca -0.04 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 59.85 1rpx s ILE 53 Cb -0.01 -2.15 0.00 0.00 0.01 0.00 0.00 42.46 40.31 1rpx s ILE 53 CO 0.03 0.57 0.00 0.35 0.00 0.00 0.00 174.94 175.89 1rpx n THR 54 N 2.80 0.00 -3.95 2.92 -2.24 -0.75 -4.93 114.28 108.12 1rpx n THR 54 Ca -0.17 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.51 1rpx n THR 54 Cb 0.52 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.65 1rpx n THR 54 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1rpx s ILE 55 N 0.26 0.11 0.00 2.28 -4.36 -1.26 -4.96 121.20 113.26 1rpx s ILE 55 Ca 0.00 -0.87 0.00 0.00 -0.26 0.00 0.00 60.65 59.52 1rpx s ILE 55 Cb 0.00 -0.36 0.00 0.00 1.25 0.00 0.00 42.46 43.35 1rpx s ILE 55 CO 0.00 -0.48 0.00 0.61 0.24 0.00 0.00 174.94 175.31 1rpx n GLY 56 N 1.50 4.70 0.36 6.27 0.00 -1.26 -4.48 105.19 112.28 1rpx n GLY 56 Ca -0.23 -2.13 0.22 0.00 0.00 0.00 0.00 46.02 43.88 1rpx n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1rpx h PRO 57 N 0.00 0.41 -0.36 1.61 0.11 -1.97 -2.09 132.00 129.72 1rpx h PRO 57 Ca 0.00 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.11 1rpx h PRO 57 Cb 0.00 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 1rpx h PRO 57 CO 0.00 0.27 0.24 1.37 -0.21 0.00 0.00 178.00 179.67 1rpx h LEU 58 N 0.43 0.33 -0.21 2.35 -0.00 -1.95 0.69 115.31 116.95 1rpx h LEU 58 Ca 0.68 -0.01 -0.22 0.00 -0.00 0.00 0.00 57.88 58.34 1rpx h LEU 58 Cb 1.53 -0.08 0.01 0.00 -0.00 0.00 0.00 40.66 42.12 1rpx h LEU 58 CO -0.48 0.23 -0.77 0.58 -0.00 0.00 0.00 178.44 178.01 1rpx h VAL 59 N 0.39 1.29 -0.47 0.15 2.07 -1.76 -2.90 116.25 115.02 1rpx h VAL 59 Ca 0.14 -2.00 -0.07 0.00 0.82 0.00 0.00 66.70 65.60 1rpx h VAL 59 Cb 0.10 1.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 1rpx h VAL 59 CO -0.03 0.63 0.04 0.58 0.02 0.00 0.00 177.57 178.80 1rpx h VAL 60 N 0.50 1.26 -0.43 2.57 2.07 -1.39 -2.45 116.25 118.37 1rpx h VAL 60 Ca -0.05 -1.00 0.03 0.00 0.82 0.00 0.00 66.70 66.51 1rpx h VAL 60 Cb 1.39 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 32.11 1rpx h VAL 60 CO 0.15 0.35 0.29 -0.78 0.02 0.00 0.00 177.57 177.60 1rpx h ASP 61 N 0.67 0.41 1.48 0.57 1.82 -0.90 -1.25 116.42 119.21 1rpx h ASP 61 Ca 0.14 -0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.77 1rpx h ASP 61 Cb 0.45 -0.10 0.00 0.00 0.68 0.00 0.00 39.33 40.37 1rpx h ASP 61 CO 0.02 0.28 -0.37 0.77 -1.61 0.00 0.00 179.24 178.33 1rpx h SER 62 N 0.48 0.00 0.61 2.28 4.64 -1.28 -3.31 113.55 116.96 1rpx h SER 62 Ca 0.17 -0.03 -0.28 0.00 -0.47 0.00 0.00 61.79 61.19 1rpx h SER 62 Cb 0.11 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.16 1rpx h SER 62 CO -0.04 0.02 -1.50 -0.07 -0.87 0.00 0.00 176.83 174.36 1rpx h LEU 63 N 0.00 0.08 -0.68 5.97 3.38 -0.86 -3.39 115.31 119.82 1rpx h LEU 63 Ca 0.00 -0.13 0.14 0.00 0.09 0.00 0.00 57.88 57.98 1rpx h LEU 63 Cb 0.92 -0.03 -0.12 0.00 0.09 0.00 0.00 40.66 41.52 1rpx h LEU 63 CO 0.00 1.11 -0.10 -0.09 0.09 0.00 0.00 178.44 179.45 1rpx h ARG 64 N 0.01 0.04 0.00 1.13 9.65 -1.36 -0.66 114.38 123.19 1rpx h ARG 64 Ca -0.21 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.67 1rpx h ARG 64 Cb 1.95 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 30.52 1rpx h ARG 64 CO 0.11 0.03 0.00 -1.00 2.80 0.00 0.00 179.97 181.90 1rpx h PRO 65 N 0.04 0.00 -0.02 0.20 0.13 -1.76 -3.24 132.00 127.35 1rpx h PRO 65 Ca 0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.47 1rpx h PRO 65 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 1rpx h PRO 65 CO -0.65 0.00 -0.13 0.44 -0.23 0.00 0.00 178.00 177.43 1rpx n ILE 66 N -2.50 0.00 -3.73 -3.56 -5.35 -0.26 -4.92 119.36 99.03 1rpx n ILE 66 Ca 0.03 -0.27 -0.13 0.00 -0.27 0.00 0.00 62.75 62.10 1rpx n ILE 66 Cb 0.32 0.78 -0.08 0.00 -1.74 0.00 0.00 39.64 38.93 1rpx n ILE 66 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 1rpx s THR 67 N -2.19 0.06 -1.94 7.28 -1.32 -1.18 -4.88 115.64 111.47 1rpx s THR 67 Ca 0.30 -0.50 0.16 0.00 -1.21 0.00 0.00 61.69 60.43 1rpx s THR 67 Cb 0.20 -0.76 0.14 0.00 -1.51 0.00 0.00 72.50 70.56 1rpx s THR 67 CO 0.40 -0.28 1.01 0.47 -2.21 0.00 0.00 174.62 174.02 1rpx n ASP 68 N 0.97 2.34 -4.78 8.08 8.00 -1.26 -4.81 116.55 125.09 1rpx n ASP 68 Ca -0.20 -1.67 -0.32 0.00 0.71 0.00 0.00 54.79 53.31 1rpx n ASP 68 Cb 0.57 -0.01 0.06 0.00 -0.02 0.00 0.00 41.12 41.72 1rpx n ASP 68 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1rpx s LEU 69 N -1.30 3.23 0.34 0.64 1.43 -1.26 -4.97 118.68 116.78 1rpx s LEU 69 Ca 0.19 1.83 -0.27 0.00 -1.03 0.00 0.00 54.13 54.85 1rpx s LEU 69 Cb 0.13 -4.53 -0.09 0.00 0.03 0.00 0.00 46.19 41.73 1rpx s LEU 69 CO 0.20 -1.67 1.09 -2.16 0.23 0.00 0.00 176.35 174.04 1rpx s PRO 70 N -4.56 4.39 -0.45 1.29 0.04 -1.26 -4.88 135.00 129.57 1rpx s PRO 70 Ca 0.63 1.70 -0.20 0.00 0.04 0.00 0.00 61.00 63.17 1rpx s PRO 70 Cb -0.17 -2.89 0.03 0.00 0.04 0.00 0.00 34.50 31.51 1rpx s PRO 70 CO 0.49 0.02 0.61 -0.51 0.04 0.00 0.00 177.00 177.64 1rpx s LEU 71 N -2.01 4.66 -0.81 -3.56 1.43 -1.26 -1.43 118.68 115.71 1rpx s LEU 71 Ca 0.51 -0.54 -0.18 0.00 -1.03 0.00 0.00 54.13 52.89 1rpx s LEU 71 Cb -0.28 -2.60 0.15 0.00 0.03 0.00 0.00 46.19 43.48 1rpx s LEU 71 CO 0.36 -0.78 0.92 -0.62 0.23 0.00 0.00 176.35 176.45 1rpx s ASP 72 N 2.15 6.54 -0.24 2.29 2.15 0.11 -1.67 116.67 128.00 1rpx s ASP 72 Ca 0.19 -2.03 -0.17 0.00 0.43 0.00 0.00 52.55 50.97 1rpx s ASP 72 Cb -0.16 -2.32 -0.03 0.00 -0.30 0.00 0.00 42.92 40.11 1rpx s ASP 72 CO 0.16 -0.96 0.47 -0.69 -0.17 0.00 0.00 175.17 173.99 1rpx s VAL 73 N 2.05 5.12 -0.28 1.11 1.01 0.16 -0.67 120.40 128.89 1rpx s VAL 73 Ca 0.23 0.81 -0.07 0.00 0.00 0.00 0.00 61.98 62.95 1rpx s VAL 73 Cb -0.12 -3.79 -0.00 0.00 0.00 0.00 0.00 36.38 32.47 1rpx s VAL 73 CO -0.05 0.14 0.07 -2.28 0.00 0.00 0.00 175.10 172.99 1rpx s HIS 74 N 1.98 3.11 -0.75 5.22 2.46 -0.09 -0.23 115.29 126.98 1rpx s HIS 74 Ca 0.20 -0.81 -0.18 0.00 0.47 0.00 0.00 55.06 54.74 1rpx s HIS 74 Cb -0.15 -2.24 0.13 0.00 -0.13 0.00 0.00 32.58 30.18 1rpx s HIS 74 CO 0.09 -0.51 0.89 -0.51 -2.47 0.00 0.00 174.74 172.23 1rpx s LEU 75 N 1.53 5.39 -1.14 8.88 1.02 0.22 -1.33 118.68 133.25 1rpx s LEU 75 Ca 0.04 -1.80 -0.05 0.00 0.02 0.00 0.00 54.13 52.34 1rpx s LEU 75 Cb -0.16 -2.33 0.26 0.00 0.02 0.00 0.00 46.19 43.98 1rpx s LEU 75 CO 0.02 -1.05 1.71 0.23 0.02 0.00 0.00 176.35 177.29 1rpx n MET 76 N 6.16 4.44 -4.07 1.70 2.81 0.74 -4.25 117.12 124.66 1rpx n MET 76 Ca 0.06 -4.24 -0.07 0.00 -1.81 0.00 0.00 57.70 51.65 1rpx n MET 76 Cb 0.46 -2.61 -0.10 0.00 -0.71 0.00 0.00 33.22 30.26 1rpx n MET 76 CO 0.00 0.00 0.00 0.96 1.51 0.00 0.00 175.97 178.44 1rpx s ILE 77 N -2.14 0.21 0.52 2.02 -4.36 -1.26 -3.23 121.20 112.95 1rpx s ILE 77 Ca 0.36 -1.73 -0.09 0.00 -0.26 0.00 0.00 60.65 58.93 1rpx s ILE 77 Cb 0.09 -1.47 -0.05 0.00 1.25 0.00 0.00 42.46 42.29 1rpx s ILE 77 CO 0.03 -0.95 0.89 0.68 0.24 0.00 0.00 174.94 175.82 1rpx s VAL 78 N -3.84 4.78 -1.32 8.37 -7.23 -1.26 -4.25 120.40 115.65 1rpx s VAL 78 Ca 0.06 0.60 -0.16 0.00 -1.81 0.00 0.00 61.98 60.67 1rpx s VAL 78 Cb 0.07 -3.83 0.01 0.00 0.56 0.00 0.00 36.38 33.20 1rpx s VAL 78 CO -0.10 -0.88 0.48 -0.62 -0.31 0.00 0.00 175.10 173.68 1rpx n GLU 79 N -2.19 -1.30 0.22 4.82 1.02 -0.38 -4.83 120.64 118.00 1rpx n GLU 79 Ca 0.03 0.23 0.17 0.00 -0.02 0.00 0.00 57.16 57.57 1rpx n GLU 79 Cb 0.54 -3.56 0.85 0.00 -0.02 0.00 0.00 31.44 29.26 1rpx n GLU 79 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1rpx h PRO 80 N -2.11 0.00 0.00 3.49 0.13 -1.74 -2.48 132.00 129.29 1rpx h PRO 80 Ca -0.67 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.45 1rpx h PRO 80 Cb 1.39 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.52 1rpx h PRO 80 CO 0.58 0.00 -0.05 0.38 -0.23 0.00 0.00 178.00 178.68 1rpx h ASP 81 N 0.00 0.00 -0.13 1.44 2.03 -1.93 -0.39 116.42 117.44 1rpx h ASP 81 Ca 0.07 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.26 1rpx h ASP 81 Cb 0.42 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.90 1rpx h ASP 81 CO -0.00 0.05 -0.29 1.56 -1.03 0.00 0.00 179.24 179.53 1rpx h GLN 82 N 0.00 0.60 0.00 4.15 1.08 -1.81 -3.19 115.11 115.94 1rpx h GLN 82 Ca -0.00 -0.25 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 1rpx h GLN 82 Cb 0.50 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1rpx h GLN 82 CO 0.01 0.82 -1.23 0.54 -0.95 0.00 0.00 178.83 178.01 1rpx n ARG 83 N -4.09 0.48 -0.11 1.46 3.00 -0.84 -4.59 116.66 111.97 1rpx n ARG 83 Ca -0.01 -0.00 -0.07 0.00 -0.01 0.00 0.00 57.85 57.76 1rpx n ARG 83 Cb 0.45 -1.66 -0.00 0.00 0.00 0.00 0.00 32.46 31.24 1rpx n ARG 83 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1rpx h VAL 84 N 0.00 0.30 -0.27 1.55 2.07 -1.08 -1.93 116.25 116.90 1rpx h VAL 84 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1rpx h VAL 84 Cb 0.88 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1rpx h VAL 84 CO 0.00 0.00 0.18 1.55 0.02 0.00 0.00 177.57 179.32 1rpx h PRO 85 N -0.21 0.28 -0.82 1.57 0.13 -1.81 -1.91 132.00 129.23 1rpx h PRO 85 Ca 0.18 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.26 1rpx h PRO 85 Cb 0.50 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.53 1rpx h PRO 85 CO -0.51 0.19 0.36 -0.44 -0.23 0.00 0.00 178.00 177.37 1rpx h ASP 86 N 0.29 1.10 0.12 1.44 3.32 -1.65 -0.81 116.42 120.23 1rpx h ASP 86 Ca 0.11 -0.15 -0.15 0.00 0.02 0.00 0.00 57.03 56.86 1rpx h ASP 86 Cb 0.07 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1rpx h ASP 86 CO -0.02 0.95 -0.54 -0.26 -1.72 0.00 0.00 179.24 177.64 1rpx h PHE 87 N 1.18 0.57 -0.23 4.55 0.04 -1.18 -1.25 116.94 120.62 1rpx h PHE 87 Ca 0.28 -0.20 -0.12 0.00 2.80 0.00 0.00 57.97 60.73 1rpx h PHE 87 Cb 0.17 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1rpx h PHE 87 CO 0.02 0.90 -0.33 0.82 -0.60 0.00 0.00 178.31 179.12 1rpx h ILE 88 N 0.35 1.32 -0.48 -0.55 2.04 -1.05 -1.86 117.51 117.28 1rpx h ILE 88 Ca 0.01 -1.53 -0.04 0.00 1.00 0.00 0.00 64.86 64.30 1rpx h ILE 88 Cb 1.06 1.76 -0.02 0.00 -0.74 0.00 0.00 36.82 38.88 1rpx h ILE 88 CO 0.10 0.48 0.15 0.50 0.00 0.00 0.00 178.15 179.37 1rpx h LYS 89 N 0.32 0.71 0.00 2.37 3.64 -1.16 0.59 116.57 123.04 1rpx h LYS 89 Ca 0.02 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1rpx h LYS 89 Cb 0.91 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1rpx h LYS 89 CO 0.08 0.62 0.00 0.00 -2.27 0.00 0.00 179.45 177.88 1rpx n ALA 90 N -2.46 1.50 0.00 5.00 0.00 -0.47 -4.85 120.51 119.22 1rpx n ALA 90 Ca 0.03 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1rpx n ALA 90 Cb 0.19 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1rpx n ALA 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rpx n GLY 91 N -0.35 1.32 3.75 0.00 0.00 0.20 -3.72 105.19 106.39 1rpx n GLY 91 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1rpx n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rpx s ALA 92 N -2.00 3.45 -0.13 4.61 0.00 -0.72 -4.68 121.76 122.28 1rpx s ALA 92 Ca 0.00 1.02 0.12 0.00 0.00 0.00 0.00 51.96 53.09 1rpx s ALA 92 Cb 0.00 -3.41 -0.24 0.00 0.00 0.00 0.00 23.12 19.47 1rpx s ALA 92 CO 0.00 -0.39 0.31 -0.25 0.00 0.00 0.00 175.76 175.43 1rpx n ASP 93 N 1.88 0.76 -4.00 0.00 8.00 -0.67 -4.74 116.55 117.78 1rpx n ASP 93 Ca 0.02 0.18 -0.24 0.00 0.71 0.00 0.00 54.79 55.46 1rpx n ASP 93 Cb 0.44 0.24 -0.17 0.00 -0.02 0.00 0.00 41.12 41.62 1rpx n ASP 93 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1rpx s ILE 94 N -2.54 1.01 -0.18 0.53 1.01 -0.93 -0.97 121.20 119.13 1rpx s ILE 94 Ca -0.12 -0.41 0.01 0.00 0.00 0.00 0.00 60.65 60.14 1rpx s ILE 94 Cb 0.07 -0.94 0.03 0.00 0.01 0.00 0.00 42.46 41.63 1rpx s ILE 94 CO 0.80 0.33 -0.14 -0.69 0.00 0.00 0.00 174.94 175.24 1rpx s VAL 95 N 0.71 1.76 -0.15 2.92 1.01 -0.41 -0.67 120.40 125.57 1rpx s VAL 95 Ca -0.14 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 60.88 1rpx s VAL 95 Cb -0.16 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 1rpx s VAL 95 CO 0.03 0.34 0.01 -0.44 0.00 0.00 0.00 175.10 175.04 1rpx s SER 96 N 1.38 5.25 0.18 3.32 0.01 0.68 -1.67 113.70 122.84 1rpx s SER 96 Ca 0.02 0.02 0.11 0.00 1.31 0.00 0.00 55.95 57.40 1rpx s SER 96 Cb -0.15 -1.80 -0.04 0.00 0.21 0.00 0.00 66.02 64.24 1rpx s SER 96 CO -0.10 0.22 -0.23 0.68 0.41 0.00 0.00 173.24 174.22 1rpx s VAL 97 N 0.09 2.19 0.37 3.43 -7.23 -0.61 -0.61 120.40 118.02 1rpx s VAL 97 Ca 0.02 -1.96 -0.24 0.00 -1.81 0.00 0.00 61.98 57.99 1rpx s VAL 97 Cb -0.13 -2.02 -0.10 0.00 0.56 0.00 0.00 36.38 34.70 1rpx s VAL 97 CO 0.02 -0.14 0.98 -1.00 -0.31 0.00 0.00 175.10 174.65 1rpx s HIS 98 N -1.68 3.48 -0.35 2.82 3.76 -1.26 -0.67 115.29 121.39 1rpx s HIS 98 Ca 0.18 1.70 0.23 0.00 -0.15 0.00 0.00 55.06 57.03 1rpx s HIS 98 Cb -0.08 -2.98 0.18 0.00 1.11 0.00 0.00 32.58 30.81 1rpx s HIS 98 CO 0.08 -0.13 1.31 0.00 -0.85 0.00 0.00 174.74 175.15 1rpx n GLU 100 N -2.81 1.91 0.28 0.00 4.71 -1.26 -4.80 120.64 118.67 1rpx n GLU 100 Ca 0.02 0.68 0.16 0.00 -0.01 0.00 0.00 57.16 58.00 1rpx n GLU 100 Cb 0.53 -2.30 0.85 0.00 -1.01 0.00 0.00 31.44 29.51 1rpx n GLU 100 CO 0.00 0.00 0.00 0.37 0.09 0.00 0.00 177.13 177.59 1rpx h GLN 101 N 2.18 0.00 0.00 3.49 5.75 -1.91 -1.16 115.11 123.46 1rpx h GLN 101 Ca -0.46 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.04 1rpx h GLN 101 Cb 1.30 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.85 1rpx h GLN 101 CO 0.60 0.06 0.00 -1.13 -2.65 0.00 0.00 178.83 175.72 1rpx n SER 102 N -3.50 0.00 0.01 -0.69 3.41 -1.26 -4.06 113.62 107.53 1rpx n SER 102 Ca -0.02 -0.81 -0.03 0.00 -0.26 0.00 0.00 58.87 57.75 1rpx n SER 102 Cb 0.19 -0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 64.07 1rpx n SER 102 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1rpx n SER 103 N -1.05 1.04 -4.21 4.04 2.88 -0.47 -4.78 113.62 111.06 1rpx n SER 103 Ca 0.22 0.15 -0.28 0.00 -1.33 0.00 0.00 58.87 57.62 1rpx n SER 103 Cb 0.13 -0.35 -0.16 0.00 -0.75 0.00 0.00 64.21 63.08 1rpx n SER 103 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1rpx s THR 104 N -2.17 1.72 -0.18 2.46 2.01 -0.98 -1.24 115.64 117.26 1rpx s THR 104 Ca -0.07 -0.90 -0.21 0.00 0.31 0.00 0.00 61.69 60.82 1rpx s THR 104 Cb 0.02 -1.45 -0.21 0.00 0.01 0.00 0.00 72.50 70.86 1rpx s THR 104 CO 0.10 0.49 0.34 0.40 -0.69 0.00 0.00 174.62 175.26 1rpx h ILE 105 N 4.97 1.04 -3.21 1.82 2.04 -1.87 -3.38 117.51 118.92 1rpx h ILE 105 Ca -0.35 -2.24 -0.77 0.00 1.00 0.00 0.00 64.86 62.51 1rpx h ILE 105 Cb 1.16 2.47 -0.31 0.00 -0.74 0.00 0.00 36.82 39.40 1rpx h ILE 105 CO 0.47 0.43 0.35 1.41 0.00 0.00 0.00 178.15 180.82 1rpx n HIS 106 N -4.35 4.04 -0.11 1.37 8.25 -1.26 -4.88 115.22 118.29 1rpx n HIS 106 Ca -0.28 -3.60 -0.05 0.00 -0.26 0.00 0.00 57.72 53.53 1rpx n HIS 106 Cb 0.70 -1.36 0.01 0.00 1.12 0.00 0.00 29.99 30.46 1rpx n HIS 106 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1rpx h LEU 107 N 5.95 -0.25 -0.20 2.41 6.46 -1.94 -1.51 115.31 126.24 1rpx h LEU 107 Ca 0.18 0.10 0.04 0.00 -0.12 0.00 0.00 57.88 58.08 1rpx h LEU 107 Cb 0.77 0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 40.85 1rpx h LEU 107 CO 1.06 -0.08 -0.05 -0.74 -0.62 0.00 0.00 178.44 178.01 1rpx h HIS 108 N 0.05 -0.10 -0.74 1.25 2.76 -1.94 -1.16 115.15 115.27 1rpx h HIS 108 Ca 0.18 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.33 1rpx h HIS 108 Cb 0.26 0.08 -0.03 0.00 1.55 0.00 0.00 27.41 29.26 1rpx h HIS 108 CO -0.29 -0.08 0.31 -0.09 -1.30 0.00 0.00 177.93 176.48 1rpx h ARG 109 N 0.00 1.09 -0.42 5.26 1.12 -1.92 -2.38 114.38 117.14 1rpx h ARG 109 Ca 0.10 -0.19 -0.00 0.00 -1.11 0.00 0.00 59.98 58.77 1rpx h ARG 109 Cb 0.14 -0.18 -0.02 0.00 -0.01 0.00 0.00 29.97 29.90 1rpx h ARG 109 CO -0.20 0.88 0.24 1.15 -3.11 0.00 0.00 179.97 178.93 1rpx h THR 110 N 1.05 1.14 -0.42 0.20 2.02 -0.80 0.17 112.91 116.27 1rpx h THR 110 Ca 0.25 -0.34 0.03 0.00 0.77 0.00 0.00 66.41 67.11 1rpx h THR 110 Cb 0.19 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.18 1rpx h THR 110 CO -0.02 0.15 0.23 0.40 0.37 0.00 0.00 175.52 176.64 1rpx h ILE 111 N 0.55 1.00 -0.39 3.11 1.08 -1.06 -1.95 117.51 119.85 1rpx h ILE 111 Ca 0.15 -0.16 -0.10 0.00 -0.39 0.00 0.00 64.86 64.36 1rpx h ILE 111 Cb 0.02 0.50 -0.02 0.00 -3.07 0.00 0.00 36.82 34.26 1rpx h ILE 111 CO -0.03 0.08 -0.17 0.78 -0.69 0.00 0.00 178.15 178.13 1rpx h ASN 112 N 0.46 0.72 -0.74 1.72 2.35 -1.12 -2.63 115.58 116.34 1rpx h ASN 112 Ca 0.18 -0.23 0.04 0.00 -0.55 0.00 0.00 56.30 55.74 1rpx h ASN 112 Cb 0.06 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.18 1rpx h ASN 112 CO -0.11 0.90 0.45 -0.61 -1.65 0.00 0.00 177.43 176.41 1rpx h GLN 113 N 0.65 0.84 -0.46 0.81 4.15 -0.20 0.11 115.11 121.01 1rpx h GLN 113 Ca 0.10 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.47 1rpx h GLN 113 Cb 0.65 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.13 1rpx h GLN 113 CO 0.05 0.55 0.28 0.82 -1.93 0.00 0.00 178.83 178.60 1rpx h ILE 114 N 0.86 1.14 -0.59 2.39 2.04 -1.07 -2.19 117.51 120.08 1rpx h ILE 114 Ca 0.31 -0.32 -0.10 0.00 1.00 0.00 0.00 64.86 65.75 1rpx h ILE 114 Cb 0.08 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 1rpx h ILE 114 CO -0.14 0.14 -0.03 0.11 0.00 0.00 0.00 178.15 178.23 1rpx h LYS 115 N 0.61 1.06 -0.97 2.37 1.57 -1.06 -2.60 116.57 117.55 1rpx h LYS 115 Ca 0.16 -0.35 0.08 0.00 -1.87 0.00 0.00 60.65 58.67 1rpx h LYS 115 Cb -0.01 -0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.14 1rpx h LYS 115 CO -0.03 1.05 0.61 0.77 -0.57 0.00 0.00 179.45 181.28 1rpx h SER 116 N 0.95 0.95 0.03 0.86 0.02 -0.41 -0.38 113.55 115.58 1rpx h SER 116 Ca 0.16 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1rpx h SER 116 Cb 0.60 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1rpx h SER 116 CO 0.04 0.58 0.00 0.18 -1.14 0.00 0.00 176.83 176.48 1rpx n LEU 117 N -4.57 0.00 0.00 5.07 4.32 -0.86 -4.91 117.00 116.05 1rpx n LEU 117 Ca 0.16 0.02 0.00 0.00 -0.02 0.00 0.00 56.01 56.17 1rpx n LEU 117 Cb 0.23 -0.02 0.00 0.00 -1.62 0.00 0.00 43.42 42.02 1rpx n LEU 117 CO 0.30 -0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.08 1rpx n GLY 118 N 0.81 0.86 3.81 -0.72 0.00 -0.15 -5.03 105.19 104.77 1rpx n GLY 118 Ca 0.21 -0.03 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1rpx n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rpx s ALA 119 N -2.00 3.79 -0.00 4.61 0.00 -1.00 -5.03 121.76 122.14 1rpx s ALA 119 Ca 0.00 -1.91 -0.26 0.00 0.00 0.00 0.00 51.96 49.79 1rpx s ALA 119 Cb 0.00 -0.81 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 1rpx s ALA 119 CO 0.00 -0.13 0.81 0.15 0.00 0.00 0.00 175.76 176.60 1rpx s LYS 120 N -3.99 4.51 -0.02 0.00 -0.14 -0.14 -4.02 119.74 115.93 1rpx s LYS 120 Ca 0.43 1.12 -0.17 0.00 -1.36 0.00 0.00 55.97 56.00 1rpx s LYS 120 Cb -0.01 -3.42 -0.05 0.00 -1.68 0.00 0.00 37.83 32.66 1rpx s LYS 120 CO 0.25 0.11 0.46 0.00 -0.76 0.00 0.00 175.35 175.42 1rpx s ALA 121 N 0.54 3.60 0.09 5.17 0.00 -1.26 -1.29 121.76 128.61 1rpx s ALA 121 Ca 0.42 -0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.29 1rpx s ALA 121 Cb -0.20 -2.52 -0.03 0.00 0.00 0.00 0.00 23.12 20.37 1rpx s ALA 121 CO 0.23 0.31 -0.15 0.20 0.00 0.00 0.00 175.76 176.35 1rpx s GLY 122 N -0.54 0.98 0.11 0.00 0.00 -0.67 -0.43 107.32 106.76 1rpx s GLY 122 Ca 0.26 -1.11 0.09 0.00 0.00 0.00 0.00 44.72 43.95 1rpx s GLY 122 CO 0.14 -1.14 -0.17 0.14 0.00 0.00 0.00 173.10 172.07 1rpx s VAL 123 N -1.44 2.92 0.07 1.40 1.01 -0.74 -1.57 120.40 122.04 1rpx s VAL 123 Ca 0.02 -1.45 0.08 0.00 0.00 0.00 0.00 61.98 60.63 1rpx s VAL 123 Cb -0.09 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.92 1rpx s VAL 123 CO 0.03 0.12 -0.22 -0.69 0.00 0.00 0.00 175.10 174.33 1rpx s VAL 124 N -1.14 1.81 -0.09 2.92 1.01 0.15 0.16 120.40 125.22 1rpx s VAL 124 Ca 0.18 -1.37 0.01 0.00 0.00 0.00 0.00 61.98 60.80 1rpx s VAL 124 Cb -0.11 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.70 1rpx s VAL 124 CO 0.10 0.15 -0.12 -0.76 0.00 0.00 0.00 175.10 174.48 1rpx s LEU 125 N -1.46 1.53 0.77 3.92 1.02 -0.42 -2.26 118.68 121.78 1rpx s LEU 125 Ca 0.08 -0.33 -0.12 0.00 0.02 0.00 0.00 54.13 53.79 1rpx s LEU 125 Cb -0.09 -0.88 0.06 0.00 0.02 0.00 0.00 46.19 45.29 1rpx s LEU 125 CO 0.03 -0.01 1.11 0.20 0.02 0.00 0.00 176.35 177.70 1rpx s ASN 126 N 1.03 4.32 0.29 2.29 0.01 -1.26 -1.91 114.94 119.71 1rpx s ASN 126 Ca -0.07 1.97 0.03 0.00 -0.71 0.00 0.00 52.86 54.07 1rpx s ASN 126 Cb -0.15 -2.54 0.71 0.00 0.41 0.00 0.00 41.25 39.68 1rpx s ASN 126 CO -0.01 -2.16 1.68 -0.65 -1.51 0.00 0.00 177.10 174.45 1rpx h PRO 127 N -0.95 0.30 -0.07 -0.60 0.11 -1.83 -0.39 132.00 128.58 1rpx h PRO 127 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1rpx h PRO 127 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1rpx h PRO 127 CO 0.50 0.20 0.00 0.41 -0.21 0.00 0.00 178.00 178.90 1rpx n GLY 128 N -1.35 -0.32 3.67 -0.55 0.00 -1.26 -4.85 105.19 100.53 1rpx n GLY 128 Ca 0.21 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1rpx n GLY 128 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rpx s THR 129 N -1.92 5.10 0.71 2.61 2.01 -0.16 -5.07 115.64 118.92 1rpx s THR 129 Ca 0.34 1.00 -0.11 0.00 0.31 0.00 0.00 61.69 63.23 1rpx s THR 129 Cb 0.17 -3.86 0.02 0.00 0.01 0.00 0.00 72.50 68.84 1rpx s THR 129 CO 0.28 0.19 1.07 -2.16 -0.69 0.00 0.00 174.62 173.31 1rpx s PRO 130 N 1.52 2.77 0.58 4.92 0.04 -1.26 -4.77 135.00 138.80 1rpx s PRO 130 Ca 0.25 1.05 0.36 0.00 0.04 0.00 0.00 61.00 62.71 1rpx s PRO 130 Cb -0.15 -1.96 1.74 0.00 0.04 0.00 0.00 34.50 34.16 1rpx s PRO 130 CO 0.10 -1.24 2.13 -0.07 0.04 0.00 0.00 177.00 177.96 1rpx h LEU 131 N -0.71 0.00 -2.01 -3.56 3.38 -1.97 -2.62 115.31 107.81 1rpx h LEU 131 Ca -0.44 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.56 1rpx h LEU 131 Cb 1.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1rpx h LEU 131 CO 0.55 0.03 0.08 0.71 0.09 0.00 0.00 178.44 179.90 1rpx h THR 132 N 0.00 0.93 -0.11 0.22 1.35 -2.01 -1.91 112.91 111.38 1rpx h THR 132 Ca -0.00 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 65.89 1rpx h THR 132 Cb 0.31 0.94 -0.00 0.00 -1.73 0.00 0.00 68.15 67.67 1rpx h THR 132 CO 0.00 0.00 0.08 0.00 -0.25 0.00 0.00 175.52 175.35 1rpx h ALA 133 N 1.94 2.06 -0.33 6.62 0.00 -1.85 -2.62 119.26 125.07 1rpx h ALA 133 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1rpx h ALA 133 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1rpx h ALA 133 CO -0.00 -0.14 0.00 0.44 0.00 0.00 0.00 179.25 179.55 1rpx n ILE 134 N -4.44 0.81 -0.17 0.00 -5.35 -0.73 -4.73 119.36 104.76 1rpx n ILE 134 Ca -0.00 -0.91 -0.02 0.00 -0.27 0.00 0.00 62.75 61.55 1rpx n ILE 134 Cb 0.20 0.64 0.07 0.00 -1.74 0.00 0.00 39.64 38.81 1rpx n ILE 134 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1rpx h GLU 135 N 2.39 0.12 -0.74 6.28 4.81 -1.38 0.81 114.58 126.87 1rpx h GLU 135 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1rpx h GLU 135 Cb 0.73 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.08 1rpx h GLU 135 CO 0.00 0.08 0.00 0.66 -0.73 0.00 0.00 179.01 179.02 1rpx n TYR 136 N -5.23 0.93 0.00 0.92 4.01 -1.26 -3.41 117.16 113.12 1rpx n TYR 136 Ca 0.06 -0.33 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 1rpx n TYR 136 Cb 0.28 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 1rpx n TYR 136 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 1rpx n VAL 137 N 0.33 0.00 0.04 -0.72 3.14 -0.82 -4.81 118.33 115.50 1rpx n VAL 137 Ca 0.13 -0.13 0.14 0.00 -2.96 0.00 0.00 64.34 61.52 1rpx n VAL 137 Cb 0.65 0.90 0.60 0.00 -1.06 0.00 0.00 33.84 34.94 1rpx n VAL 137 CO 0.00 0.00 0.00 0.25 -6.46 0.00 0.00 176.83 170.62 1rpx h LEU 138 N 0.00 0.14 -0.10 6.55 5.85 -0.88 0.74 115.31 127.60 1rpx h LEU 138 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1rpx h LEU 138 Cb 0.00 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1rpx h LEU 138 CO 0.00 0.09 0.00 -0.90 -0.34 0.00 0.00 178.44 177.29 1rpx n ASP 139 N -4.45 0.63 -0.04 1.25 5.75 -1.26 -3.90 116.55 114.52 1rpx n ASP 139 Ca 0.06 0.57 0.02 0.00 -0.01 0.00 0.00 54.79 55.43 1rpx n ASP 139 Cb 0.37 -0.74 -0.16 0.00 -1.03 0.00 0.00 41.12 39.56 1rpx n ASP 139 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1rpx n ALA 140 N -1.73 2.23 -1.78 2.12 0.00 0.23 -5.02 120.51 116.57 1rpx n ALA 140 Ca 0.05 -0.85 -0.32 0.00 0.00 0.00 0.00 53.44 52.32 1rpx n ALA 140 Cb 0.38 -0.53 -0.01 0.00 0.00 0.00 0.00 19.45 19.29 1rpx n ALA 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1rpx s VAL 141 N -3.07 4.31 -0.59 0.00 -7.23 -1.07 -4.92 120.40 107.83 1rpx s VAL 141 Ca -0.08 1.03 0.20 0.00 -1.81 0.00 0.00 61.98 61.31 1rpx s VAL 141 Cb 0.10 -3.62 -0.25 0.00 0.56 0.00 0.00 36.38 33.18 1rpx s VAL 141 CO 0.87 -0.71 0.68 0.47 -0.31 0.00 0.00 175.10 176.11 1rpx n ASP 142 N -1.96 0.74 -3.63 4.85 8.00 0.42 -4.78 116.55 120.18 1rpx n ASP 142 Ca 0.07 -0.61 -0.15 0.00 0.71 0.00 0.00 54.79 54.81 1rpx n ASP 142 Cb 0.54 1.33 -0.07 0.00 -0.02 0.00 0.00 41.12 42.90 1rpx n ASP 142 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1rpx s LEU 143 N -3.45 -0.09 -0.06 0.64 0.20 -0.88 -1.65 118.68 113.39 1rpx s LEU 143 Ca 0.02 0.65 0.04 0.00 0.69 0.00 0.00 54.13 55.53 1rpx s LEU 143 Cb 0.14 2.01 0.00 0.00 -0.43 0.00 0.00 46.19 47.91 1rpx s LEU 143 CO 0.81 -0.45 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.56 1rpx s VAL 144 N -0.83 1.46 -0.19 1.68 1.01 0.38 -1.80 120.40 122.11 1rpx s VAL 144 Ca -0.09 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1rpx s VAL 144 Cb -0.03 -1.28 -0.00 0.00 0.00 0.00 0.00 36.38 35.08 1rpx s VAL 144 CO 0.06 0.42 -0.10 -0.22 0.00 0.00 0.00 175.10 175.26 1rpx s LEU 145 N 0.30 2.64 -0.27 3.92 0.20 0.12 -0.25 118.68 125.35 1rpx s LEU 145 Ca -0.10 -0.45 -0.10 0.00 0.69 0.00 0.00 54.13 54.17 1rpx s LEU 145 Cb -0.14 -1.64 -0.04 0.00 -0.43 0.00 0.00 46.19 43.94 1rpx s LEU 145 CO 0.04 0.02 0.14 -0.63 -0.29 0.00 0.00 176.35 175.63 1rpx s ILE 146 N 1.20 4.91 -0.27 6.68 1.09 0.23 -1.30 121.20 133.75 1rpx s ILE 146 Ca 0.02 0.03 -0.27 0.00 -1.10 0.00 0.00 60.65 59.34 1rpx s ILE 146 Cb -0.14 -3.33 0.01 0.00 -1.06 0.00 0.00 42.46 37.94 1rpx s ILE 146 CO -0.04 0.28 0.95 -0.04 -0.10 0.00 0.00 174.94 175.99 1rpx s MET 147 N 1.70 4.14 -0.24 2.79 -1.94 -0.80 -2.33 119.30 122.63 1rpx s MET 147 Ca 0.07 1.05 0.14 0.00 -1.71 0.00 0.00 55.69 55.23 1rpx s MET 147 Cb -0.16 -3.68 0.78 0.00 2.01 0.00 0.00 34.83 33.78 1rpx s MET 147 CO 0.08 -0.67 1.72 -1.13 -0.01 0.00 0.00 175.02 175.01 1rpx n SER 148 N 6.34 5.40 -3.62 3.03 3.41 0.01 -3.76 113.62 124.42 1rpx n SER 148 Ca 0.09 -2.99 -0.16 0.00 -0.26 0.00 0.00 58.87 55.55 1rpx n SER 148 Cb 0.47 -0.68 -0.07 0.00 -0.26 0.00 0.00 64.21 63.67 1rpx n SER 148 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1rpx s VAL 149 N -2.82 0.02 -0.24 -3.33 0.11 -1.25 -0.54 120.40 112.35 1rpx s VAL 149 Ca 0.53 -0.14 -0.29 0.00 -2.93 0.00 0.00 61.98 59.15 1rpx s VAL 149 Cb 0.41 -0.86 -0.01 0.00 -1.53 0.00 0.00 36.38 34.40 1rpx s VAL 149 CO 0.15 -0.08 1.38 0.20 -3.33 0.00 0.00 175.10 173.42 1rpx s ASN 150 N -0.98 6.67 0.33 3.54 0.01 -1.26 -4.66 114.94 118.59 1rpx s ASN 150 Ca -0.10 1.46 -0.29 0.00 -0.71 0.00 0.00 52.86 53.22 1rpx s ASN 150 Cb -0.02 -2.54 -0.11 0.00 0.41 0.00 0.00 41.25 38.99 1rpx s ASN 150 CO 0.07 -1.04 1.52 -2.16 -1.51 0.00 0.00 177.10 173.98 1rpx s PRO 151 N 4.12 4.13 0.00 -0.60 0.04 -1.26 -3.41 135.00 138.03 1rpx s PRO 151 Ca 0.60 2.55 0.00 0.00 0.04 0.00 0.00 61.00 64.19 1rpx s PRO 151 Cb -0.20 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.33 1rpx s PRO 151 CO 0.23 -0.56 0.00 0.41 0.04 0.00 0.00 177.00 177.12 1rpx n GLY 152 N 1.31 2.69 3.95 0.56 0.00 -1.26 -4.78 105.19 107.66 1rpx n GLY 152 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 1rpx n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rpx s PHE 153 N -2.46 3.17 0.30 1.61 0.40 -1.22 -4.67 117.98 115.11 1rpx s PHE 153 Ca 0.00 0.29 0.07 0.00 -0.60 0.00 0.00 56.93 56.69 1rpx s PHE 153 Cb 0.00 -2.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.01 1rpx s PHE 153 CO 0.00 -0.56 0.30 0.20 0.70 0.00 0.00 175.22 175.86 1rpx s GLY 154 N -4.27 1.58 -0.91 4.36 0.00 -1.26 -4.60 107.32 102.22 1rpx s GLY 154 Ca 0.51 -1.51 -0.04 0.00 0.00 0.00 0.00 44.72 43.68 1rpx s GLY 154 CO 0.40 -1.47 0.78 0.61 0.00 0.00 0.00 173.10 173.41 1rpx n GLY 155 N -1.37 -0.11 3.42 0.20 0.00 -1.26 -5.00 105.19 101.08 1rpx n GLY 155 Ca -0.04 -0.04 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 1rpx n GLY 155 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rpx s GLN 156 N -5.55 3.40 0.16 1.61 -1.52 -1.26 -5.09 119.66 111.40 1rpx s GLN 156 Ca 0.26 -0.66 0.10 0.00 -1.95 0.00 0.00 55.36 53.10 1rpx s GLN 156 Cb -0.11 -3.44 -0.04 0.00 -0.22 0.00 0.00 33.01 29.19 1rpx s GLN 156 CO 0.51 -0.34 -0.16 -1.54 -0.25 0.00 0.00 175.29 173.51 1rpx s SER 157 N 1.59 3.90 -0.16 5.90 1.04 -1.26 -4.74 113.70 119.98 1rpx s SER 157 Ca 0.05 -0.65 -0.42 0.00 0.48 0.00 0.00 55.95 55.42 1rpx s SER 157 Cb -0.16 -0.53 -0.19 0.00 0.10 0.00 0.00 66.02 65.23 1rpx s SER 157 CO 0.05 0.14 1.32 0.33 0.98 0.00 0.00 173.24 176.05 1rpx n PHE 158 N 0.38 1.22 -3.01 5.02 7.35 -1.26 -4.82 117.46 122.33 1rpx n PHE 158 Ca -0.13 0.98 -0.43 0.00 -0.76 0.00 0.00 57.45 57.11 1rpx n PHE 158 Cb 0.55 -2.20 -0.06 0.00 0.35 0.00 0.00 39.48 38.12 1rpx n PHE 158 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1rpx s ILE 159 N 1.26 4.67 0.25 -2.13 1.01 0.30 -4.95 121.20 121.60 1rpx s ILE 159 Ca 0.95 0.06 -0.03 0.00 0.00 0.00 0.00 60.65 61.62 1rpx s ILE 159 Cb -1.27 -4.35 0.23 0.00 0.01 0.00 0.00 42.46 37.08 1rpx s ILE 159 CO 0.64 -0.83 1.70 -0.08 0.00 0.00 0.00 174.94 176.37 1rpx h GLU 160 N 9.06 0.34 -0.08 2.79 4.57 -1.91 -2.34 114.58 127.01 1rpx h GLU 160 Ca -0.26 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 57.92 1rpx h GLU 160 Cb 1.09 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 29.60 1rpx h GLU 160 CO 0.98 0.23 0.29 0.66 -1.18 0.00 0.00 179.01 179.99 1rpx h SER 161 N 0.35 0.00 0.78 1.04 4.64 -1.99 -1.45 113.55 116.92 1rpx h SER 161 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1rpx h SER 161 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1rpx h SER 161 CO -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.49 1rpx n GLN 162 N -3.13 0.18 -0.12 4.77 1.13 -0.88 -2.92 117.38 116.41 1rpx n GLN 162 Ca -0.00 0.39 -0.12 0.00 -1.94 0.00 0.00 57.00 55.32 1rpx n GLN 162 Cb 0.37 -1.83 -0.03 0.00 0.11 0.00 0.00 30.24 28.86 1rpx n GLN 162 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1rpx h VAL 163 N 0.00 1.28 -0.94 5.09 2.07 -1.47 -1.72 116.25 120.57 1rpx h VAL 163 Ca 0.00 -1.35 0.01 0.00 0.82 0.00 0.00 66.70 66.18 1rpx h VAL 163 Cb 0.39 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 1rpx h VAL 163 CO 0.00 0.44 0.62 0.50 0.02 0.00 0.00 177.57 179.15 1rpx h LYS 164 N 0.57 1.24 -0.54 1.57 3.64 -1.73 -0.70 116.57 120.62 1rpx h LYS 164 Ca 0.08 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1rpx h LYS 164 Cb 0.76 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 1rpx h LYS 164 CO 0.06 0.82 -0.02 -0.22 -2.27 0.00 0.00 179.45 177.82 1rpx h LYS 165 N 1.27 0.93 -0.47 1.90 3.64 -1.52 -0.68 116.57 121.65 1rpx h LYS 165 Ca 0.34 -0.29 -0.10 0.00 -1.27 0.00 0.00 60.65 59.34 1rpx h LYS 165 Cb -0.14 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 1rpx h LYS 165 CO -0.07 0.94 -0.09 0.82 -2.27 0.00 0.00 179.45 178.78 1rpx h ILE 166 N 0.85 1.27 0.43 2.00 2.04 -0.71 -1.80 117.51 121.59 1rpx h ILE 166 Ca 0.15 -1.20 -0.02 0.00 1.00 0.00 0.00 64.86 64.80 1rpx h ILE 166 Cb 0.54 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1rpx h ILE 166 CO 0.03 0.41 -0.21 -1.28 0.00 0.00 0.00 178.15 177.11 1rpx h SER 167 N 0.72 -0.49 -0.89 1.72 0.87 -0.76 -1.81 113.55 112.92 1rpx h SER 167 Ca 0.12 -0.01 0.12 0.00 -1.23 0.00 0.00 61.79 60.79 1rpx h SER 167 Cb 0.62 0.13 -0.07 0.00 -0.44 0.00 0.00 62.40 62.64 1rpx h SER 167 CO 0.04 -0.32 0.57 0.44 -0.53 0.00 0.00 176.83 177.04 1rpx h ASP 168 N -0.61 0.74 -0.40 6.23 3.32 -1.10 -1.09 116.42 123.50 1rpx h ASP 168 Ca -0.06 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1rpx h ASP 168 Cb 0.46 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1rpx h ASP 168 CO 0.10 0.41 0.16 0.25 -1.72 0.00 0.00 179.24 178.43 1rpx h LEU 169 N 0.80 0.55 -0.14 1.55 5.85 -1.02 -1.95 115.31 120.94 1rpx h LEU 169 Ca 0.43 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 59.00 1rpx h LEU 169 Cb 0.55 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1rpx h LEU 169 CO -0.19 0.56 0.02 0.03 -0.34 0.00 0.00 178.44 178.52 1rpx h ARG 170 N 0.50 0.08 0.22 1.25 2.47 -0.36 -1.31 114.38 117.23 1rpx h ARG 170 Ca 0.13 -0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.86 1rpx h ARG 170 Cb 0.19 -0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 28.45 1rpx h ARG 170 CO -0.01 0.05 -0.50 0.87 0.56 0.00 0.00 179.97 180.94 1rpx h LYS 171 N 0.08 -0.77 -0.77 0.04 1.57 -1.22 -0.92 116.57 114.57 1rpx h LYS 171 Ca 0.06 0.05 0.17 0.00 -1.87 0.00 0.00 60.65 59.07 1rpx h LYS 171 Cb 0.06 0.18 -0.11 0.00 0.08 0.00 0.00 32.23 32.43 1rpx h LYS 171 CO -0.09 -0.51 0.23 0.82 -0.57 0.00 0.00 179.45 179.32 1rpx h ILE 172 N -0.80 0.52 -0.31 1.86 2.04 -1.25 0.70 117.51 120.26 1rpx h ILE 172 Ca -0.01 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1rpx h ILE 172 Cb 0.77 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1rpx h ILE 172 CO -0.22 0.06 0.16 0.00 0.00 0.00 0.00 178.15 178.14 1rpx h ALA 174 N 1.02 0.22 -0.18 0.00 0.00 0.39 0.33 119.26 121.03 1rpx h ALA 174 Ca 0.11 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1rpx h ALA 174 Cb 0.10 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1rpx h ALA 174 CO -0.01 -0.26 -0.20 0.93 0.00 0.00 0.00 179.25 179.71 1rpx h GLU 175 N 0.19 -0.22 0.00 0.00 5.08 -0.78 -0.39 114.58 118.46 1rpx h GLU 175 Ca 0.06 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1rpx h GLU 175 Cb 0.05 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1rpx h GLU 175 CO -0.01 -0.15 0.00 0.54 -1.00 0.00 0.00 179.01 178.39 1rpx n ARG 176 N -5.34 0.89 -3.28 2.33 1.74 -0.49 -4.89 116.66 107.61 1rpx n ARG 176 Ca -0.02 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 56.89 1rpx n ARG 176 Cb 0.26 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.25 1rpx n ARG 176 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rpx n GLY 177 N 0.88 -0.14 3.41 -0.13 0.00 0.20 -5.03 105.19 104.38 1rpx n GLY 177 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 1rpx n GLY 177 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rpx s LEU 178 N -5.58 2.41 -0.39 0.99 1.43 0.90 -5.01 118.68 113.43 1rpx s LEU 178 Ca 0.39 -0.53 0.08 0.00 -1.03 0.00 0.00 54.13 53.05 1rpx s LEU 178 Cb -0.17 -1.40 0.26 0.00 0.03 0.00 0.00 46.19 44.91 1rpx s LEU 178 CO 0.53 0.25 0.56 -0.46 0.23 0.00 0.00 176.35 177.46 1rpx n ASN 179 N 1.56 0.15 -4.83 2.29 2.04 -1.26 -4.16 115.26 111.04 1rpx n ASN 179 Ca -0.17 -2.75 -0.30 0.00 -0.44 0.00 0.00 54.58 50.92 1rpx n ASN 179 Cb 0.52 -0.55 0.08 0.00 -2.53 0.00 0.00 39.78 37.30 1rpx n ASN 179 CO 0.00 0.00 0.00 -2.16 -0.44 0.00 0.00 177.26 174.66 1rpx s PRO 180 N -1.27 2.26 0.33 -0.53 0.04 -1.26 -4.98 135.00 129.58 1rpx s PRO 180 Ca 0.35 0.54 -0.29 0.00 0.04 0.00 0.00 61.00 61.65 1rpx s PRO 180 Cb 0.19 -1.95 -0.10 0.00 0.04 0.00 0.00 34.50 32.69 1rpx s PRO 180 CO -0.11 -1.47 1.27 -1.58 0.04 0.00 0.00 177.00 175.14 1rpx s TRP 181 N -3.25 3.12 -0.35 0.56 0.52 -0.66 -4.85 118.94 114.04 1rpx s TRP 181 Ca 0.60 1.47 -0.02 0.00 0.02 0.00 0.00 56.10 58.17 1rpx s TRP 181 Cb -0.13 -3.60 0.07 0.00 -1.15 0.00 0.00 33.47 28.66 1rpx s TRP 181 CO 0.53 -1.64 0.09 0.42 0.02 0.00 0.00 176.95 176.38 1rpx s ILE 182 N -1.16 3.14 -0.01 2.03 1.01 -1.26 -0.47 121.20 124.48 1rpx s ILE 182 Ca 0.49 -1.67 -0.02 0.00 0.00 0.00 0.00 60.65 59.45 1rpx s ILE 182 Cb -0.38 -2.97 -0.04 0.00 0.01 0.00 0.00 42.46 39.09 1rpx s ILE 182 CO 0.50 -0.36 0.15 -0.70 0.00 0.00 0.00 174.94 174.53 1rpx s GLU 183 N 1.21 3.32 0.03 2.79 2.12 0.65 -1.67 118.70 127.15 1rpx s GLU 183 Ca 0.01 -0.36 0.06 0.00 0.36 0.00 0.00 54.97 55.04 1rpx s GLU 183 Cb -0.21 -3.03 -0.02 0.00 0.26 0.00 0.00 34.13 31.13 1rpx s GLU 183 CO -0.02 0.67 -0.18 0.08 -0.54 0.00 0.00 175.26 175.27 1rpx s VAL 184 N -1.27 1.48 -0.11 3.70 1.01 -0.30 -0.60 120.40 124.31 1rpx s VAL 184 Ca 0.25 -1.07 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 1rpx s VAL 184 Cb -0.12 -1.29 0.06 0.00 0.00 0.00 0.00 36.38 35.03 1rpx s VAL 184 CO 0.16 0.19 0.23 -0.62 0.00 0.00 0.00 175.10 175.06 1rpx s ASP 185 N -1.03 0.34 0.00 3.32 2.15 -0.98 -1.09 116.67 119.38 1rpx s ASP 185 Ca 0.06 0.50 0.00 0.00 0.43 0.00 0.00 52.55 53.54 1rpx s ASP 185 Cb -0.08 0.53 0.00 0.00 -0.30 0.00 0.00 42.92 43.06 1rpx s ASP 185 CO 0.01 -0.23 0.00 0.61 -0.17 0.00 0.00 175.17 175.40 1rpx n GLY 186 N 5.13 1.64 2.33 2.66 0.00 -1.26 -0.81 105.19 114.86 1rpx n GLY 186 Ca -0.10 -0.10 -0.16 0.00 0.00 0.00 0.00 46.02 45.66 1rpx n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rpx n GLY 187 N 0.00 -0.30 3.64 -0.02 0.00 -1.26 -4.26 105.19 102.99 1rpx n GLY 187 Ca 0.00 -0.19 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 1rpx n GLY 187 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rpx s VAL 188 N -2.82 5.18 0.35 1.61 1.01 -1.26 -4.44 120.40 120.03 1rpx s VAL 188 Ca 0.01 0.66 0.05 0.00 0.00 0.00 0.00 61.98 62.70 1rpx s VAL 188 Cb -0.00 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1rpx s VAL 188 CO 0.01 0.21 0.19 -0.83 0.00 0.00 0.00 175.10 174.68 1rpx s GLY 189 N 1.30 2.34 0.61 4.51 0.00 -1.26 -4.68 107.32 110.13 1rpx s GLY 189 Ca 0.17 -1.69 0.33 0.00 0.00 0.00 0.00 44.72 43.53 1rpx s GLY 189 CO 0.09 -1.62 2.27 -0.56 0.00 0.00 0.00 173.10 173.27 1rpx h PRO 190 N 2.05 0.00 -0.00 2.90 0.13 -1.85 -1.27 132.00 133.96 1rpx h PRO 190 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1rpx h PRO 190 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1rpx h PRO 190 CO 0.47 0.00 -0.22 0.36 -0.23 0.00 0.00 178.00 178.38 1rpx n LYS 191 N -3.69 0.10 0.00 0.86 0.00 -1.26 -4.23 118.16 109.94 1rpx n LYS 191 Ca -0.03 -0.03 0.00 0.00 -0.00 0.00 0.00 58.31 58.25 1rpx n LYS 191 Cb 0.10 -1.50 0.00 0.00 -0.00 0.00 0.00 35.03 33.63 1rpx n LYS 191 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1rpx n ASN 192 N -1.42 0.15 0.11 -5.58 6.94 -0.90 -4.84 115.26 109.72 1rpx n ASN 192 Ca 0.07 -0.97 0.16 0.00 -0.02 0.00 0.00 54.58 53.83 1rpx n ASN 192 Cb 0.33 0.01 0.70 0.00 -2.36 0.00 0.00 39.78 38.46 1rpx n ASN 192 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rpx h ALA 193 N 0.00 2.22 -0.88 -2.53 0.00 -1.42 -1.95 119.26 114.70 1rpx h ALA 193 Ca 0.00 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1rpx h ALA 193 Cb 0.41 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1rpx h ALA 193 CO 0.00 -0.40 0.57 0.10 0.00 0.00 0.00 179.25 179.52 1rpx h TYR 194 N 0.00 1.01 -0.21 0.00 -0.00 -1.86 -0.51 116.97 115.40 1rpx h TYR 194 Ca 0.15 0.03 0.06 0.00 0.00 0.00 0.00 58.73 58.96 1rpx h TYR 194 Cb 0.63 -0.33 -0.06 0.00 0.00 0.00 0.00 36.73 36.97 1rpx h TYR 194 CO 0.00 0.54 -0.22 0.87 -0.00 0.00 0.00 178.16 179.35 1rpx h LYS 195 N 1.00 -0.23 0.00 0.10 1.57 -1.72 0.21 116.57 117.50 1rpx h LYS 195 Ca 0.37 0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.99 1rpx h LYS 195 Cb 0.19 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 1rpx h LYS 195 CO -0.14 -0.15 -0.86 -0.39 -0.57 0.00 0.00 179.45 177.34 1rpx h VAL 196 N -0.24 1.57 -0.60 0.50 -1.51 -1.63 -2.49 116.25 111.85 1rpx h VAL 196 Ca 0.13 -2.98 -0.10 0.00 -1.23 0.00 0.00 66.70 62.52 1rpx h VAL 196 Cb 0.43 2.63 -0.02 0.00 -2.13 0.00 0.00 31.29 32.19 1rpx h VAL 196 CO -0.35 0.84 -0.02 0.40 -1.23 0.00 0.00 177.57 177.21 1rpx h ILE 197 N 0.00 1.27 -0.52 7.19 2.04 -0.58 -1.14 117.51 125.77 1rpx h ILE 197 Ca -0.01 -1.18 -0.08 0.00 1.00 0.00 0.00 64.86 64.59 1rpx h ILE 197 Cb 1.56 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.44 1rpx h ILE 197 CO 0.11 0.43 0.03 -0.33 0.00 0.00 0.00 178.15 178.39 1rpx h GLU 198 N 0.97 0.89 0.00 2.37 5.08 -0.56 -2.75 114.58 120.59 1rpx h GLU 198 Ca 0.17 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1rpx h GLU 198 Cb 0.59 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1rpx h GLU 198 CO 0.04 0.91 0.00 0.00 -1.00 0.00 0.00 179.01 178.95 1rpx h ALA 199 N 0.95 1.00 0.00 3.43 0.00 -1.23 -3.46 119.26 119.95 1rpx h ALA 199 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1rpx h ALA 199 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1rpx h ALA 199 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1rpx n GLY 200 N -0.57 0.39 3.72 0.00 0.00 -0.97 -3.75 105.19 104.01 1rpx n GLY 200 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1rpx n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rpx s ALA 201 N -1.36 3.36 -0.91 4.61 0.00 -0.47 -4.80 121.76 122.21 1rpx s ALA 201 Ca 0.00 0.81 0.08 0.00 0.00 0.00 0.00 51.96 52.85 1rpx s ALA 201 Cb 0.00 -3.42 0.08 0.00 0.00 0.00 0.00 23.12 19.78 1rpx s ALA 201 CO 0.00 -0.37 0.79 0.27 0.00 0.00 0.00 175.76 176.45 1rpx n ASN 202 N 3.59 1.75 -3.74 0.00 6.94 -0.67 -4.47 115.26 118.65 1rpx n ASN 202 Ca 0.07 -1.40 -0.22 0.00 -0.02 0.00 0.00 54.58 53.02 1rpx n ASN 202 Cb 0.47 -0.02 -0.18 0.00 -2.36 0.00 0.00 39.78 37.69 1rpx n ASN 202 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rpx s ALA 203 N -0.67 0.56 -0.09 -2.53 0.00 -0.95 -0.59 121.76 117.48 1rpx s ALA 203 Ca 0.10 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.05 1rpx s ALA 203 Cb 0.07 -0.71 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 1rpx s ALA 203 CO 0.10 -0.47 -0.18 -0.51 0.00 0.00 0.00 175.76 174.70 1rpx s LEU 204 N 2.03 2.46 -0.18 0.00 1.43 0.48 -1.15 118.68 123.76 1rpx s LEU 204 Ca 0.05 -0.38 -0.07 0.00 -1.03 0.00 0.00 54.13 52.70 1rpx s LEU 204 Cb -0.12 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.55 1rpx s LEU 204 CO -0.05 0.22 0.05 -0.69 0.23 0.00 0.00 176.35 176.12 1rpx s VAL 205 N 0.00 4.69 -0.01 -1.59 1.01 -0.25 -0.21 120.40 124.04 1rpx s VAL 205 Ca -0.06 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.86 1rpx s VAL 205 Cb -0.15 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.13 1rpx s VAL 205 CO 0.05 0.46 -0.03 0.00 0.00 0.00 0.00 175.10 175.58 1rpx s ALA 206 N 0.40 0.29 0.00 5.51 0.00 -1.22 -4.26 121.76 122.47 1rpx s ALA 206 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 51.89 1rpx s ALA 206 Cb -0.13 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.88 1rpx s ALA 206 CO 0.01 0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.22 1rpx n GLY 207 N 3.20 0.04 0.29 0.00 0.00 -1.26 -0.62 105.19 106.84 1rpx n GLY 207 Ca -0.15 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.93 1rpx n GLY 207 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1rpx h SER 208 N 0.00 0.28 -0.21 1.61 4.64 -1.92 0.06 113.55 118.01 1rpx h SER 208 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rpx h SER 208 Cb 0.00 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 1rpx h SER 208 CO 0.00 0.20 0.14 0.00 -0.87 0.00 0.00 176.83 176.30 1rpx h ALA 209 N 1.84 1.85 0.00 5.18 0.00 -1.87 1.00 119.26 127.25 1rpx h ALA 209 Ca 0.10 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 54.65 1rpx h ALA 209 Cb 0.00 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 1rpx h ALA 209 CO -0.02 0.14 -2.28 1.33 0.00 0.00 0.00 179.25 178.42 1rpx n VAL 210 N -4.51 1.28 0.09 0.00 0.24 -0.69 -4.31 118.33 110.44 1rpx n VAL 210 Ca 0.00 -0.47 -0.06 0.00 -2.04 0.00 0.00 64.34 61.76 1rpx n VAL 210 Cb 0.07 -1.35 0.05 0.00 -1.47 0.00 0.00 33.84 31.15 1rpx n VAL 210 CO 0.00 0.00 0.00 -0.26 -2.14 0.00 0.00 176.83 174.43 1rpx h PHE 211 N -0.09 0.23 -0.14 6.34 0.04 -1.04 -3.06 116.94 119.21 1rpx h PHE 211 Ca -0.51 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.15 1rpx h PHE 211 Cb 1.75 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.87 1rpx h PHE 211 CO 0.01 0.86 0.00 0.41 -0.60 0.00 0.00 178.31 179.00 1rpx n GLY 212 N 0.63 -0.01 3.89 -1.45 0.00 0.34 -4.91 105.19 103.68 1rpx n GLY 212 Ca -0.03 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 1rpx n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rpx s ALA 213 N -1.82 3.61 0.15 4.61 0.00 -1.16 -5.01 121.76 122.15 1rpx s ALA 213 Ca 0.29 -0.39 -0.16 0.00 0.00 0.00 0.00 51.96 51.71 1rpx s ALA 213 Cb 0.15 -2.36 0.02 0.00 0.00 0.00 0.00 23.12 20.93 1rpx s ALA 213 CO 0.23 0.45 1.80 -1.00 0.00 0.00 0.00 175.76 177.24 1rpx h PRO 214 N 2.33 0.56 -5.14 0.00 0.13 -1.91 -3.41 132.00 124.57 1rpx h PRO 214 Ca -0.47 -0.04 -0.66 0.00 -0.87 0.00 0.00 66.00 63.96 1rpx h PRO 214 Cb 1.17 -0.12 -0.34 0.00 0.13 0.00 0.00 31.00 31.84 1rpx h PRO 214 CO 0.69 0.40 -0.87 0.34 -0.23 0.00 0.00 178.00 178.33 1rpx s ASP 215 N -5.62 2.97 0.01 1.44 -1.08 -1.26 -5.04 116.67 108.09 1rpx s ASP 215 Ca -0.13 -0.56 -0.25 0.00 -0.52 0.00 0.00 52.55 51.09 1rpx s ASP 215 Cb 0.11 -1.36 -0.19 0.00 -1.46 0.00 0.00 42.92 40.02 1rpx s ASP 215 CO 0.73 0.09 1.39 1.88 0.52 0.00 0.00 175.17 179.77 1rpx h TYR 216 N 7.19 0.02 -0.53 -5.34 0.05 -1.83 -2.77 116.97 113.76 1rpx h TYR 216 Ca -0.29 -0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.55 1rpx h TYR 216 Cb 1.20 -0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.90 1rpx h TYR 216 CO 0.47 0.38 0.35 0.00 -1.05 0.00 0.00 178.16 178.31 1rpx h ALA 217 N 0.64 1.89 -0.10 3.88 0.00 -1.95 -0.82 119.26 122.79 1rpx h ALA 217 Ca 0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1rpx h ALA 217 Cb 0.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1rpx h ALA 217 CO 0.00 0.02 -0.38 0.93 0.00 0.00 0.00 179.25 179.82 1rpx h GLU 218 N 0.47 0.43 -0.44 0.00 5.08 -1.87 -1.44 114.58 116.82 1rpx h GLU 218 Ca 0.23 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1rpx h GLU 218 Cb 0.30 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1rpx h GLU 218 CO -0.06 0.96 0.25 0.00 -1.00 0.00 0.00 179.01 179.16 1rpx h ALA 219 N 0.47 0.56 -0.23 3.43 0.00 -1.13 0.75 119.26 123.11 1rpx h ALA 219 Ca -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1rpx h ALA 219 Cb 1.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1rpx h ALA 219 CO 0.08 0.07 0.10 0.82 0.00 0.00 0.00 179.25 180.32 1rpx h ILE 220 N 0.57 1.15 -0.66 0.00 2.04 -1.21 -1.47 117.51 117.94 1rpx h ILE 220 Ca 0.16 -0.44 -0.08 0.00 1.00 0.00 0.00 64.86 65.49 1rpx h ILE 220 Cb 0.02 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 1rpx h ILE 220 CO -0.03 0.15 0.08 0.50 0.00 0.00 0.00 178.15 178.85 1rpx h LYS 221 N 0.23 1.10 0.00 2.37 3.64 -1.06 -2.37 116.57 120.48 1rpx h LYS 221 Ca 0.08 -0.31 -0.01 0.00 -1.27 0.00 0.00 60.65 59.14 1rpx h LYS 221 Cb 0.14 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1rpx h LYS 221 CO -0.01 1.02 -0.05 0.78 -2.27 0.00 0.00 179.45 178.92 1rpx h GLY 222 N 1.04 0.00 0.18 5.01 0.00 0.78 -2.42 103.07 107.65 1rpx h GLY 222 Ca 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.46 1rpx h GLY 222 CO 0.02 0.00 -0.33 -2.22 0.00 0.00 0.00 176.54 174.01 1rpx h ILE 223 N 0.00 1.64 0.00 2.60 2.04 -0.78 -3.09 117.51 119.93 1rpx h ILE 223 Ca -0.00 -2.38 0.00 0.00 1.00 0.00 0.00 64.86 63.48 1rpx h ILE 223 Cb 0.41 3.24 0.00 0.00 -0.74 0.00 0.00 36.82 39.73 1rpx h ILE 223 CO 0.01 0.62 0.00 2.29 0.00 0.00 0.00 178.15 181.06 1rpx n LYS 224 N -4.46 0.11 -0.21 2.37 2.85 -0.97 -2.82 118.16 115.03 1rpx n LYS 224 Ca -0.13 0.23 0.06 0.00 -1.05 0.00 0.00 58.31 57.42 1rpx n LYS 224 Cb 0.59 -1.67 0.16 0.00 -0.65 0.00 0.00 35.03 33.45 1rpx n LYS 224 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1rpx n THR 225 N -1.87 1.59 -1.78 0.58 -2.24 -0.92 -4.91 114.28 104.73 1rpx n THR 225 Ca 0.04 -1.53 -0.42 0.00 -2.27 0.00 0.00 64.05 59.87 1rpx n THR 225 Cb 0.28 0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.60 1rpx n THR 225 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1rpx s SER 226 N -1.67 6.45 0.30 3.42 0.15 -1.13 -5.00 113.70 116.23 1rpx s SER 226 Ca 0.27 2.76 0.03 0.00 0.70 0.00 0.00 55.95 59.70 1rpx s SER 226 Cb 0.20 -2.59 -0.05 0.00 -1.71 0.00 0.00 66.02 61.87 1rpx s SER 226 CO 0.08 -0.95 0.08 -0.54 1.20 0.00 0.00 173.24 173.12 1rpx s LYS 227 N 1.74 1.55 -0.63 5.44 1.02 -1.26 -4.29 119.74 123.31 1rpx s LYS 227 Ca 0.76 -1.86 0.01 0.00 0.02 0.00 0.00 55.97 54.90 1rpx s LYS 227 Cb -0.47 -0.53 0.41 0.00 -0.52 0.00 0.00 37.83 36.71 1rpx s LYS 227 CO 0.33 -0.27 1.67 2.89 -0.92 0.00 0.00 175.35 179.06 1rpx n ARG 228 N -0.59 3.04 -1.67 1.68 -4.01 -1.26 -4.85 116.66 108.99 1rpx n ARG 228 Ca -0.01 -3.82 -0.48 0.00 -1.04 0.00 0.00 57.85 52.50 1rpx n ARG 228 Cb 0.66 -2.27 -0.05 0.00 -3.04 0.00 0.00 32.46 27.76 1rpx n ARG 228 CO 0.00 0.00 0.00 -2.30 -3.04 0.00 0.00 177.63 172.29 1rpx n PRO 229 N -0.63 2.05 0.00 2.89 -0.02 -1.26 -5.21 135.00 132.82 1rpx n PRO 229 Ca 0.51 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.73 1rpx n PRO 229 Cb 0.54 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1rpx n PRO 229 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57