#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 -2.50 114.38 111.54 1rpx h ARG 2 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1rpx h ARG 2 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1rpx h ARG 2 CO 0.00 0.00 -0.15 1.33 -1.07 0.00 0.00 179.97 180.08 1rpx n VAL 3 N -2.94 0.00 0.26 2.04 0.24 -1.26 -4.02 118.33 112.65 1rpx n VAL 3 Ca -0.02 -0.04 0.13 0.00 -2.04 0.00 0.00 64.34 62.37 1rpx n VAL 3 Cb 0.14 -0.11 0.71 0.00 -1.47 0.00 0.00 33.84 33.12 1rpx n VAL 3 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1rpx h ASP 4 N 0.41 0.00 -0.11 -1.34 3.32 -1.93 -2.34 116.42 114.42 1rpx h ASP 4 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1rpx h ASP 4 Cb 0.40 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1rpx h ASP 4 CO 0.00 0.12 0.00 2.29 -1.72 0.00 0.00 179.24 179.93 1rpx n LYS 5 N -3.56 1.29 -4.69 3.56 2.85 -1.26 -4.78 118.16 111.57 1rpx n LYS 5 Ca -0.01 -0.45 -0.33 0.00 -1.05 0.00 0.00 58.31 56.47 1rpx n LYS 5 Cb 0.26 -1.15 -0.14 0.00 -0.65 0.00 0.00 35.03 33.35 1rpx n LYS 5 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1rpx s PHE 6 N -1.85 2.86 0.00 5.58 0.08 -0.88 -5.11 117.98 118.66 1rpx s PHE 6 Ca 0.14 -0.55 -0.16 0.00 0.12 0.00 0.00 56.93 56.47 1rpx s PHE 6 Cb 0.07 -1.87 -0.06 0.00 -0.57 0.00 0.00 43.02 40.59 1rpx s PHE 6 CO 0.10 -0.16 0.45 0.45 -0.10 0.00 0.00 175.22 175.96 1rpx s SER 7 N 0.33 6.85 0.00 1.36 0.15 -1.26 -4.96 113.70 116.17 1rpx s SER 7 Ca -0.09 1.01 0.21 0.00 0.70 0.00 0.00 55.95 57.79 1rpx s SER 7 Cb -0.15 -2.28 1.17 0.00 -1.71 0.00 0.00 66.02 63.04 1rpx s SER 7 CO 0.05 0.27 1.67 0.29 1.20 0.00 0.00 173.24 176.72 1rpx n LYS 8 N 2.04 0.47 0.09 5.44 5.02 -1.26 -2.37 118.16 127.59 1rpx n LYS 8 Ca -0.12 0.05 0.12 0.00 -2.02 0.00 0.00 58.31 56.34 1rpx n LYS 8 Cb 0.52 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 34.21 1rpx n LYS 8 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1rpx h SER 9 N 0.00 0.00 -0.70 4.39 4.64 -1.97 -3.47 113.55 116.45 1rpx h SER 9 Ca 0.00 -0.13 -0.53 0.00 -0.47 0.00 0.00 61.79 60.66 1rpx h SER 9 Cb 0.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1rpx h SER 9 CO 0.00 0.07 -0.19 1.51 -0.87 0.00 0.00 176.83 177.35 1rpx s ASP 10 N -4.60 4.90 -0.39 4.97 1.47 -1.00 -5.09 116.67 116.94 1rpx s ASP 10 Ca 0.06 -1.02 -0.11 0.00 1.18 0.00 0.00 52.55 52.66 1rpx s ASP 10 Cb 0.12 0.34 0.04 0.00 -0.34 0.00 0.00 42.92 43.08 1rpx s ASP 10 CO 0.71 -1.23 0.22 -0.63 0.68 0.00 0.00 175.17 174.92 1rpx s ILE 11 N -2.71 4.50 0.08 2.11 1.01 -1.26 -4.84 121.20 120.09 1rpx s ILE 11 Ca 0.50 -1.00 -0.30 0.00 0.00 0.00 0.00 60.65 59.84 1rpx s ILE 11 Cb -0.04 -3.58 -0.05 0.00 0.01 0.00 0.00 42.46 38.80 1rpx s ILE 11 CO 0.31 -0.31 1.01 -0.63 0.00 0.00 0.00 174.94 175.31 1rpx s ILE 12 N 1.52 4.50 -0.21 2.92 1.09 0.72 -4.90 121.20 126.84 1rpx s ILE 12 Ca 0.02 1.95 -0.02 0.00 -1.10 0.00 0.00 60.65 61.50 1rpx s ILE 12 Cb -0.20 -4.25 0.00 0.00 -1.06 0.00 0.00 42.46 36.95 1rpx s ILE 12 CO 0.06 0.24 -0.08 -0.69 -0.10 0.00 0.00 174.94 174.37 1rpx s VAL 13 N 0.39 3.01 -0.64 2.92 1.01 -1.26 -0.31 120.40 125.52 1rpx s VAL 13 Ca 0.50 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.85 1rpx s VAL 13 Cb -0.24 -2.37 0.16 0.00 0.00 0.00 0.00 36.38 33.93 1rpx s VAL 13 CO 0.30 0.42 0.42 -0.55 0.00 0.00 0.00 175.10 175.69 1rpx s SER 14 N 1.42 4.80 0.36 3.32 0.15 0.48 -1.36 113.70 122.87 1rpx s SER 14 Ca 0.05 -3.35 -0.28 0.00 0.70 0.00 0.00 55.95 53.08 1rpx s SER 14 Cb -0.14 -1.70 -0.10 0.00 -1.71 0.00 0.00 66.02 62.37 1rpx s SER 14 CO -0.06 -0.20 1.33 -2.16 1.20 0.00 0.00 173.24 173.35 1rpx s PRO 15 N -0.76 4.19 -0.27 5.44 0.04 -1.22 -3.33 135.00 139.08 1rpx s PRO 15 Ca 0.21 2.24 -0.25 0.00 0.04 0.00 0.00 61.00 63.23 1rpx s PRO 15 Cb -0.16 -2.94 0.00 0.00 0.04 0.00 0.00 34.50 31.44 1rpx s PRO 15 CO -0.07 -0.34 0.87 0.45 0.04 0.00 0.00 177.00 177.95 1rpx s SER 16 N -0.54 6.81 0.06 6.66 0.15 0.33 -0.93 113.70 126.24 1rpx s SER 16 Ca 0.52 0.94 0.14 0.00 0.70 0.00 0.00 55.95 58.26 1rpx s SER 16 Cb -0.40 -2.45 0.62 0.00 -1.71 0.00 0.00 66.02 62.08 1rpx s SER 16 CO 0.53 -0.62 1.45 2.30 1.20 0.00 0.00 173.24 178.10 1rpx n ILE 17 N 5.45 1.11 0.24 6.45 -5.35 -0.86 -2.91 119.36 123.50 1rpx n ILE 17 Ca 0.06 0.30 0.15 0.00 -0.27 0.00 0.00 62.75 63.00 1rpx n ILE 17 Cb 0.47 -1.13 0.84 0.00 -1.74 0.00 0.00 39.64 38.08 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 -0.48 7.28 3.38 -1.93 0.67 115.31 124.23 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 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1rpx h LEU 18 CO 0.00 0.00 -0.16 -1.20 0.09 0.00 0.00 178.44 177.17 1rpx n SER 19 N -3.93 0.91 -4.84 -0.43 7.64 -1.15 -4.92 113.62 106.91 1rpx n SER 19 Ca -0.01 -0.90 -0.29 0.00 1.01 0.00 0.00 58.87 58.69 1rpx n SER 19 Cb 0.21 0.05 0.10 0.00 -1.01 0.00 0.00 64.21 63.55 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 -2.40 2.62 -0.48 -0.43 0.00 0.23 -4.84 121.76 116.46 1rpx s ALA 20 Ca 0.28 -0.70 -0.21 0.00 0.00 0.00 0.00 51.96 51.34 1rpx s ALA 20 Cb 0.20 -2.94 0.04 0.00 0.00 0.00 0.00 23.12 20.41 1rpx s ALA 20 CO 0.47 -1.74 0.70 1.21 0.00 0.00 0.00 175.76 176.41 1rpx s ASN 21 N -4.60 6.30 0.00 0.00 3.84 -1.26 -4.95 114.94 114.27 1rpx s ASN 21 Ca 0.63 -0.50 0.08 0.00 0.21 0.00 0.00 52.86 53.28 1rpx s ASN 21 Cb -0.10 -2.34 0.34 0.00 -0.55 0.00 0.00 41.25 38.60 1rpx s ASN 21 CO 0.49 -0.90 1.25 0.49 -2.79 0.00 0.00 177.10 175.64 1rpx n PHE 22 N 6.48 0.00 0.18 0.43 3.01 -1.26 -2.06 117.46 124.25 1rpx n PHE 22 Ca -0.02 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.53 1rpx n PHE 22 Cb 0.47 -0.50 0.11 0.00 -0.01 0.00 0.00 39.48 39.56 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 -1.82 4.37 4.64 -2.04 -3.36 113.55 115.35 1rpx h SER 23 Ca 0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 1rpx h SER 23 Cb 0.13 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 61.82 1rpx h SER 23 CO 0.00 0.12 -1.13 2.29 -0.87 0.00 0.00 176.83 177.24 1rpx n LYS 24 N -3.07 1.28 -0.26 4.77 2.85 -0.87 -4.96 118.16 117.90 1rpx n LYS 24 Ca 0.03 -3.52 -0.06 0.00 -1.05 0.00 0.00 58.31 53.70 1rpx n LYS 24 Cb 0.58 -1.68 0.05 0.00 -0.65 0.00 0.00 35.03 33.33 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 2.99 0.97 -0.08 -5.58 5.85 -1.69 -1.52 115.31 116.24 1rpx h LEU 25 Ca 0.07 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 1rpx h LEU 25 Cb 0.97 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.74 1rpx h LEU 25 CO 0.54 0.86 0.04 1.23 -0.34 0.00 0.00 178.44 180.77 1rpx h GLY 26 N 1.02 0.13 0.94 3.75 0.00 -1.92 -0.72 103.07 106.26 1rpx h GLY 26 Ca 0.24 -0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.52 1rpx h GLY 26 CO -0.02 0.06 0.40 -2.09 0.00 0.00 0.00 176.54 174.89 1rpx h GLU 27 N 0.00 0.79 -0.94 4.80 4.81 -1.96 -0.85 114.58 121.23 1rpx h GLU 27 Ca 0.03 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1rpx h GLU 27 Cb 0.13 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.29 1rpx h GLU 27 CO -0.00 0.52 0.62 0.37 -0.73 0.00 0.00 179.01 179.78 1rpx h GLN 28 N 0.81 1.24 -0.17 1.92 5.75 -1.05 -1.01 115.11 122.59 1rpx h GLN 28 Ca 0.24 -0.08 -0.10 0.00 -0.15 0.00 0.00 58.65 58.56 1rpx h GLN 28 Cb -0.04 -0.28 -0.00 0.00 1.07 0.00 0.00 27.48 28.24 1rpx h GLN 28 CO -0.08 0.83 -0.29 0.28 -2.65 0.00 0.00 178.83 176.91 1rpx h VAL 29 N 1.27 1.35 -0.37 2.39 2.07 -0.57 -2.81 116.25 119.58 1rpx h VAL 29 Ca 0.34 -1.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.33 1rpx h VAL 29 Cb -0.14 1.91 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1rpx h VAL 29 CO -0.07 0.46 0.22 0.11 0.02 0.00 0.00 177.57 178.31 1rpx h LYS 30 N 0.14 0.50 0.25 1.57 1.57 -0.96 -1.69 116.57 117.95 1rpx h LYS 30 Ca 0.01 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1rpx h LYS 30 Cb 0.88 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1rpx h LYS 30 CO 0.07 0.35 -0.12 0.00 -0.57 0.00 0.00 179.45 179.17 1rpx h ALA 31 N 1.74 -0.34 0.00 3.86 0.00 -1.06 -1.49 119.26 121.97 1rpx h ALA 31 Ca 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rpx h ALA 31 Cb -0.02 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1rpx h ALA 31 CO -0.03 -0.61 0.00 -0.84 0.00 0.00 0.00 179.25 177.78 1rpx h ILE 32 N -0.50 0.00 0.01 0.00 3.07 -1.24 -2.25 117.51 116.59 1rpx h ILE 32 Ca -0.03 -0.40 -0.00 0.00 1.55 0.00 0.00 64.86 65.97 1rpx h ILE 32 Cb 0.37 1.31 0.00 0.00 -0.27 0.00 0.00 36.82 38.23 1rpx h ILE 32 CO 0.06 0.00 -0.00 -0.08 -1.05 0.00 0.00 178.15 177.07 1rpx h GLU 33 N 0.00 -0.01 0.00 0.16 4.81 -1.00 -2.37 114.58 116.17 1rpx h GLU 33 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1rpx h GLU 33 Cb 0.45 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1rpx h GLU 33 CO 0.00 0.69 0.00 1.04 -0.73 0.00 0.00 179.01 180.01 1rpx n GLN 34 N -4.75 0.12 0.00 1.92 6.02 -0.59 -0.51 117.38 119.59 1rpx n GLN 34 Ca -0.09 0.43 0.14 0.00 -0.01 0.00 0.00 57.00 57.47 1rpx n GLN 34 Cb 0.35 -1.77 0.53 0.00 1.02 0.00 0.00 30.24 30.38 1rpx n GLN 34 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1rpx n ALA 35 N -1.68 2.83 -0.34 -1.58 0.00 -0.86 -4.95 120.51 113.93 1rpx n ALA 35 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1rpx n ALA 35 Cb 0.16 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.29 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 1.38 0.79 3.74 0.00 0.00 0.33 -4.46 105.19 106.96 1rpx n GLY 36 Ca 0.11 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.46 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 -3.72 1.92 -4.48 0.00 8.00 -0.46 -4.89 116.55 112.93 1rpx n ASP 38 Ca 0.08 0.38 -0.23 0.00 0.71 0.00 0.00 54.79 55.73 1rpx n ASP 38 Cb 0.54 -0.86 -0.11 0.00 -0.02 0.00 0.00 41.12 40.68 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 -2.49 2.07 -0.19 1.24 0.51 -1.07 -4.20 118.94 114.81 1rpx s TRP 39 Ca -0.34 -0.80 -0.00 0.00 -2.12 0.00 0.00 56.10 52.84 1rpx s TRP 39 Cb 0.11 -1.32 0.01 0.00 -0.81 0.00 0.00 33.47 31.46 1rpx s TRP 39 CO 0.50 0.20 -0.16 0.42 -0.51 0.00 0.00 176.95 177.40 1rpx s ILE 40 N -3.07 2.42 -0.19 2.03 1.01 -0.31 -3.44 121.20 119.66 1rpx s ILE 40 Ca 0.34 -0.82 -0.16 0.00 0.00 0.00 0.00 60.65 60.01 1rpx s ILE 40 Cb 0.07 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 1rpx s ILE 40 CO 0.15 0.51 0.41 -2.28 0.00 0.00 0.00 174.94 173.73 1rpx s HIS 41 N 1.31 3.40 -0.29 3.97 2.46 -0.10 0.61 115.29 126.64 1rpx s HIS 41 Ca 0.05 0.67 -0.01 0.00 0.47 0.00 0.00 55.06 56.24 1rpx s HIS 41 Cb -0.13 -2.53 0.05 0.00 -0.13 0.00 0.00 32.58 29.84 1rpx s HIS 41 CO -0.10 0.03 -0.02 0.08 -2.47 0.00 0.00 174.74 172.26 1rpx s VAL 42 N 1.18 2.82 -0.45 0.89 1.01 0.13 -2.02 120.40 123.96 1rpx s VAL 42 Ca 0.20 -1.43 -0.23 0.00 0.00 0.00 0.00 61.98 60.52 1rpx s VAL 42 Cb -0.15 -2.63 0.03 0.00 0.00 0.00 0.00 36.38 33.63 1rpx s VAL 42 CO 0.08 -0.09 0.78 -1.81 0.00 0.00 0.00 175.10 174.06 1rpx s ASP 43 N 1.22 6.40 -0.35 3.32 1.01 -1.26 -1.09 116.67 125.92 1rpx s ASP 43 Ca -0.06 -0.13 -0.13 0.00 0.71 0.00 0.00 52.55 52.94 1rpx s ASP 43 Cb -0.20 -2.38 -0.01 0.00 1.01 0.00 0.00 42.92 41.34 1rpx s ASP 43 CO -0.02 -0.92 0.26 -0.69 0.21 0.00 0.00 175.17 174.01 1rpx s VAL 44 N 3.28 5.28 -0.03 -1.27 1.01 -0.49 -4.33 120.40 123.84 1rpx s VAL 44 Ca 0.29 -0.28 0.07 0.00 0.00 0.00 0.00 61.98 62.06 1rpx s VAL 44 Cb -0.12 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 1rpx s VAL 44 CO 0.22 -0.07 -0.24 -0.04 0.00 0.00 0.00 175.10 174.97 1rpx s MET 45 N 1.73 2.11 0.00 2.72 -1.94 -1.26 -0.26 119.30 122.41 1rpx s MET 45 Ca 0.06 -0.87 0.14 0.00 -1.71 0.00 0.00 55.69 53.32 1rpx s MET 45 Cb -0.18 -1.96 0.22 0.00 2.01 0.00 0.00 34.83 34.93 1rpx s MET 45 CO 0.11 0.48 1.10 -0.40 -0.01 0.00 0.00 175.02 176.30 1rpx n ASP 46 N 2.62 2.59 0.00 3.03 5.75 -1.18 -1.93 116.55 127.44 1rpx n ASP 46 Ca -0.16 -1.76 0.00 0.00 -0.01 0.00 0.00 54.79 52.86 1rpx n ASP 46 Cb 0.52 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.49 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 0.82 2.28 0.27 6.12 0.00 0.76 -4.82 105.19 110.63 1rpx n GLY 47 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 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 0.45 0.03 1.61 5.12 -1.26 -4.55 116.66 116.05 1rpx n ARG 48 Ca 0.00 0.18 -0.05 0.00 -1.93 0.00 0.00 57.85 56.05 1rpx n ARG 48 Cb 0.00 -1.28 0.15 0.00 -1.16 0.00 0.00 32.46 30.17 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 -0.82 0.54 -3.85 -1.55 3.57 -1.88 -3.44 116.94 109.51 1rpx h PHE 49 Ca -0.16 -0.15 -0.34 0.00 3.53 0.00 0.00 57.97 60.86 1rpx h PHE 49 Cb 1.01 -0.12 -0.20 0.00 2.79 0.00 0.00 35.95 39.43 1rpx h PHE 49 CO -0.28 0.78 -0.75 0.14 -2.23 0.00 0.00 178.31 175.98 1rpx s VAL 50 N -4.23 0.90 -0.18 1.41 -7.23 -1.26 -5.02 120.40 104.79 1rpx s VAL 50 Ca -0.06 -1.41 -0.05 0.00 -1.81 0.00 0.00 61.98 58.64 1rpx s VAL 50 Cb 0.13 -1.10 -0.20 0.00 0.56 0.00 0.00 36.38 35.77 1rpx s VAL 50 CO 0.80 -0.42 3.01 -0.81 -0.31 0.00 0.00 175.10 177.38 1rpx n PRO 51 N 0.98 1.83 -3.55 4.82 -0.04 -1.26 -2.89 135.00 134.88 1rpx n PRO 51 Ca -0.19 -0.96 -0.15 0.00 -0.04 0.00 0.00 63.50 62.16 1rpx n PRO 51 Cb 0.56 -2.01 -0.06 0.00 -0.04 0.00 0.00 33.50 31.95 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 2.24 -0.55 -0.10 3.54 2.47 -1.26 -4.95 114.94 116.34 1rpx s ASN 52 Ca 0.55 0.66 0.03 0.00 0.42 0.00 0.00 52.86 54.52 1rpx s ASN 52 Cb 0.25 0.53 -0.01 0.00 -1.45 0.00 0.00 41.25 40.57 1rpx s ASN 52 CO -0.01 -0.46 -0.20 -0.63 -3.72 0.00 0.00 177.10 172.08 1rpx s ILE 53 N -0.98 2.41 0.00 -5.21 1.01 -1.26 -0.17 121.20 116.99 1rpx s ILE 53 Ca -0.06 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 59.68 1rpx s ILE 53 Cb -0.01 -1.95 0.00 0.00 0.01 0.00 0.00 42.46 40.52 1rpx s ILE 53 CO 0.05 0.55 0.00 0.35 0.00 0.00 0.00 174.94 175.90 1rpx n THR 54 N 3.38 0.00 -3.84 2.92 -2.24 -0.81 -4.94 114.28 108.75 1rpx n THR 54 Ca -0.18 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.48 1rpx n THR 54 Cb 0.53 -0.19 -0.09 0.00 -2.10 0.00 0.00 70.33 68.47 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 0.00 0.08 0.00 2.28 -4.36 -1.26 -4.97 121.20 112.98 1rpx s ILE 55 Ca 0.00 -0.69 0.00 0.00 -0.26 0.00 0.00 60.65 59.70 1rpx s ILE 55 Cb 0.00 -0.61 0.00 0.00 1.25 0.00 0.00 42.46 43.10 1rpx s ILE 55 CO 0.00 -0.38 0.00 0.61 0.24 0.00 0.00 174.94 175.41 1rpx n GLY 56 N 1.20 4.94 0.38 6.27 0.00 -1.26 -4.46 105.19 112.25 1rpx n GLY 56 Ca -0.21 -2.12 0.21 0.00 0.00 0.00 0.00 46.02 43.90 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 0.47 -0.25 1.61 0.11 -1.97 -2.19 132.00 129.78 1rpx h PRO 57 Ca 0.00 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.10 1rpx h PRO 57 Cb 0.00 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 1rpx h PRO 57 CO 0.00 0.31 0.16 1.37 -0.21 0.00 0.00 178.00 179.63 1rpx h LEU 58 N 0.48 0.23 -0.15 2.35 -0.00 -1.95 0.12 115.31 116.39 1rpx h LEU 58 Ca 0.63 -0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 58.27 1rpx h LEU 58 Cb 1.40 -0.06 0.01 0.00 -0.00 0.00 0.00 40.66 42.01 1rpx h LEU 58 CO -0.40 0.16 -0.91 0.58 -0.00 0.00 0.00 178.44 177.87 1rpx h VAL 59 N 0.27 1.33 -0.40 0.15 2.07 -1.79 -2.82 116.25 115.07 1rpx h VAL 59 Ca 0.10 -2.23 -0.04 0.00 0.82 0.00 0.00 66.70 65.34 1rpx h VAL 59 Cb 0.05 2.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 1rpx h VAL 59 CO -0.02 0.68 0.08 0.58 0.02 0.00 0.00 177.57 178.91 1rpx h VAL 60 N 0.36 1.24 -0.33 2.57 2.07 -1.40 -2.65 116.25 118.11 1rpx h VAL 60 Ca -0.08 -0.83 0.06 0.00 0.82 0.00 0.00 66.70 66.66 1rpx h VAL 60 Cb 1.54 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 1rpx h VAL 60 CO 0.17 0.29 0.23 -0.78 0.02 0.00 0.00 177.57 177.49 1rpx h ASP 61 N 0.51 0.18 0.84 0.57 1.82 -0.80 -1.11 116.42 118.43 1rpx h ASP 61 Ca 0.12 -0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.76 1rpx h ASP 61 Cb 0.34 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.31 1rpx h ASP 61 CO 0.00 0.12 -0.51 -1.54 -1.61 0.00 0.00 179.24 175.70 1rpx n SER 62 N -4.48 0.62 -0.02 2.28 3.41 -1.06 -3.80 113.62 110.57 1rpx n SER 62 Ca 0.04 0.10 -0.12 0.00 -0.26 0.00 0.00 58.87 58.63 1rpx n SER 62 Cb 0.26 0.07 -0.14 0.00 -0.26 0.00 0.00 64.21 64.13 1rpx n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1rpx n LEU 63 N -1.95 1.37 -0.27 1.04 4.77 -0.52 -4.42 117.00 117.01 1rpx n LEU 63 Ca 0.04 0.35 0.06 0.00 -0.03 0.00 0.00 56.01 56.42 1rpx n LEU 63 Cb 0.41 -0.19 0.16 0.00 -2.33 0.00 0.00 43.42 41.47 1rpx n LEU 63 CO 0.35 0.53 0.81 -0.09 -1.33 0.00 0.00 177.39 177.65 1rpx h ARG 64 N 0.02 0.08 0.00 3.23 9.65 -1.38 -0.45 114.38 125.53 1rpx h ARG 64 Ca -0.33 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.54 1rpx h ARG 64 Cb 2.02 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 30.59 1rpx h ARG 64 CO 0.08 0.05 0.00 -1.00 2.80 0.00 0.00 179.97 181.90 1rpx h PRO 65 N 0.08 0.00 -0.02 0.20 0.13 -1.77 -3.24 132.00 127.38 1rpx h PRO 65 Ca 0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.56 1rpx h PRO 65 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1rpx h PRO 65 CO -0.70 0.00 -0.06 0.44 -0.23 0.00 0.00 178.00 177.44 1rpx n ILE 66 N -2.43 0.00 -3.73 -3.56 -5.35 -0.19 -4.94 119.36 99.16 1rpx n ILE 66 Ca 0.04 -0.32 -0.13 0.00 -0.27 0.00 0.00 62.75 62.07 1rpx n ILE 66 Cb 0.36 0.86 -0.08 0.00 -1.74 0.00 0.00 39.64 39.04 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 -2.09 0.06 -1.02 7.28 -1.32 -1.17 -4.89 115.64 112.50 1rpx s THR 67 Ca 0.32 -0.53 0.17 0.00 -1.21 0.00 0.00 61.69 60.44 1rpx s THR 67 Cb 0.20 -0.80 -0.13 0.00 -1.51 0.00 0.00 72.50 70.25 1rpx s THR 67 CO 0.36 -0.29 0.77 0.47 -2.21 0.00 0.00 174.62 173.72 1rpx n ASP 68 N 0.88 1.05 -4.76 8.08 8.00 -1.26 -4.82 116.55 123.72 1rpx n ASP 68 Ca -0.20 -1.02 -0.37 0.00 0.71 0.00 0.00 54.79 53.90 1rpx n ASP 68 Cb 0.58 0.86 0.02 0.00 -0.02 0.00 0.00 41.12 42.56 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 -2.62 3.86 0.44 0.64 1.43 -1.26 -4.95 118.68 116.22 1rpx s LEU 69 Ca 0.09 2.53 -0.24 0.00 -1.03 0.00 0.00 54.13 55.48 1rpx s LEU 69 Cb 0.13 -4.34 -0.08 0.00 0.03 0.00 0.00 46.19 41.94 1rpx s LEU 69 CO 0.62 -1.37 1.25 -2.16 0.23 0.00 0.00 176.35 174.92 1rpx s PRO 70 N -2.93 3.80 -0.44 1.29 0.04 -1.26 -4.82 135.00 130.68 1rpx s PRO 70 Ca 0.70 2.00 -0.18 0.00 0.04 0.00 0.00 61.00 63.56 1rpx s PRO 70 Cb -0.34 -2.57 0.03 0.00 0.04 0.00 0.00 34.50 31.66 1rpx s PRO 70 CO 0.40 -0.58 0.49 -0.51 0.04 0.00 0.00 177.00 176.84 1rpx s LEU 71 N -2.77 4.86 -0.61 -3.56 1.43 -1.26 -1.16 118.68 115.61 1rpx s LEU 71 Ca 0.61 -0.69 -0.19 0.00 -1.03 0.00 0.00 54.13 52.83 1rpx s LEU 71 Cb -0.34 -2.43 0.10 0.00 0.03 0.00 0.00 46.19 43.55 1rpx s LEU 71 CO 0.43 -0.65 0.74 -0.62 0.23 0.00 0.00 176.35 176.48 1rpx s ASP 72 N 1.97 6.20 -0.29 2.29 2.15 0.20 -1.31 116.67 127.88 1rpx s ASP 72 Ca 0.13 -1.44 -0.11 0.00 0.43 0.00 0.00 52.55 51.56 1rpx s ASP 72 Cb -0.17 -2.31 -0.04 0.00 -0.30 0.00 0.00 42.92 40.10 1rpx s ASP 72 CO 0.14 -1.13 0.18 -0.69 -0.17 0.00 0.00 175.17 173.50 1rpx s VAL 73 N 2.75 5.12 -0.29 1.11 1.01 0.86 0.17 120.40 131.13 1rpx s VAL 73 Ca 0.13 -0.02 -0.09 0.00 0.00 0.00 0.00 61.98 62.00 1rpx s VAL 73 Cb -0.23 -3.50 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1rpx s VAL 73 CO 0.06 0.18 0.14 -2.28 0.00 0.00 0.00 175.10 173.20 1rpx s HIS 74 N 1.72 3.16 -0.82 5.22 2.46 -0.25 0.13 115.29 126.91 1rpx s HIS 74 Ca 0.06 -0.41 -0.18 0.00 0.47 0.00 0.00 55.06 55.00 1rpx s HIS 74 Cb -0.16 -2.33 0.13 0.00 -0.13 0.00 0.00 32.58 30.09 1rpx s HIS 74 CO 0.10 -0.38 0.97 -0.51 -2.47 0.00 0.00 174.74 172.44 1rpx s LEU 75 N 1.64 5.33 -1.15 8.88 1.02 0.26 -1.40 118.68 133.27 1rpx s LEU 75 Ca 0.05 -1.91 -0.05 0.00 0.02 0.00 0.00 54.13 52.24 1rpx s LEU 75 Cb -0.16 -2.35 0.26 0.00 0.02 0.00 0.00 46.19 43.96 1rpx s LEU 75 CO 0.06 -1.04 1.67 0.23 0.02 0.00 0.00 176.35 177.30 1rpx n MET 76 N 6.21 4.31 -4.05 1.70 2.81 0.65 -4.24 117.12 124.51 1rpx n MET 76 Ca 0.13 -4.21 -0.08 0.00 -1.81 0.00 0.00 57.70 51.73 1rpx n MET 76 Cb 0.47 -2.64 -0.09 0.00 -0.71 0.00 0.00 33.22 30.25 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 -1.90 0.19 0.45 2.02 -4.36 -1.26 -3.07 121.20 113.27 1rpx s ILE 77 Ca 0.35 -1.69 -0.08 0.00 -0.26 0.00 0.00 60.65 58.98 1rpx s ILE 77 Cb 0.08 -1.54 -0.05 0.00 1.25 0.00 0.00 42.46 42.21 1rpx s ILE 77 CO 0.05 -0.87 0.78 0.68 0.24 0.00 0.00 174.94 175.82 1rpx s VAL 78 N -3.92 4.85 -1.30 8.37 -7.23 -1.26 -4.21 120.40 115.70 1rpx s VAL 78 Ca 0.08 0.41 -0.15 0.00 -1.81 0.00 0.00 61.98 60.50 1rpx s VAL 78 Cb 0.07 -3.80 0.01 0.00 0.56 0.00 0.00 36.38 33.22 1rpx s VAL 78 CO -0.09 -0.70 0.53 -0.62 -0.31 0.00 0.00 175.10 173.91 1rpx n GLU 79 N -1.82 -1.50 0.22 4.82 1.02 -0.12 -4.84 120.64 118.42 1rpx n GLU 79 Ca 0.01 0.28 0.15 0.00 -0.02 0.00 0.00 57.16 57.58 1rpx n GLU 79 Cb 0.55 -3.72 0.79 0.00 -0.02 0.00 0.00 31.44 29.04 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 -2.07 0.00 0.00 3.49 0.13 -1.73 -2.71 132.00 129.11 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 1.38 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.51 1rpx h PRO 80 CO 0.57 0.00 -0.06 0.38 -0.23 0.00 0.00 178.00 178.66 1rpx h ASP 81 N 0.00 0.00 -0.08 1.44 2.03 -1.93 -0.86 116.42 117.02 1rpx h ASP 81 Ca 0.06 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.24 1rpx h ASP 81 Cb 0.29 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.78 1rpx h ASP 81 CO -0.00 0.06 -0.33 1.56 -1.03 0.00 0.00 179.24 179.50 1rpx h GLN 82 N 0.00 0.56 0.00 4.15 1.08 -1.85 -3.25 115.11 115.81 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 0.34 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1rpx h GLN 82 CO 0.01 0.82 -1.18 0.54 -0.95 0.00 0.00 178.83 178.07 1rpx n ARG 83 N -4.07 0.43 -0.07 1.46 3.00 -0.77 -4.61 116.66 112.04 1rpx n ARG 83 Ca -0.01 -0.00 -0.09 0.00 -0.01 0.00 0.00 57.85 57.73 1rpx n ARG 83 Cb 0.47 -1.64 -0.03 0.00 0.00 0.00 0.00 32.46 31.26 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 0.22 -0.17 1.55 2.07 -1.22 -1.89 116.25 116.81 1rpx h VAL 84 Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1rpx h VAL 84 Cb 0.84 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 1rpx h VAL 84 CO 0.00 0.00 0.13 1.55 0.02 0.00 0.00 177.57 179.27 1rpx h PRO 85 N -0.33 0.00 -0.58 1.57 0.13 -1.81 -1.51 132.00 129.46 1rpx h PRO 85 Ca 0.13 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.17 1rpx h PRO 85 Cb 0.56 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.67 1rpx h PRO 85 CO -0.47 0.00 -0.01 -0.44 -0.23 0.00 0.00 178.00 176.85 1rpx h ASP 86 N 0.00 1.00 -0.17 1.44 3.32 -1.64 0.62 116.42 120.99 1rpx h ASP 86 Ca 0.08 -0.29 -0.14 0.00 0.02 0.00 0.00 57.03 56.71 1rpx h ASP 86 Cb 0.34 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1rpx h ASP 86 CO -0.00 1.06 -0.37 -0.26 -1.72 0.00 0.00 179.24 177.95 1rpx h PHE 87 N 0.94 0.82 -0.08 4.55 0.04 -1.06 -1.45 116.94 120.69 1rpx h PHE 87 Ca 0.17 -0.23 -0.05 0.00 2.80 0.00 0.00 57.97 60.65 1rpx h PHE 87 Cb 0.56 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.53 1rpx h PHE 87 CO 0.04 0.96 -0.16 0.82 -0.60 0.00 0.00 178.31 179.37 1rpx h ILE 88 N 0.57 1.41 -0.44 -0.55 2.04 -1.25 -2.05 117.51 117.24 1rpx h ILE 88 Ca 0.05 -1.46 0.10 0.00 1.00 0.00 0.00 64.86 64.55 1rpx h ILE 88 Cb 0.90 2.17 -0.02 0.00 -0.74 0.00 0.00 36.82 39.13 1rpx h ILE 88 CO 0.08 0.41 0.31 0.11 0.00 0.00 0.00 178.15 179.06 1rpx h LYS 89 N -0.22 0.14 0.00 2.37 1.57 -0.83 0.37 116.57 119.96 1rpx h LYS 89 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1rpx h LYS 89 Cb 0.75 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1rpx h LYS 89 CO 0.04 0.09 0.00 0.00 -0.57 0.00 0.00 179.45 179.01 1rpx n ALA 90 N -2.58 2.19 0.00 3.86 0.00 -0.55 -4.90 120.51 118.53 1rpx n ALA 90 Ca 0.07 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1rpx n ALA 90 Cb 0.41 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 1.02 1.52 3.74 0.00 0.00 0.13 -3.67 105.19 107.94 1rpx n GLY 91 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 3.37 -0.14 4.61 0.00 -0.79 -4.68 121.76 122.12 1rpx s ALA 92 Ca 0.00 0.79 0.05 0.00 0.00 0.00 0.00 51.96 52.80 1rpx s ALA 92 Cb 0.00 -3.33 -0.23 0.00 0.00 0.00 0.00 23.12 19.56 1rpx s ALA 92 CO 0.00 -0.14 0.27 -0.25 0.00 0.00 0.00 175.76 175.64 1rpx n ASP 93 N 2.07 1.39 -4.07 0.00 8.00 -0.43 -4.74 116.55 118.78 1rpx n ASP 93 Ca 0.01 0.16 -0.27 0.00 0.71 0.00 0.00 54.79 55.40 1rpx n ASP 93 Cb 0.46 -0.23 -0.17 0.00 -0.02 0.00 0.00 41.12 41.16 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 -2.55 1.43 -0.24 0.53 1.01 -0.76 -0.82 121.20 119.80 1rpx s ILE 94 Ca -0.18 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 59.86 1rpx s ILE 94 Cb 0.07 -1.29 0.05 0.00 0.01 0.00 0.00 42.46 41.30 1rpx s ILE 94 CO 0.76 0.42 -0.11 -0.69 0.00 0.00 0.00 174.94 175.32 1rpx s VAL 95 N 0.75 2.00 -0.18 2.92 1.01 -0.36 -0.10 120.40 126.44 1rpx s VAL 95 Ca -0.12 -1.41 -0.12 0.00 0.00 0.00 0.00 61.98 60.33 1rpx s VAL 95 Cb -0.16 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.09 1rpx s VAL 95 CO 0.02 0.06 0.21 -0.44 0.00 0.00 0.00 175.10 174.95 1rpx s SER 96 N 1.20 6.32 0.11 3.32 0.01 0.12 -1.80 113.70 122.99 1rpx s SER 96 Ca -0.06 0.37 0.11 0.00 1.31 0.00 0.00 55.95 57.68 1rpx s SER 96 Cb -0.18 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.88 1rpx s SER 96 CO -0.07 0.15 -0.27 0.68 0.41 0.00 0.00 173.24 174.15 1rpx s VAL 97 N 0.34 2.21 0.34 3.43 -7.23 -0.06 -0.57 120.40 118.86 1rpx s VAL 97 Ca 0.12 -1.68 -0.26 0.00 -1.81 0.00 0.00 61.98 58.35 1rpx s VAL 97 Cb -0.12 -1.95 -0.09 0.00 0.56 0.00 0.00 36.38 34.78 1rpx s VAL 97 CO 0.01 0.14 1.03 -1.00 -0.31 0.00 0.00 175.10 174.97 1rpx s HIS 98 N -1.02 3.48 -0.45 2.82 3.76 -1.26 -0.43 115.29 122.20 1rpx s HIS 98 Ca 0.13 1.71 0.23 0.00 -0.15 0.00 0.00 55.06 56.98 1rpx s HIS 98 Cb -0.10 -3.12 0.30 0.00 1.11 0.00 0.00 32.58 30.77 1rpx s HIS 98 CO 0.05 -0.37 1.41 0.00 -0.85 0.00 0.00 174.74 174.98 1rpx n GLU 100 N -2.70 2.26 0.30 0.00 4.71 -1.26 -4.79 120.64 119.17 1rpx n GLU 100 Ca 0.03 0.80 0.20 0.00 -0.01 0.00 0.00 57.16 58.18 1rpx n GLU 100 Cb 0.51 -2.50 1.05 0.00 -1.01 0.00 0.00 31.44 29.49 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 4.31 0.00 -0.02 3.49 5.75 -1.91 0.05 115.11 126.78 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 1.26 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.81 1rpx h GLN 101 CO 0.76 0.00 0.00 -1.13 -2.65 0.00 0.00 178.83 175.81 1rpx n SER 102 N -2.89 0.65 0.01 -0.69 3.41 -1.26 -4.12 113.62 108.73 1rpx n SER 102 Ca -0.03 -1.27 -0.03 0.00 -0.26 0.00 0.00 58.87 57.29 1rpx n SER 102 Cb 0.11 -0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.04 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 -0.47 1.00 -4.21 4.04 2.88 -0.03 -4.77 113.62 112.07 1rpx n SER 103 Ca 0.21 0.14 -0.28 0.00 -1.33 0.00 0.00 58.87 57.61 1rpx n SER 103 Cb 0.21 -0.34 -0.16 0.00 -0.75 0.00 0.00 64.21 63.17 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 -2.14 1.70 -0.18 2.46 2.01 -0.99 -0.95 115.64 117.55 1rpx s THR 104 Ca -0.06 -0.89 -0.22 0.00 0.31 0.00 0.00 61.69 60.83 1rpx s THR 104 Cb 0.01 -1.44 -0.20 0.00 0.01 0.00 0.00 72.50 70.89 1rpx s THR 104 CO 0.08 0.48 0.34 0.40 -0.69 0.00 0.00 174.62 175.24 1rpx h ILE 105 N 5.00 1.09 -3.12 1.82 2.04 -1.87 -3.38 117.51 119.09 1rpx h ILE 105 Ca -0.34 -2.13 -0.77 0.00 1.00 0.00 0.00 64.86 62.62 1rpx h ILE 105 Cb 1.16 2.37 -0.31 0.00 -0.74 0.00 0.00 36.82 39.31 1rpx h ILE 105 CO 0.48 0.37 0.38 1.41 0.00 0.00 0.00 178.15 180.78 1rpx n HIS 106 N -4.50 3.72 -0.15 1.37 8.25 -1.26 -4.88 115.22 117.77 1rpx n HIS 106 Ca -0.24 -3.45 -0.03 0.00 -0.26 0.00 0.00 57.72 53.74 1rpx n HIS 106 Cb 0.58 -1.31 0.04 0.00 1.12 0.00 0.00 29.99 30.43 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 5.79 -0.32 -0.22 2.41 6.46 -1.94 -1.33 115.31 126.17 1rpx h LEU 107 Ca 0.19 0.13 0.03 0.00 -0.12 0.00 0.00 57.88 58.11 1rpx h LEU 107 Cb 0.74 0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 40.88 1rpx h LEU 107 CO 1.10 -0.11 0.02 -0.74 -0.62 0.00 0.00 178.44 178.08 1rpx h HIS 108 N 0.06 0.03 -0.75 1.25 2.76 -1.94 -1.41 115.15 115.14 1rpx h HIS 108 Ca 0.23 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.38 1rpx h HIS 108 Cb 0.36 0.02 -0.03 0.00 1.55 0.00 0.00 27.41 29.30 1rpx h HIS 108 CO -0.35 -0.01 0.30 -0.09 -1.30 0.00 0.00 177.93 176.48 1rpx h ARG 109 N 0.10 1.12 -0.62 5.26 1.12 -1.87 -2.41 114.38 117.07 1rpx h ARG 109 Ca 0.10 -0.20 -0.04 0.00 -1.11 0.00 0.00 59.98 58.74 1rpx h ARG 109 Cb 0.12 -0.18 -0.03 0.00 -0.01 0.00 0.00 29.97 29.87 1rpx h ARG 109 CO -0.16 0.91 0.24 1.15 -3.11 0.00 0.00 179.97 179.00 1rpx h THR 110 N 1.09 1.24 -0.07 0.20 2.02 -0.82 0.59 112.91 117.15 1rpx h THR 110 Ca 0.25 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 1rpx h THR 110 Cb 0.21 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1rpx h THR 110 CO -0.02 0.29 0.04 0.40 0.37 0.00 0.00 175.52 176.60 1rpx h ILE 111 N 0.88 1.08 -0.63 3.11 1.08 -1.05 -2.30 117.51 119.67 1rpx h ILE 111 Ca 0.21 -0.21 -0.04 0.00 -0.39 0.00 0.00 64.86 64.42 1rpx h ILE 111 Cb 0.23 1.08 -0.03 0.00 -3.07 0.00 0.00 36.82 35.03 1rpx h ILE 111 CO -0.01 0.06 0.23 0.78 -0.69 0.00 0.00 178.15 178.52 1rpx h ASN 112 N 0.04 0.86 -0.90 1.72 2.35 -1.15 -2.50 115.58 116.00 1rpx h ASN 112 Ca 0.03 -0.13 0.02 0.00 -0.55 0.00 0.00 56.30 55.67 1rpx h ASN 112 Cb 0.07 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.17 1rpx h ASN 112 CO -0.00 0.79 0.59 -0.61 -1.65 0.00 0.00 177.43 176.54 1rpx h GLN 113 N 0.92 1.14 -0.60 0.81 4.15 -0.72 0.14 115.11 120.95 1rpx h GLN 113 Ca 0.21 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.54 1rpx h GLN 113 Cb 0.22 -0.26 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 1rpx h GLN 113 CO -0.01 0.75 0.27 0.82 -1.93 0.00 0.00 178.83 178.72 1rpx h ILE 114 N 1.17 1.22 -0.30 2.39 2.04 -0.99 -2.24 117.51 120.79 1rpx h ILE 114 Ca 0.34 -0.64 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 1rpx h ILE 114 Cb -0.07 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 1rpx h ILE 114 CO -0.10 0.26 -0.10 0.11 0.00 0.00 0.00 178.15 178.32 1rpx h LYS 115 N 0.82 0.60 -0.94 2.37 1.57 -1.04 -2.27 116.57 117.68 1rpx h LYS 115 Ca 0.20 -0.24 0.14 0.00 -1.87 0.00 0.00 60.65 58.88 1rpx h LYS 115 Cb 0.15 -0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.35 1rpx h LYS 115 CO -0.02 0.80 0.60 0.77 -0.57 0.00 0.00 179.45 181.03 1rpx h SER 116 N 0.36 0.76 -0.02 0.86 0.02 -0.55 0.28 113.55 115.27 1rpx h SER 116 Ca 0.07 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1rpx h SER 116 Cb 0.60 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.04 1rpx h SER 116 CO 0.04 0.38 0.00 0.18 -1.14 0.00 0.00 176.83 176.29 1rpx n LEU 117 N -4.60 0.22 0.00 5.07 4.32 -0.86 -4.91 117.00 116.23 1rpx n LEU 117 Ca 0.18 -0.09 0.00 0.00 -0.02 0.00 0.00 56.01 56.09 1rpx n LEU 117 Cb 0.44 -0.01 0.00 0.00 -1.62 0.00 0.00 43.42 42.23 1rpx n LEU 117 CO 0.28 0.04 0.00 0.61 -1.22 0.00 0.00 177.39 177.10 1rpx n GLY 118 N 0.88 0.78 3.90 -0.72 0.00 0.98 -5.03 105.19 105.99 1rpx n GLY 118 Ca 0.16 -0.00 -0.21 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 4.16 -0.09 4.61 0.00 -0.87 -4.97 121.76 122.61 1rpx s ALA 119 Ca 0.00 -1.83 -0.23 0.00 0.00 0.00 0.00 51.96 49.90 1rpx s ALA 119 Cb 0.00 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 1rpx s ALA 119 CO 0.00 -0.28 0.67 0.15 0.00 0.00 0.00 175.76 176.30 1rpx s LYS 120 N -4.19 4.40 -0.02 0.00 -0.14 -0.00 -4.09 119.74 115.69 1rpx s LYS 120 Ca 0.48 0.80 -0.21 0.00 -1.36 0.00 0.00 55.97 55.68 1rpx s LYS 120 Cb -0.04 -3.46 -0.05 0.00 -1.68 0.00 0.00 37.83 32.60 1rpx s LYS 120 CO 0.28 0.04 0.62 0.00 -0.76 0.00 0.00 175.35 175.53 1rpx s ALA 121 N 0.92 3.44 0.06 5.17 0.00 -1.26 -1.23 121.76 128.87 1rpx s ALA 121 Ca 0.35 0.05 0.07 0.00 0.00 0.00 0.00 51.96 52.43 1rpx s ALA 121 Cb -0.17 -2.80 -0.03 0.00 0.00 0.00 0.00 23.12 20.12 1rpx s ALA 121 CO 0.16 0.09 -0.19 0.20 0.00 0.00 0.00 175.76 176.01 1rpx s GLY 122 N 0.10 1.10 0.00 0.00 0.00 -0.75 -0.14 107.32 107.63 1rpx s GLY 122 Ca 0.32 -1.08 0.05 0.00 0.00 0.00 0.00 44.72 44.01 1rpx s GLY 122 CO 0.17 -1.05 -0.12 0.14 0.00 0.00 0.00 173.10 172.24 1rpx s VAL 123 N -0.96 3.24 0.08 1.40 1.01 -0.93 -0.89 120.40 123.35 1rpx s VAL 123 Ca 0.06 -0.89 0.09 0.00 0.00 0.00 0.00 61.98 61.23 1rpx s VAL 123 Cb -0.09 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 1rpx s VAL 123 CO 0.03 0.42 -0.22 -0.69 0.00 0.00 0.00 175.10 174.63 1rpx s VAL 124 N -0.91 2.51 -0.08 2.92 1.01 0.42 -0.09 120.40 126.18 1rpx s VAL 124 Ca 0.15 -1.44 0.02 0.00 0.00 0.00 0.00 61.98 60.71 1rpx s VAL 124 Cb -0.11 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.22 1rpx s VAL 124 CO 0.05 0.24 -0.13 -0.76 0.00 0.00 0.00 175.10 174.50 1rpx s LEU 125 N -1.67 1.61 0.74 3.92 1.02 -0.51 -2.22 118.68 121.57 1rpx s LEU 125 Ca 0.14 -0.34 -0.11 0.00 0.02 0.00 0.00 54.13 53.84 1rpx s LEU 125 Cb -0.10 -0.92 0.04 0.00 0.02 0.00 0.00 46.19 45.23 1rpx s LEU 125 CO 0.06 0.01 1.09 0.20 0.02 0.00 0.00 176.35 177.72 1rpx s ASN 126 N 0.90 4.77 0.28 2.29 0.01 -1.26 -1.73 114.94 120.20 1rpx s ASN 126 Ca -0.10 1.81 0.02 0.00 -0.71 0.00 0.00 52.86 53.89 1rpx s ASN 126 Cb -0.15 -2.52 0.69 0.00 0.41 0.00 0.00 41.25 39.68 1rpx s ASN 126 CO 0.01 -1.86 1.67 -0.65 -1.51 0.00 0.00 177.10 174.76 1rpx h PRO 127 N -0.85 0.28 -0.07 -0.60 0.11 -1.83 0.27 132.00 129.32 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 1.23 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1rpx h PRO 127 CO 0.53 0.19 0.00 0.41 -0.21 0.00 0.00 178.00 178.91 1rpx n GLY 128 N -1.36 -0.36 3.71 -0.55 0.00 -1.26 -4.84 105.19 100.54 1rpx n GLY 128 Ca 0.21 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.91 5.12 0.57 2.61 2.01 0.08 -5.06 115.64 119.06 1rpx s THR 129 Ca 0.33 1.13 -0.15 0.00 0.31 0.00 0.00 61.69 63.31 1rpx s THR 129 Cb 0.16 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.72 1rpx s THR 129 CO 0.26 0.26 1.02 -2.16 -0.69 0.00 0.00 174.62 173.32 1rpx s PRO 130 N 0.94 3.57 0.59 4.92 0.04 -1.26 -4.78 135.00 139.02 1rpx s PRO 130 Ca 0.30 1.02 0.36 0.00 0.04 0.00 0.00 61.00 62.72 1rpx s PRO 130 Cb -0.16 -2.08 1.84 0.00 0.04 0.00 0.00 34.50 34.14 1rpx s PRO 130 CO 0.13 -0.59 2.18 -0.07 0.04 0.00 0.00 177.00 178.69 1rpx h LEU 131 N 0.43 0.00 -2.15 -3.56 3.38 -1.97 -2.28 115.31 109.16 1rpx h LEU 131 Ca -0.46 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.56 1rpx h LEU 131 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1rpx h LEU 131 CO 0.60 0.04 0.15 0.71 0.09 0.00 0.00 178.44 180.03 1rpx h THR 132 N 0.00 0.68 -0.65 0.22 1.35 -2.01 -2.18 112.91 110.32 1rpx h THR 132 Ca -0.00 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.92 1rpx h THR 132 Cb 0.22 0.89 -0.04 0.00 -1.73 0.00 0.00 68.15 67.49 1rpx h THR 132 CO 0.00 0.00 0.43 0.00 -0.25 0.00 0.00 175.52 175.71 1rpx h ALA 133 N 1.86 1.74 -0.43 6.62 0.00 -1.80 -2.80 119.26 124.45 1rpx h ALA 133 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1rpx h ALA 133 Cb 0.39 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1rpx h ALA 133 CO -0.00 0.16 0.00 0.44 0.00 0.00 0.00 179.25 179.85 1rpx n ILE 134 N -4.47 0.75 -0.16 0.00 -5.35 -0.83 -4.70 119.36 104.59 1rpx n ILE 134 Ca 0.09 -0.87 -0.03 0.00 -0.27 0.00 0.00 62.75 61.67 1rpx n ILE 134 Cb 0.21 0.72 0.04 0.00 -1.74 0.00 0.00 39.64 38.87 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 3.37 -0.01 -0.66 6.28 4.81 -1.43 -0.23 114.58 126.70 1rpx h GLU 135 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1rpx h GLU 135 Cb 0.85 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.23 1rpx h GLU 135 CO 0.00 -0.01 0.00 0.66 -0.73 0.00 0.00 179.01 178.93 1rpx n TYR 136 N -5.37 0.74 -0.14 0.92 4.02 -1.26 -3.39 117.16 112.68 1rpx n TYR 136 Ca 0.05 -0.28 0.00 0.00 -0.01 0.00 0.00 57.90 57.66 1rpx n TYR 136 Cb 0.28 -0.19 0.00 0.00 -0.02 0.00 0.00 39.34 39.41 1rpx n TYR 136 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 176.86 177.40 1rpx n VAL 137 N 0.31 0.00 0.18 -0.72 3.14 -0.72 -4.79 118.33 115.73 1rpx n VAL 137 Ca 0.11 -0.19 0.07 0.00 -2.96 0.00 0.00 64.34 61.37 1rpx n VAL 137 Cb 0.53 1.14 0.57 0.00 -1.06 0.00 0.00 33.84 35.02 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 -0.17 6.55 5.85 -1.08 -1.05 115.31 125.55 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 0.07 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1rpx h LEU 138 CO 0.00 0.10 0.00 -2.24 -0.34 0.00 0.00 178.44 175.96 1rpx h ASP 139 N 0.16 0.00 0.03 1.25 2.03 -1.87 -3.31 116.42 114.72 1rpx h ASP 139 Ca 0.04 0.00 -0.02 0.00 -0.73 0.00 0.00 57.03 56.32 1rpx h ASP 139 Cb -0.01 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.48 1rpx h ASP 139 CO -0.01 0.00 -1.99 0.00 -1.03 0.00 0.00 179.24 176.21 1rpx n ALA 140 N -1.82 2.72 -1.90 4.15 0.00 -0.42 -5.01 120.51 118.23 1rpx n ALA 140 Ca 0.05 -0.56 -0.32 0.00 0.00 0.00 0.00 53.44 52.61 1rpx n ALA 140 Cb 0.40 -0.73 -0.03 0.00 0.00 0.00 0.00 19.45 19.09 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 -3.45 4.58 -0.57 0.00 -7.23 -1.08 -4.91 120.40 107.73 1rpx s VAL 141 Ca -0.08 1.11 0.21 0.00 -1.81 0.00 0.00 61.98 61.41 1rpx s VAL 141 Cb 0.13 -3.73 -0.27 0.00 0.56 0.00 0.00 36.38 33.08 1rpx s VAL 141 CO 0.90 -0.67 0.70 0.47 -0.31 0.00 0.00 175.10 176.19 1rpx n ASP 142 N -1.56 0.61 -3.66 4.85 8.00 0.80 -4.78 116.55 120.82 1rpx n ASP 142 Ca 0.06 -0.57 -0.14 0.00 0.71 0.00 0.00 54.79 54.85 1rpx n ASP 142 Cb 0.54 1.41 -0.07 0.00 -0.02 0.00 0.00 41.12 42.98 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 -3.62 0.28 -0.08 0.64 0.20 -0.92 -1.59 118.68 113.59 1rpx s LEU 143 Ca 0.01 0.21 0.01 0.00 0.69 0.00 0.00 54.13 55.06 1rpx s LEU 143 Cb 0.15 1.79 0.02 0.00 -0.43 0.00 0.00 46.19 47.71 1rpx s LEU 143 CO 0.86 -0.58 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.56 1rpx s VAL 144 N -1.76 1.04 -0.21 1.68 1.01 0.11 -2.20 120.40 120.07 1rpx s VAL 144 Ca -0.10 -0.38 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 1rpx s VAL 144 Cb -0.02 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 1rpx s VAL 144 CO 0.03 0.35 -0.01 -0.22 0.00 0.00 0.00 175.10 175.25 1rpx s LEU 145 N 1.01 3.17 -0.29 3.92 0.20 0.87 0.07 118.68 127.63 1rpx s LEU 145 Ca -0.08 -0.25 -0.10 0.00 0.69 0.00 0.00 54.13 54.39 1rpx s LEU 145 Cb -0.15 -1.81 -0.02 0.00 -0.43 0.00 0.00 46.19 43.78 1rpx s LEU 145 CO -0.00 0.03 0.15 -0.63 -0.29 0.00 0.00 176.35 175.61 1rpx s ILE 146 N 1.19 4.75 -0.19 6.68 1.09 0.23 -1.42 121.20 133.52 1rpx s ILE 146 Ca 0.03 -0.22 -0.28 0.00 -1.10 0.00 0.00 60.65 59.07 1rpx s ILE 146 Cb -0.14 -3.35 -0.00 0.00 -1.06 0.00 0.00 42.46 37.91 1rpx s ILE 146 CO 0.01 0.16 0.99 -0.04 -0.10 0.00 0.00 174.94 175.96 1rpx s MET 147 N 1.65 4.31 -0.24 2.79 -1.94 -0.71 -2.27 119.30 122.90 1rpx s MET 147 Ca 0.06 1.30 0.14 0.00 -1.71 0.00 0.00 55.69 55.47 1rpx s MET 147 Cb -0.16 -3.60 0.63 0.00 2.01 0.00 0.00 34.83 33.70 1rpx s MET 147 CO 0.07 -0.49 1.58 -1.13 -0.01 0.00 0.00 175.02 175.03 1rpx n SER 148 N 5.78 4.28 -3.58 3.03 3.41 0.28 -3.79 113.62 123.01 1rpx n SER 148 Ca 0.10 -3.14 -0.17 0.00 -0.26 0.00 0.00 58.87 55.40 1rpx n SER 148 Cb 0.47 -0.63 -0.07 0.00 -0.26 0.00 0.00 64.21 63.73 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 -2.91 0.01 -0.26 -3.33 0.11 -1.25 -0.77 120.40 112.00 1rpx s VAL 149 Ca 0.48 -0.12 -0.29 0.00 -2.93 0.00 0.00 61.98 59.12 1rpx s VAL 149 Cb 0.39 -0.90 -0.00 0.00 -1.53 0.00 0.00 36.38 34.34 1rpx s VAL 149 CO 0.10 -0.07 1.26 0.20 -3.33 0.00 0.00 175.10 173.26 1rpx s ASN 150 N -1.20 6.79 0.30 3.54 0.01 -1.26 -4.65 114.94 118.47 1rpx s ASN 150 Ca -0.11 1.33 -0.30 0.00 -0.71 0.00 0.00 52.86 53.07 1rpx s ASN 150 Cb -0.01 -2.54 -0.11 0.00 0.41 0.00 0.00 41.25 38.99 1rpx s ASN 150 CO 0.08 -0.96 1.56 -2.16 -1.51 0.00 0.00 177.10 174.12 1rpx s PRO 151 N 3.89 4.13 0.00 -0.60 0.04 -1.26 -3.35 135.00 137.86 1rpx s PRO 151 Ca 0.54 2.55 0.00 0.00 0.04 0.00 0.00 61.00 64.13 1rpx s PRO 151 Cb -0.17 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.34 1rpx s PRO 151 CO 0.19 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 177.05 1rpx n GLY 152 N 1.88 2.21 3.97 0.56 0.00 -1.26 -4.78 105.19 107.77 1rpx n GLY 152 Ca 0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.88 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 -3.00 3.08 0.28 1.61 0.40 -1.21 -4.64 117.98 114.50 1rpx s PHE 153 Ca 0.00 0.02 0.07 0.00 -0.60 0.00 0.00 56.93 56.42 1rpx s PHE 153 Cb 0.00 -2.35 -0.03 0.00 0.51 0.00 0.00 43.02 41.15 1rpx s PHE 153 CO 0.00 -0.41 0.28 0.20 0.70 0.00 0.00 175.22 175.99 1rpx s GLY 154 N -4.27 1.50 -0.91 4.36 0.00 -1.26 -4.60 107.32 102.14 1rpx s GLY 154 Ca 0.50 -1.46 -0.04 0.00 0.00 0.00 0.00 44.72 43.73 1rpx s GLY 154 CO 0.36 -1.45 0.78 0.61 0.00 0.00 0.00 173.10 173.41 1rpx n GLY 155 N -1.32 -0.11 3.48 0.20 0.00 -1.26 -5.00 105.19 101.17 1rpx n GLY 155 Ca -0.05 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 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 -5.52 3.71 0.19 1.61 -1.52 -1.26 -5.09 119.66 111.78 1rpx s GLN 156 Ca 0.24 -0.46 0.11 0.00 -1.95 0.00 0.00 55.36 53.30 1rpx s GLN 156 Cb -0.11 -3.27 -0.04 0.00 -0.22 0.00 0.00 33.01 29.37 1rpx s GLN 156 CO 0.52 -0.07 -0.24 -1.54 -0.25 0.00 0.00 175.29 173.71 1rpx s SER 157 N 1.29 3.40 -0.14 5.90 1.04 -1.26 -4.77 113.70 119.16 1rpx s SER 157 Ca 0.05 -0.87 -0.42 0.00 0.48 0.00 0.00 55.95 55.19 1rpx s SER 157 Cb -0.15 -0.25 -0.19 0.00 0.10 0.00 0.00 66.02 65.53 1rpx s SER 157 CO 0.03 0.11 1.28 0.33 0.98 0.00 0.00 173.24 175.97 1rpx n PHE 158 N 0.25 1.11 -3.02 5.02 7.35 -1.26 -4.80 117.46 122.10 1rpx n PHE 158 Ca -0.12 1.01 -0.44 0.00 -0.76 0.00 0.00 57.45 57.14 1rpx n PHE 158 Cb 0.56 -2.17 -0.05 0.00 0.35 0.00 0.00 39.48 38.17 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 1.05 4.65 0.29 -2.13 1.01 0.05 -4.95 121.20 121.16 1rpx s ILE 159 Ca 0.95 -0.50 0.03 0.00 0.00 0.00 0.00 60.65 61.12 1rpx s ILE 159 Cb -1.29 -4.49 0.30 0.00 0.01 0.00 0.00 42.46 36.99 1rpx s ILE 159 CO 0.63 -1.11 1.67 -0.08 0.00 0.00 0.00 174.94 176.04 1rpx h GLU 160 N 9.25 0.27 0.00 2.79 4.57 -1.91 -1.50 114.58 128.05 1rpx h GLU 160 Ca -0.28 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.88 1rpx h GLU 160 Cb 1.08 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.61 1rpx h GLU 160 CO 1.08 0.18 0.20 0.66 -1.18 0.00 0.00 179.01 179.95 1rpx h SER 161 N 0.28 0.00 1.12 1.04 4.64 -1.99 -1.80 113.55 116.84 1rpx h SER 161 Ca 0.56 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.85 1rpx h SER 161 Cb 1.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1rpx h SER 161 CO -0.60 0.00 -0.12 1.56 -0.87 0.00 0.00 176.83 176.80 1rpx h GLN 162 N 0.00 0.00 -0.82 4.77 1.08 -1.65 -3.08 115.11 115.41 1rpx h GLN 162 Ca 0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1rpx h GLN 162 Cb 0.40 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.79 1rpx h GLN 162 CO 0.00 0.12 0.44 0.28 -0.95 0.00 0.00 178.83 178.72 1rpx h VAL 163 N 0.00 1.24 -0.62 -0.54 2.07 -1.52 -1.35 116.25 115.54 1rpx h VAL 163 Ca -0.00 -0.61 -0.09 0.00 0.82 0.00 0.00 66.70 66.82 1rpx h VAL 163 Cb 0.71 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1rpx h VAL 163 CO 0.02 0.27 0.03 0.50 0.02 0.00 0.00 177.57 178.40 1rpx h LYS 164 N 1.15 1.06 -0.83 1.57 3.64 -1.73 -2.45 116.57 118.99 1rpx h LYS 164 Ca 0.29 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1rpx h LYS 164 Cb 0.03 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 1rpx h LYS 164 CO -0.05 1.02 0.47 -0.22 -2.27 0.00 0.00 179.45 178.40 1rpx h LYS 165 N 0.98 1.14 -0.32 1.90 3.64 -1.34 -1.09 116.57 121.48 1rpx h LYS 165 Ca 0.18 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1rpx h LYS 165 Cb 0.53 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1rpx h LYS 165 CO 0.03 0.83 0.16 0.82 -2.27 0.00 0.00 179.45 179.02 1rpx h ILE 166 N 1.15 1.15 -0.07 2.00 2.04 -1.02 -0.86 117.51 121.89 1rpx h ILE 166 Ca 0.29 -0.42 -0.13 0.00 1.00 0.00 0.00 64.86 65.61 1rpx h ILE 166 Cb 0.01 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1rpx h ILE 166 CO -0.05 0.15 -0.52 0.77 0.00 0.00 0.00 178.15 178.50 1rpx h SER 167 N 0.39 0.20 -0.04 1.72 4.64 -1.20 -1.18 113.55 118.08 1rpx h SER 167 Ca 0.11 -0.10 -0.10 0.00 -0.47 0.00 0.00 61.79 61.23 1rpx h SER 167 Cb 0.10 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 1rpx h SER 167 CO -0.02 0.69 -0.26 0.44 -0.87 0.00 0.00 176.83 176.81 1rpx h ASP 168 N 0.15 0.47 -0.22 4.97 5.19 -1.01 -1.85 116.42 124.11 1rpx h ASP 168 Ca 0.00 -0.16 -0.02 0.00 -0.62 0.00 0.00 57.03 56.23 1rpx h ASP 168 Cb 0.98 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 40.35 1rpx h ASP 168 CO 0.08 0.72 0.05 0.25 -3.12 0.00 0.00 179.24 177.22 1rpx h LEU 169 N 0.41 0.34 -0.40 1.55 5.85 -0.65 -1.45 115.31 120.95 1rpx h LEU 169 Ca 0.06 -0.24 0.06 0.00 0.84 0.00 0.00 57.88 58.60 1rpx h LEU 169 Cb 0.68 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.56 1rpx h LEU 169 CO 0.05 0.49 0.09 0.03 -0.34 0.00 0.00 178.44 178.76 1rpx h ARG 170 N 0.17 0.21 -0.33 1.25 2.47 -0.93 -0.68 114.38 116.54 1rpx h ARG 170 Ca 0.07 -0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.82 1rpx h ARG 170 Cb 0.29 -0.05 -0.04 0.00 -1.65 0.00 0.00 29.97 28.53 1rpx h ARG 170 CO 0.00 0.14 0.10 0.87 0.56 0.00 0.00 179.97 181.64 1rpx h LYS 171 N 0.22 0.23 -0.89 0.04 1.57 -1.20 0.62 116.57 117.15 1rpx h LYS 171 Ca 0.19 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.94 1rpx h LYS 171 Cb 0.23 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 1rpx h LYS 171 CO -0.25 0.15 0.49 0.82 -0.57 0.00 0.00 179.45 180.10 1rpx h ILE 172 N 0.24 1.26 -0.47 1.86 2.04 -0.64 -1.33 117.51 120.46 1rpx h ILE 172 Ca 0.15 -0.63 -0.08 0.00 1.00 0.00 0.00 64.86 65.30 1rpx h ILE 172 Cb 0.13 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.24 1rpx h ILE 172 CO -0.17 0.29 -0.02 0.00 0.00 0.00 0.00 178.15 178.25 1rpx h ALA 174 N 0.91 0.35 -0.17 0.00 0.00 -0.48 0.12 119.26 120.00 1rpx h ALA 174 Ca 0.13 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1rpx h ALA 174 Cb 0.53 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1rpx h ALA 174 CO 0.03 -0.17 -0.31 0.93 0.00 0.00 0.00 179.25 179.73 1rpx h GLU 175 N 0.37 0.32 0.00 0.00 5.08 -1.12 -2.90 114.58 116.34 1rpx h GLU 175 Ca 0.10 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1rpx h GLU 175 Cb -0.03 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1rpx h GLU 175 CO -0.02 0.61 -0.37 0.54 -1.00 0.00 0.00 179.01 178.77 1rpx n ARG 176 N -4.10 0.21 -1.75 2.33 5.12 -0.36 -4.95 116.66 113.16 1rpx n ARG 176 Ca -0.01 0.10 -0.00 0.00 -1.93 0.00 0.00 57.85 56.01 1rpx n ARG 176 Cb 0.42 -1.67 -0.00 0.00 -1.16 0.00 0.00 32.46 30.05 1rpx n ARG 176 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1rpx n GLY 177 N 1.37 0.37 3.78 -0.13 0.00 0.19 -5.06 105.19 105.72 1rpx n GLY 177 Ca 0.05 -0.94 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.00 3.77 -0.38 0.99 1.43 0.05 -5.03 118.68 119.51 1rpx s LEU 178 Ca 0.00 -0.10 0.12 0.00 -1.03 0.00 0.00 54.13 53.12 1rpx s LEU 178 Cb 0.00 -2.41 0.38 0.00 0.03 0.00 0.00 46.19 44.18 1rpx s LEU 178 CO 0.00 0.11 0.94 -3.20 0.23 0.00 0.00 176.35 174.43 1rpx n ASN 179 N -0.01 0.01 -4.83 2.29 5.15 -1.26 -4.29 115.26 112.32 1rpx n ASN 179 Ca -0.09 -3.02 -0.30 0.00 -0.60 0.00 0.00 54.58 50.58 1rpx n ASN 179 Cb 0.53 0.11 0.07 0.00 -0.53 0.00 0.00 39.78 39.97 1rpx n ASN 179 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1rpx s PRO 180 N -1.74 2.49 0.43 1.20 0.04 -1.26 -4.99 135.00 131.16 1rpx s PRO 180 Ca 0.31 0.65 -0.25 0.00 0.04 0.00 0.00 61.00 61.75 1rpx s PRO 180 Cb 0.37 -1.96 -0.08 0.00 0.04 0.00 0.00 34.50 32.87 1rpx s PRO 180 CO -0.05 -1.34 1.28 -1.58 0.04 0.00 0.00 177.00 175.35 1rpx s TRP 181 N -3.19 2.80 -0.31 0.56 0.52 -0.62 -4.86 118.94 113.83 1rpx s TRP 181 Ca 0.59 1.44 0.00 0.00 0.02 0.00 0.00 56.10 58.16 1rpx s TRP 181 Cb -0.13 -3.61 0.07 0.00 -1.15 0.00 0.00 33.47 28.64 1rpx s TRP 181 CO 0.54 -2.01 0.01 0.42 0.02 0.00 0.00 176.95 175.93 1rpx s ILE 182 N -1.32 2.70 0.05 2.03 1.01 -1.26 -0.72 121.20 123.69 1rpx s ILE 182 Ca 0.59 -1.72 0.00 0.00 0.00 0.00 0.00 60.65 59.52 1rpx s ILE 182 Cb -0.36 -2.68 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 1rpx s ILE 182 CO 0.46 -0.26 0.17 -0.70 0.00 0.00 0.00 174.94 174.60 1rpx s GLU 183 N 1.13 3.29 -0.01 2.79 2.12 0.11 -1.91 118.70 126.22 1rpx s GLU 183 Ca -0.01 -0.49 0.04 0.00 0.36 0.00 0.00 54.97 54.87 1rpx s GLU 183 Cb -0.20 -2.97 -0.01 0.00 0.26 0.00 0.00 34.13 31.22 1rpx s GLU 183 CO -0.04 0.61 -0.13 0.08 -0.54 0.00 0.00 175.26 175.25 1rpx s VAL 184 N -1.44 1.01 -0.06 3.70 1.01 -0.42 -0.60 120.40 123.61 1rpx s VAL 184 Ca 0.32 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 1rpx s VAL 184 Cb -0.13 -0.85 0.04 0.00 0.00 0.00 0.00 36.38 35.44 1rpx s VAL 184 CO 0.25 0.29 0.11 -0.62 0.00 0.00 0.00 175.10 175.13 1rpx s ASP 185 N -0.22 0.37 0.00 3.32 2.15 -0.96 -0.78 116.67 120.54 1rpx s ASP 185 Ca 0.03 0.22 0.00 0.00 0.43 0.00 0.00 52.55 53.23 1rpx s ASP 185 Cb -0.06 0.10 0.00 0.00 -0.30 0.00 0.00 42.92 42.67 1rpx s ASP 185 CO -0.00 -0.19 0.00 0.61 -0.17 0.00 0.00 175.17 175.42 1rpx n GLY 186 N 4.69 1.82 2.37 2.66 0.00 -1.26 -0.56 105.19 114.90 1rpx n GLY 186 Ca -0.17 -0.20 -0.17 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.34 3.66 -0.02 0.00 -1.26 -4.28 105.19 102.96 1rpx n GLY 187 Ca 0.00 -0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.88 5.20 0.34 1.61 1.01 -1.26 -4.43 120.40 120.00 1rpx s VAL 188 Ca 0.02 0.67 0.05 0.00 0.00 0.00 0.00 61.98 62.73 1rpx s VAL 188 Cb -0.01 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 1rpx s VAL 188 CO 0.03 0.25 0.22 -0.83 0.00 0.00 0.00 175.10 174.76 1rpx s GLY 189 N 1.10 2.33 0.59 4.51 0.00 -1.26 -4.68 107.32 109.92 1rpx s GLY 189 Ca 0.18 -1.79 0.33 0.00 0.00 0.00 0.00 44.72 43.43 1rpx s GLY 189 CO 0.08 -1.57 2.25 -0.56 0.00 0.00 0.00 173.10 173.29 1rpx h PRO 190 N 2.08 0.00 -0.00 2.90 0.13 -1.85 -1.19 132.00 134.07 1rpx h PRO 190 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 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 0.44 0.02 -0.20 0.36 -0.23 0.00 0.00 178.00 178.39 1rpx n LYS 191 N -3.63 0.39 0.00 0.86 0.00 -1.26 -4.24 118.16 110.27 1rpx n LYS 191 Ca -0.03 -0.16 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 1rpx n LYS 191 Cb 0.11 -1.50 0.00 0.00 -0.00 0.00 0.00 35.03 33.64 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 -1.17 0.00 0.25 -5.58 6.94 -0.93 -4.86 115.26 109.91 1rpx n ASN 192 Ca 0.10 -1.00 0.07 0.00 -0.02 0.00 0.00 54.58 53.73 1rpx n ASN 192 Cb 0.31 0.00 0.59 0.00 -2.36 0.00 0.00 39.78 38.32 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 1.87 -0.80 -2.53 0.00 -1.41 -2.57 119.26 113.81 1rpx h ALA 193 Ca 0.00 -0.07 0.13 0.00 0.00 0.00 0.00 54.91 54.98 1rpx h ALA 193 Cb 0.72 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 1rpx h ALA 193 CO 0.00 0.09 0.53 0.10 0.00 0.00 0.00 179.25 179.97 1rpx h TYR 194 N 0.00 0.66 -0.19 0.00 -0.00 -1.86 -0.14 116.97 115.44 1rpx h TYR 194 Ca -0.00 0.02 0.05 0.00 0.00 0.00 0.00 58.73 58.79 1rpx h TYR 194 Cb 0.13 -0.21 -0.05 0.00 0.00 0.00 0.00 36.73 36.61 1rpx h TYR 194 CO 0.00 0.26 -0.11 0.87 -0.00 0.00 0.00 178.16 179.18 1rpx h LYS 195 N 0.57 -0.10 0.00 0.10 1.57 -1.82 0.29 116.57 117.18 1rpx h LYS 195 Ca 0.39 0.01 -0.20 0.00 -1.87 0.00 0.00 60.65 58.98 1rpx h LYS 195 Cb 0.71 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1rpx h LYS 195 CO -0.15 -0.06 -0.98 -0.39 -0.57 0.00 0.00 179.45 177.29 1rpx h VAL 196 N -0.10 1.56 -0.22 0.50 -1.51 -1.58 -2.69 116.25 112.20 1rpx h VAL 196 Ca 0.11 -3.23 -0.02 0.00 -1.23 0.00 0.00 66.70 62.32 1rpx h VAL 196 Cb 0.26 2.77 -0.01 0.00 -2.13 0.00 0.00 31.29 32.18 1rpx h VAL 196 CO -0.25 0.89 0.05 0.40 -1.23 0.00 0.00 177.57 177.42 1rpx h ILE 197 N 0.00 1.21 0.00 7.19 2.04 -0.67 -0.55 117.51 126.73 1rpx h ILE 197 Ca -0.03 -0.70 -0.04 0.00 1.00 0.00 0.00 64.86 65.09 1rpx h ILE 197 Cb 1.74 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 39.06 1rpx h ILE 197 CO 0.12 0.22 -0.21 -0.33 0.00 0.00 0.00 178.15 177.95 1rpx h GLU 198 N 0.18 0.00 0.00 2.37 5.08 -0.49 -2.30 114.58 119.42 1rpx h GLU 198 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1rpx h GLU 198 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1rpx h GLU 198 CO 0.00 0.21 0.00 0.00 -1.00 0.00 0.00 179.01 178.22 1rpx h ALA 199 N 1.79 1.00 0.00 3.43 0.00 -1.11 -3.47 119.26 120.90 1rpx h ALA 199 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rpx h ALA 199 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1rpx h ALA 199 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1rpx n GLY 200 N 0.88 0.61 3.72 0.00 0.00 -0.85 -3.59 105.19 105.96 1rpx n GLY 200 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.46 3.23 -0.96 4.61 0.00 -0.27 -4.78 121.76 122.12 1rpx s ALA 201 Ca 0.00 0.60 0.09 0.00 0.00 0.00 0.00 51.96 52.65 1rpx s ALA 201 Cb 0.00 -3.33 0.04 0.00 0.00 0.00 0.00 23.12 19.84 1rpx s ALA 201 CO 0.00 -0.17 0.70 0.27 0.00 0.00 0.00 175.76 176.56 1rpx n ASN 202 N 3.38 1.49 -3.79 0.00 0.23 -0.81 -4.44 115.26 111.33 1rpx n ASN 202 Ca 0.05 -1.25 -0.22 0.00 -0.53 0.00 0.00 54.58 52.63 1rpx n ASN 202 Cb 0.50 0.17 -0.17 0.00 -2.08 0.00 0.00 39.78 38.19 1rpx n ASN 202 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1rpx s ALA 203 N -0.90 0.68 -0.10 -2.53 0.00 -1.04 -0.20 121.76 117.68 1rpx s ALA 203 Ca 0.09 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.99 1rpx s ALA 203 Cb 0.07 -0.67 -0.00 0.00 0.00 0.00 0.00 23.12 22.52 1rpx s ALA 203 CO 0.14 -0.37 -0.23 -0.51 0.00 0.00 0.00 175.76 174.79 1rpx s LEU 204 N 1.75 2.14 -0.19 0.00 1.43 0.57 -1.29 118.68 123.09 1rpx s LEU 204 Ca 0.02 -0.54 -0.09 0.00 -1.03 0.00 0.00 54.13 52.48 1rpx s LEU 204 Cb -0.13 -1.42 -0.05 0.00 0.03 0.00 0.00 46.19 44.62 1rpx s LEU 204 CO -0.04 0.17 0.13 -0.69 0.23 0.00 0.00 176.35 176.15 1rpx s VAL 205 N 0.29 5.41 -0.01 -1.59 1.01 0.04 -0.39 120.40 125.16 1rpx s VAL 205 Ca -0.17 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.00 1rpx s VAL 205 Cb -0.17 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 32.76 1rpx s VAL 205 CO 0.08 0.47 -0.01 0.00 0.00 0.00 0.00 175.10 175.65 1rpx s ALA 206 N 0.13 0.12 0.00 5.51 0.00 -1.21 -4.31 121.76 121.99 1rpx s ALA 206 Ca 0.09 0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.07 1rpx s ALA 206 Cb -0.11 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1rpx s ALA 206 CO -0.01 -0.00 0.00 0.41 0.00 0.00 0.00 175.76 176.16 1rpx n GLY 207 N 3.30 0.11 0.31 0.00 0.00 -1.26 -0.52 105.19 107.14 1rpx n GLY 207 Ca -0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.92 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 0.38 -0.18 1.61 4.64 -1.93 -0.94 113.55 117.13 1rpx h SER 208 Ca 0.00 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.33 1rpx h SER 208 Cb 0.00 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 1rpx h SER 208 CO 0.00 0.26 0.12 0.00 -0.87 0.00 0.00 176.83 176.35 1rpx h ALA 209 N 1.78 1.96 0.00 5.18 0.00 -1.87 0.78 119.26 127.08 1rpx h ALA 209 Ca 0.15 -0.01 -0.38 0.00 0.00 0.00 0.00 54.91 54.67 1rpx h ALA 209 Cb 0.06 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 1rpx h ALA 209 CO -0.03 0.02 -2.36 1.33 0.00 0.00 0.00 179.25 178.21 1rpx n VAL 210 N -4.51 1.35 0.07 0.00 0.24 -0.74 -4.27 118.33 110.47 1rpx n VAL 210 Ca 0.00 -0.43 -0.06 0.00 -2.04 0.00 0.00 64.34 61.80 1rpx n VAL 210 Cb 0.13 -1.56 0.10 0.00 -1.47 0.00 0.00 33.84 31.04 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 -0.42 0.39 -0.14 6.34 0.04 -1.25 -2.93 116.94 118.97 1rpx h PHE 211 Ca -0.57 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 60.04 1rpx h PHE 211 Cb 1.69 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 39.77 1rpx h PHE 211 CO -0.02 0.84 0.00 0.41 -0.60 0.00 0.00 178.31 178.94 1rpx n GLY 212 N 0.31 -0.13 3.89 -1.45 0.00 0.26 -4.89 105.19 103.18 1rpx n GLY 212 Ca -0.03 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 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 -1.81 3.69 0.16 4.61 0.00 -1.11 -5.00 121.76 122.30 1rpx s ALA 213 Ca 0.25 -0.46 -0.16 0.00 0.00 0.00 0.00 51.96 51.59 1rpx s ALA 213 Cb 0.13 -2.25 0.02 0.00 0.00 0.00 0.00 23.12 21.02 1rpx s ALA 213 CO 0.19 0.56 1.82 -1.00 0.00 0.00 0.00 175.76 177.33 1rpx h PRO 214 N 2.58 0.56 -5.11 0.00 0.13 -1.90 -3.41 132.00 124.85 1rpx h PRO 214 Ca -0.46 -0.03 -0.66 0.00 -0.87 0.00 0.00 66.00 63.98 1rpx h PRO 214 Cb 1.17 -0.13 -0.34 0.00 0.13 0.00 0.00 31.00 31.83 1rpx h PRO 214 CO 0.71 0.37 -0.86 0.34 -0.23 0.00 0.00 178.00 178.32 1rpx s ASP 215 N -5.58 2.96 0.01 1.44 -1.08 -1.26 -5.04 116.67 108.12 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 0.07 1.39 1.88 0.52 0.00 0.00 175.17 179.76 1rpx h TYR 216 N 7.30 -0.04 -0.43 -5.34 0.05 -1.83 -2.63 116.97 114.05 1rpx h TYR 216 Ca -0.31 -0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.49 1rpx h TYR 216 Cb 1.19 0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.92 1rpx h TYR 216 CO 0.47 0.30 0.29 0.00 -1.05 0.00 0.00 178.16 178.17 1rpx h ALA 217 N 0.56 1.77 -0.16 3.88 0.00 -1.94 -0.80 119.26 122.58 1rpx h ALA 217 Ca -0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1rpx h ALA 217 Cb 0.36 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1rpx h ALA 217 CO 0.01 0.20 -0.15 0.93 0.00 0.00 0.00 179.25 180.23 1rpx h GLU 218 N 0.52 0.38 -0.60 0.00 5.08 -1.90 -1.40 114.58 116.66 1rpx h GLU 218 Ca 0.17 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1rpx h GLU 218 Cb 0.04 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1rpx h GLU 218 CO -0.04 0.76 0.35 0.00 -1.00 0.00 0.00 179.01 179.07 1rpx h ALA 219 N 0.62 0.77 -0.26 3.43 0.00 -1.07 0.49 119.26 123.24 1rpx h ALA 219 Ca 0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1rpx h ALA 219 Cb 0.68 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1rpx h ALA 219 CO 0.04 0.27 0.09 0.82 0.00 0.00 0.00 179.25 180.46 1rpx h ILE 220 N 0.81 1.19 -0.30 0.00 2.04 -1.15 -2.09 117.51 118.01 1rpx h ILE 220 Ca 0.21 -0.60 -0.13 0.00 1.00 0.00 0.00 64.86 65.35 1rpx h ILE 220 Cb 0.01 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1rpx h ILE 220 CO -0.04 0.20 -0.33 0.50 0.00 0.00 0.00 178.15 178.48 1rpx h LYS 221 N 0.26 0.66 0.00 2.37 3.64 -1.03 -2.40 116.57 120.07 1rpx h LYS 221 Ca 0.08 -0.31 -0.01 0.00 -1.27 0.00 0.00 60.65 59.15 1rpx h LYS 221 Cb 0.22 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1rpx h LYS 221 CO -0.00 0.90 -0.05 0.78 -2.27 0.00 0.00 179.45 178.80 1rpx h GLY 222 N 0.99 0.00 0.27 5.01 0.00 0.12 -1.48 103.07 107.99 1rpx h GLY 222 Ca 0.06 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.27 1rpx h GLY 222 CO 0.07 0.00 -0.56 -2.22 0.00 0.00 0.00 176.54 173.83 1rpx h ILE 223 N 0.00 1.52 0.00 2.60 2.04 -0.89 -2.99 117.51 119.79 1rpx h ILE 223 Ca -0.00 -2.39 -0.02 0.00 1.00 0.00 0.00 64.86 63.45 1rpx h ILE 223 Cb 0.31 3.12 -0.00 0.00 -0.74 0.00 0.00 36.82 39.51 1rpx h ILE 223 CO 0.01 0.62 -0.08 0.07 0.00 0.00 0.00 178.15 178.77 1rpx h LYS 224 N -0.73 0.00 -0.42 2.37 2.10 -1.29 -3.06 116.57 115.53 1rpx h LYS 224 Ca -0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 1rpx h LYS 224 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 1rpx h LYS 224 CO 0.03 0.08 0.00 0.25 -2.00 0.00 0.00 179.45 177.81 1rpx n THR 225 N -3.19 2.01 -1.93 0.07 -2.24 -0.57 -4.93 114.28 103.50 1rpx n THR 225 Ca 0.01 -1.47 -0.42 0.00 -2.27 0.00 0.00 64.05 59.89 1rpx n THR 225 Cb 0.37 -0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.55 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 -1.33 6.59 0.11 3.42 0.15 -1.13 -5.00 113.70 116.52 1rpx s SER 226 Ca 0.43 2.53 0.06 0.00 0.70 0.00 0.00 55.95 59.67 1rpx s SER 226 Cb 0.31 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 62.01 1rpx s SER 226 CO 0.15 -0.87 -0.14 -0.54 1.20 0.00 0.00 173.24 173.05 1rpx s LYS 227 N 2.14 0.98 -0.01 5.44 1.02 -1.26 -4.23 119.74 123.81 1rpx s LYS 227 Ca 0.73 -1.19 -0.36 0.00 0.02 0.00 0.00 55.97 55.17 1rpx s LYS 227 Cb -0.41 -0.87 -0.15 0.00 -0.52 0.00 0.00 37.83 35.88 1rpx s LYS 227 CO 0.32 0.17 1.62 -2.13 -0.92 0.00 0.00 175.35 174.41 1rpx n ARG 228 N 0.65 1.66 0.23 1.68 0.63 -1.26 -4.83 116.66 115.43 1rpx n ARG 228 Ca -0.16 0.61 0.15 0.00 -0.92 0.00 0.00 57.85 57.52 1rpx n ARG 228 Cb 0.57 -2.34 0.80 0.00 0.45 0.00 0.00 32.46 31.93 1rpx n ARG 228 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 1rpx h PRO 229 N 6.59 0.00 0.00 -0.14 0.13 -1.99 -3.54 132.00 133.05 1rpx h PRO 229 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1rpx h PRO 229 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1rpx h PRO 229 CO 0.89 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 176.75