#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 0.26 0.00 1.43 3.08 -1.96 -2.03 114.38 115.16 1rpx h ARG 2 Ca 0.00 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.95 1rpx h ARG 2 Cb 0.00 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1rpx h ARG 2 CO 0.00 0.17 -0.39 -0.39 -1.07 0.00 0.00 179.97 178.29 1rpx h VAL 3 N 0.27 0.82 0.00 2.04 -1.51 -1.96 -3.19 116.25 112.72 1rpx h VAL 3 Ca 0.41 -1.66 -0.00 0.00 -1.23 0.00 0.00 66.70 64.23 1rpx h VAL 3 Cb 1.21 2.04 -0.00 0.00 -2.13 0.00 0.00 31.29 32.41 1rpx h VAL 3 CO -0.11 0.38 -0.00 0.44 -1.23 0.00 0.00 177.57 177.05 1rpx h ASP 4 N 0.00 0.00 0.34 4.19 3.32 -1.83 -1.20 116.42 121.24 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 1.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1rpx h ASP 4 CO 0.05 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.86 1rpx n LYS 5 N -3.38 0.44 -4.03 3.56 5.02 -1.21 -4.73 118.16 113.83 1rpx n LYS 5 Ca -0.03 0.05 -0.31 0.00 -2.02 0.00 0.00 58.31 55.99 1rpx n LYS 5 Cb 0.08 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.53 1rpx n LYS 5 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1rpx s PHE 6 N -2.43 3.30 0.00 2.13 0.40 -0.46 -5.11 117.98 115.82 1rpx s PHE 6 Ca 0.26 0.16 0.03 0.00 -0.60 0.00 0.00 56.93 56.78 1rpx s PHE 6 Cb 0.16 -1.69 -0.03 0.00 0.51 0.00 0.00 43.02 41.97 1rpx s PHE 6 CO 0.34 0.55 -0.05 -1.54 0.70 0.00 0.00 175.22 175.23 1rpx s SER 7 N -2.24 4.78 0.00 1.36 1.04 -1.26 -4.99 113.70 112.39 1rpx s SER 7 Ca 0.29 -0.10 0.15 0.00 0.48 0.00 0.00 55.95 56.77 1rpx s SER 7 Cb -0.12 -1.16 0.84 0.00 0.10 0.00 0.00 66.02 65.68 1rpx s SER 7 CO 0.21 0.28 1.38 0.29 0.98 0.00 0.00 173.24 176.38 1rpx n LYS 8 N 1.50 0.35 0.05 4.02 5.02 -1.26 -2.47 118.16 125.38 1rpx n LYS 8 Ca -0.15 0.07 0.12 0.00 -2.02 0.00 0.00 58.31 56.33 1rpx n LYS 8 Cb 0.53 -1.50 0.20 0.00 -0.02 0.00 0.00 35.03 34.23 1rpx n LYS 8 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1rpx n SER 9 N -1.14 0.67 -4.93 4.39 7.64 -1.26 -4.88 113.62 114.11 1rpx n SER 9 Ca 0.09 0.11 -0.20 0.00 1.01 0.00 0.00 58.87 59.88 1rpx n SER 9 Cb 0.09 0.11 0.06 0.00 -1.01 0.00 0.00 64.21 63.46 1rpx n SER 9 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1rpx s ASP 10 N -4.09 5.00 -0.40 6.43 1.01 -1.03 -5.08 116.67 118.52 1rpx s ASP 10 Ca 0.07 -0.60 -0.05 0.00 0.71 0.00 0.00 52.55 52.68 1rpx s ASP 10 Cb 0.14 -0.01 0.09 0.00 1.01 0.00 0.00 42.92 44.16 1rpx s ASP 10 CO 0.71 -1.38 0.19 -0.63 0.21 0.00 0.00 175.17 174.28 1rpx s ILE 11 N -2.75 3.55 0.16 0.77 1.01 -1.26 -4.82 121.20 117.86 1rpx s ILE 11 Ca 0.62 -1.75 -0.30 0.00 0.00 0.00 0.00 60.65 59.22 1rpx s ILE 11 Cb -0.07 -3.29 -0.07 0.00 0.01 0.00 0.00 42.46 39.04 1rpx s ILE 11 CO 0.39 -0.55 1.09 -0.63 0.00 0.00 0.00 174.94 175.25 1rpx s ILE 12 N 1.25 3.95 -0.20 2.92 1.09 -0.05 -4.88 121.20 125.28 1rpx s ILE 12 Ca 0.04 1.65 -0.02 0.00 -1.10 0.00 0.00 60.65 61.22 1rpx s ILE 12 Cb -0.23 -4.05 0.00 0.00 -1.06 0.00 0.00 42.46 37.12 1rpx s ILE 12 CO -0.02 0.27 -0.10 -0.69 -0.10 0.00 0.00 174.94 174.29 1rpx s VAL 13 N -0.10 2.86 -0.64 2.92 1.01 -1.26 -0.38 120.40 124.80 1rpx s VAL 13 Ca 0.50 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.84 1rpx s VAL 13 Cb -0.29 -2.27 0.16 0.00 0.00 0.00 0.00 36.38 33.98 1rpx s VAL 13 CO 0.34 0.47 0.42 -0.55 0.00 0.00 0.00 175.10 175.78 1rpx s SER 14 N 1.40 4.76 0.36 3.32 0.15 0.66 -1.26 113.70 123.09 1rpx s SER 14 Ca 0.05 -3.43 -0.28 0.00 0.70 0.00 0.00 55.95 53.00 1rpx s SER 14 Cb -0.14 -1.68 -0.10 0.00 -1.71 0.00 0.00 66.02 62.39 1rpx s SER 14 CO -0.07 -0.17 1.36 -2.16 1.20 0.00 0.00 173.24 173.39 1rpx s PRO 15 N -0.87 4.19 -0.35 5.44 0.04 -1.22 -3.53 135.00 138.70 1rpx s PRO 15 Ca 0.21 2.31 -0.27 0.00 0.04 0.00 0.00 61.00 63.29 1rpx s PRO 15 Cb -0.15 -2.96 0.01 0.00 0.04 0.00 0.00 34.50 31.44 1rpx s PRO 15 CO -0.08 -0.37 0.96 0.45 0.04 0.00 0.00 177.00 178.00 1rpx s SER 16 N -0.45 6.75 0.00 6.66 0.15 0.85 -0.96 113.70 126.70 1rpx s SER 16 Ca 0.52 0.74 0.10 0.00 0.70 0.00 0.00 55.95 58.01 1rpx s SER 16 Cb -0.41 -2.48 0.45 0.00 -1.71 0.00 0.00 66.02 61.86 1rpx s SER 16 CO 0.55 -0.84 1.26 2.30 1.20 0.00 0.00 173.24 177.71 1rpx n ILE 17 N 5.90 1.08 0.26 6.45 -5.35 -0.82 -2.68 119.36 124.21 1rpx n ILE 17 Ca 0.08 0.27 0.10 0.00 -0.27 0.00 0.00 62.75 62.94 1rpx n ILE 17 Cb 0.48 -1.11 0.71 0.00 -1.74 0.00 0.00 39.64 37.99 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 -0.31 7.28 3.38 -1.92 -0.48 115.31 123.25 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 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1rpx h LEU 18 CO 0.00 0.06 -0.18 -1.20 0.09 0.00 0.00 178.44 177.21 1rpx n SER 19 N -4.14 0.66 -4.79 -0.43 7.64 -1.09 -4.91 113.62 106.56 1rpx n SER 19 Ca -0.03 -0.64 -0.29 0.00 1.01 0.00 0.00 58.87 58.92 1rpx n SER 19 Cb 0.14 0.00 0.13 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 -2.52 1.94 -0.41 -0.43 0.00 -0.19 -4.85 121.76 115.29 1rpx s ALA 20 Ca 0.26 -0.56 -0.21 0.00 0.00 0.00 0.00 51.96 51.45 1rpx s ALA 20 Cb 0.20 -3.01 0.02 0.00 0.00 0.00 0.00 23.12 20.32 1rpx s ALA 20 CO 0.50 -2.18 0.66 1.21 0.00 0.00 0.00 175.76 175.96 1rpx s ASN 21 N -4.14 6.37 0.37 0.00 3.84 -1.26 -4.96 114.94 115.16 1rpx s ASN 21 Ca 0.64 -0.13 0.27 0.00 0.21 0.00 0.00 52.86 53.85 1rpx s ASN 21 Cb -0.14 -2.33 1.25 0.00 -0.55 0.00 0.00 41.25 39.48 1rpx s ASN 21 CO 0.52 -0.74 1.82 -0.26 -2.79 0.00 0.00 177.10 175.66 1rpx h PHE 22 N 8.75 0.00 0.00 0.43 -1.00 -1.95 -2.73 116.94 120.44 1rpx h PHE 22 Ca -0.26 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.50 1rpx h PHE 22 Cb 1.10 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.66 1rpx h PHE 22 CO 0.75 0.00 -0.14 0.66 -1.61 0.00 0.00 178.31 177.97 1rpx h SER 23 N 0.00 0.00 -1.64 2.17 4.64 -2.04 -3.33 113.55 113.36 1rpx h SER 23 Ca 0.00 0.00 -0.45 0.00 -0.47 0.00 0.00 61.79 60.87 1rpx h SER 23 Cb 0.27 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 61.96 1rpx h SER 23 CO 0.00 0.14 -1.16 2.29 -0.87 0.00 0.00 176.83 177.23 1rpx n LYS 24 N -3.18 1.22 -0.22 4.77 2.85 -1.04 -4.96 118.16 117.59 1rpx n LYS 24 Ca 0.02 -3.44 -0.06 0.00 -1.05 0.00 0.00 58.31 53.78 1rpx n LYS 24 Cb 0.49 -1.58 0.04 0.00 -0.65 0.00 0.00 35.03 33.32 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 0.73 -0.27 -5.58 5.85 -1.65 -1.35 115.31 116.03 1rpx h LEU 25 Ca 0.04 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 1rpx h LEU 25 Cb 1.02 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 1rpx h LEU 25 CO 0.53 0.56 0.16 1.23 -0.34 0.00 0.00 178.44 180.58 1rpx h GLY 26 N 0.83 0.40 0.98 3.75 0.00 -1.93 -0.24 103.07 106.86 1rpx h GLY 26 Ca 0.22 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1rpx h GLY 26 CO -0.04 0.17 0.26 -2.09 0.00 0.00 0.00 176.54 174.84 1rpx h GLU 27 N 0.34 0.63 -0.70 4.80 4.81 -1.95 -0.31 114.58 122.19 1rpx h GLU 27 Ca 0.10 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1rpx h GLU 27 Cb 0.04 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 1rpx h GLU 27 CO -0.02 0.48 0.46 0.37 -0.73 0.00 0.00 179.01 179.57 1rpx h GLN 28 N 0.60 0.87 0.01 1.92 5.75 -0.96 -0.98 115.11 122.34 1rpx h GLN 28 Ca 0.16 -0.05 -0.17 0.00 -0.15 0.00 0.00 58.65 58.44 1rpx h GLN 28 Cb 0.02 -0.20 0.01 0.00 1.07 0.00 0.00 27.48 28.39 1rpx h GLN 28 CO -0.03 0.58 -0.69 0.28 -2.65 0.00 0.00 178.83 176.32 1rpx h VAL 29 N 0.90 1.41 -0.25 2.39 2.07 -0.53 -2.95 116.25 119.29 1rpx h VAL 29 Ca 0.27 -2.15 -0.00 0.00 0.82 0.00 0.00 66.70 65.64 1rpx h VAL 29 Cb -0.02 2.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1rpx h VAL 29 CO -0.07 0.63 0.15 0.11 0.02 0.00 0.00 177.57 178.41 1rpx h LYS 30 N -0.06 0.34 0.31 1.57 1.57 -0.83 -1.47 116.57 118.00 1rpx h LYS 30 Ca -0.09 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1rpx h LYS 30 Cb 1.40 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1rpx h LYS 30 CO 0.13 0.24 -0.15 0.00 -0.57 0.00 0.00 179.45 179.10 1rpx h ALA 31 N 1.82 -0.41 0.00 3.86 0.00 -1.14 -1.80 119.26 121.59 1rpx h ALA 31 Ca 0.09 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1rpx h ALA 31 Cb -0.02 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1rpx h ALA 31 CO -0.02 -0.63 -0.17 -0.84 0.00 0.00 0.00 179.25 177.59 1rpx h ILE 32 N -0.61 0.52 -0.31 0.00 3.07 -1.33 -0.75 117.51 118.09 1rpx h ILE 32 Ca -0.04 -0.87 -0.12 0.00 1.55 0.00 0.00 64.86 65.39 1rpx h ILE 32 Cb 0.44 1.59 -0.01 0.00 -0.27 0.00 0.00 36.82 38.57 1rpx h ILE 32 CO 0.07 0.17 -0.29 -0.08 -1.05 0.00 0.00 178.15 176.97 1rpx h GLU 33 N 0.00 0.65 -0.23 0.16 4.81 -1.05 -2.51 114.58 116.41 1rpx h GLU 33 Ca -0.00 -0.28 -0.10 0.00 -0.13 0.00 0.00 59.36 58.85 1rpx h GLU 33 Cb 0.58 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 1rpx h GLU 33 CO 0.02 0.86 -0.24 0.37 -0.73 0.00 0.00 179.01 179.30 1rpx h GLN 34 N 0.56 0.57 0.00 1.92 5.75 -0.47 -3.00 115.11 120.44 1rpx h GLN 34 Ca 0.07 -0.30 0.00 0.00 -0.15 0.00 0.00 58.65 58.27 1rpx h GLN 34 Cb 0.78 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.34 1rpx h GLN 34 CO 0.06 0.90 0.00 0.00 -2.65 0.00 0.00 178.83 177.14 1rpx n ALA 35 N -2.47 1.33 0.00 3.38 0.00 -0.37 -4.82 120.51 117.56 1rpx n ALA 35 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1rpx n ALA 35 Cb 0.43 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.84 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 -1.05 0.73 3.70 0.00 0.00 -1.13 -4.09 105.19 103.35 1rpx n GLY 36 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 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 -3.25 1.97 -4.35 0.00 8.00 -0.39 -4.85 116.55 113.69 1rpx n ASP 38 Ca 0.14 0.13 -0.18 0.00 0.71 0.00 0.00 54.79 55.59 1rpx n ASP 38 Cb 0.50 -0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 40.85 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 -2.51 1.64 -0.21 1.24 0.51 -1.06 -4.21 118.94 114.35 1rpx s TRP 39 Ca -0.36 -0.94 -0.01 0.00 -2.12 0.00 0.00 56.10 52.66 1rpx s TRP 39 Cb 0.12 -0.97 0.01 0.00 -0.81 0.00 0.00 33.47 31.82 1rpx s TRP 39 CO 0.55 -0.05 -0.12 0.42 -0.51 0.00 0.00 176.95 177.24 1rpx s ILE 40 N -3.42 2.65 -0.21 2.03 1.01 -0.48 -3.39 121.20 119.39 1rpx s ILE 40 Ca 0.31 -0.82 -0.19 0.00 0.00 0.00 0.00 60.65 59.95 1rpx s ILE 40 Cb 0.06 -2.20 -0.03 0.00 0.01 0.00 0.00 42.46 40.30 1rpx s ILE 40 CO 0.10 0.43 0.53 -2.28 0.00 0.00 0.00 174.94 173.72 1rpx s HIS 41 N 1.36 3.35 -0.30 3.97 2.46 -0.14 0.17 115.29 126.16 1rpx s HIS 41 Ca 0.04 0.76 -0.03 0.00 0.47 0.00 0.00 55.06 56.31 1rpx s HIS 41 Cb -0.14 -2.69 0.04 0.00 -0.13 0.00 0.00 32.58 29.66 1rpx s HIS 41 CO -0.08 -0.14 0.01 0.08 -2.47 0.00 0.00 174.74 172.14 1rpx s VAL 42 N 1.80 3.15 -0.52 0.89 1.01 0.12 -1.95 120.40 124.89 1rpx s VAL 42 Ca 0.24 -1.26 -0.22 0.00 0.00 0.00 0.00 61.98 60.74 1rpx s VAL 42 Cb -0.15 -2.77 0.05 0.00 0.00 0.00 0.00 36.38 33.51 1rpx s VAL 42 CO 0.09 -0.07 0.80 -1.81 0.00 0.00 0.00 175.10 174.12 1rpx s ASP 43 N 1.30 6.30 -0.38 3.32 1.01 -1.26 -0.90 116.67 126.06 1rpx s ASP 43 Ca -0.04 -0.55 -0.16 0.00 0.71 0.00 0.00 52.55 52.52 1rpx s ASP 43 Cb -0.19 -2.37 0.00 0.00 1.01 0.00 0.00 42.92 41.37 1rpx s ASP 43 CO -0.01 -1.07 0.39 -0.69 0.21 0.00 0.00 175.17 174.01 1rpx s VAL 44 N 3.37 5.14 -0.04 -1.27 1.01 -0.39 -4.31 120.40 123.91 1rpx s VAL 44 Ca 0.24 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.15 1rpx s VAL 44 Cb -0.15 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1rpx s VAL 44 CO 0.17 -0.24 -0.25 -0.04 0.00 0.00 0.00 175.10 174.74 1rpx s MET 45 N 2.05 2.34 0.00 2.72 -1.94 -1.26 0.04 119.30 123.25 1rpx s MET 45 Ca 0.12 -0.91 0.15 0.00 -1.71 0.00 0.00 55.69 53.33 1rpx s MET 45 Cb -0.17 -2.11 0.23 0.00 2.01 0.00 0.00 34.83 34.79 1rpx s MET 45 CO 0.12 0.47 1.11 -0.40 -0.01 0.00 0.00 175.02 176.32 1rpx n ASP 46 N 2.69 2.62 0.00 3.03 5.68 -1.20 -2.09 116.55 127.28 1rpx n ASP 46 Ca -0.17 -1.76 0.00 0.00 -0.50 0.00 0.00 54.79 52.36 1rpx n ASP 46 Cb 0.51 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 1rpx n ASP 46 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rpx n GLY 47 N 0.86 1.98 0.28 6.12 0.00 0.17 -4.80 105.19 109.80 1rpx n GLY 47 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.07 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 0.40 -0.08 1.61 5.12 -1.26 -4.55 116.66 115.90 1rpx n ARG 48 Ca 0.00 0.16 -0.03 0.00 -1.93 0.00 0.00 57.85 56.05 1rpx n ARG 48 Cb 0.00 -1.19 0.20 0.00 -1.16 0.00 0.00 32.46 30.31 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 -0.75 0.75 -3.95 -1.55 3.57 -1.87 -3.43 116.94 109.71 1rpx h PHE 49 Ca 0.00 -0.09 -0.36 0.00 3.53 0.00 0.00 57.97 61.05 1rpx h PHE 49 Cb 0.75 -0.21 -0.21 0.00 2.79 0.00 0.00 35.95 39.06 1rpx h PHE 49 CO -0.32 0.70 -0.76 0.14 -2.23 0.00 0.00 178.31 175.84 1rpx s VAL 50 N -5.00 0.89 -0.27 1.41 -7.23 -1.26 -5.01 120.40 103.92 1rpx s VAL 50 Ca -0.09 -1.23 -0.05 0.00 -1.81 0.00 0.00 61.98 58.80 1rpx s VAL 50 Cb 0.15 -0.90 -0.16 0.00 0.56 0.00 0.00 36.38 36.03 1rpx s VAL 50 CO 0.80 -0.30 2.59 -0.81 -0.31 0.00 0.00 175.10 177.07 1rpx n PRO 51 N 1.32 1.67 -3.58 4.82 -0.04 -1.26 -2.68 135.00 135.24 1rpx n PRO 51 Ca -0.22 -0.93 -0.11 0.00 -0.04 0.00 0.00 63.50 62.21 1rpx n PRO 51 Cb 0.54 -2.02 -0.05 0.00 -0.04 0.00 0.00 33.50 31.93 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 2.49 -0.40 -0.07 3.54 2.47 -1.26 -4.95 114.94 116.76 1rpx s ASN 52 Ca 0.47 0.48 0.04 0.00 0.42 0.00 0.00 52.86 54.27 1rpx s ASN 52 Cb 0.20 0.39 -0.02 0.00 -1.45 0.00 0.00 41.25 40.38 1rpx s ASN 52 CO -0.01 -0.33 -0.20 -0.63 -3.72 0.00 0.00 177.10 172.21 1rpx s ILE 53 N -0.93 2.53 0.00 -5.21 1.01 -1.26 -0.66 121.20 116.69 1rpx s ILE 53 Ca -0.02 -0.89 0.00 0.00 0.00 0.00 0.00 60.65 59.74 1rpx s ILE 53 Cb -0.01 -1.97 0.00 0.00 0.01 0.00 0.00 42.46 40.49 1rpx s ILE 53 CO 0.01 0.57 0.00 0.35 0.00 0.00 0.00 174.94 175.87 1rpx n THR 54 N 2.88 0.00 -3.90 2.92 -2.24 -0.89 -4.95 114.28 108.11 1rpx n THR 54 Ca -0.17 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.50 1rpx n THR 54 Cb 0.52 0.00 -0.10 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 0.06 0.10 0.00 2.28 -4.36 -1.26 -4.97 121.20 113.06 1rpx s ILE 55 Ca 0.00 -0.82 0.00 0.00 -0.26 0.00 0.00 60.65 59.57 1rpx s ILE 55 Cb 0.00 -0.52 0.00 0.00 1.25 0.00 0.00 42.46 43.19 1rpx s ILE 55 CO 0.00 -0.45 0.00 0.61 0.24 0.00 0.00 174.94 175.34 1rpx n GLY 56 N 1.31 4.15 0.40 6.27 0.00 -1.26 -4.53 105.19 111.53 1rpx n GLY 56 Ca -0.22 -2.14 0.23 0.00 0.00 0.00 0.00 46.02 43.89 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 0.38 -0.65 1.61 0.11 -1.97 -2.19 132.00 129.29 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 -0.04 0.00 0.11 0.00 0.00 31.00 30.99 1rpx h PRO 57 CO 0.00 0.25 0.43 1.37 -0.21 0.00 0.00 178.00 179.85 1rpx h LEU 58 N 0.40 0.69 -0.38 2.35 -0.00 -1.95 0.15 115.31 116.57 1rpx h LEU 58 Ca 0.61 -0.01 -0.18 0.00 -0.00 0.00 0.00 57.88 58.30 1rpx h LEU 58 Cb 1.54 -0.16 -0.00 0.00 -0.00 0.00 0.00 40.66 42.04 1rpx h LEU 58 CO -0.33 0.48 -0.60 0.58 -0.00 0.00 0.00 178.44 178.58 1rpx h VAL 59 N 0.80 1.30 -0.57 0.15 2.07 -1.78 -2.55 116.25 115.68 1rpx h VAL 59 Ca 0.26 -1.83 -0.07 0.00 0.82 0.00 0.00 66.70 65.87 1rpx h VAL 59 Cb 0.03 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1rpx h VAL 59 CO -0.07 0.58 0.07 0.58 0.02 0.00 0.00 177.57 178.75 1rpx h VAL 60 N 0.52 1.26 -0.13 2.57 2.07 -1.33 -2.66 116.25 118.55 1rpx h VAL 60 Ca -0.00 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 1rpx h VAL 60 Cb 1.18 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1rpx h VAL 60 CO 0.12 0.37 0.05 -0.78 0.02 0.00 0.00 177.57 177.35 1rpx h ASP 61 N 0.85 0.15 1.00 0.57 3.58 -0.60 -1.72 116.42 120.24 1rpx h ASP 61 Ca 0.17 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.61 1rpx h ASP 61 Cb 0.45 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.46 1rpx h ASP 61 CO 0.02 0.14 -0.46 -1.54 -2.88 0.00 0.00 179.24 174.51 1rpx n SER 62 N -4.48 0.71 -0.02 2.28 3.41 -0.97 -3.78 113.62 110.77 1rpx n SER 62 Ca -0.01 0.22 -0.09 0.00 -0.26 0.00 0.00 58.87 58.73 1rpx n SER 62 Cb 0.11 -0.07 -0.14 0.00 -0.26 0.00 0.00 64.21 63.84 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 -2.12 0.89 -0.28 1.04 4.77 -0.72 -4.39 117.00 116.19 1rpx n LEU 63 Ca 0.04 0.40 0.09 0.00 -0.03 0.00 0.00 56.01 56.51 1rpx n LEU 63 Cb 0.43 0.15 0.24 0.00 -2.33 0.00 0.00 43.42 41.91 1rpx n LEU 63 CO 0.35 0.40 1.00 -0.09 -1.33 0.00 0.00 177.39 177.72 1rpx h ARG 64 N 0.00 0.35 0.00 3.23 9.65 -1.45 -1.01 114.38 125.16 1rpx h ARG 64 Ca -0.29 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.56 1rpx h ARG 64 Cb 2.02 -0.08 0.00 0.00 -1.39 0.00 0.00 29.97 30.52 1rpx h ARG 64 CO 0.08 0.23 0.00 -1.00 2.80 0.00 0.00 179.97 182.08 1rpx h PRO 65 N 0.37 0.00 -0.05 0.20 0.13 -1.77 -3.31 132.00 127.57 1rpx h PRO 65 Ca 0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.61 1rpx h PRO 65 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1rpx h PRO 65 CO -0.50 0.00 0.00 0.44 -0.23 0.00 0.00 178.00 177.71 1rpx n ILE 66 N -2.82 0.05 -3.59 -3.56 -5.35 -0.39 -4.92 119.36 98.78 1rpx n ILE 66 Ca 0.04 -0.30 -0.12 0.00 -0.27 0.00 0.00 62.75 62.10 1rpx n ILE 66 Cb 0.44 0.56 -0.05 0.00 -1.74 0.00 0.00 39.64 38.86 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 -1.95 0.04 -0.93 7.28 -1.32 -1.20 -4.87 115.64 112.68 1rpx s THR 67 Ca 0.36 -0.36 0.08 0.00 -1.21 0.00 0.00 61.69 60.56 1rpx s THR 67 Cb 0.20 -1.03 0.06 0.00 -1.51 0.00 0.00 72.50 70.22 1rpx s THR 67 CO 0.32 -0.20 0.75 -0.67 -2.21 0.00 0.00 174.62 172.61 1rpx n ASP 68 N 0.14 1.65 -4.76 8.08 -0.08 -1.26 -4.83 116.55 115.49 1rpx n ASP 68 Ca -0.17 -1.33 -0.34 0.00 -1.51 0.00 0.00 54.79 51.44 1rpx n ASP 68 Cb 0.62 -0.00 0.05 0.00 2.34 0.00 0.00 41.12 44.12 1rpx n ASP 68 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1rpx s LEU 69 N -0.64 3.46 0.34 -2.67 1.43 -1.26 -4.95 118.68 114.39 1rpx s LEU 69 Ca 0.09 2.14 -0.28 0.00 -1.03 0.00 0.00 54.13 55.05 1rpx s LEU 69 Cb 0.06 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.62 1rpx s LEU 69 CO 0.09 -1.70 1.19 -2.16 0.23 0.00 0.00 176.35 174.01 1rpx s PRO 70 N -3.85 4.33 -0.42 1.29 0.04 -1.26 -4.85 135.00 130.27 1rpx s PRO 70 Ca 0.70 1.95 -0.20 0.00 0.04 0.00 0.00 61.00 63.50 1rpx s PRO 70 Cb -0.24 -2.96 0.02 0.00 0.04 0.00 0.00 34.50 31.36 1rpx s PRO 70 CO 0.39 -0.12 0.61 -0.51 0.04 0.00 0.00 177.00 177.41 1rpx s LEU 71 N -1.95 4.52 -0.59 -3.56 1.43 -1.26 -1.38 118.68 115.90 1rpx s LEU 71 Ca 0.51 -0.33 -0.18 0.00 -1.03 0.00 0.00 54.13 53.09 1rpx s LEU 71 Cb -0.34 -2.68 0.11 0.00 0.03 0.00 0.00 46.19 43.31 1rpx s LEU 71 CO 0.44 -0.72 0.67 -0.62 0.23 0.00 0.00 176.35 176.35 1rpx s ASP 72 N 1.95 6.19 -0.27 2.29 2.15 0.13 -1.13 116.67 127.97 1rpx s ASP 72 Ca 0.21 -1.51 -0.11 0.00 0.43 0.00 0.00 52.55 51.57 1rpx s ASP 72 Cb -0.15 -2.28 -0.05 0.00 -0.30 0.00 0.00 42.92 40.14 1rpx s ASP 72 CO 0.18 -1.07 0.17 -0.69 -0.17 0.00 0.00 175.17 173.59 1rpx s VAL 73 N 2.47 5.21 -0.31 1.11 1.01 0.15 0.13 120.40 130.16 1rpx s VAL 73 Ca 0.10 0.14 -0.08 0.00 0.00 0.00 0.00 61.98 62.13 1rpx s VAL 73 Cb -0.25 -3.47 0.01 0.00 0.00 0.00 0.00 36.38 32.66 1rpx s VAL 73 CO 0.05 0.27 0.12 -2.28 0.00 0.00 0.00 175.10 173.26 1rpx s HIS 74 N 1.66 3.18 -0.93 5.22 2.46 -0.08 -0.14 115.29 126.66 1rpx s HIS 74 Ca 0.07 -0.89 -0.19 0.00 0.47 0.00 0.00 55.06 54.52 1rpx s HIS 74 Cb -0.16 -2.31 0.13 0.00 -0.13 0.00 0.00 32.58 30.11 1rpx s HIS 74 CO 0.10 -0.56 1.14 -0.51 -2.47 0.00 0.00 174.74 172.43 1rpx s LEU 75 N 1.53 4.99 -1.26 8.88 1.02 0.16 -1.26 118.68 132.73 1rpx s LEU 75 Ca 0.03 -2.00 -0.07 0.00 0.02 0.00 0.00 54.13 52.10 1rpx s LEU 75 Cb -0.18 -2.41 0.17 0.00 0.02 0.00 0.00 46.19 43.80 1rpx s LEU 75 CO 0.04 -1.09 2.03 0.23 0.02 0.00 0.00 176.35 177.58 1rpx n MET 76 N 6.65 4.16 -4.14 1.70 2.81 0.11 -4.26 117.12 124.15 1rpx n MET 76 Ca 0.24 -3.66 -0.09 0.00 -1.81 0.00 0.00 57.70 52.38 1rpx n MET 76 Cb 0.49 -2.75 -0.10 0.00 -0.71 0.00 0.00 33.22 30.15 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 -0.73 0.34 0.35 2.02 -4.36 -1.26 -3.21 121.20 114.36 1rpx s ILE 77 Ca 0.44 -1.88 -0.13 0.00 -0.26 0.00 0.00 60.65 58.82 1rpx s ILE 77 Cb 0.13 -1.76 -0.08 0.00 1.25 0.00 0.00 42.46 42.00 1rpx s ILE 77 CO -0.03 -0.77 0.73 0.68 0.24 0.00 0.00 174.94 175.79 1rpx s VAL 78 N -3.86 4.75 -1.25 8.37 -7.23 -1.26 -4.14 120.40 115.78 1rpx s VAL 78 Ca 0.14 0.76 -0.13 0.00 -1.81 0.00 0.00 61.98 60.95 1rpx s VAL 78 Cb 0.07 -3.66 -0.00 0.00 0.56 0.00 0.00 36.38 33.35 1rpx s VAL 78 CO -0.04 -0.31 0.64 -0.62 -0.31 0.00 0.00 175.10 174.46 1rpx n GLU 79 N -0.72 -2.11 0.20 4.82 1.02 -0.21 -4.86 120.64 118.78 1rpx n GLU 79 Ca 0.03 0.42 0.15 0.00 -0.02 0.00 0.00 57.16 57.74 1rpx n GLU 79 Cb 0.53 -4.23 0.78 0.00 -0.02 0.00 0.00 31.44 28.51 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 -1.92 0.00 0.00 3.49 0.13 -1.73 -2.57 132.00 129.40 1rpx h PRO 80 Ca -0.65 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.48 1rpx h PRO 80 Cb 1.37 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.50 1rpx h PRO 80 CO 0.54 0.00 -0.01 0.38 -0.23 0.00 0.00 178.00 178.68 1rpx h ASP 81 N 0.00 0.00 -0.20 1.44 2.03 -1.93 -0.90 116.42 116.85 1rpx h ASP 81 Ca 0.08 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.24 1rpx h ASP 81 Cb 0.37 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.86 1rpx h ASP 81 CO -0.00 0.01 -0.36 1.56 -1.03 0.00 0.00 179.24 179.41 1rpx h GLN 82 N 0.00 0.73 0.00 4.15 1.08 -1.82 -3.25 115.11 115.99 1rpx h GLN 82 Ca -0.00 -0.36 0.00 0.00 -1.45 0.00 0.00 58.65 56.84 1rpx h GLN 82 Cb 0.32 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.75 1rpx h GLN 82 CO 0.00 0.98 -1.01 0.54 -0.95 0.00 0.00 178.83 178.38 1rpx n ARG 83 N -4.05 0.34 -0.02 1.46 3.00 -0.89 -4.60 116.66 111.89 1rpx n ARG 83 Ca -0.01 0.01 -0.10 0.00 -0.01 0.00 0.00 57.85 57.74 1rpx n ARG 83 Cb 0.51 -1.63 -0.04 0.00 0.00 0.00 0.00 32.46 31.31 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 0.27 -0.13 1.55 2.07 -1.22 -2.08 116.25 116.70 1rpx h VAL 84 Ca 0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1rpx h VAL 84 Cb 0.77 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 1rpx h VAL 84 CO 0.00 0.00 0.10 1.55 0.02 0.00 0.00 177.57 179.24 1rpx h PRO 85 N -0.37 0.00 -0.54 1.57 0.13 -1.81 -1.67 132.00 129.30 1rpx h PRO 85 Ca 0.11 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.15 1rpx h PRO 85 Cb 0.55 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.66 1rpx h PRO 85 CO -0.39 0.00 -0.02 -0.44 -0.23 0.00 0.00 178.00 176.92 1rpx h ASP 86 N 0.00 0.93 0.58 1.44 3.32 -1.68 -0.89 116.42 120.13 1rpx h ASP 86 Ca 0.06 -0.26 -0.13 0.00 0.02 0.00 0.00 57.03 56.72 1rpx h ASP 86 Cb 0.27 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 1rpx h ASP 86 CO -0.00 1.00 -0.61 -0.26 -1.72 0.00 0.00 179.24 177.64 1rpx h PHE 87 N 0.87 0.04 0.03 4.55 0.04 -1.14 -1.67 116.94 119.65 1rpx h PHE 87 Ca 0.16 -0.01 -0.27 0.00 2.80 0.00 0.00 57.97 60.64 1rpx h PHE 87 Cb 0.54 -0.01 0.02 0.00 2.20 0.00 0.00 35.95 38.71 1rpx h PHE 87 CO 0.03 0.63 -1.09 0.82 -0.60 0.00 0.00 178.31 178.11 1rpx h ILE 88 N 0.02 1.29 -0.16 -0.55 2.04 -1.14 -1.68 117.51 117.33 1rpx h ILE 88 Ca -0.01 -2.31 -0.08 0.00 1.00 0.00 0.00 64.86 63.45 1rpx h ILE 88 Cb 1.09 2.46 -0.01 0.00 -0.74 0.00 0.00 36.82 39.61 1rpx h ILE 88 CO 0.08 0.71 -0.28 0.11 0.00 0.00 0.00 178.15 178.78 1rpx h LYS 89 N 0.36 0.30 0.00 2.37 1.57 -1.15 -0.78 116.57 119.23 1rpx h LYS 89 Ca -0.14 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1rpx h LYS 89 Cb 1.74 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 34.03 1rpx h LYS 89 CO 0.21 0.56 0.00 0.00 -0.57 0.00 0.00 179.45 179.65 1rpx n ALA 90 N -2.48 1.76 0.00 3.86 0.00 -0.63 -4.87 120.51 118.15 1rpx n ALA 90 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1rpx n ALA 90 Cb 0.39 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.58 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 0.18 1.53 3.75 0.00 0.00 -0.30 -3.77 105.19 106.57 1rpx n GLY 91 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 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 3.38 -0.16 4.61 0.00 -0.65 -4.66 121.76 122.29 1rpx s ALA 92 Ca 0.00 0.81 0.15 0.00 0.00 0.00 0.00 51.96 52.91 1rpx s ALA 92 Cb 0.00 -3.30 -0.24 0.00 0.00 0.00 0.00 23.12 19.58 1rpx s ALA 92 CO 0.00 -0.07 0.23 -0.25 0.00 0.00 0.00 175.76 175.68 1rpx n ASP 93 N 1.47 0.43 -3.94 0.00 8.00 -0.28 -4.76 116.55 117.48 1rpx n ASP 93 Ca -0.01 0.12 -0.25 0.00 0.71 0.00 0.00 54.79 55.36 1rpx n ASP 93 Cb 0.46 0.55 -0.17 0.00 -0.02 0.00 0.00 41.12 41.94 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 -2.53 0.97 -0.25 0.53 1.01 -0.84 -0.75 121.20 119.34 1rpx s ILE 94 Ca -0.10 -0.31 0.01 0.00 0.00 0.00 0.00 60.65 60.25 1rpx s ILE 94 Cb 0.07 -0.95 0.05 0.00 0.01 0.00 0.00 42.46 41.63 1rpx s ILE 94 CO 0.81 0.34 -0.10 -0.69 0.00 0.00 0.00 174.94 175.30 1rpx s VAL 95 N 1.26 2.36 -0.19 2.92 1.01 -0.47 0.29 120.40 127.58 1rpx s VAL 95 Ca -0.04 -1.42 -0.09 0.00 0.00 0.00 0.00 61.98 60.43 1rpx s VAL 95 Cb -0.14 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.89 1rpx s VAL 95 CO -0.03 0.07 0.11 -0.44 0.00 0.00 0.00 175.10 174.82 1rpx s SER 96 N 1.18 6.06 0.11 3.32 0.01 0.80 -1.79 113.70 123.39 1rpx s SER 96 Ca -0.05 0.20 0.11 0.00 1.31 0.00 0.00 55.95 57.52 1rpx s SER 96 Cb -0.19 -2.05 -0.04 0.00 0.21 0.00 0.00 66.02 63.96 1rpx s SER 96 CO -0.06 0.19 -0.27 0.68 0.41 0.00 0.00 173.24 174.20 1rpx s VAL 97 N 0.28 2.26 0.40 3.43 -7.23 -0.35 -0.67 120.40 118.51 1rpx s VAL 97 Ca 0.07 -1.67 -0.25 0.00 -1.81 0.00 0.00 61.98 58.32 1rpx s VAL 97 Cb -0.11 -1.98 -0.09 0.00 0.56 0.00 0.00 36.38 34.76 1rpx s VAL 97 CO -0.01 0.15 1.11 -1.00 -0.31 0.00 0.00 175.10 175.04 1rpx s HIS 98 N -1.01 3.17 -0.41 2.82 3.76 -1.26 -0.26 115.29 122.10 1rpx s HIS 98 Ca 0.14 1.60 0.23 0.00 -0.15 0.00 0.00 55.06 56.88 1rpx s HIS 98 Cb -0.10 -3.27 0.20 0.00 1.11 0.00 0.00 32.58 30.52 1rpx s HIS 98 CO 0.05 -0.98 1.27 0.00 -0.85 0.00 0.00 174.74 174.23 1rpx n GLU 100 N -2.59 1.99 0.26 0.00 4.71 -1.26 -4.79 120.64 118.96 1rpx n GLU 100 Ca 0.02 0.70 0.10 0.00 -0.01 0.00 0.00 57.16 57.97 1rpx n GLU 100 Cb 0.51 -2.25 0.69 0.00 -1.01 0.00 0.00 31.44 29.38 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 2.42 0.00 0.00 3.49 5.75 -1.92 -1.41 115.11 123.45 1rpx h GLN 101 Ca -0.45 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.05 1rpx h GLN 101 Cb 1.29 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.84 1rpx h GLN 101 CO 0.62 0.06 0.00 -1.13 -2.65 0.00 0.00 178.83 175.73 1rpx n SER 102 N -4.18 0.00 0.00 -0.69 3.41 -1.26 -3.89 113.62 107.01 1rpx n SER 102 Ca -0.03 -0.34 -0.04 0.00 -0.26 0.00 0.00 58.87 58.21 1rpx n SER 102 Cb 0.15 -0.15 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 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 -1.15 1.22 -4.27 4.04 2.88 -0.58 -4.78 113.62 110.98 1rpx n SER 103 Ca 0.13 0.18 -0.30 0.00 -1.33 0.00 0.00 58.87 57.55 1rpx n SER 103 Cb 0.12 -0.42 -0.16 0.00 -0.75 0.00 0.00 64.21 63.00 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 -2.24 1.95 -0.17 2.46 2.01 -0.93 -1.05 115.64 117.66 1rpx s THR 104 Ca -0.09 -1.04 -0.16 0.00 0.31 0.00 0.00 61.69 60.71 1rpx s THR 104 Cb 0.02 -1.63 -0.13 0.00 0.01 0.00 0.00 72.50 70.77 1rpx s THR 104 CO 0.13 0.55 0.13 0.40 -0.69 0.00 0.00 174.62 175.13 1rpx h ILE 105 N 4.70 0.63 -3.14 1.82 2.04 -1.86 -3.38 117.51 118.32 1rpx h ILE 105 Ca -0.39 -1.70 -0.80 0.00 1.00 0.00 0.00 64.86 62.97 1rpx h ILE 105 Cb 1.14 1.42 -0.27 0.00 -0.74 0.00 0.00 36.82 38.36 1rpx h ILE 105 CO 0.47 0.21 0.69 1.41 0.00 0.00 0.00 178.15 180.94 1rpx n HIS 106 N -4.55 3.66 -0.12 1.37 8.25 -1.26 -4.89 115.22 117.69 1rpx n HIS 106 Ca -0.18 -3.19 -0.06 0.00 -0.26 0.00 0.00 57.72 54.03 1rpx n HIS 106 Cb 0.46 -1.49 0.00 0.00 1.12 0.00 0.00 29.99 30.08 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 6.12 -0.80 -0.47 2.41 6.46 -1.94 -1.52 115.31 125.58 1rpx h LEU 107 Ca 0.20 0.17 0.05 0.00 -0.12 0.00 0.00 57.88 58.18 1rpx h LEU 107 Cb 0.73 0.41 -0.05 0.00 -0.73 0.00 0.00 40.66 41.02 1rpx h LEU 107 CO 1.20 -0.26 0.20 -0.74 -0.62 0.00 0.00 178.44 178.23 1rpx h HIS 108 N -0.17 0.37 -0.56 1.25 2.76 -1.95 -1.10 115.15 115.76 1rpx h HIS 108 Ca 0.19 0.02 -0.06 0.00 -2.20 0.00 0.00 60.37 58.32 1rpx h HIS 108 Cb 0.47 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.31 1rpx h HIS 108 CO -0.47 0.16 0.10 -0.09 -1.30 0.00 0.00 177.93 176.33 1rpx h ARG 109 N 0.40 0.92 -0.75 5.26 1.12 -1.86 -2.48 114.38 117.00 1rpx h ARG 109 Ca 0.22 -0.24 -0.00 0.00 -1.11 0.00 0.00 59.98 58.84 1rpx h ARG 109 Cb 0.18 -0.11 -0.04 0.00 -0.01 0.00 0.00 29.97 29.99 1rpx h ARG 109 CO -0.19 0.88 0.45 1.15 -3.11 0.00 0.00 179.97 179.15 1rpx h THR 110 N 0.82 1.21 -0.32 0.20 2.02 -0.78 0.12 112.91 116.18 1rpx h THR 110 Ca 0.17 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.88 1rpx h THR 110 Cb 0.40 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1rpx h THR 110 CO 0.01 0.22 0.19 0.40 0.37 0.00 0.00 175.52 176.71 1rpx h ILE 111 N 1.02 1.11 -0.25 3.11 1.08 -1.09 -2.15 117.51 120.35 1rpx h ILE 111 Ca 0.27 -0.26 -0.09 0.00 -0.39 0.00 0.00 64.86 64.38 1rpx h ILE 111 Cb -0.03 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 34.41 1rpx h ILE 111 CO -0.05 0.11 -0.23 0.78 -0.69 0.00 0.00 178.15 178.07 1rpx h ASN 112 N 0.41 0.46 -0.80 1.72 2.35 -0.99 -2.69 115.58 116.05 1rpx h ASN 112 Ca 0.12 -0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 1rpx h ASN 112 Cb 0.01 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.22 1rpx h ASN 112 CO -0.02 0.70 0.43 -0.61 -1.65 0.00 0.00 177.43 176.28 1rpx h GLN 113 N 0.41 1.12 -0.12 0.81 4.15 -0.41 0.99 115.11 122.06 1rpx h GLN 113 Ca 0.06 -0.13 -0.00 0.00 0.77 0.00 0.00 58.65 59.35 1rpx h GLN 113 Cb 0.63 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1rpx h GLN 113 CO 0.05 0.83 0.07 0.82 -1.93 0.00 0.00 178.83 178.66 1rpx h ILE 114 N 1.11 1.09 -0.61 2.39 2.04 -1.11 -2.29 117.51 120.13 1rpx h ILE 114 Ca 0.28 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.86 1rpx h ILE 114 Cb 0.04 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 1rpx h ILE 114 CO -0.04 0.08 0.20 0.11 0.00 0.00 0.00 178.15 178.50 1rpx h LYS 115 N 0.10 0.94 -0.62 2.37 1.57 -1.17 -2.52 116.57 117.24 1rpx h LYS 115 Ca 0.04 -0.19 0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1rpx h LYS 115 Cb 0.07 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 1rpx h LYS 115 CO -0.01 0.83 0.41 0.77 -0.57 0.00 0.00 179.45 180.88 1rpx h SER 116 N 0.86 0.48 -0.01 0.86 0.02 -0.60 0.71 113.55 115.87 1rpx h SER 116 Ca 0.20 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1rpx h SER 116 Cb 0.27 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1rpx h SER 116 CO -0.01 0.30 0.00 0.18 -1.14 0.00 0.00 176.83 176.17 1rpx n LEU 117 N -4.48 0.34 0.00 5.07 4.32 -0.88 -4.93 117.00 116.45 1rpx n LEU 117 Ca 0.09 -0.12 0.00 0.00 -0.02 0.00 0.00 56.01 55.96 1rpx n LEU 117 Cb 0.29 -0.01 0.00 0.00 -1.62 0.00 0.00 43.42 42.08 1rpx n LEU 117 CO 0.34 0.06 0.00 0.61 -1.22 0.00 0.00 177.39 177.18 1rpx n GLY 118 N 0.99 0.80 3.94 -0.72 0.00 0.24 -5.04 105.19 105.42 1rpx n GLY 118 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.10 4.39 -0.07 4.61 0.00 -1.05 -5.02 121.76 122.52 1rpx s ALA 119 Ca 0.00 -1.75 -0.19 0.00 0.00 0.00 0.00 51.96 50.02 1rpx s ALA 119 Cb 0.00 -1.11 -0.05 0.00 0.00 0.00 0.00 23.12 21.96 1rpx s ALA 119 CO 0.00 -0.46 0.52 0.15 0.00 0.00 0.00 175.76 175.97 1rpx s LYS 120 N -4.34 4.29 -0.07 0.00 -0.14 0.07 -4.14 119.74 115.41 1rpx s LYS 120 Ca 0.48 0.56 -0.16 0.00 -1.36 0.00 0.00 55.97 55.49 1rpx s LYS 120 Cb -0.04 -3.39 -0.05 0.00 -1.68 0.00 0.00 37.83 32.67 1rpx s LYS 120 CO 0.29 0.27 0.42 0.00 -0.76 0.00 0.00 175.35 175.57 1rpx s ALA 121 N 0.21 3.60 0.10 5.17 0.00 -1.26 -1.37 121.76 128.21 1rpx s ALA 121 Ca 0.28 -0.24 0.08 0.00 0.00 0.00 0.00 51.96 52.07 1rpx s ALA 121 Cb -0.16 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.44 1rpx s ALA 121 CO 0.13 0.24 -0.19 0.20 0.00 0.00 0.00 175.76 176.14 1rpx s GLY 122 N -0.21 1.17 -0.00 0.00 0.00 -0.74 -0.17 107.32 107.37 1rpx s GLY 122 Ca 0.23 -1.22 0.06 0.00 0.00 0.00 0.00 44.72 43.80 1rpx s GLY 122 CO 0.11 -1.23 -0.19 0.14 0.00 0.00 0.00 173.10 171.93 1rpx s VAL 123 N -1.29 2.68 0.11 1.40 1.01 -0.86 -1.21 120.40 122.24 1rpx s VAL 123 Ca 0.05 -1.02 0.09 0.00 0.00 0.00 0.00 61.98 61.10 1rpx s VAL 123 Cb -0.09 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1rpx s VAL 123 CO 0.04 0.48 -0.18 -0.69 0.00 0.00 0.00 175.10 174.76 1rpx s VAL 124 N -0.78 2.88 -0.08 2.92 1.01 0.64 -0.33 120.40 126.66 1rpx s VAL 124 Ca 0.12 -1.48 0.01 0.00 0.00 0.00 0.00 61.98 60.63 1rpx s VAL 124 Cb -0.10 -2.32 0.02 0.00 0.00 0.00 0.00 36.38 33.98 1rpx s VAL 124 CO 0.02 0.11 -0.10 -0.76 0.00 0.00 0.00 175.10 174.37 1rpx s LEU 125 N -2.13 1.46 0.77 3.92 1.02 -0.63 -2.09 118.68 121.01 1rpx s LEU 125 Ca 0.18 -0.28 -0.11 0.00 0.02 0.00 0.00 54.13 53.95 1rpx s LEU 125 Cb -0.11 -0.78 0.05 0.00 0.02 0.00 0.00 46.19 45.38 1rpx s LEU 125 CO 0.10 -0.02 1.08 0.20 0.02 0.00 0.00 176.35 177.73 1rpx s ASN 126 N 1.01 4.62 0.28 2.29 0.01 -1.26 -2.04 114.94 119.85 1rpx s ASN 126 Ca -0.08 1.66 0.01 0.00 -0.71 0.00 0.00 52.86 53.74 1rpx s ASN 126 Cb -0.15 -2.41 0.65 0.00 0.41 0.00 0.00 41.25 39.75 1rpx s ASN 126 CO -0.00 -1.93 1.68 -0.65 -1.51 0.00 0.00 177.10 174.68 1rpx h PRO 127 N -1.06 0.31 -0.00 -0.60 0.11 -1.82 -0.47 132.00 128.46 1rpx h PRO 127 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1rpx h PRO 127 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1rpx h PRO 127 CO 0.54 0.20 -0.02 0.41 -0.21 0.00 0.00 178.00 178.93 1rpx n GLY 128 N -1.35 -0.80 3.69 -0.55 0.00 -1.26 -4.85 105.19 100.07 1rpx n GLY 128 Ca 0.20 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.13 5.08 0.64 2.61 2.01 -0.19 -5.06 115.64 118.60 1rpx s THR 129 Ca 0.41 1.18 -0.13 0.00 0.31 0.00 0.00 61.69 63.46 1rpx s THR 129 Cb 0.21 -3.93 -0.02 0.00 0.01 0.00 0.00 72.50 68.78 1rpx s THR 129 CO 0.39 0.22 1.05 -2.16 -0.69 0.00 0.00 174.62 173.43 1rpx s PRO 130 N 1.20 3.18 0.59 4.92 0.04 -1.26 -4.77 135.00 138.90 1rpx s PRO 130 Ca 0.30 1.03 0.36 0.00 0.04 0.00 0.00 61.00 62.73 1rpx s PRO 130 Cb -0.16 -2.02 1.81 0.00 0.04 0.00 0.00 34.50 34.17 1rpx s PRO 130 CO 0.13 -0.91 2.17 -0.07 0.04 0.00 0.00 177.00 178.36 1rpx h LEU 131 N -0.16 0.00 -1.80 -3.56 3.38 -1.97 -2.41 115.31 108.80 1rpx h LEU 131 Ca -0.45 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.61 1rpx h LEU 131 Cb 1.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1rpx h LEU 131 CO 0.58 0.04 0.32 0.71 0.09 0.00 0.00 178.44 180.17 1rpx h THR 132 N 0.00 0.88 -0.42 0.22 1.35 -2.01 -1.24 112.91 111.69 1rpx h THR 132 Ca -0.00 -0.08 0.07 0.00 -0.55 0.00 0.00 66.41 65.85 1rpx h THR 132 Cb 0.24 0.63 -0.02 0.00 -1.73 0.00 0.00 68.15 67.27 1rpx h THR 132 CO 0.00 0.04 0.29 0.00 -0.25 0.00 0.00 175.52 175.60 1rpx h ALA 133 N 1.76 2.07 -0.33 6.62 0.00 -1.82 -2.55 119.26 125.02 1rpx h ALA 133 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1rpx h ALA 133 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1rpx h ALA 133 CO -0.04 -0.16 0.00 0.44 0.00 0.00 0.00 179.25 179.49 1rpx n ILE 134 N -4.47 0.58 -0.14 0.00 -5.35 -0.48 -4.72 119.36 104.79 1rpx n ILE 134 Ca 0.06 -0.79 -0.05 0.00 -0.27 0.00 0.00 62.75 61.70 1rpx n ILE 134 Cb 0.31 0.86 0.02 0.00 -1.74 0.00 0.00 39.64 39.09 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 3.28 -0.10 -0.42 6.28 4.81 -1.36 0.23 114.58 127.30 1rpx h GLU 135 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1rpx h GLU 135 Cb 0.81 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.21 1rpx h GLU 135 CO 0.00 -0.07 0.00 0.66 -0.73 0.00 0.00 179.01 178.87 1rpx n TYR 136 N -5.39 0.40 0.00 0.92 4.01 -1.26 -3.37 117.16 112.47 1rpx n TYR 136 Ca 0.03 -0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 1rpx n TYR 136 Cb 0.30 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.26 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 0.17 0.00 0.08 -0.72 3.14 -0.77 -4.78 118.33 115.44 1rpx n VAL 137 Ca 0.08 -0.27 0.13 0.00 -2.96 0.00 0.00 64.34 61.32 1rpx n VAL 137 Cb 0.29 0.89 0.61 0.00 -1.06 0.00 0.00 33.84 34.57 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 0.11 0.00 6.55 5.85 -0.99 0.82 115.31 127.65 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 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.01 1rpx h LEU 138 CO 0.00 0.07 -0.04 -0.90 -0.34 0.00 0.00 178.44 177.23 1rpx n ASP 139 N -4.46 0.10 -0.01 1.25 5.75 -1.26 -3.87 116.55 114.04 1rpx n ASP 139 Ca 0.04 0.45 0.07 0.00 -0.01 0.00 0.00 54.79 55.34 1rpx n ASP 139 Cb 0.33 -0.46 -0.12 0.00 -1.03 0.00 0.00 41.12 39.83 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 -1.52 2.51 -1.79 2.12 0.00 0.26 -5.03 120.51 117.05 1rpx n ALA 140 Ca 0.07 -0.43 -0.32 0.00 0.00 0.00 0.00 53.44 52.75 1rpx n ALA 140 Cb 0.35 -0.50 -0.02 0.00 0.00 0.00 0.00 19.45 19.27 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 -3.04 4.31 -0.14 0.00 -7.23 -1.04 -4.92 120.40 108.34 1rpx s VAL 141 Ca -0.06 1.12 0.22 0.00 -1.81 0.00 0.00 61.98 61.45 1rpx s VAL 141 Cb 0.10 -3.62 -0.30 0.00 0.56 0.00 0.00 36.38 33.12 1rpx s VAL 141 CO 0.66 -0.62 0.57 0.47 -0.31 0.00 0.00 175.10 175.86 1rpx n ASP 142 N -1.68 0.16 -3.73 4.85 8.00 0.76 -4.78 116.55 120.12 1rpx n ASP 142 Ca 0.07 -0.06 -0.14 0.00 0.71 0.00 0.00 54.79 55.38 1rpx n ASP 142 Cb 0.54 1.78 -0.09 0.00 -0.02 0.00 0.00 41.12 43.33 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 -4.45 0.64 -0.08 0.64 0.20 -0.77 -1.46 118.68 113.40 1rpx s LEU 143 Ca -0.06 0.27 0.03 0.00 0.69 0.00 0.00 54.13 55.06 1rpx s LEU 143 Cb 0.14 1.41 0.01 0.00 -0.43 0.00 0.00 46.19 47.31 1rpx s LEU 143 CO 0.90 -0.41 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.69 1rpx s VAL 144 N -1.05 1.50 -0.20 1.68 1.01 -0.24 -2.03 120.40 121.07 1rpx s VAL 144 Ca -0.11 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 1rpx s VAL 144 Cb -0.04 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 1rpx s VAL 144 CO 0.04 0.44 -0.04 -0.22 0.00 0.00 0.00 175.10 175.32 1rpx s LEU 145 N 0.59 2.99 -0.28 3.92 0.20 0.55 -0.25 118.68 126.40 1rpx s LEU 145 Ca -0.15 -0.32 -0.09 0.00 0.69 0.00 0.00 54.13 54.26 1rpx s LEU 145 Cb -0.16 -1.75 -0.02 0.00 -0.43 0.00 0.00 46.19 43.82 1rpx s LEU 145 CO 0.05 0.04 0.13 -0.63 -0.29 0.00 0.00 176.35 175.64 1rpx s ILE 146 N 1.13 4.62 -0.14 6.68 1.09 -0.10 -1.60 121.20 132.89 1rpx s ILE 146 Ca 0.02 -0.20 -0.29 0.00 -1.10 0.00 0.00 60.65 59.08 1rpx s ILE 146 Cb -0.15 -3.25 -0.01 0.00 -1.06 0.00 0.00 42.46 38.00 1rpx s ILE 146 CO -0.00 0.22 0.98 -0.04 -0.10 0.00 0.00 174.94 175.99 1rpx s MET 147 N 1.64 4.37 -0.22 2.79 -1.94 -0.86 -2.24 119.30 122.84 1rpx s MET 147 Ca 0.06 1.32 0.15 0.00 -1.71 0.00 0.00 55.69 55.50 1rpx s MET 147 Cb -0.16 -3.56 0.62 0.00 2.01 0.00 0.00 34.83 33.73 1rpx s MET 147 CO 0.06 -0.37 1.54 -1.13 -0.01 0.00 0.00 175.02 175.12 1rpx n SER 148 N 5.27 4.26 -3.58 3.03 3.41 0.12 -3.83 113.62 122.30 1rpx n SER 148 Ca 0.09 -3.10 -0.17 0.00 -0.26 0.00 0.00 58.87 55.43 1rpx n SER 148 Cb 0.48 -0.61 -0.07 0.00 -0.26 0.00 0.00 64.21 63.76 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 -2.88 0.01 -0.31 -3.33 0.11 -1.25 -0.67 120.40 112.08 1rpx s VAL 149 Ca 0.47 -0.12 -0.29 0.00 -2.93 0.00 0.00 61.98 59.11 1rpx s VAL 149 Cb 0.38 -0.91 0.00 0.00 -1.53 0.00 0.00 36.38 34.32 1rpx s VAL 149 CO 0.10 -0.06 1.34 0.20 -3.33 0.00 0.00 175.10 173.35 1rpx s ASN 150 N -1.22 6.59 0.35 3.54 0.01 -1.26 -4.64 114.94 118.31 1rpx s ASN 150 Ca -0.12 1.17 -0.29 0.00 -0.71 0.00 0.00 52.86 52.92 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 0.09 -1.15 1.50 -0.81 -1.51 0.00 0.00 177.10 175.21 1rpx n PRO 151 N 7.47 2.62 -0.01 -0.60 -0.04 -1.26 -3.30 135.00 139.89 1rpx n PRO 151 Ca 0.15 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.54 1rpx n PRO 151 Cb 0.47 -2.66 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 1rpx n PRO 151 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1rpx n GLY 152 N 1.03 2.66 3.97 0.55 0.00 -1.26 -4.77 105.19 107.37 1rpx n GLY 152 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.90 3.11 0.25 1.61 0.40 -1.21 -4.64 117.98 114.60 1rpx s PHE 153 Ca 0.00 0.06 0.06 0.00 -0.60 0.00 0.00 56.93 56.45 1rpx s PHE 153 Cb 0.00 -2.33 -0.03 0.00 0.51 0.00 0.00 43.02 41.17 1rpx s PHE 153 CO 0.00 -0.38 0.28 0.20 0.70 0.00 0.00 175.22 176.02 1rpx s GLY 154 N -4.25 1.33 -0.82 4.36 0.00 -1.26 -4.59 107.32 102.09 1rpx s GLY 154 Ca 0.50 -1.34 -0.03 0.00 0.00 0.00 0.00 44.72 43.85 1rpx s GLY 154 CO 0.36 -1.37 0.70 0.61 0.00 0.00 0.00 173.10 173.40 1rpx n GLY 155 N -1.29 -0.04 3.43 0.20 0.00 -1.26 -5.01 105.19 101.22 1rpx n GLY 155 Ca -0.08 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 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 -5.36 3.63 0.15 1.61 -1.52 -1.26 -5.09 119.66 111.81 1rpx s GLN 156 Ca 0.19 -0.49 0.10 0.00 -1.95 0.00 0.00 55.36 53.21 1rpx s GLN 156 Cb -0.08 -3.30 -0.04 0.00 -0.22 0.00 0.00 33.01 29.36 1rpx s GLN 156 CO 0.47 -0.19 -0.21 -1.54 -0.25 0.00 0.00 175.29 173.57 1rpx s SER 157 N 1.60 3.68 -0.08 5.90 1.04 -1.26 -4.74 113.70 119.85 1rpx s SER 157 Ca 0.06 -0.68 -0.41 0.00 0.48 0.00 0.00 55.95 55.40 1rpx s SER 157 Cb -0.15 -0.41 -0.20 0.00 0.10 0.00 0.00 66.02 65.36 1rpx s SER 157 CO 0.03 0.15 1.14 0.33 0.98 0.00 0.00 173.24 175.88 1rpx n PHE 158 N 0.60 0.81 -3.11 5.02 7.35 -1.26 -4.83 117.46 122.03 1rpx n PHE 158 Ca -0.15 1.07 -0.44 0.00 -0.76 0.00 0.00 57.45 57.17 1rpx n PHE 158 Cb 0.54 -2.09 -0.06 0.00 0.35 0.00 0.00 39.48 38.22 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 0.46 4.80 0.23 -2.13 1.01 0.16 -4.96 121.20 120.77 1rpx s ILE 159 Ca 0.92 -0.39 -0.08 0.00 0.00 0.00 0.00 60.65 61.10 1rpx s ILE 159 Cb -1.30 -4.34 0.24 0.00 0.01 0.00 0.00 42.46 37.07 1rpx s ILE 159 CO 0.60 -0.86 1.66 -0.08 0.00 0.00 0.00 174.94 176.26 1rpx h GLU 160 N 9.05 0.14 -0.06 2.79 4.57 -1.91 -1.86 114.58 127.30 1rpx h GLU 160 Ca -0.27 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 57.92 1rpx h GLU 160 Cb 1.09 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.65 1rpx h GLU 160 CO 0.99 0.09 0.42 0.66 -1.18 0.00 0.00 179.01 179.99 1rpx h SER 161 N 0.14 0.00 1.06 1.04 4.64 -1.99 -1.32 113.55 117.13 1rpx h SER 161 Ca 0.38 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.66 1rpx h SER 161 Cb 0.64 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1rpx h SER 161 CO -0.58 0.00 -0.15 1.56 -0.87 0.00 0.00 176.83 176.80 1rpx h GLN 162 N 0.00 0.00 -0.89 4.77 1.08 -1.71 -3.00 115.11 115.35 1rpx h GLN 162 Ca 0.03 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1rpx h GLN 162 Cb 0.88 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.26 1rpx h GLN 162 CO -0.00 0.15 0.54 0.28 -0.95 0.00 0.00 178.83 178.85 1rpx h VAL 163 N 0.00 1.25 -0.49 -0.54 2.07 -1.43 -1.37 116.25 115.74 1rpx h VAL 163 Ca -0.00 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1rpx h VAL 163 Cb 0.72 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1rpx h VAL 163 CO 0.02 0.26 0.28 0.50 0.02 0.00 0.00 177.57 178.65 1rpx h LYS 164 N 1.23 0.67 -0.99 1.57 3.64 -1.71 -0.62 116.57 120.36 1rpx h LYS 164 Ca 0.32 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.64 1rpx h LYS 164 Cb -0.06 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 31.58 1rpx h LYS 164 CO -0.06 0.51 0.64 -0.22 -2.27 0.00 0.00 179.45 178.05 1rpx h LYS 165 N 0.65 1.32 -0.24 1.90 3.64 -1.44 0.16 116.57 122.56 1rpx h LYS 165 Ca 0.17 -0.09 -0.04 0.00 -1.27 0.00 0.00 60.65 59.43 1rpx h LYS 165 Cb 0.02 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 31.54 1rpx h LYS 165 CO -0.03 0.88 0.01 0.82 -2.27 0.00 0.00 179.45 178.86 1rpx h ILE 166 N 1.35 1.25 -0.23 2.00 2.04 -0.77 -0.69 117.51 122.46 1rpx h ILE 166 Ca 0.36 -0.87 0.02 0.00 1.00 0.00 0.00 64.86 65.38 1rpx h ILE 166 Cb -0.13 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 1rpx h ILE 166 CO -0.08 0.27 0.08 -1.28 0.00 0.00 0.00 178.15 177.15 1rpx h SER 167 N 0.20 0.09 -0.79 1.72 0.87 -0.65 -0.88 113.55 114.11 1rpx h SER 167 Ca 0.07 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.65 1rpx h SER 167 Cb 0.39 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.32 1rpx h SER 167 CO 0.01 0.08 0.48 0.44 -0.53 0.00 0.00 176.83 177.32 1rpx h ASP 168 N 0.19 0.96 -0.69 6.23 3.32 -0.61 -1.85 116.42 123.97 1rpx h ASP 168 Ca 0.10 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 1rpx h ASP 168 Cb 0.06 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 1rpx h ASP 168 CO -0.10 0.73 0.25 0.25 -1.72 0.00 0.00 179.24 178.65 1rpx h LEU 169 N 1.10 0.97 0.16 1.55 5.85 -0.47 -1.68 115.31 122.79 1rpx h LEU 169 Ca 0.29 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1rpx h LEU 169 Cb -0.05 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.73 1rpx h LEU 169 CO -0.05 0.90 -0.07 0.03 -0.34 0.00 0.00 178.44 178.90 1rpx h ARG 170 N 0.99 -0.20 -0.71 1.25 2.47 -0.43 -1.16 114.38 116.59 1rpx h ARG 170 Ca 0.23 0.01 0.11 0.00 -1.26 0.00 0.00 59.98 59.07 1rpx h ARG 170 Cb 0.25 0.05 -0.08 0.00 -1.65 0.00 0.00 29.97 28.54 1rpx h ARG 170 CO -0.01 -0.11 0.31 0.87 0.56 0.00 0.00 179.97 181.58 1rpx h LYS 171 N -0.23 0.48 -0.54 0.04 1.57 -1.19 -0.45 116.57 116.25 1rpx h LYS 171 Ca -0.02 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1rpx h LYS 171 Cb 0.18 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1rpx h LYS 171 CO 0.04 0.32 -0.00 0.82 -0.57 0.00 0.00 179.45 180.05 1rpx h ILE 172 N 0.50 1.26 -0.12 1.86 2.04 -1.13 -1.86 117.51 120.06 1rpx h ILE 172 Ca 0.37 -1.08 -0.10 0.00 1.00 0.00 0.00 64.86 65.04 1rpx h ILE 172 Cb 0.47 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1rpx h ILE 172 CO -0.33 0.39 -0.38 0.00 0.00 0.00 0.00 178.15 177.83 1rpx h ALA 174 N 1.39 -0.52 -0.61 0.00 0.00 -0.75 0.47 119.26 119.24 1rpx h ALA 174 Ca 0.02 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.86 1rpx h ALA 174 Cb 0.77 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 1rpx h ALA 174 CO 0.06 -0.70 0.23 0.93 0.00 0.00 0.00 179.25 179.78 1rpx h GLU 175 N -0.71 0.40 -0.00 0.00 5.08 -1.27 -1.61 114.58 116.48 1rpx h GLU 175 Ca -0.05 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1rpx h GLU 175 Cb 0.50 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1rpx h GLU 175 CO 0.09 0.27 -0.25 0.54 -1.00 0.00 0.00 179.01 178.65 1rpx n ARG 176 N -4.99 0.11 -3.02 2.33 1.74 -0.95 -4.96 116.66 106.92 1rpx n ARG 176 Ca 0.09 -0.04 -0.13 0.00 -0.77 0.00 0.00 57.85 57.00 1rpx n ARG 176 Cb 0.27 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.28 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 1.47 -0.32 3.36 -0.13 0.00 0.12 -5.03 105.19 104.65 1rpx n GLY 177 Ca 0.07 0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -5.20 2.26 -0.40 0.99 1.43 0.95 -5.02 118.68 113.69 1rpx s LEU 178 Ca 0.10 -0.68 0.11 0.00 -1.03 0.00 0.00 54.13 52.63 1rpx s LEU 178 Cb -0.01 -1.20 0.34 0.00 0.03 0.00 0.00 46.19 45.35 1rpx s LEU 178 CO 0.56 0.19 0.74 -3.20 0.23 0.00 0.00 176.35 174.88 1rpx n ASN 179 N 1.27 1.23 -4.89 2.29 5.15 -1.26 -4.43 115.26 114.62 1rpx n ASN 179 Ca -0.18 -3.07 -0.30 0.00 -0.60 0.00 0.00 54.58 50.43 1rpx n ASN 179 Cb 0.53 -0.61 0.04 0.00 -0.53 0.00 0.00 39.78 39.21 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 -2.48 2.89 0.47 1.20 0.04 -1.26 -5.00 135.00 130.86 1rpx s PRO 180 Ca 0.41 0.44 -0.23 0.00 0.04 0.00 0.00 61.00 61.66 1rpx s PRO 180 Cb 0.33 -2.04 -0.07 0.00 0.04 0.00 0.00 34.50 32.76 1rpx s PRO 180 CO -0.09 -1.00 1.22 -1.58 0.04 0.00 0.00 177.00 175.59 1rpx s TRP 181 N -3.33 2.76 -0.34 0.56 0.52 -0.54 -4.86 118.94 113.72 1rpx s TRP 181 Ca 0.58 1.49 0.02 0.00 0.02 0.00 0.00 56.10 58.21 1rpx s TRP 181 Cb -0.11 -3.49 0.09 0.00 -1.15 0.00 0.00 33.47 28.81 1rpx s TRP 181 CO 0.51 -1.82 0.05 0.42 0.02 0.00 0.00 176.95 176.13 1rpx s ILE 182 N -1.46 2.58 0.14 2.03 1.01 -1.26 -1.08 121.20 123.15 1rpx s ILE 182 Ca 0.64 -2.05 -0.04 0.00 0.00 0.00 0.00 60.65 59.20 1rpx s ILE 182 Cb -0.32 -2.76 -0.05 0.00 0.01 0.00 0.00 42.46 39.34 1rpx s ILE 182 CO 0.39 -0.47 0.36 -0.70 0.00 0.00 0.00 174.94 174.52 1rpx s GLU 183 N 1.03 3.59 0.02 2.79 2.12 0.66 -1.97 118.70 126.94 1rpx s GLU 183 Ca 0.05 -0.15 0.04 0.00 0.36 0.00 0.00 54.97 55.27 1rpx s GLU 183 Cb -0.20 -2.87 -0.02 0.00 0.26 0.00 0.00 34.13 31.31 1rpx s GLU 183 CO -0.06 0.48 -0.11 0.08 -0.54 0.00 0.00 175.26 175.10 1rpx s VAL 184 N -1.66 0.89 -0.14 3.70 1.01 -0.55 -0.92 120.40 122.72 1rpx s VAL 184 Ca 0.40 -0.76 -0.06 0.00 0.00 0.00 0.00 61.98 61.57 1rpx s VAL 184 Cb -0.12 -0.80 0.06 0.00 0.00 0.00 0.00 36.38 35.52 1rpx s VAL 184 CO 0.25 0.04 0.29 -0.62 0.00 0.00 0.00 175.10 175.07 1rpx s ASP 185 N -0.81 0.04 0.00 3.32 2.15 -0.95 -1.35 116.67 119.08 1rpx s ASP 185 Ca 0.01 0.65 0.00 0.00 0.43 0.00 0.00 52.55 53.64 1rpx s ASP 185 Cb -0.06 0.71 0.00 0.00 -0.30 0.00 0.00 42.92 43.27 1rpx s ASP 185 CO 0.00 -0.22 0.00 0.61 -0.17 0.00 0.00 175.17 175.40 1rpx n GLY 186 N 4.98 2.09 2.36 2.66 0.00 -1.26 -0.70 105.19 115.32 1rpx n GLY 186 Ca -0.13 -0.19 -0.17 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.04 3.64 -0.02 0.00 -1.26 -4.31 105.19 103.20 1rpx n GLY 187 Ca 0.00 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.84 5.15 0.36 1.61 1.01 -1.26 -4.42 120.40 120.00 1rpx s VAL 188 Ca 0.00 0.76 0.06 0.00 0.00 0.00 0.00 61.98 62.80 1rpx s VAL 188 Cb 0.00 -3.76 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1rpx s VAL 188 CO 0.00 0.18 0.22 -0.83 0.00 0.00 0.00 175.10 174.67 1rpx s GLY 189 N 1.31 2.43 0.56 4.51 0.00 -1.26 -4.68 107.32 110.18 1rpx s GLY 189 Ca 0.19 -1.74 0.28 0.00 0.00 0.00 0.00 44.72 43.46 1rpx s GLY 189 CO 0.09 -1.60 2.16 -0.56 0.00 0.00 0.00 173.10 173.19 1rpx h PRO 190 N 2.02 0.00 -0.00 2.90 0.13 -1.85 -1.03 132.00 134.16 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 0.06 -0.12 0.36 -0.23 0.00 0.00 178.00 178.51 1rpx n LYS 191 N -3.75 0.44 0.00 0.86 0.00 -1.26 -4.20 118.16 110.25 1rpx n LYS 191 Ca -0.02 -0.12 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 1rpx n LYS 191 Cb 0.16 -1.50 0.00 0.00 -0.00 0.00 0.00 35.03 33.69 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 0.30 -5.58 6.94 -1.00 -4.86 115.26 109.90 1rpx n ASN 192 Ca 0.12 -1.00 0.16 0.00 -0.02 0.00 0.00 54.58 53.84 1rpx n ASN 192 Cb 0.29 0.00 0.97 0.00 -2.36 0.00 0.00 39.78 38.68 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 1.44 -0.87 -2.53 0.00 -1.37 -2.13 119.26 113.80 1rpx h ALA 193 Ca 0.00 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1rpx h ALA 193 Cb 0.53 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1rpx h ALA 193 CO 0.00 0.00 0.57 0.10 0.00 0.00 0.00 179.25 179.92 1rpx h TYR 194 N 0.00 1.04 -0.33 0.00 -0.00 -1.86 -1.15 116.97 114.67 1rpx h TYR 194 Ca -0.00 0.03 0.07 0.00 0.00 0.00 0.00 58.73 58.83 1rpx h TYR 194 Cb 0.00 -0.34 -0.07 0.00 0.00 0.00 0.00 36.73 36.31 1rpx h TYR 194 CO 0.00 0.59 -0.17 0.87 -0.00 0.00 0.00 178.16 179.45 1rpx h LYS 195 N 1.06 -0.12 0.00 0.10 1.57 -1.75 0.39 116.57 117.82 1rpx h LYS 195 Ca 0.35 0.01 -0.16 0.00 -1.87 0.00 0.00 60.65 58.98 1rpx h LYS 195 Cb 0.07 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1rpx h LYS 195 CO -0.11 -0.08 -0.77 -0.39 -0.57 0.00 0.00 179.45 177.53 1rpx h VAL 196 N -0.12 1.40 -0.05 0.50 -1.51 -1.64 -2.69 116.25 112.15 1rpx h VAL 196 Ca 0.17 -2.80 -0.01 0.00 -1.23 0.00 0.00 66.70 62.83 1rpx h VAL 196 Cb 0.38 2.57 -0.00 0.00 -2.13 0.00 0.00 31.29 32.11 1rpx h VAL 196 CO -0.40 0.76 -0.01 0.40 -1.23 0.00 0.00 177.57 177.09 1rpx h ILE 197 N 0.00 1.28 -0.45 7.19 2.04 -0.46 -0.93 117.51 126.18 1rpx h ILE 197 Ca -0.01 -0.88 0.08 0.00 1.00 0.00 0.00 64.86 65.05 1rpx h ILE 197 Cb 1.51 1.78 -0.06 0.00 -0.74 0.00 0.00 36.82 39.31 1rpx h ILE 197 CO 0.10 0.24 0.08 -0.33 0.00 0.00 0.00 178.15 178.23 1rpx h GLU 198 N -0.25 0.20 -0.00 2.37 5.08 -0.28 -0.96 114.58 120.73 1rpx h GLU 198 Ca 0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1rpx h GLU 198 Cb 0.38 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1rpx h GLU 198 CO 0.00 0.13 0.01 0.00 -1.00 0.00 0.00 179.01 178.16 1rpx h ALA 199 N 1.36 1.29 0.00 3.43 0.00 -1.37 -3.46 119.26 120.51 1rpx h ALA 199 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1rpx h ALA 199 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1rpx h ALA 199 CO -0.30 -0.01 0.00 0.41 0.00 0.00 0.00 179.25 179.34 1rpx n GLY 200 N -1.21 0.34 3.70 0.00 0.00 -0.36 -3.60 105.19 104.06 1rpx n GLY 200 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 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 -1.31 3.36 -1.04 4.61 0.00 -0.40 -4.79 121.76 122.20 1rpx s ALA 201 Ca 0.00 0.64 0.09 0.00 0.00 0.00 0.00 51.96 52.69 1rpx s ALA 201 Cb 0.00 -3.44 0.13 0.00 0.00 0.00 0.00 23.12 19.81 1rpx s ALA 201 CO 0.00 -0.50 0.93 0.27 0.00 0.00 0.00 175.76 176.46 1rpx n ASN 202 N 4.44 2.09 -3.74 0.00 0.23 -0.83 -4.44 115.26 113.01 1rpx n ASN 202 Ca 0.09 -1.58 -0.23 0.00 -0.53 0.00 0.00 54.58 52.32 1rpx n ASN 202 Cb 0.48 -0.06 -0.17 0.00 -2.08 0.00 0.00 39.78 37.94 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 -0.85 0.66 -0.11 -2.53 0.00 -1.06 -0.87 121.76 117.00 1rpx s ALA 203 Ca 0.14 -0.18 0.02 0.00 0.00 0.00 0.00 51.96 51.94 1rpx s ALA 203 Cb 0.08 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 1rpx s ALA 203 CO 0.12 -0.61 -0.18 -0.51 0.00 0.00 0.00 175.76 174.57 1rpx s LEU 204 N 2.00 2.43 -0.17 0.00 1.43 0.49 -1.49 118.68 123.37 1rpx s LEU 204 Ca 0.04 -0.42 -0.07 0.00 -1.03 0.00 0.00 54.13 52.64 1rpx s LEU 204 Cb -0.13 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 1rpx s LEU 204 CO -0.06 0.18 0.07 -0.69 0.23 0.00 0.00 176.35 176.09 1rpx s VAL 205 N 0.25 4.90 -0.01 -1.59 1.01 -0.46 -0.25 120.40 124.26 1rpx s VAL 205 Ca -0.12 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.85 1rpx s VAL 205 Cb -0.16 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1rpx s VAL 205 CO 0.07 0.48 0.03 0.00 0.00 0.00 0.00 175.10 175.67 1rpx s ALA 206 N 0.18 -0.06 0.00 5.51 0.00 -1.23 -4.29 121.76 121.87 1rpx s ALA 206 Ca 0.05 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.09 1rpx s ALA 206 Cb -0.12 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.95 1rpx s ALA 206 CO 0.00 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.16 1rpx n GLY 207 N 3.08 0.19 0.31 0.00 0.00 -1.26 -0.11 105.19 107.40 1rpx n GLY 207 Ca -0.12 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.98 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 0.27 -0.06 1.61 4.64 -1.92 0.17 113.55 118.25 1rpx h SER 208 Ca 0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1rpx h SER 208 Cb 0.00 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1rpx h SER 208 CO 0.00 0.18 0.02 0.00 -0.87 0.00 0.00 176.83 176.16 1rpx h ALA 209 N 1.81 1.85 0.00 5.18 0.00 -1.88 0.31 119.26 126.54 1rpx h ALA 209 Ca 0.14 -0.05 -0.38 0.00 0.00 0.00 0.00 54.91 54.62 1rpx h ALA 209 Cb 0.17 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 1rpx h ALA 209 CO -0.03 0.12 -2.34 1.33 0.00 0.00 0.00 179.25 178.34 1rpx n VAL 210 N -4.47 1.32 0.17 0.00 0.24 -0.62 -4.29 118.33 110.69 1rpx n VAL 210 Ca -0.01 -0.40 0.03 0.00 -2.04 0.00 0.00 64.34 61.91 1rpx n VAL 210 Cb 0.12 -1.62 0.30 0.00 -1.47 0.00 0.00 33.84 31.18 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 -0.52 0.00 -0.19 6.34 0.04 -1.06 -2.83 116.94 118.72 1rpx h PHE 211 Ca -0.58 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.19 1rpx h PHE 211 Cb 1.64 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.79 1rpx h PHE 211 CO -0.04 0.44 0.00 0.41 -0.60 0.00 0.00 178.31 178.52 1rpx n GLY 212 N 0.08 0.56 3.87 -1.45 0.00 0.10 -4.92 105.19 103.43 1rpx n GLY 212 Ca -0.01 -0.49 -0.32 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.77 3.53 0.19 4.61 0.00 -1.07 -5.00 121.76 122.25 1rpx s ALA 213 Ca 0.34 -0.25 -0.12 0.00 0.00 0.00 0.00 51.96 51.93 1rpx s ALA 213 Cb 0.19 -2.48 0.12 0.00 0.00 0.00 0.00 23.12 20.95 1rpx s ALA 213 CO 0.28 0.44 1.85 -1.00 0.00 0.00 0.00 175.76 177.32 1rpx h PRO 214 N 2.36 0.89 -4.94 0.00 0.13 -1.91 -3.41 132.00 125.13 1rpx h PRO 214 Ca -0.47 -0.07 -0.62 0.00 -0.87 0.00 0.00 66.00 63.97 1rpx h PRO 214 Cb 1.17 -0.19 -0.34 0.00 0.13 0.00 0.00 31.00 31.77 1rpx h PRO 214 CO 0.68 0.62 -0.85 0.34 -0.23 0.00 0.00 178.00 178.56 1rpx s ASP 215 N -5.86 2.72 0.02 1.44 -1.08 -1.26 -5.03 116.67 107.61 1rpx s ASP 215 Ca -0.13 -0.50 -0.25 0.00 -0.52 0.00 0.00 52.55 51.15 1rpx s ASP 215 Cb 0.14 -1.24 -0.18 0.00 -1.46 0.00 0.00 42.92 40.18 1rpx s ASP 215 CO 0.77 0.05 1.40 1.88 0.52 0.00 0.00 175.17 179.78 1rpx h TYR 216 N 7.36 -0.08 -0.39 -5.34 0.05 -1.83 -2.75 116.97 113.98 1rpx h TYR 216 Ca -0.31 -0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.50 1rpx h TYR 216 Cb 1.18 0.03 -0.02 0.00 1.01 0.00 0.00 36.73 38.93 1rpx h TYR 216 CO 0.47 0.24 0.26 0.00 -1.05 0.00 0.00 178.16 178.09 1rpx h ALA 217 N 0.50 1.89 -0.12 3.88 0.00 -1.94 -0.62 119.26 122.84 1rpx h ALA 217 Ca -0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1rpx h ALA 217 Cb 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1rpx h ALA 217 CO 0.01 0.06 -0.31 0.93 0.00 0.00 0.00 179.25 179.94 1rpx h GLU 218 N 0.39 0.43 -0.46 0.00 5.08 -1.86 -1.77 114.58 116.39 1rpx h GLU 218 Ca 0.16 -0.30 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1rpx h GLU 218 Cb 0.17 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1rpx h GLU 218 CO -0.04 0.91 0.27 0.00 -1.00 0.00 0.00 179.01 179.15 1rpx h ALA 219 N 0.52 0.58 -0.37 3.43 0.00 -1.15 0.62 119.26 122.89 1rpx h ALA 219 Ca -0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1rpx h ALA 219 Cb 0.92 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1rpx h ALA 219 CO 0.07 0.08 0.19 0.82 0.00 0.00 0.00 179.25 180.41 1rpx h ILE 220 N 0.61 1.15 -0.16 0.00 2.04 -1.15 -1.60 117.51 118.41 1rpx h ILE 220 Ca 0.16 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1rpx h ILE 220 Cb 0.01 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1rpx h ILE 220 CO -0.03 0.16 0.05 0.50 0.00 0.00 0.00 178.15 178.83 1rpx h LYS 221 N 0.46 0.24 -0.01 2.37 3.64 -1.07 -2.25 116.57 119.95 1rpx h LYS 221 Ca 0.13 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1rpx h LYS 221 Cb 0.08 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1rpx h LYS 221 CO -0.02 0.35 0.04 0.78 -2.27 0.00 0.00 179.45 178.33 1rpx h GLY 222 N 0.08 0.00 0.00 5.01 0.00 0.50 -1.46 103.07 107.20 1rpx h GLY 222 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.28 1rpx h GLY 222 CO -0.00 0.00 -0.55 -2.22 0.00 0.00 0.00 176.54 173.77 1rpx h ILE 223 N 0.00 1.33 0.00 2.60 2.04 -0.83 -3.09 117.51 119.55 1rpx h ILE 223 Ca 0.00 -2.21 0.00 0.00 1.00 0.00 0.00 64.86 63.66 1rpx h ILE 223 Cb 0.09 2.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.89 1rpx h ILE 223 CO -0.00 0.45 0.00 2.29 0.00 0.00 0.00 178.15 180.89 1rpx n LYS 224 N -4.54 0.17 -0.05 2.37 2.85 -0.89 -2.67 118.16 115.40 1rpx n LYS 224 Ca -0.19 0.15 0.04 0.00 -1.05 0.00 0.00 58.31 57.27 1rpx n LYS 224 Cb 0.55 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 33.49 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 -1.35 1.33 -1.83 0.58 -2.24 -0.60 -4.89 114.28 105.27 1rpx n THR 225 Ca 0.07 -1.50 -0.42 0.00 -2.27 0.00 0.00 64.05 59.93 1rpx n THR 225 Cb 0.16 0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.54 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 -1.81 6.50 0.08 3.42 0.15 -1.09 -5.00 113.70 115.95 1rpx s SER 226 Ca 0.14 2.69 0.06 0.00 0.70 0.00 0.00 55.95 59.54 1rpx s SER 226 Cb 0.13 -2.59 -0.03 0.00 -1.71 0.00 0.00 66.02 61.82 1rpx s SER 226 CO 0.01 -0.91 -0.16 -0.54 1.20 0.00 0.00 173.24 172.85 1rpx s LYS 227 N 1.71 0.89 0.10 5.44 1.02 -1.26 -4.31 119.74 123.32 1rpx s LYS 227 Ca 0.74 -1.01 -0.31 0.00 0.02 0.00 0.00 55.97 55.42 1rpx s LYS 227 Cb -0.45 -0.94 -0.10 0.00 -0.52 0.00 0.00 37.83 35.82 1rpx s LYS 227 CO 0.33 0.21 1.83 0.50 -0.92 0.00 0.00 175.35 177.30 1rpx s ARG 228 N -1.80 4.14 0.14 1.68 3.52 -1.26 -4.89 118.95 120.49 1rpx s ARG 228 Ca 0.00 2.56 -0.31 0.00 -0.13 0.00 0.00 55.73 57.85 1rpx s ARG 228 Cb -0.10 -3.69 -0.10 0.00 -1.56 0.00 0.00 34.95 29.51 1rpx s ARG 228 CO 0.03 -0.85 1.66 -1.25 -0.81 0.00 0.00 175.30 174.08 1rpx s PRO 229 N 3.01 4.18 0.00 5.12 0.04 -1.26 -5.19 135.00 140.90 1rpx s PRO 229 Ca 0.81 2.44 0.09 0.00 0.04 0.00 0.00 61.00 64.38 1rpx s PRO 229 Cb -0.45 -3.33 0.54 0.00 0.04 0.00 0.00 34.50 31.30 1rpx s PRO 229 CO 0.37 -0.71 0.99 -1.91 0.04 0.00 0.00 177.00 175.77