#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dmx n THR 26 N 0.00 1.57 -2.80 2.61 -2.24 -1.26 -4.68 114.28 107.48 1dmx n THR 26 Ca 0.00 -0.59 -0.35 0.00 -2.27 0.00 0.00 64.05 60.84 1dmx n THR 26 Cb 0.00 -1.51 -0.01 0.00 -2.10 0.00 0.00 70.33 66.71 1dmx n THR 26 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1dmx n ARG 27 N -3.33 4.43 -3.18 -0.78 1.74 -1.26 -4.80 116.66 109.48 1dmx n ARG 27 Ca -0.42 -4.75 -0.29 0.00 -0.77 0.00 0.00 57.85 51.62 1dmx n ARG 27 Cb 1.00 -2.37 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 1dmx n ARG 27 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1dmx s GLN 28 N -3.88 3.66 0.23 5.56 -1.52 -1.26 -2.77 119.66 119.68 1dmx s GLN 28 Ca 0.43 0.11 0.04 0.00 -1.95 0.00 0.00 55.36 53.99 1dmx s GLN 28 Cb 0.22 -2.57 -0.05 0.00 -0.22 0.00 0.00 33.01 30.39 1dmx s GLN 28 CO -0.12 0.13 -0.01 -1.12 -0.25 0.00 0.00 175.29 173.91 1dmx s SER 29 N -3.26 1.93 0.89 5.90 0.01 -1.26 -4.71 113.70 113.19 1dmx s SER 29 Ca 0.46 -1.21 -0.14 0.00 1.31 0.00 0.00 55.95 56.37 1dmx s SER 29 Cb -0.11 -0.01 0.13 0.00 0.21 0.00 0.00 66.02 66.25 1dmx s SER 29 CO 0.31 -0.49 1.22 -2.16 0.41 0.00 0.00 173.24 172.53 1dmx s PRO 30 N -3.85 1.32 0.35 12.44 0.04 -1.26 -4.66 135.00 139.38 1dmx s PRO 30 Ca 0.28 -0.04 0.03 0.00 0.04 0.00 0.00 61.00 61.32 1dmx s PRO 30 Cb 0.05 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.66 1dmx s PRO 30 CO 0.09 -2.01 0.10 0.96 0.04 0.00 0.00 177.00 176.17 1dmx s ILE 31 N -3.62 0.82 -0.31 0.56 -4.36 -1.26 0.79 121.20 113.82 1dmx s ILE 31 Ca 0.66 -2.00 -0.13 0.00 -0.26 0.00 0.00 60.65 58.93 1dmx s ILE 31 Cb -0.09 -2.58 -0.03 0.00 1.25 0.00 0.00 42.46 41.01 1dmx s ILE 31 CO 0.51 0.00 0.26 0.21 0.24 0.00 0.00 174.94 176.16 1dmx s ASN 32 N -3.51 6.09 -0.59 4.36 2.47 -1.26 -2.77 114.94 119.73 1dmx s ASN 32 Ca 0.31 -0.13 -0.26 0.00 0.42 0.00 0.00 52.86 53.21 1dmx s ASN 32 Cb 0.06 -2.15 0.04 0.00 -1.45 0.00 0.00 41.25 37.75 1dmx s ASN 32 CO 0.15 -0.17 1.07 -0.63 -3.72 0.00 0.00 177.10 173.80 1dmx s ILE 33 N 1.84 4.18 -0.14 -5.21 1.01 0.24 -4.83 121.20 118.28 1dmx s ILE 33 Ca 0.09 0.49 -0.02 0.00 0.00 0.00 0.00 60.65 61.21 1dmx s ILE 33 Cb -0.16 -4.66 -0.02 0.00 0.01 0.00 0.00 42.46 37.63 1dmx s ILE 33 CO 0.11 -1.29 -0.08 -1.10 0.00 0.00 0.00 174.94 172.57 1dmx s GLN 34 N 4.51 3.52 0.59 2.79 -0.21 -1.26 0.62 119.66 130.22 1dmx s GLN 34 Ca 0.35 -0.60 0.29 0.00 0.02 0.00 0.00 55.36 55.42 1dmx s GLN 34 Cb -0.10 -2.77 1.57 0.00 1.00 0.00 0.00 33.01 32.71 1dmx s GLN 34 CO 0.21 0.24 2.00 2.35 -2.12 0.00 0.00 175.29 177.96 1dmx h TRP 35 N 6.68 0.00 0.00 0.91 -0.00 -1.96 0.14 115.95 121.72 1dmx h TRP 35 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.60 1dmx h TRP 35 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.36 1dmx h TRP 35 CO 0.52 0.00 0.00 1.57 -0.00 0.00 0.00 178.44 180.53 1dmx h LYS 36 N 0.00 0.00 0.00 2.65 2.10 -2.01 -2.28 116.57 117.04 1dmx h LYS 36 Ca 0.14 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 1dmx h LYS 36 Cb 0.82 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.15 1dmx h LYS 36 CO -0.00 0.00 -1.28 -0.25 -2.00 0.00 0.00 179.45 175.92 1dmx n ASP 37 N -2.63 0.65 -4.73 7.07 8.00 0.47 -4.97 116.55 120.40 1dmx n ASP 37 Ca 0.02 -0.60 -0.41 0.00 0.71 0.00 0.00 54.79 54.50 1dmx n ASP 37 Cb 0.28 1.25 -0.04 0.00 -0.02 0.00 0.00 41.12 42.59 1dmx n ASP 37 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1dmx s SER 38 N -3.55 7.18 -0.12 -2.24 0.01 -0.86 -4.20 113.70 109.92 1dmx s SER 38 Ca 0.03 2.09 -0.00 0.00 1.31 0.00 0.00 55.95 59.38 1dmx s SER 38 Cb 0.15 -2.60 0.03 0.00 0.21 0.00 0.00 66.02 63.81 1dmx s SER 38 CO 0.87 -0.32 -0.08 0.54 0.41 0.00 0.00 173.24 174.67 1dmx s VAL 39 N 0.15 1.04 -0.01 3.43 0.11 -0.74 -4.94 120.40 119.44 1dmx s VAL 39 Ca 0.52 -0.31 -0.30 0.00 -2.93 0.00 0.00 61.98 58.97 1dmx s VAL 39 Cb -0.30 -1.06 -0.06 0.00 -1.53 0.00 0.00 36.38 33.43 1dmx s VAL 39 CO 0.34 0.36 1.47 -0.47 -3.33 0.00 0.00 175.10 173.46 1dmx s TYR 40 N 1.70 2.64 -0.48 1.54 5.04 -1.26 -0.86 117.35 125.67 1dmx s TYR 40 Ca 0.05 0.66 -0.09 0.00 -2.44 0.00 0.00 57.07 55.24 1dmx s TYR 40 Cb -0.13 -3.73 0.12 0.00 0.35 0.00 0.00 41.96 38.57 1dmx s TYR 40 CO -0.08 -2.82 0.36 0.34 -1.34 0.00 0.00 175.55 172.01 1dmx s ASP 41 N 2.21 5.73 0.00 4.32 -1.08 -0.51 -4.89 116.67 122.46 1dmx s ASP 41 Ca 0.66 -1.93 0.06 0.00 -0.52 0.00 0.00 52.55 50.82 1dmx s ASP 41 Cb -0.32 -2.02 0.38 0.00 -1.46 0.00 0.00 42.92 39.50 1dmx s ASP 41 CO 0.27 -0.70 1.14 -0.81 0.52 0.00 0.00 175.17 175.59 1dmx n PRO 42 N 4.89 0.89 0.00 4.34 -0.04 -1.26 -2.88 135.00 140.93 1dmx n PRO 42 Ca -0.08 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.51 1dmx n PRO 42 Cb 0.41 -1.11 0.21 0.00 -0.04 0.00 0.00 33.50 32.96 1dmx n PRO 42 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1dmx n GLN 43 N -0.61 1.87 -2.40 0.54 -0.06 -1.26 -4.91 117.38 110.55 1dmx n GLN 43 Ca 0.05 -1.43 -0.42 0.00 -2.00 0.00 0.00 57.00 53.19 1dmx n GLN 43 Cb 0.02 -1.47 -0.03 0.00 -4.06 0.00 0.00 30.24 24.70 1dmx n GLN 43 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1dmx s LEU 44 N -2.12 4.30 0.76 1.69 1.43 -1.14 -5.01 118.68 118.59 1dmx s LEU 44 Ca 0.28 1.91 -0.11 0.00 -1.03 0.00 0.00 54.13 55.19 1dmx s LEU 44 Cb 0.20 -3.56 0.05 0.00 0.03 0.00 0.00 46.19 42.91 1dmx s LEU 44 CO 0.37 -0.59 1.10 0.00 0.23 0.00 0.00 176.35 177.45 1dmx s ALA 45 N 2.06 2.26 0.50 4.21 0.00 -1.25 -4.86 121.76 124.68 1dmx s ALA 45 Ca 0.58 0.33 -0.24 0.00 0.00 0.00 0.00 51.96 52.63 1dmx s ALA 45 Cb -0.27 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.50 1dmx s ALA 45 CO 0.24 -1.72 1.41 -1.25 0.00 0.00 0.00 175.76 174.44 1dmx s PRO 46 N -4.75 3.42 -0.45 0.00 0.04 -1.26 -1.00 135.00 131.00 1dmx s PRO 46 Ca 0.62 2.36 -0.20 0.00 0.04 0.00 0.00 61.00 63.83 1dmx s PRO 46 Cb -0.18 -2.47 0.03 0.00 0.04 0.00 0.00 34.50 31.92 1dmx s PRO 46 CO 0.54 -1.01 0.60 -1.17 0.04 0.00 0.00 177.00 175.99 1dmx s LEU 47 N -3.10 4.66 -0.14 -3.56 2.96 -1.26 -2.74 118.68 115.49 1dmx s LEU 47 Ca 0.66 -0.51 -0.19 0.00 -0.22 0.00 0.00 54.13 53.86 1dmx s LEU 47 Cb -0.43 -2.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.62 1dmx s LEU 47 CO 0.53 -0.76 0.54 -0.13 -1.32 0.00 0.00 176.35 175.21 1dmx s ARG 48 N 2.65 4.30 -0.12 1.98 3.00 0.46 -4.92 118.95 126.30 1dmx s ARG 48 Ca 0.19 0.53 0.00 0.00 0.00 0.00 0.00 55.73 56.45 1dmx s ARG 48 Cb -0.16 -3.49 0.02 0.00 0.00 0.00 0.00 34.95 31.33 1dmx s ARG 48 CO 0.17 0.02 -0.11 0.08 0.00 0.00 0.00 175.30 175.45 1dmx s VAL 49 N 1.06 1.28 -0.19 3.52 1.01 -1.26 -1.60 120.40 124.22 1dmx s VAL 49 Ca 0.28 -0.46 -0.04 0.00 0.00 0.00 0.00 61.98 61.75 1dmx s VAL 49 Cb -0.16 -1.23 0.09 0.00 0.00 0.00 0.00 36.38 35.08 1dmx s VAL 49 CO 0.11 0.41 0.23 -0.94 0.00 0.00 0.00 175.10 174.91 1dmx s SER 50 N 1.46 1.15 -0.03 3.32 1.04 -0.95 -5.04 113.70 114.64 1dmx s SER 50 Ca 0.02 -0.07 -0.01 0.00 0.48 0.00 0.00 55.95 56.37 1dmx s SER 50 Cb -0.13 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.42 1dmx s SER 50 CO -0.07 -0.31 0.04 -0.31 0.98 0.00 0.00 173.24 173.56 1dmx s TYR 51 N 2.35 3.20 -0.82 5.02 2.02 -1.26 -1.63 117.35 126.22 1dmx s TYR 51 Ca 0.07 0.18 -0.21 0.00 -0.37 0.00 0.00 57.07 56.73 1dmx s TYR 51 Cb -0.15 -1.74 0.09 0.00 -0.40 0.00 0.00 41.96 39.75 1dmx s TYR 51 CO -0.12 0.51 1.12 0.34 -1.57 0.00 0.00 175.55 175.84 1dmx s ASP 52 N -1.38 6.40 0.49 2.29 2.15 -1.26 -4.87 116.67 120.48 1dmx s ASP 52 Ca 0.18 -1.44 0.29 0.00 0.43 0.00 0.00 52.55 52.02 1dmx s ASP 52 Cb -0.12 -2.44 1.37 0.00 -0.30 0.00 0.00 42.92 41.43 1dmx s ASP 52 CO 0.09 -1.33 1.81 0.00 -0.17 0.00 0.00 175.17 175.57 1dmx h ALA 53 N 9.35 2.74 0.00 3.66 0.00 -1.97 -0.17 119.26 132.86 1dmx h ALA 53 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1dmx h ALA 53 Cb 1.04 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1dmx h ALA 53 CO 1.20 -1.08 0.00 0.00 0.00 0.00 0.00 179.25 179.37 1dmx h ALA 54 N 1.52 1.00 -0.10 0.00 0.00 -1.89 -0.76 119.26 119.02 1dmx h ALA 54 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1dmx h ALA 54 Cb 1.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.65 1dmx h ALA 54 CO -0.11 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.01 1dmx n SER 55 N -2.77 0.65 -4.72 0.00 3.41 -0.08 -4.80 113.62 105.30 1dmx n SER 55 Ca -0.01 -1.83 -0.42 0.00 -0.26 0.00 0.00 58.87 56.35 1dmx n SER 55 Cb 0.14 -0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 63.99 1dmx n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dmx n ARG 57 N 3.24 0.19 -4.04 0.00 5.12 -0.07 -4.69 116.66 116.41 1dmx n ARG 57 Ca 0.07 0.07 -0.10 0.00 -1.93 0.00 0.00 57.85 55.96 1dmx n ARG 57 Cb 0.46 -0.76 -0.06 0.00 -1.16 0.00 0.00 32.46 30.94 1dmx n ARG 57 CO 0.00 0.00 0.00 1.52 -1.93 0.00 0.00 177.63 177.22 1dmx s TYR 58 N -2.04 0.55 -0.09 -1.55 1.13 -1.20 0.10 117.35 114.25 1dmx s TYR 58 Ca -0.10 -0.88 0.02 0.00 -1.41 0.00 0.00 57.07 54.70 1dmx s TYR 58 Cb 0.01 0.04 0.01 0.00 -1.10 0.00 0.00 41.96 40.92 1dmx s TYR 58 CO 0.15 -0.94 -0.16 -1.17 -2.51 0.00 0.00 175.55 170.92 1dmx s LEU 59 N -3.06 1.79 0.14 -3.49 0.20 0.07 0.08 118.68 114.41 1dmx s LEU 59 Ca 0.26 -0.42 0.02 0.00 0.69 0.00 0.00 54.13 54.68 1dmx s LEU 59 Cb 0.01 -1.08 -0.04 0.00 -0.43 0.00 0.00 46.19 44.64 1dmx s LEU 59 CO 0.10 0.06 -0.03 -1.66 -0.29 0.00 0.00 176.35 174.53 1dmx s TRP 60 N 0.71 1.06 -0.35 5.38 1.48 -0.25 -1.19 118.94 125.79 1dmx s TRP 60 Ca -0.12 -0.96 -0.16 0.00 -1.06 0.00 0.00 56.10 53.79 1dmx s TRP 60 Cb -0.16 -0.60 -0.01 0.00 -1.16 0.00 0.00 33.47 31.54 1dmx s TRP 60 CO 0.03 -0.17 0.43 1.21 -4.06 0.00 0.00 176.95 174.39 1dmx s ASN 61 N -3.11 6.24 0.35 -2.66 3.84 0.13 -0.55 114.94 119.17 1dmx s ASN 61 Ca 0.18 -0.15 0.18 0.00 0.21 0.00 0.00 52.86 53.28 1dmx s ASN 61 Cb 0.05 -2.23 0.33 0.00 -0.55 0.00 0.00 41.25 38.86 1dmx s ASN 61 CO -0.00 -0.40 1.57 0.71 -2.79 0.00 0.00 177.10 176.18 1dmx h THR 62 N 5.57 0.66 0.00 -5.21 1.35 -1.56 0.43 112.91 114.15 1dmx h THR 62 Ca -0.29 -1.75 0.00 0.00 -0.55 0.00 0.00 66.41 63.82 1dmx h THR 62 Cb 1.13 2.19 0.00 0.00 -1.73 0.00 0.00 68.15 69.74 1dmx h THR 62 CO 0.73 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.96 1dmx n GLY 63 N 0.92 2.50 0.64 5.82 0.00 -1.26 -4.64 105.19 109.16 1dmx n GLY 63 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 1dmx n GLY 63 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1dmx n TYR 64 N -0.73 0.00 -3.85 1.61 9.36 -1.26 -4.66 117.16 117.62 1dmx n TYR 64 Ca 0.00 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.19 1dmx n TYR 64 Cb 0.00 -0.34 -0.01 0.00 -0.63 0.00 0.00 39.34 38.36 1dmx n TYR 64 CO 0.00 0.00 0.00 1.97 0.22 0.00 0.00 176.86 179.05 1dmx n PHE 65 N -3.68 -0.39 -4.30 2.98 1.16 -1.26 -4.81 117.46 107.16 1dmx n PHE 65 Ca -0.17 -0.47 -0.33 0.00 -1.87 0.00 0.00 57.45 54.61 1dmx n PHE 65 Cb 0.49 0.08 -0.09 0.00 -1.61 0.00 0.00 39.48 38.35 1dmx n PHE 65 CO 0.00 0.00 0.00 -0.59 -1.87 0.00 0.00 176.76 174.30 1dmx s PHE 66 N -3.47 3.08 -0.04 2.97 -0.12 -1.26 -1.42 117.98 117.71 1dmx s PHE 66 Ca 0.06 0.09 0.02 0.00 -0.05 0.00 0.00 56.93 57.05 1dmx s PHE 66 Cb 0.00 -1.68 0.02 0.00 -0.63 0.00 0.00 43.02 40.72 1dmx s PHE 66 CO 0.04 0.46 -0.07 -1.14 -0.05 0.00 0.00 175.22 174.46 1dmx s GLN 67 N -1.47 1.04 -0.26 1.99 0.74 0.29 -3.64 119.66 118.34 1dmx s GLN 67 Ca 0.19 -0.22 -0.17 0.00 0.05 0.00 0.00 55.36 55.21 1dmx s GLN 67 Cb -0.11 -0.96 -0.03 0.00 1.10 0.00 0.00 33.01 33.01 1dmx s GLN 67 CO 0.09 -0.01 0.47 0.08 -0.55 0.00 0.00 175.29 175.37 1dmx s VAL 68 N 0.67 5.11 -0.02 1.34 1.01 -0.76 -1.09 120.40 126.66 1dmx s VAL 68 Ca -0.10 0.78 -0.09 0.00 0.00 0.00 0.00 61.98 62.57 1dmx s VAL 68 Cb -0.13 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1dmx s VAL 68 CO 0.01 0.12 0.28 -0.70 0.00 0.00 0.00 175.10 174.81 1dmx s GLU 69 N 2.16 3.63 0.34 2.72 2.56 0.11 -2.81 118.70 127.42 1dmx s GLU 69 Ca 0.19 0.03 0.10 0.00 0.00 0.00 0.00 54.97 55.29 1dmx s GLU 69 Cb -0.16 -3.13 -0.06 0.00 2.00 0.00 0.00 34.13 32.78 1dmx s GLU 69 CO 0.09 0.68 -0.10 -0.06 -0.56 0.00 0.00 175.26 175.32 1dmx s PHE 70 N -1.19 2.40 -0.49 5.30 0.40 -0.11 -0.89 117.98 123.41 1dmx s PHE 70 Ca 0.24 -0.50 -0.21 0.00 -0.60 0.00 0.00 56.93 55.86 1dmx s PHE 70 Cb -0.14 -1.38 0.04 0.00 0.51 0.00 0.00 43.02 42.06 1dmx s PHE 70 CO 0.13 0.59 0.70 0.34 0.70 0.00 0.00 175.22 177.67 1dmx s ASP 71 N -3.61 6.28 0.00 1.36 -1.08 0.60 -4.87 116.67 115.35 1dmx s ASP 71 Ca 0.32 -0.59 0.09 0.00 -0.52 0.00 0.00 52.55 51.85 1dmx s ASP 71 Cb 0.02 -2.33 0.34 0.00 -1.46 0.00 0.00 42.92 39.50 1dmx s ASP 71 CO 0.16 -0.92 1.25 -0.90 0.52 0.00 0.00 175.17 175.28 1dmx n ASP 72 N 6.47 0.83 0.00 -0.34 5.75 -1.26 -3.96 116.55 124.04 1dmx n ASP 72 Ca -0.03 -1.89 0.09 0.00 -0.01 0.00 0.00 54.79 52.95 1dmx n ASP 72 Cb 0.47 -0.09 0.47 0.00 -1.03 0.00 0.00 41.12 40.93 1dmx n ASP 72 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1dmx n SER 73 N -0.09 0.00 -4.43 -1.12 7.64 -1.26 -4.53 113.62 109.83 1dmx n SER 73 Ca 0.08 0.04 -0.44 0.00 1.01 0.00 0.00 58.87 59.56 1dmx n SER 73 Cb 0.15 -0.30 -0.05 0.00 -1.01 0.00 0.00 64.21 63.00 1dmx n SER 73 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dmx n GLU 75 N 6.78 0.39 -0.01 0.00 1.02 -1.26 -2.45 120.64 125.12 1dmx n GLU 75 Ca -0.06 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.07 1dmx n GLU 75 Cb 0.45 -1.21 -0.01 0.00 -0.02 0.00 0.00 31.44 30.65 1dmx n GLU 75 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1dmx n ASP 76 N 0.35 3.88 -4.62 1.62 5.68 -1.26 -4.97 116.55 117.23 1dmx n ASP 76 Ca 0.00 -0.01 -0.43 0.00 -0.50 0.00 0.00 54.79 53.85 1dmx n ASP 76 Cb 0.11 -0.02 -0.02 0.00 -1.14 0.00 0.00 41.12 40.04 1dmx n ASP 76 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1dmx s SER 77 N -4.14 6.55 0.00 -1.12 0.15 -1.02 -4.77 113.70 109.34 1dmx s SER 77 Ca -0.02 1.15 0.00 0.00 0.70 0.00 0.00 55.95 57.78 1dmx s SER 77 Cb 0.00 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 1dmx s SER 77 CO 0.03 -1.20 0.00 0.61 1.20 0.00 0.00 173.24 173.89 1dmx n GLY 78 N 4.56 -0.52 3.29 9.45 0.00 -0.65 -2.20 105.19 119.12 1dmx n GLY 78 Ca 0.16 -0.93 -0.16 0.00 0.00 0.00 0.00 46.02 45.09 1dmx n GLY 78 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1dmx s ILE 79 N -3.27 0.98 0.22 -0.61 -4.36 -0.14 -2.24 121.20 111.77 1dmx s ILE 79 Ca 0.00 -2.03 -0.23 0.00 -0.26 0.00 0.00 60.65 58.14 1dmx s ILE 79 Cb 0.00 -2.18 0.04 0.00 1.25 0.00 0.00 42.46 41.58 1dmx s ILE 79 CO 0.00 -0.46 0.77 -0.55 0.24 0.00 0.00 174.94 174.94 1dmx s SER 80 N -3.24 -0.29 0.00 4.36 0.15 -0.63 -0.73 113.70 113.32 1dmx s SER 80 Ca 0.25 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.46 1dmx s SER 80 Cb 0.05 0.64 0.00 0.00 -1.71 0.00 0.00 66.02 65.00 1dmx s SER 80 CO 0.06 -1.15 0.00 0.61 1.20 0.00 0.00 173.24 173.96 1dmx n GLY 81 N -0.44 -1.80 7.00 9.45 0.00 -1.26 -0.40 105.19 117.74 1dmx n GLY 81 Ca -0.07 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1dmx n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dmx n GLY 82 N 0.00 2.69 0.42 -0.02 0.00 -0.17 -2.10 105.19 106.01 1dmx n GLY 82 Ca 0.00 -0.24 0.04 0.00 0.00 0.00 0.00 46.02 45.82 1dmx n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dmx n PRO 83 N 14.00 1.52 -3.30 1.61 -0.04 -1.26 -3.79 135.00 143.74 1dmx n PRO 83 Ca 0.00 -0.81 -0.35 0.00 -0.04 0.00 0.00 63.50 62.30 1dmx n PRO 83 Cb 0.00 -1.18 -0.06 0.00 -0.04 0.00 0.00 33.50 32.22 1dmx n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1dmx s LEU 84 N -1.02 4.30 0.00 1.53 1.43 -0.89 -4.96 118.68 119.07 1dmx s LEU 84 Ca 0.16 1.14 0.27 0.00 -1.03 0.00 0.00 54.13 54.66 1dmx s LEU 84 Cb 0.08 -3.44 0.80 0.00 0.03 0.00 0.00 46.19 43.66 1dmx s LEU 84 CO 0.11 0.05 1.62 0.61 0.23 0.00 0.00 176.35 178.96 1dmx n GLY 85 N 0.59 -1.33 0.00 -3.19 0.00 -1.26 -4.56 105.19 95.44 1dmx n GLY 85 Ca -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1dmx n GLY 85 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1dmx n ASN 86 N -1.47 0.00 -4.73 1.61 6.94 -1.26 -5.06 115.26 111.28 1dmx n ASN 86 Ca 0.06 -0.39 -0.41 0.00 -0.02 0.00 0.00 54.58 53.82 1dmx n ASN 86 Cb 0.34 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.71 1dmx n ASN 86 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1dmx s HIS 87 N -4.06 3.82 -0.15 -2.53 5.65 -1.26 -4.48 115.29 112.28 1dmx s HIS 87 Ca 0.00 1.79 0.02 0.00 0.25 0.00 0.00 55.06 57.12 1dmx s HIS 87 Cb 0.00 -3.03 0.01 0.00 -1.18 0.00 0.00 32.58 28.38 1dmx s HIS 87 CO 0.00 0.23 -0.21 0.71 -0.65 0.00 0.00 174.74 174.82 1dmx s TYR 88 N -0.11 2.68 -0.12 3.88 1.51 0.09 -4.26 117.35 121.01 1dmx s TYR 88 Ca 0.46 -1.40 -0.29 0.00 -1.01 0.00 0.00 57.07 54.83 1dmx s TYR 88 Cb -0.23 -1.83 -0.01 0.00 -0.11 0.00 0.00 41.96 39.78 1dmx s TYR 88 CO 0.30 -0.65 1.00 1.03 -1.11 0.00 0.00 175.55 176.12 1dmx s ARG 89 N 0.91 4.40 0.33 -0.62 0.52 -0.36 -0.96 118.95 123.16 1dmx s ARG 89 Ca -0.05 1.37 -0.29 0.00 -0.52 0.00 0.00 55.73 56.25 1dmx s ARG 89 Cb -0.15 -3.55 -0.12 0.00 0.52 0.00 0.00 34.95 31.65 1dmx s ARG 89 CO -0.04 -0.35 1.48 -0.11 0.02 0.00 0.00 175.30 176.31 1dmx n LEU 90 N 5.15 4.24 0.03 2.53 7.94 -0.94 -1.84 117.00 134.11 1dmx n LEU 90 Ca 0.09 1.19 -0.01 0.00 -1.11 0.00 0.00 56.01 56.17 1dmx n LEU 90 Cb 0.48 -1.57 -0.00 0.00 0.53 0.00 0.00 43.42 42.86 1dmx n LEU 90 CO 0.52 -0.02 -0.15 1.17 -1.11 0.00 0.00 177.39 177.79 1dmx n LYS 91 N 1.25 0.04 -3.81 1.96 3.00 -0.24 -4.39 118.16 115.97 1dmx n LYS 91 Ca 0.06 0.01 -0.09 0.00 -0.00 0.00 0.00 58.31 58.29 1dmx n LYS 91 Cb 0.37 -0.56 0.03 0.00 0.00 0.00 0.00 35.03 34.87 1dmx n LYS 91 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 1dmx s GLN 92 N -2.05 2.25 -0.27 1.64 1.03 -1.18 -0.93 119.66 120.15 1dmx s GLN 92 Ca -0.02 -1.46 -0.22 0.00 0.04 0.00 0.00 55.36 53.70 1dmx s GLN 92 Cb 0.00 0.62 0.07 0.00 0.03 0.00 0.00 33.01 33.74 1dmx s GLN 92 CO 0.03 -1.06 0.70 -0.59 -2.54 0.00 0.00 175.29 171.83 1dmx s PHE 93 N -2.12 -0.87 0.26 9.60 -0.12 -1.12 -0.89 117.98 122.72 1dmx s PHE 93 Ca 0.16 1.97 0.04 0.00 -0.05 0.00 0.00 56.93 59.05 1dmx s PHE 93 Cb -0.05 0.39 -0.02 0.00 -0.63 0.00 0.00 43.02 42.71 1dmx s PHE 93 CO 0.12 -0.42 0.15 -2.39 -0.05 0.00 0.00 175.22 172.62 1dmx n HIS 94 N 3.24 -0.22 -4.31 3.49 1.44 -0.75 -1.83 115.22 116.28 1dmx n HIS 94 Ca -0.16 -1.92 -0.17 0.00 -2.01 0.00 0.00 57.72 53.46 1dmx n HIS 94 Cb 0.56 0.10 -0.10 0.00 0.12 0.00 0.00 29.99 30.67 1dmx n HIS 94 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1dmx s PHE 95 N -2.79 1.52 -0.04 -1.40 0.40 -1.24 -1.32 117.98 113.11 1dmx s PHE 95 Ca 0.21 -0.69 0.02 0.00 -0.60 0.00 0.00 56.93 55.87 1dmx s PHE 95 Cb 0.01 -0.75 0.01 0.00 0.51 0.00 0.00 43.02 42.80 1dmx s PHE 95 CO 0.15 0.21 -0.07 -1.01 0.70 0.00 0.00 175.22 175.20 1dmx s HIS 96 N -3.16 0.85 0.18 0.36 3.76 -0.02 -4.61 115.29 112.65 1dmx s HIS 96 Ca 0.21 -0.24 -0.06 0.00 -0.15 0.00 0.00 55.06 54.82 1dmx s HIS 96 Cb 0.01 -0.68 -0.02 0.00 1.11 0.00 0.00 32.58 33.00 1dmx s HIS 96 CO 0.04 -0.16 0.22 1.67 -0.85 0.00 0.00 174.74 175.67 1dmx s TRP 97 N 0.60 0.69 0.41 1.40 -2.14 -1.22 -1.24 118.94 117.44 1dmx s TRP 97 Ca -0.09 -1.02 0.03 0.00 2.66 0.00 0.00 56.10 57.68 1dmx s TRP 97 Cb -0.12 -0.25 0.03 0.00 -3.10 0.00 0.00 33.47 30.03 1dmx s TRP 97 CO 0.01 -0.69 0.22 0.41 -2.66 0.00 0.00 176.95 174.23 1dmx n GLY 98 N -0.22 3.09 0.10 3.67 0.00 -1.22 -1.93 105.19 108.69 1dmx n GLY 98 Ca -0.04 -2.29 0.13 0.00 0.00 0.00 0.00 46.02 43.82 1dmx n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dmx n ALA 99 N -2.01 2.21 -2.18 4.61 0.00 -1.26 -4.34 120.51 117.54 1dmx n ALA 99 Ca -0.14 -0.01 -0.11 0.00 0.00 0.00 0.00 53.44 53.17 1dmx n ALA 99 Cb 0.49 -1.46 -0.10 0.00 0.00 0.00 0.00 19.45 18.38 1dmx n ALA 99 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1dmx s THR 100 N -3.12 0.06 -1.03 0.00 -4.23 -1.26 -5.02 115.64 101.04 1dmx s THR 100 Ca 0.10 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.65 1dmx s THR 100 Cb 0.12 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.69 1dmx s THR 100 CO 0.57 -0.23 0.42 0.47 -0.54 0.00 0.00 174.62 175.30 1dmx n ASP 101 N -0.18 0.80 -0.01 3.99 8.00 -1.26 -3.30 116.55 124.59 1dmx n ASP 101 Ca -0.02 -1.65 0.09 0.00 0.71 0.00 0.00 54.79 53.92 1dmx n ASP 101 Cb 0.65 -0.40 -0.14 0.00 -0.02 0.00 0.00 41.12 41.21 1dmx n ASP 101 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1dmx n GLU 102 N 0.07 0.54 -3.81 -1.24 1.02 -1.26 -4.52 120.64 111.44 1dmx n GLU 102 Ca 0.00 -0.16 -0.09 0.00 -0.02 0.00 0.00 57.16 56.88 1dmx n GLU 102 Cb 0.20 -1.43 -0.05 0.00 -0.02 0.00 0.00 31.44 30.15 1dmx n GLU 102 CO 0.00 0.00 0.00 1.67 1.18 0.00 0.00 177.13 179.98 1dmx s TRP 103 N -3.25 0.04 0.00 -0.32 -2.14 -1.21 -4.70 118.94 107.37 1dmx s TRP 103 Ca -0.07 -0.40 0.00 0.00 2.66 0.00 0.00 56.10 58.30 1dmx s TRP 103 Cb 0.11 0.26 0.00 0.00 -3.10 0.00 0.00 33.47 30.74 1dmx s TRP 103 CO 0.75 -0.86 0.00 0.41 -2.66 0.00 0.00 176.95 174.58 1dmx n GLY 104 N -0.31 0.37 3.83 3.67 0.00 -0.53 -3.37 105.19 108.86 1dmx n GLY 104 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1dmx n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dmx s SER 105 N 0.00 5.73 -0.15 1.61 1.04 0.11 -3.45 113.70 118.59 1dmx s SER 105 Ca 0.00 1.60 -0.13 0.00 0.48 0.00 0.00 55.95 57.90 1dmx s SER 105 Cb 0.00 -2.50 -0.10 0.00 0.10 0.00 0.00 66.02 63.52 1dmx s SER 105 CO 0.00 -1.21 0.13 -0.33 0.98 0.00 0.00 173.24 172.81 1dmx h GLU 106 N -0.31 0.00 -7.38 4.02 5.08 -1.90 -3.46 114.58 110.63 1dmx h GLU 106 Ca -0.45 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.42 1dmx h GLU 106 Cb 1.21 0.00 0.11 0.00 0.50 0.00 0.00 28.75 30.57 1dmx h GLU 106 CO 0.58 0.43 0.34 -1.01 -1.00 0.00 0.00 179.01 178.34 1dmx s HIS 107 N -2.10 2.84 0.04 4.33 3.76 -1.26 -4.61 115.29 118.30 1dmx s HIS 107 Ca -0.15 1.24 -0.01 0.00 -0.15 0.00 0.00 55.06 55.99 1dmx s HIS 107 Cb 0.02 -3.07 -0.03 0.00 1.11 0.00 0.00 32.58 30.60 1dmx s HIS 107 CO 0.34 -1.71 -0.03 0.00 -0.85 0.00 0.00 174.74 172.50 1dmx s ALA 108 N -3.10 0.40 -0.30 -1.40 0.00 -1.12 -4.63 121.76 111.62 1dmx s ALA 108 Ca 0.60 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 51.55 1dmx s ALA 108 Cb -0.15 0.24 0.08 0.00 0.00 0.00 0.00 23.12 23.30 1dmx s ALA 108 CO 0.55 -0.32 0.01 0.14 0.00 0.00 0.00 175.76 176.14 1dmx s VAL 109 N -3.28 1.90 -1.35 0.00 -7.23 -0.54 0.80 120.40 110.70 1dmx s VAL 109 Ca 0.01 -1.85 -0.08 0.00 -1.81 0.00 0.00 61.98 58.25 1dmx s VAL 109 Cb 0.03 -2.28 0.02 0.00 0.56 0.00 0.00 36.38 34.71 1dmx s VAL 109 CO -0.08 -0.41 1.13 0.47 -0.31 0.00 0.00 175.10 175.90 1dmx n ASP 110 N 4.46 -5.45 0.00 4.85 8.00 0.20 -1.64 116.55 126.98 1dmx n ASP 110 Ca -0.03 -0.58 0.00 0.00 0.71 0.00 0.00 54.79 54.88 1dmx n ASP 110 Cb 0.42 -4.91 0.00 0.00 -0.02 0.00 0.00 41.12 36.61 1dmx n ASP 110 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dmx n GLY 111 N -1.84 2.63 3.71 0.44 0.00 -1.26 -5.01 105.19 103.87 1dmx n GLY 111 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1dmx n GLY 111 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1dmx s HIS 112 N -2.20 3.68 -0.05 1.61 5.04 -0.65 -5.01 115.29 117.71 1dmx s HIS 112 Ca 0.00 1.70 0.05 0.00 -1.54 0.00 0.00 55.06 55.27 1dmx s HIS 112 Cb 0.00 -3.12 -0.02 0.00 0.04 0.00 0.00 32.58 29.47 1dmx s HIS 112 CO 0.00 -0.04 -0.18 0.95 -2.34 0.00 0.00 174.74 173.13 1dmx s THR 113 N 0.76 2.71 0.40 0.89 -4.23 -1.26 -1.47 115.64 113.44 1dmx s THR 113 Ca 0.51 -0.85 0.01 0.00 -1.18 0.00 0.00 61.69 60.18 1dmx s THR 113 Cb -0.22 -2.03 -0.02 0.00 1.34 0.00 0.00 72.50 71.57 1dmx s THR 113 CO 0.29 0.58 0.61 -0.31 -0.54 0.00 0.00 174.62 175.25 1dmx s TYR 114 N -0.56 3.34 0.46 3.99 2.02 -1.26 -4.68 117.35 120.67 1dmx s TYR 114 Ca 0.08 0.28 0.18 0.00 -0.37 0.00 0.00 57.07 57.23 1dmx s TYR 114 Cb -0.11 -2.12 1.15 0.00 -0.40 0.00 0.00 41.96 40.48 1dmx s TYR 114 CO 0.01 -0.14 1.97 -1.35 -1.57 0.00 0.00 175.55 174.47 1dmx h PRO 115 N 0.56 0.26 -2.86 -1.71 0.11 -1.78 0.34 132.00 126.93 1dmx h PRO 115 Ca -0.48 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.68 1dmx h PRO 115 Cb 1.24 -0.06 -0.08 0.00 0.11 0.00 0.00 31.00 32.21 1dmx h PRO 115 CO 0.59 0.18 0.28 0.00 -0.21 0.00 0.00 178.00 178.83 1dmx s ALA 116 N -5.27 -1.43 -0.04 -0.75 0.00 -1.25 -3.52 121.76 109.51 1dmx s ALA 116 Ca -0.07 0.06 -0.03 0.00 0.00 0.00 0.00 51.96 51.92 1dmx s ALA 116 Cb 0.20 0.80 0.01 0.00 0.00 0.00 0.00 23.12 24.14 1dmx s ALA 116 CO 0.75 -0.94 0.10 -2.00 0.00 0.00 0.00 175.76 173.66 1dmx s GLU 117 N -3.73 0.10 -0.08 0.00 2.12 -0.37 -1.24 118.70 115.49 1dmx s GLU 117 Ca 0.08 0.17 -0.01 0.00 0.36 0.00 0.00 54.97 55.57 1dmx s GLU 117 Cb -0.04 0.00 -0.03 0.00 0.26 0.00 0.00 34.13 34.32 1dmx s GLU 117 CO -0.00 -0.04 -0.02 -1.17 -0.54 0.00 0.00 175.26 173.48 1dmx s LEU 118 N 0.28 3.43 -0.10 2.70 0.20 0.15 -0.84 118.68 124.50 1dmx s LEU 118 Ca -0.02 0.08 0.02 0.00 0.69 0.00 0.00 54.13 54.90 1dmx s LEU 118 Cb -0.03 -1.77 0.01 0.00 -0.43 0.00 0.00 46.19 43.97 1dmx s LEU 118 CO -0.01 0.36 -0.16 -1.00 -0.29 0.00 0.00 176.35 175.25 1dmx s HIS 119 N -0.80 2.01 -0.37 5.38 3.76 -0.43 -1.01 115.29 123.82 1dmx s HIS 119 Ca 0.12 -0.89 -0.09 0.00 -0.15 0.00 0.00 55.06 54.05 1dmx s HIS 119 Cb -0.11 -1.42 0.03 0.00 1.11 0.00 0.00 32.58 32.19 1dmx s HIS 119 CO 0.02 -0.43 0.18 -0.51 -0.85 0.00 0.00 174.74 173.14 1dmx s LEU 120 N 0.80 4.62 -0.21 0.89 1.43 -0.42 -1.82 118.68 123.96 1dmx s LEU 120 Ca -0.10 -1.07 -0.13 0.00 -1.03 0.00 0.00 54.13 51.79 1dmx s LEU 120 Cb -0.16 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 1dmx s LEU 120 CO 0.01 -0.38 0.29 -0.69 0.23 0.00 0.00 176.35 175.82 1dmx s VAL 121 N 1.50 5.28 0.06 -1.59 1.01 -0.07 -1.83 120.40 124.76 1dmx s VAL 121 Ca 0.01 0.48 0.06 0.00 0.00 0.00 0.00 61.98 62.53 1dmx s VAL 121 Cb -0.19 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1dmx s VAL 121 CO 0.05 0.31 -0.16 -1.00 0.00 0.00 0.00 175.10 174.30 1dmx s HIS 122 N 1.10 1.39 0.25 5.22 3.76 -0.97 -1.08 115.29 124.97 1dmx s HIS 122 Ca 0.14 -0.39 0.10 0.00 -0.15 0.00 0.00 55.06 54.76 1dmx s HIS 122 Cb -0.14 -0.80 -0.05 0.00 1.11 0.00 0.00 32.58 32.70 1dmx s HIS 122 CO 0.06 0.08 -0.10 1.67 -0.85 0.00 0.00 174.74 175.59 1dmx s TRP 123 N -1.00 2.52 -1.00 1.40 1.48 -0.77 -1.91 118.94 119.66 1dmx s TRP 123 Ca 0.02 -0.27 -0.21 0.00 -1.06 0.00 0.00 56.10 54.59 1dmx s TRP 123 Cb -0.09 -1.13 0.09 0.00 -1.16 0.00 0.00 33.47 31.17 1dmx s TRP 123 CO 0.02 0.63 1.33 1.21 -4.06 0.00 0.00 176.95 176.09 1dmx s ASN 124 N -3.43 6.58 0.00 -2.66 3.84 0.27 -1.22 114.94 118.32 1dmx s ASN 124 Ca 0.29 -1.77 0.13 0.00 0.21 0.00 0.00 52.86 51.73 1dmx s ASN 124 Cb -0.06 -2.50 0.58 0.00 -0.55 0.00 0.00 41.25 38.72 1dmx s ASN 124 CO 0.17 -1.30 1.41 -1.54 -2.79 0.00 0.00 177.10 173.05 1dmx n SER 125 N 7.85 0.00 -0.07 -4.21 3.41 -1.26 -0.82 113.62 118.52 1dmx n SER 125 Ca 0.30 0.44 -0.13 0.00 -0.26 0.00 0.00 58.87 59.22 1dmx n SER 125 Cb 0.50 -0.47 -0.11 0.00 -0.26 0.00 0.00 64.21 63.87 1dmx n SER 125 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1dmx h THR 126 N 0.00 1.45 0.04 6.66 2.02 -1.88 -3.38 112.91 117.81 1dmx h THR 126 Ca 0.00 -2.14 -0.23 0.00 0.77 0.00 0.00 66.41 64.80 1dmx h THR 126 Cb 0.21 2.79 -0.02 0.00 -1.74 0.00 0.00 68.15 69.39 1dmx h THR 126 CO 0.00 0.49 -1.11 0.11 0.37 0.00 0.00 175.52 175.38 1dmx h LYS 127 N -1.00 0.08 -6.28 6.66 6.56 -1.91 -3.46 116.57 117.22 1dmx h LYS 127 Ca -0.04 -0.14 -0.69 0.00 -1.06 0.00 0.00 60.65 58.72 1dmx h LYS 127 Cb 0.91 0.05 -0.27 0.00 -0.57 0.00 0.00 32.23 32.35 1dmx h LYS 127 CO -0.02 1.05 -0.83 0.71 -2.06 0.00 0.00 179.45 178.29 1dmx s TYR 128 N -2.69 2.54 0.39 -1.35 2.02 -0.00 -5.01 117.35 113.24 1dmx s TYR 128 Ca -0.01 -0.39 0.08 0.00 -0.37 0.00 0.00 57.07 56.38 1dmx s TYR 128 Cb 0.09 -1.60 0.78 0.00 -0.40 0.00 0.00 41.96 40.83 1dmx s TYR 128 CO 0.84 0.01 1.94 1.49 -1.57 0.00 0.00 175.55 178.26 1dmx h GLU 129 N 5.63 0.35 -3.64 -0.62 4.81 -1.86 -3.39 114.58 115.86 1dmx h GLU 129 Ca -0.41 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 58.69 1dmx h GLU 129 Cb 1.15 -0.06 -0.11 0.00 0.63 0.00 0.00 28.75 30.36 1dmx h GLU 129 CO 0.49 0.40 -0.17 0.54 -0.73 0.00 0.00 179.01 179.53 1dmx s ASN 130 N -6.82 -0.08 0.36 1.04 2.20 -1.26 -5.06 114.94 105.31 1dmx s ASN 130 Ca -0.06 -0.71 0.05 0.00 -0.94 0.00 0.00 52.86 51.19 1dmx s ASN 130 Cb 0.16 0.50 0.69 0.00 -2.00 0.00 0.00 41.25 40.60 1dmx s ASN 130 CO 0.74 -0.97 1.96 0.22 -2.94 0.00 0.00 177.10 176.11 1dmx h TYR 131 N 2.40 0.59 -0.38 1.54 3.20 -1.97 -0.84 116.97 121.50 1dmx h TYR 131 Ca -0.30 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.49 1dmx h TYR 131 Cb 1.24 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.31 1dmx h TYR 131 CO 0.38 0.46 -0.01 0.87 -1.64 0.00 0.00 178.16 178.21 1dmx h LYS 132 N 0.59 0.62 0.26 1.82 6.56 -2.00 -0.71 116.57 123.71 1dmx h LYS 132 Ca 0.15 -0.15 -0.34 0.00 -1.06 0.00 0.00 60.65 59.25 1dmx h LYS 132 Cb 0.11 -0.08 0.04 0.00 -0.57 0.00 0.00 32.23 31.73 1dmx h LYS 132 CO -0.02 0.65 -1.49 0.87 -2.06 0.00 0.00 179.45 177.40 1dmx h LYS 133 N 0.58 0.55 -0.70 3.15 1.57 -1.89 -3.33 116.57 116.50 1dmx h LYS 133 Ca 0.12 -0.94 -0.01 0.00 -1.87 0.00 0.00 60.65 57.96 1dmx h LYS 133 Cb 0.39 0.35 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1dmx h LYS 133 CO 0.02 1.45 0.42 0.00 -0.57 0.00 0.00 179.45 180.76 1dmx h ALA 134 N 0.15 0.89 -0.02 3.86 0.00 -0.96 -2.80 119.26 120.39 1dmx h ALA 134 Ca -0.26 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.57 1dmx h ALA 134 Cb 2.18 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 19.69 1dmx h ALA 134 CO 0.28 0.37 0.05 0.66 0.00 0.00 0.00 179.25 180.61 1dmx h SER 135 N 0.96 0.00 -0.27 0.00 4.64 -1.24 -2.60 113.55 115.04 1dmx h SER 135 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1dmx h SER 135 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1dmx h SER 135 CO -0.05 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.24 1dmx n VAL 136 N -3.40 0.80 -4.61 0.95 0.24 -1.07 -4.68 118.33 106.57 1dmx n VAL 136 Ca -0.02 -0.90 -0.26 0.00 -2.04 0.00 0.00 64.34 61.11 1dmx n VAL 136 Cb 0.13 0.64 -0.06 0.00 -1.47 0.00 0.00 33.84 33.08 1dmx n VAL 136 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dmx n GLY 137 N 0.50 3.66 0.00 7.63 0.00 -0.98 -4.90 105.19 111.09 1dmx n GLY 137 Ca 0.10 -2.33 0.00 0.00 0.00 0.00 0.00 46.02 43.80 1dmx n GLY 137 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1dmx n GLU 138 N -1.02 0.00 -2.75 1.61 2.13 -1.26 -1.99 120.64 117.35 1dmx n GLU 138 Ca -0.16 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.39 1dmx n GLU 138 Cb 0.53 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 32.22 1dmx n GLU 138 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1dmx n ASN 139 N 0.00 4.34 -0.07 4.31 3.02 -1.26 -4.53 115.26 121.07 1dmx n ASN 139 Ca 0.00 -3.64 -0.08 0.00 -0.03 0.00 0.00 54.58 50.83 1dmx n ASN 139 Cb 0.00 -0.52 0.08 0.00 -0.61 0.00 0.00 39.78 38.73 1dmx n ASN 139 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1dmx h GLY 140 N 2.82 0.79 -2.20 7.41 0.00 -1.18 -3.40 103.07 107.30 1dmx h GLY 140 Ca 0.19 -0.72 -0.50 0.00 0.00 0.00 0.00 47.33 46.30 1dmx h GLY 140 CO 0.81 0.65 -0.67 1.08 0.00 0.00 0.00 176.54 178.41 1dmx s LEU 141 N -8.78 2.48 -0.08 3.11 1.43 -0.20 0.97 118.68 117.61 1dmx s LEU 141 Ca -0.09 -1.20 -0.03 0.00 -1.03 0.00 0.00 54.13 51.78 1dmx s LEU 141 Cb 0.13 -0.65 0.04 0.00 0.03 0.00 0.00 46.19 45.74 1dmx s LEU 141 CO 0.84 -0.35 0.16 0.00 0.23 0.00 0.00 176.35 177.23 1dmx s ALA 142 N -3.00 -0.25 -0.02 4.21 0.00 -0.80 -1.59 121.76 120.31 1dmx s ALA 142 Ca 0.30 0.66 0.06 0.00 0.00 0.00 0.00 51.96 52.99 1dmx s ALA 142 Cb 0.04 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 1dmx s ALA 142 CO 0.12 -0.31 -0.21 0.08 0.00 0.00 0.00 175.76 175.45 1dmx s VAL 143 N 1.59 1.63 -0.25 0.00 1.01 -0.50 -2.29 120.40 121.60 1dmx s VAL 143 Ca -0.05 -0.88 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 1dmx s VAL 143 Cb -0.12 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1dmx s VAL 143 CO -0.06 0.46 0.13 -0.63 0.00 0.00 0.00 175.10 175.00 1dmx s ILE 144 N -0.48 4.87 -0.18 2.22 1.01 -0.76 -0.33 121.20 127.54 1dmx s ILE 144 Ca 0.08 0.02 -0.08 0.00 0.00 0.00 0.00 60.65 60.67 1dmx s ILE 144 Cb -0.08 -3.29 -0.04 0.00 0.01 0.00 0.00 42.46 39.06 1dmx s ILE 144 CO -0.01 0.32 0.07 -0.83 0.00 0.00 0.00 174.94 174.50 1dmx s GLY 145 N 1.47 1.94 0.01 6.18 0.00 0.13 -1.30 107.32 115.74 1dmx s GLY 145 Ca 0.06 -0.73 0.07 0.00 0.00 0.00 0.00 44.72 44.12 1dmx s GLY 145 CO 0.06 0.06 -0.21 0.14 0.00 0.00 0.00 173.10 173.15 1dmx s VAL 146 N 0.32 1.64 -0.11 1.40 1.01 -0.18 -0.99 120.40 123.49 1dmx s VAL 146 Ca 0.04 -0.99 -0.08 0.00 0.00 0.00 0.00 61.98 60.95 1dmx s VAL 146 Cb -0.12 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 1dmx s VAL 146 CO -0.00 0.37 0.18 -0.36 0.00 0.00 0.00 175.10 175.28 1dmx s PHE 147 N -0.60 3.60 -0.06 5.22 0.08 -1.26 -0.67 117.98 124.29 1dmx s PHE 147 Ca 0.08 0.58 -0.03 0.00 0.12 0.00 0.00 56.93 57.68 1dmx s PHE 147 Cb -0.08 -2.01 -0.04 0.00 -0.57 0.00 0.00 43.02 40.32 1dmx s PHE 147 CO 0.00 0.68 0.07 -0.51 -0.10 0.00 0.00 175.22 175.37 1dmx s LEU 148 N -0.90 3.92 0.06 -0.37 1.02 -0.37 -1.00 118.68 121.04 1dmx s LEU 148 Ca 0.16 0.23 0.02 0.00 0.02 0.00 0.00 54.13 54.56 1dmx s LEU 148 Cb -0.13 -2.06 -0.03 0.00 0.02 0.00 0.00 46.19 43.99 1dmx s LEU 148 CO 0.05 0.35 -0.07 -1.59 0.02 0.00 0.00 176.35 175.11 1dmx s LYS 149 N -1.25 0.64 0.27 1.70 -2.85 -0.55 -3.78 119.74 113.91 1dmx s LYS 149 Ca 0.17 -1.00 -0.30 0.00 -1.00 0.00 0.00 55.97 53.85 1dmx s LYS 149 Cb -0.12 -0.20 -0.10 0.00 -2.06 0.00 0.00 37.83 35.35 1dmx s LYS 149 CO 0.07 0.01 1.35 -0.51 0.10 0.00 0.00 175.35 176.37 1dmx s LEU 150 N -2.22 4.41 0.00 2.77 1.02 -1.26 -1.34 118.68 122.07 1dmx s LEU 150 Ca -0.01 2.59 0.00 0.00 0.02 0.00 0.00 54.13 56.73 1dmx s LEU 150 Cb -0.03 -3.63 0.00 0.00 0.02 0.00 0.00 46.19 42.55 1dmx s LEU 150 CO -0.02 -0.58 0.00 0.61 0.02 0.00 0.00 176.35 176.38 1dmx n GLY 151 N 1.72 -0.54 3.78 -3.19 0.00 0.82 -4.75 105.19 103.02 1dmx n GLY 151 Ca 0.04 0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.95 1dmx n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dmx s ALA 152 N -1.00 2.82 0.49 4.61 0.00 -1.26 -4.12 121.76 123.30 1dmx s ALA 152 Ca 0.00 0.77 -0.23 0.00 0.00 0.00 0.00 51.96 52.50 1dmx s ALA 152 Cb 0.00 -3.33 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 1dmx s ALA 152 CO 0.00 -0.58 1.36 -1.58 0.00 0.00 0.00 175.76 174.96 1dmx s HIS 153 N -1.79 2.45 -0.29 0.00 2.46 -1.26 -2.32 115.29 114.54 1dmx s HIS 153 Ca 0.69 1.36 -0.05 0.00 0.47 0.00 0.00 55.06 57.53 1dmx s HIS 153 Cb -0.22 -3.78 0.02 0.00 -0.13 0.00 0.00 32.58 28.47 1dmx s HIS 153 CO 0.26 -2.70 0.03 -1.58 -2.47 0.00 0.00 174.74 168.29 1dmx s HIS 154 N -1.29 3.15 0.15 3.88 5.04 -1.26 -4.84 115.29 120.12 1dmx s HIS 154 Ca 0.66 -1.32 -0.17 0.00 -1.54 0.00 0.00 55.06 52.69 1dmx s HIS 154 Cb -0.40 -2.18 0.03 0.00 0.04 0.00 0.00 32.58 30.07 1dmx s HIS 154 CO 0.49 -0.67 1.76 1.96 -2.34 0.00 0.00 174.74 175.94 1dmx h GLN 155 N 8.14 0.29 -0.35 2.88 1.08 -1.94 -2.47 115.11 122.74 1dmx h GLN 155 Ca -0.29 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 56.85 1dmx h GLN 155 Cb 1.11 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.45 1dmx h GLN 155 CO 0.59 0.19 0.04 0.00 -0.95 0.00 0.00 178.83 178.70 1dmx h ALA 156 N 1.19 1.43 -0.19 3.87 0.00 -1.95 -2.83 119.26 120.78 1dmx h ALA 156 Ca 0.14 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1dmx h ALA 156 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1dmx h ALA 156 CO -0.12 0.41 -0.45 1.25 0.00 0.00 0.00 179.25 180.34 1dmx h LEU 157 N 0.51 0.52 -1.06 0.00 5.85 -1.82 -3.24 115.31 116.06 1dmx h LEU 157 Ca 0.11 -0.24 0.18 0.00 0.84 0.00 0.00 57.88 58.77 1dmx h LEU 157 Cb 0.26 -0.15 -0.10 0.00 0.37 0.00 0.00 40.66 41.05 1dmx h LEU 157 CO 0.00 0.90 0.62 -0.61 -0.34 0.00 0.00 178.44 179.01 1dmx h GLN 158 N 0.39 0.75 -0.96 1.25 5.75 -1.18 0.17 115.11 121.28 1dmx h GLN 158 Ca 0.03 -0.05 0.07 0.00 -0.15 0.00 0.00 58.65 58.55 1dmx h GLN 158 Cb 0.95 -0.17 -0.07 0.00 1.07 0.00 0.00 27.48 29.26 1dmx h GLN 158 CO 0.08 0.50 0.61 0.87 -2.65 0.00 0.00 178.83 178.24 1dmx h LYS 159 N 0.77 1.06 -0.16 1.69 1.57 -1.67 0.37 116.57 120.21 1dmx h LYS 159 Ca 0.56 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 59.23 1dmx h LYS 159 Cb 0.86 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.92 1dmx h LYS 159 CO -0.34 0.70 -0.07 -0.07 -0.57 0.00 0.00 179.45 179.10 1dmx h LEU 160 N 1.09 0.34 -0.61 2.94 3.38 -0.89 -3.15 115.31 118.41 1dmx h LEU 160 Ca 0.42 -0.40 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1dmx h LEU 160 Cb 0.21 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1dmx h LEU 160 CO -0.18 0.67 0.38 0.58 0.09 0.00 0.00 178.44 179.97 1dmx h VAL 161 N 0.01 1.08 0.00 1.22 2.07 -0.64 -2.65 116.25 117.34 1dmx h VAL 161 Ca 0.04 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1dmx h VAL 161 Cb 0.54 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1dmx h VAL 161 CO 0.02 0.14 0.20 0.44 0.02 0.00 0.00 177.57 178.38 1dmx h ASP 162 N 0.74 0.00 -0.01 0.57 5.19 -0.23 -2.02 116.42 120.66 1dmx h ASP 162 Ca 0.24 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.65 1dmx h ASP 162 Cb 0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.52 1dmx h ASP 162 CO -0.10 0.00 -0.31 1.33 -3.12 0.00 0.00 179.24 177.04 1dmx n VAL 163 N -2.86 0.00 -0.30 -1.35 0.24 -1.00 -4.71 118.33 108.34 1dmx n VAL 163 Ca -0.02 -0.35 0.08 0.00 -2.04 0.00 0.00 64.34 62.01 1dmx n VAL 163 Cb 0.25 1.15 0.30 0.00 -1.47 0.00 0.00 33.84 34.07 1dmx n VAL 163 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1dmx h LEU 164 N 1.41 0.80 -1.87 1.34 3.38 -1.35 -1.65 115.31 117.37 1dmx h LEU 164 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1dmx h LEU 164 Cb 0.45 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1dmx h LEU 164 CO 0.00 0.45 0.14 -0.65 0.09 0.00 0.00 178.44 178.47 1dmx h PRO 165 N 0.87 0.00 0.00 1.13 0.11 -1.84 0.70 132.00 132.97 1dmx h PRO 165 Ca 0.44 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.40 1dmx h PRO 165 Cb 0.49 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 1dmx h PRO 165 CO -0.20 0.00 -0.70 0.93 -0.21 0.00 0.00 178.00 177.82 1dmx h GLU 166 N 0.00 0.00 -0.32 1.05 4.39 -1.66 -3.33 114.58 114.72 1dmx h GLU 166 Ca 0.00 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.59 1dmx h GLU 166 Cb 0.28 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.86 1dmx h GLU 166 CO 0.00 0.70 -0.02 1.33 -1.16 0.00 0.00 179.01 179.86 1dmx n VAL 167 N -3.32 2.43 -0.28 3.13 0.24 0.23 -4.69 118.33 116.07 1dmx n VAL 167 Ca 0.01 -2.34 0.16 0.00 -2.04 0.00 0.00 64.34 60.13 1dmx n VAL 167 Cb 0.80 -0.29 0.43 0.00 -1.47 0.00 0.00 33.84 33.31 1dmx n VAL 167 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1dmx h ARG 168 N 1.29 0.55 -6.29 7.34 2.43 -1.64 -3.41 114.38 114.64 1dmx h ARG 168 Ca 0.13 -0.03 -0.54 0.00 -0.81 0.00 0.00 59.98 58.73 1dmx h ARG 168 Cb 1.58 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.99 1dmx h ARG 168 CO 0.32 0.36 -0.28 -1.01 -1.51 0.00 0.00 179.97 177.86 1dmx s HIS 169 N -5.59 3.48 0.69 2.20 3.76 -1.26 -0.26 115.29 118.31 1dmx s HIS 169 Ca -0.09 0.45 -0.16 0.00 -0.15 0.00 0.00 55.06 55.11 1dmx s HIS 169 Cb 0.23 -1.94 0.02 0.00 1.11 0.00 0.00 32.58 32.00 1dmx s HIS 169 CO 0.79 0.33 1.21 -1.59 -0.85 0.00 0.00 174.74 174.63 1dmx s LYS 170 N -3.30 2.39 -0.52 1.40 -2.85 -1.06 -2.90 119.74 112.91 1dmx s LYS 170 Ca 0.40 1.77 0.00 0.00 -1.00 0.00 0.00 55.97 57.15 1dmx s LYS 170 Cb -0.11 -1.86 0.00 0.00 -2.06 0.00 0.00 37.83 33.80 1dmx s LYS 170 CO 0.29 -1.65 0.00 -0.25 0.10 0.00 0.00 175.35 173.84 1dmx n ASP 171 N -2.40 -5.41 -4.84 0.03 8.00 0.15 -4.76 116.55 107.32 1dmx n ASP 171 Ca 0.13 0.12 -0.35 0.00 0.71 0.00 0.00 54.79 55.41 1dmx n ASP 171 Cb 0.50 -3.34 -0.06 0.00 -0.02 0.00 0.00 41.12 38.20 1dmx n ASP 171 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1dmx s THR 172 N -1.57 4.78 0.03 -3.53 2.01 -1.14 -4.86 115.64 111.36 1dmx s THR 172 Ca 0.00 0.91 -0.01 0.00 0.31 0.00 0.00 61.69 62.91 1dmx s THR 172 Cb 0.00 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 1dmx s THR 172 CO 0.00 0.17 -0.02 0.00 -0.69 0.00 0.00 174.62 174.08 1dmx s GLN 173 N -2.12 0.44 -0.02 4.92 0.00 -1.26 -0.70 119.66 120.92 1dmx s GLN 173 Ca 0.41 -0.84 -0.00 0.00 -0.00 0.00 0.00 55.36 54.93 1dmx s GLN 173 Cb -0.15 0.15 0.02 0.00 0.00 0.00 0.00 33.01 33.04 1dmx s GLN 173 CO 0.20 -0.08 0.04 0.54 0.00 0.00 0.00 175.29 175.99 1dmx s VAL 174 N -2.42 -0.04 0.64 3.63 0.11 -0.34 -4.91 120.40 117.07 1dmx s VAL 174 Ca -0.07 0.16 -0.18 0.00 -2.93 0.00 0.00 61.98 58.96 1dmx s VAL 174 Cb -0.03 -0.08 -0.01 0.00 -1.53 0.00 0.00 36.38 34.73 1dmx s VAL 174 CO -0.04 0.06 1.24 0.00 -3.33 0.00 0.00 175.10 173.03 1dmx s ALA 175 N 0.80 2.39 0.09 1.54 0.00 -1.26 -0.75 121.76 124.57 1dmx s ALA 175 Ca -0.07 1.06 0.10 0.00 0.00 0.00 0.00 51.96 53.05 1dmx s ALA 175 Cb -0.09 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 1dmx s ALA 175 CO -0.02 -1.49 -0.26 -1.64 0.00 0.00 0.00 175.76 172.34 1dmx s MET 176 N -3.49 1.55 0.70 0.00 -1.94 0.11 -4.73 119.30 111.52 1dmx s MET 176 Ca 0.79 -1.22 -0.02 0.00 -1.71 0.00 0.00 55.69 53.52 1dmx s MET 176 Cb -0.33 -1.89 0.10 0.00 2.01 0.00 0.00 34.83 34.72 1dmx s MET 176 CO 0.38 0.47 0.98 0.20 -0.01 0.00 0.00 175.02 177.04 1dmx s GLY 177 N -1.67 1.77 -0.31 -0.03 0.00 -1.26 -4.50 107.32 101.32 1dmx s GLY 177 Ca 0.12 -1.49 -0.42 0.00 0.00 0.00 0.00 44.72 42.94 1dmx s GLY 177 CO 0.04 -0.99 1.66 -1.05 0.00 0.00 0.00 173.10 172.76 1dmx n PRO 178 N -2.82 0.81 -4.05 2.90 -0.02 -1.26 -4.79 135.00 125.77 1dmx n PRO 178 Ca 0.13 0.30 -0.16 0.00 -2.02 0.00 0.00 63.50 61.74 1dmx n PRO 178 Cb 0.60 -1.92 -0.15 0.00 -0.02 0.00 0.00 33.50 32.01 1dmx n PRO 178 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1dmx s PHE 179 N 3.10 0.36 -0.32 6.00 5.36 -0.31 -4.91 117.98 127.25 1dmx s PHE 179 Ca 0.99 -0.06 -0.08 0.00 -0.96 0.00 0.00 56.93 56.83 1dmx s PHE 179 Cb -1.18 -0.29 0.02 0.00 -0.34 0.00 0.00 43.02 41.22 1dmx s PHE 179 CO 0.69 -0.05 0.12 0.34 -1.46 0.00 0.00 175.22 174.86 1dmx s ASP 180 N 0.24 5.34 0.45 6.13 2.15 -1.26 -4.24 116.67 125.48 1dmx s ASP 180 Ca -0.02 -0.87 0.17 0.00 0.43 0.00 0.00 52.55 52.26 1dmx s ASP 180 Cb -0.05 -1.92 1.12 0.00 -0.30 0.00 0.00 42.92 41.77 1dmx s ASP 180 CO -0.00 -0.27 1.95 -0.65 -0.17 0.00 0.00 175.17 176.03 1dmx h PRO 181 N 8.28 0.31 -0.01 4.34 0.11 -1.97 -1.61 132.00 141.45 1dmx h PRO 181 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1dmx h PRO 181 Cb 1.11 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1dmx h PRO 181 CO 0.62 0.21 0.01 0.77 -0.21 0.00 0.00 178.00 179.40 1dmx h SER 182 N 0.32 0.00 0.46 -2.05 0.02 -1.96 0.60 113.55 110.94 1dmx h SER 182 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1dmx h SER 182 Cb 0.81 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.35 1dmx h SER 182 CO -0.08 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.61 1dmx n LEU 184 N -1.59 1.31 -4.91 0.00 4.77 0.20 -4.77 117.00 112.01 1dmx n LEU 184 Ca 0.03 -0.58 -0.27 0.00 -0.03 0.00 0.00 56.01 55.16 1dmx n LEU 184 Cb 0.15 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1dmx n LEU 184 CO 0.13 0.29 0.51 -0.04 -1.33 0.00 0.00 177.39 176.94 1dmx s MET 185 N -2.81 3.14 0.38 3.23 -1.94 -0.26 -4.90 119.30 116.15 1dmx s MET 185 Ca 0.11 0.07 -0.12 0.00 -1.71 0.00 0.00 55.69 54.04 1dmx s MET 185 Cb 0.16 -2.30 -0.07 0.00 2.01 0.00 0.00 34.83 34.63 1dmx s MET 185 CO 0.77 -0.53 0.77 -1.25 -0.01 0.00 0.00 175.02 174.77 1dmx s PRO 186 N -4.91 3.86 0.18 2.03 0.04 -1.26 -4.99 135.00 129.95 1dmx s PRO 186 Ca 0.52 0.56 -0.14 0.00 0.04 0.00 0.00 61.00 61.97 1dmx s PRO 186 Cb -0.10 -2.39 0.15 0.00 0.04 0.00 0.00 34.50 32.20 1dmx s PRO 186 CO 0.45 0.01 1.70 0.00 0.04 0.00 0.00 177.00 179.21 1dmx h ALA 187 N 1.56 0.45 -2.41 8.56 0.00 -1.95 -3.39 119.26 122.08 1dmx h ALA 187 Ca -0.47 0.12 -0.55 0.00 0.00 0.00 0.00 54.91 54.00 1dmx h ALA 187 Cb 1.18 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 1dmx h ALA 187 CO 0.64 -0.36 0.38 0.00 0.00 0.00 0.00 179.25 179.91 1dmx n ARG 189 N 4.39 2.32 -2.05 0.00 5.12 -1.26 -4.66 116.66 120.52 1dmx n ARG 189 Ca 0.05 -3.09 -0.38 0.00 -1.93 0.00 0.00 57.85 52.50 1dmx n ARG 189 Cb 0.50 -1.95 0.01 0.00 -1.16 0.00 0.00 32.46 29.86 1dmx n ARG 189 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1dmx s ASP 190 N -1.99 5.92 0.31 0.55 1.01 -1.26 -4.94 116.67 116.27 1dmx s ASP 190 Ca 0.48 2.54 -0.08 0.00 0.71 0.00 0.00 52.55 56.20 1dmx s ASP 190 Cb 0.42 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.73 1dmx s ASP 190 CO 0.05 -1.11 0.51 -0.72 0.21 0.00 0.00 175.17 174.11 1dmx s TYR 191 N -1.39 0.66 0.07 4.23 1.13 -1.26 -1.53 117.35 119.25 1dmx s TYR 191 Ca 0.64 -1.00 0.08 0.00 -1.41 0.00 0.00 57.07 55.39 1dmx s TYR 191 Cb -0.35 0.14 -0.04 0.00 -1.10 0.00 0.00 41.96 40.62 1dmx s TYR 191 CO 0.43 -1.12 -0.19 -1.58 -2.51 0.00 0.00 175.55 170.57 1dmx s TRP 192 N -3.37 2.52 0.01 -3.49 0.51 0.56 -1.86 118.94 113.83 1dmx s TRP 192 Ca 0.25 -0.27 -0.00 0.00 -2.12 0.00 0.00 56.10 53.96 1dmx s TRP 192 Cb -0.01 -1.40 -0.01 0.00 -0.81 0.00 0.00 33.47 31.23 1dmx s TRP 192 CO 0.14 0.30 -0.01 -0.08 -0.51 0.00 0.00 176.95 176.79 1dmx s THR 193 N -1.01 0.08 -0.16 2.01 -1.32 0.16 -0.93 115.64 114.48 1dmx s THR 193 Ca 0.16 -0.64 -0.30 0.00 -1.21 0.00 0.00 61.69 59.69 1dmx s THR 193 Cb -0.10 -0.20 0.13 0.00 -1.51 0.00 0.00 72.50 70.81 1dmx s THR 193 CO 0.07 -0.35 1.03 -0.72 -2.21 0.00 0.00 174.62 172.43 1dmx s TYR 194 N -1.04 -0.33 0.28 9.09 -0.85 -1.08 -1.81 117.35 121.61 1dmx s TYR 194 Ca -0.11 0.51 -0.28 0.00 -0.52 0.00 0.00 57.07 56.67 1dmx s TYR 194 Cb -0.07 0.47 -0.09 0.00 0.38 0.00 0.00 41.96 42.64 1dmx s TYR 194 CO -0.01 -0.33 0.94 -1.25 -1.52 0.00 0.00 175.55 173.38 1dmx s PRO 195 N -1.39 4.71 0.00 -3.49 0.04 -1.26 -0.73 135.00 132.88 1dmx s PRO 195 Ca 0.00 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.44 1dmx s PRO 195 Cb -0.01 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.50 1dmx s PRO 195 CO -0.01 0.40 0.00 0.41 0.04 0.00 0.00 177.00 177.84 1dmx n GLY 196 N 1.02 4.67 3.22 0.56 0.00 0.21 -4.85 105.19 110.01 1dmx n GLY 196 Ca -0.00 -0.95 -0.14 0.00 0.00 0.00 0.00 46.02 44.94 1dmx n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dmx s SER 197 N 1.36 0.48 0.53 1.61 1.04 -1.11 -2.96 113.70 114.64 1dmx s SER 197 Ca 0.00 -1.47 -0.20 0.00 0.48 0.00 0.00 55.95 54.77 1dmx s SER 197 Cb 0.00 0.42 -0.06 0.00 0.10 0.00 0.00 66.02 66.48 1dmx s SER 197 CO 0.00 -0.89 1.12 -0.76 0.98 0.00 0.00 173.24 173.69 1dmx s LEU 198 N -3.21 3.77 -0.10 2.42 1.43 -0.03 -4.41 118.68 118.55 1dmx s LEU 198 Ca 0.39 2.15 0.19 0.00 -1.03 0.00 0.00 54.13 55.83 1dmx s LEU 198 Cb 0.06 -4.57 0.71 0.00 0.03 0.00 0.00 46.19 42.42 1dmx s LEU 198 CO 0.15 -1.16 1.61 0.35 0.23 0.00 0.00 176.35 177.54 1dmx n THR 199 N -1.23 1.73 -4.12 5.49 -2.24 -1.26 -4.35 114.28 108.30 1dmx n THR 199 Ca 0.11 -1.19 -0.15 0.00 -2.27 0.00 0.00 64.05 60.56 1dmx n THR 199 Cb 0.51 0.18 -0.11 0.00 -2.10 0.00 0.00 70.33 68.80 1dmx n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1dmx s THR 200 N -1.74 0.81 0.48 4.28 -4.23 -1.26 -4.60 115.64 109.37 1dmx s THR 200 Ca 0.50 -1.29 -0.22 0.00 -1.18 0.00 0.00 61.69 59.50 1dmx s THR 200 Cb 0.32 -0.94 -0.09 0.00 1.34 0.00 0.00 72.50 73.12 1dmx s THR 200 CO 0.25 -0.38 0.92 -2.65 -0.54 0.00 0.00 174.62 172.22 1dmx n PRO 201 N 1.18 1.11 0.00 3.99 -0.02 -1.26 -1.05 135.00 138.95 1dmx n PRO 201 Ca -0.21 0.41 0.04 0.00 -2.02 0.00 0.00 63.50 61.72 1dmx n PRO 201 Cb 0.55 -2.00 0.23 0.00 -0.02 0.00 0.00 33.50 32.27 1dmx n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1dmx n PRO 202 N -0.10 0.67 -3.72 0.52 -0.04 -1.26 -4.98 135.00 126.09 1dmx n PRO 202 Ca 0.11 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.31 1dmx n PRO 202 Cb 0.42 -1.18 0.05 0.00 -0.04 0.00 0.00 33.50 32.75 1dmx n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1dmx n LEU 203 N -0.68 -3.09 -4.76 1.53 4.77 -0.22 -4.93 117.00 109.62 1dmx n LEU 203 Ca 0.06 -0.69 -0.40 0.00 -0.03 0.00 0.00 56.01 54.95 1dmx n LEU 203 Cb 0.03 -2.79 -0.05 0.00 -2.33 0.00 0.00 43.42 38.27 1dmx n LEU 203 CO 0.04 0.51 0.72 0.00 -1.33 0.00 0.00 177.39 177.34 1dmx s ALA 204 N -3.38 3.35 -1.28 -1.18 0.00 -1.26 -4.53 121.76 113.47 1dmx s ALA 204 Ca 0.45 0.75 -0.12 0.00 0.00 0.00 0.00 51.96 53.05 1dmx s ALA 204 Cb -0.22 -3.27 0.15 0.00 0.00 0.00 0.00 23.12 19.78 1dmx s ALA 204 CO 0.78 -0.00 1.79 0.39 0.00 0.00 0.00 175.76 178.72 1dmx n GLU 205 N 1.18 3.43 0.00 0.00 1.02 -1.26 -0.86 120.64 124.15 1dmx n GLU 205 Ca -0.01 -3.49 0.00 0.00 -0.02 0.00 0.00 57.16 53.64 1dmx n GLU 205 Cb 0.46 -3.04 0.00 0.00 -0.02 0.00 0.00 31.44 28.84 1dmx n GLU 205 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1dmx n SER 206 N 4.96 0.98 -4.51 1.62 3.41 -1.17 -4.81 113.62 114.09 1dmx n SER 206 Ca 0.41 -1.24 -0.36 0.00 -0.26 0.00 0.00 58.87 57.42 1dmx n SER 206 Cb 0.39 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.22 1dmx n SER 206 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1dmx s VAL 207 N -0.24 4.58 -0.37 -3.33 1.01 -1.16 -1.04 120.40 119.86 1dmx s VAL 207 Ca 0.00 -0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.68 1dmx s VAL 207 Cb 0.00 -3.13 0.01 0.00 0.00 0.00 0.00 36.38 33.25 1dmx s VAL 207 CO 0.00 0.35 0.68 -0.89 0.00 0.00 0.00 175.10 175.24 1dmx s THR 208 N 1.38 4.83 0.15 3.92 2.01 -0.62 0.64 115.64 127.94 1dmx s THR 208 Ca 0.06 0.60 -0.22 0.00 0.31 0.00 0.00 61.69 62.43 1dmx s THR 208 Cb -0.15 -4.14 -0.08 0.00 0.01 0.00 0.00 72.50 68.15 1dmx s THR 208 CO 0.04 -0.40 0.69 0.26 -0.69 0.00 0.00 174.62 174.53 1dmx s TRP 209 N 2.85 3.82 -0.23 4.92 0.52 0.09 -1.40 118.94 129.51 1dmx s TRP 209 Ca 0.26 1.45 -0.03 0.00 0.02 0.00 0.00 56.10 57.81 1dmx s TRP 209 Cb -0.14 -2.64 0.07 0.00 -1.15 0.00 0.00 33.47 29.61 1dmx s TRP 209 CO 0.16 0.50 0.07 0.42 0.02 0.00 0.00 176.95 178.12 1dmx s ILE 210 N -1.22 0.47 -0.18 2.03 1.01 0.55 -2.65 121.20 121.20 1dmx s ILE 210 Ca 0.35 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 60.24 1dmx s ILE 210 Cb -0.20 -1.12 -0.02 0.00 0.01 0.00 0.00 42.46 41.13 1dmx s ILE 210 CO 0.23 -0.38 -0.06 -0.69 0.00 0.00 0.00 174.94 174.04 1dmx s VAL 211 N 1.86 3.51 -0.24 2.92 1.01 -0.11 0.20 120.40 129.55 1dmx s VAL 211 Ca 0.03 -0.47 -0.28 0.00 0.00 0.00 0.00 61.98 61.26 1dmx s VAL 211 Cb -0.17 -2.55 0.01 0.00 0.00 0.00 0.00 36.38 33.66 1dmx s VAL 211 CO -0.16 0.46 0.98 -1.58 0.00 0.00 0.00 175.10 174.81 1dmx s GLN 212 N 0.87 4.22 0.52 2.72 2.00 -0.16 -0.32 119.66 129.51 1dmx s GLN 212 Ca -0.01 1.22 0.26 0.00 -2.00 0.00 0.00 55.36 54.82 1dmx s GLN 212 Cb -0.15 -3.65 1.39 0.00 0.80 0.00 0.00 33.01 31.40 1dmx s GLN 212 CO 0.01 -0.62 1.96 -0.22 -0.50 0.00 0.00 175.29 175.93 1dmx h LYS 213 N 7.56 0.03 -5.13 1.67 3.64 -1.61 -3.41 116.57 119.32 1dmx h LYS 213 Ca -0.20 -0.00 -0.65 0.00 -1.27 0.00 0.00 60.65 58.52 1dmx h LYS 213 Cb 1.07 -0.01 -0.16 0.00 -0.41 0.00 0.00 32.23 32.72 1dmx h LYS 213 CO 0.95 0.02 -0.13 0.99 -2.27 0.00 0.00 179.45 179.01 1dmx s THR 214 N -5.04 5.07 0.67 1.00 2.01 -1.26 -5.05 115.64 113.04 1dmx s THR 214 Ca -0.05 0.23 -0.14 0.00 0.31 0.00 0.00 61.69 62.04 1dmx s THR 214 Cb 0.20 -3.91 0.00 0.00 0.01 0.00 0.00 72.50 68.80 1dmx s THR 214 CO 0.74 -0.17 1.09 -2.16 -0.69 0.00 0.00 174.62 173.43 1dmx s PRO 215 N 2.26 2.86 -0.16 4.92 0.04 -1.26 -4.63 135.00 139.01 1dmx s PRO 215 Ca 0.16 1.25 -0.04 0.00 0.04 0.00 0.00 61.00 62.41 1dmx s PRO 215 Cb -0.16 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 1dmx s PRO 215 CO 0.13 -1.19 -0.02 0.08 0.04 0.00 0.00 177.00 176.04 1dmx s VAL 216 N -2.55 4.01 0.49 -0.36 1.01 -0.17 -4.92 120.40 117.91 1dmx s VAL 216 Ca 0.64 -0.31 -0.18 0.00 0.00 0.00 0.00 61.98 62.13 1dmx s VAL 216 Cb -0.18 -2.77 -0.09 0.00 0.00 0.00 0.00 36.38 33.34 1dmx s VAL 216 CO 0.44 0.48 0.99 -1.61 0.00 0.00 0.00 175.10 175.40 1dmx s GLU 217 N 0.43 3.97 0.08 2.72 2.02 -1.26 -1.49 118.70 125.16 1dmx s GLU 217 Ca -0.03 1.07 -0.19 0.00 0.02 0.00 0.00 54.97 55.85 1dmx s GLU 217 Cb -0.14 -2.14 0.04 0.00 0.10 0.00 0.00 34.13 32.00 1dmx s GLU 217 CO 0.02 -0.26 0.45 0.14 0.02 0.00 0.00 175.26 175.64 1dmx s VAL 218 N -2.40 0.05 0.51 2.63 -7.23 -0.45 -4.47 120.40 109.03 1dmx s VAL 218 Ca 0.61 -0.40 -0.02 0.00 -1.81 0.00 0.00 61.98 60.36 1dmx s VAL 218 Cb -0.11 -1.03 0.01 0.00 0.56 0.00 0.00 36.38 35.81 1dmx s VAL 218 CO 0.25 -0.22 0.76 -0.94 -0.31 0.00 0.00 175.10 174.64 1dmx s SER 219 N -2.31 5.66 0.34 4.85 1.04 -1.17 -0.13 113.70 121.98 1dmx s SER 219 Ca -0.02 0.38 0.02 0.00 0.48 0.00 0.00 55.95 56.81 1dmx s SER 219 Cb 0.00 -1.49 0.62 0.00 0.10 0.00 0.00 66.02 65.25 1dmx s SER 219 CO -0.06 -0.89 1.99 -0.65 0.98 0.00 0.00 173.24 174.61 1dmx h PRO 220 N 0.16 0.87 -0.59 4.02 0.11 -1.94 -2.66 132.00 131.97 1dmx h PRO 220 Ca -0.45 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.65 1dmx h PRO 220 Cb 1.26 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 32.13 1dmx h PRO 220 CO 0.58 0.58 0.33 0.77 -0.21 0.00 0.00 178.00 180.04 1dmx h SER 221 N 0.90 0.50 -0.33 -2.05 0.02 -1.98 0.45 113.55 111.06 1dmx h SER 221 Ca 0.27 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.21 1dmx h SER 221 Cb -0.03 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1dmx h SER 221 CO -0.07 0.34 0.09 1.56 -1.14 0.00 0.00 176.83 177.61 1dmx h GLN 222 N 0.63 0.52 -0.08 3.45 4.20 -1.87 -2.56 115.11 119.39 1dmx h GLN 222 Ca 0.25 -0.12 -0.10 0.00 0.06 0.00 0.00 58.65 58.75 1dmx h GLN 222 Cb 0.11 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 1dmx h GLN 222 CO -0.15 0.57 -0.39 1.25 -0.67 0.00 0.00 178.83 179.44 1dmx h LEU 223 N 0.37 0.18 -1.11 1.46 6.46 -1.21 -2.71 115.31 118.76 1dmx h LEU 223 Ca 0.10 -0.07 -0.05 0.00 -0.12 0.00 0.00 57.88 57.74 1dmx h LEU 223 Cb 0.27 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.13 1dmx h LEU 223 CO -0.00 0.57 0.10 0.28 -0.62 0.00 0.00 178.44 178.76 1dmx h SER 224 N 0.15 0.68 0.28 1.25 0.02 0.07 -2.64 113.55 113.35 1dmx h SER 224 Ca 0.01 -0.12 -0.05 0.00 -0.84 0.00 0.00 61.79 60.79 1dmx h SER 224 Cb 0.77 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1dmx h SER 224 CO 0.06 0.69 -0.26 0.24 -1.14 0.00 0.00 176.83 176.42 1dmx h MET 225 N 0.71 0.00 -0.52 3.45 2.86 -1.12 -2.44 114.93 117.86 1dmx h MET 225 Ca 0.16 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.77 1dmx h MET 225 Cb 0.29 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 1dmx h MET 225 CO 0.00 0.26 0.23 0.74 1.06 0.00 0.00 176.91 179.20 1dmx h PHE 226 N 0.00 0.73 0.00 -0.22 -1.00 -1.48 -2.82 116.94 112.14 1dmx h PHE 226 Ca -0.00 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.75 1dmx h PHE 226 Cb 0.47 -0.23 0.00 0.00 3.61 0.00 0.00 35.95 39.80 1dmx h PHE 226 CO 0.00 0.55 0.00 0.54 -1.61 0.00 0.00 178.31 177.79 1dmx n ARG 227 N -4.36 0.79 -0.18 1.51 1.74 -0.92 -2.83 116.66 112.42 1dmx n ARG 227 Ca 0.04 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.24 1dmx n ARG 227 Cb 0.14 -1.33 0.21 0.00 -1.02 0.00 0.00 32.46 30.46 1dmx n ARG 227 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1dmx n THR 228 N -0.83 0.47 -1.99 0.55 -2.24 -1.06 -4.55 114.28 104.63 1dmx n THR 228 Ca 0.13 -0.74 -0.30 0.00 -2.27 0.00 0.00 64.05 60.87 1dmx n THR 228 Cb 0.06 1.02 0.03 0.00 -2.10 0.00 0.00 70.33 69.34 1dmx n THR 228 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1dmx s LEU 229 N -1.51 3.12 0.09 3.22 1.43 -1.13 -4.84 118.68 119.06 1dmx s LEU 229 Ca 0.38 1.19 0.08 0.00 -1.03 0.00 0.00 54.13 54.74 1dmx s LEU 229 Cb 0.23 -4.10 -0.03 0.00 0.03 0.00 0.00 46.19 42.32 1dmx s LEU 229 CO 0.31 -1.07 -0.20 -0.76 0.23 0.00 0.00 176.35 174.86 1dmx s LEU 230 N -5.20 2.27 0.23 1.79 1.02 0.64 -0.04 118.68 119.39 1dmx s LEU 230 Ca 0.56 -0.64 0.15 0.00 0.02 0.00 0.00 54.13 54.21 1dmx s LEU 230 Cb -0.11 -0.88 0.01 0.00 0.02 0.00 0.00 46.19 45.24 1dmx s LEU 230 CO 0.51 0.07 1.32 -0.26 0.02 0.00 0.00 176.35 178.01 1dmx h PHE 231 N 4.27 0.00 -3.47 0.29 0.04 0.02 -3.35 116.94 114.75 1dmx h PHE 231 Ca -0.45 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 59.79 1dmx h PHE 231 Cb 1.18 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.30 1dmx h PHE 231 CO 0.59 0.53 -0.09 -1.54 -0.60 0.00 0.00 178.31 177.20 1dmx s SER 232 N -6.33 6.64 0.88 2.17 1.04 -1.24 -4.73 113.70 112.13 1dmx s SER 232 Ca 0.03 0.96 0.00 0.00 0.48 0.00 0.00 55.95 57.42 1dmx s SER 232 Cb 0.08 -2.24 0.00 0.00 0.10 0.00 0.00 66.02 63.96 1dmx s SER 232 CO 0.76 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.49 1dmx n GLY 233 N -0.21 -1.14 3.75 7.32 0.00 -1.26 -2.55 105.19 111.11 1dmx n GLY 233 Ca 0.01 -1.66 -0.40 0.00 0.00 0.00 0.00 46.02 43.97 1dmx n GLY 233 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dmx s ARG 234 N -2.65 4.61 0.00 1.61 0.52 -1.26 -3.57 118.95 118.21 1dmx s ARG 234 Ca 0.00 1.22 0.00 0.00 -0.52 0.00 0.00 55.73 56.43 1dmx s ARG 234 Cb 0.00 -3.32 0.00 0.00 0.52 0.00 0.00 34.95 32.15 1dmx s ARG 234 CO 0.00 0.41 0.00 0.41 0.02 0.00 0.00 175.30 176.14 1dmx n GLY 235 N 1.96 3.04 3.72 -3.53 0.00 -1.26 -5.04 105.19 104.07 1dmx n GLY 235 Ca -0.03 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 1dmx n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dmx s GLU 236 N 0.00 0.22 0.48 1.61 2.02 -1.23 -5.03 118.70 116.77 1dmx s GLU 236 Ca 0.00 0.18 -0.21 0.00 0.02 0.00 0.00 54.97 54.96 1dmx s GLU 236 Cb 0.00 -1.74 -0.08 0.00 0.10 0.00 0.00 34.13 32.41 1dmx s GLU 236 CO 0.00 -2.80 1.08 -2.00 0.02 0.00 0.00 175.26 171.56 1dmx s GLU 237 N -5.28 3.75 -0.63 1.61 2.12 -1.26 -4.94 118.70 114.07 1dmx s GLU 237 Ca 0.67 1.50 -0.28 0.00 0.36 0.00 0.00 54.97 57.23 1dmx s GLU 237 Cb -0.14 -2.19 0.02 0.00 0.26 0.00 0.00 34.13 32.09 1dmx s GLU 237 CO 0.55 -0.50 1.36 -1.21 -0.54 0.00 0.00 175.26 174.93 1dmx s GLU 238 N -3.05 3.25 -0.63 4.30 2.02 -1.26 -4.72 118.70 118.60 1dmx s GLU 238 Ca 0.67 0.19 -0.10 0.00 0.02 0.00 0.00 54.97 55.75 1dmx s GLU 238 Cb -0.21 -4.14 0.16 0.00 0.10 0.00 0.00 34.13 30.04 1dmx s GLU 238 CO 0.25 -2.03 0.52 0.34 0.02 0.00 0.00 175.26 174.36 1dmx s ASP 239 N 4.23 5.99 0.43 -0.19 2.15 -1.26 -5.04 116.67 122.97 1dmx s ASP 239 Ca 0.46 -2.40 -0.23 0.00 0.43 0.00 0.00 52.55 50.81 1dmx s ASP 239 Cb -0.09 -2.06 -0.11 0.00 -0.30 0.00 0.00 42.92 40.36 1dmx s ASP 239 CO 0.21 -0.59 0.79 0.52 -0.17 0.00 0.00 175.17 175.94 1dmx n VAL 240 N 4.28 2.23 -3.13 1.11 0.31 -1.26 0.67 118.33 122.53 1dmx n VAL 240 Ca 0.03 -0.50 -0.45 0.00 -0.01 0.00 0.00 64.34 63.41 1dmx n VAL 240 Cb 0.42 -0.86 -0.04 0.00 -0.91 0.00 0.00 33.84 32.45 1dmx n VAL 240 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 1dmx s MET 241 N -1.86 3.19 0.08 5.55 1.75 0.95 -4.43 119.30 124.53 1dmx s MET 241 Ca 0.64 -1.56 -0.09 0.00 -1.25 0.00 0.00 55.69 53.42 1dmx s MET 241 Cb -0.57 -4.38 0.00 0.00 2.84 0.00 0.00 34.83 32.72 1dmx s MET 241 CO 0.57 -1.53 0.21 0.14 -0.65 0.00 0.00 175.02 173.76 1dmx s VAL 242 N 2.27 0.13 -1.42 10.11 -7.23 -1.26 -4.53 120.40 118.47 1dmx s VAL 242 Ca 0.15 -1.07 -0.11 0.00 -1.81 0.00 0.00 61.98 59.14 1dmx s VAL 242 Cb -0.20 -1.24 0.04 0.00 0.56 0.00 0.00 36.38 35.54 1dmx s VAL 242 CO 0.02 -0.59 1.12 0.59 -0.31 0.00 0.00 175.10 175.93 1dmx n ASN 243 N 0.08 -5.86 -2.44 4.85 3.02 -0.81 -4.89 115.26 109.21 1dmx n ASN 243 Ca -0.16 -0.62 -0.27 0.00 -0.03 0.00 0.00 54.58 53.50 1dmx n ASN 243 Cb 0.62 -4.65 -0.04 0.00 -0.61 0.00 0.00 39.78 35.10 1dmx n ASN 243 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1dmx n ASN 244 N -2.96 6.57 -4.21 6.41 6.94 -1.06 -4.91 115.26 122.05 1dmx n ASN 244 Ca 0.02 -3.25 -0.23 0.00 -0.02 0.00 0.00 54.58 51.10 1dmx n ASN 244 Cb 0.55 -1.19 -0.14 0.00 -2.36 0.00 0.00 39.78 36.64 1dmx n ASN 244 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 1dmx s TYR 245 N -1.94 1.58 0.41 -2.53 -0.85 -1.26 -4.67 117.35 108.09 1dmx s TYR 245 Ca 0.55 -0.36 -0.21 0.00 -0.52 0.00 0.00 57.07 56.53 1dmx s TYR 245 Cb 0.37 -0.94 -0.11 0.00 0.38 0.00 0.00 41.96 41.67 1dmx s TYR 245 CO -0.20 0.07 0.93 0.50 -1.52 0.00 0.00 175.55 175.32 1dmx s ARG 246 N -1.17 4.22 0.64 -3.49 3.52 -1.26 -5.04 118.95 116.36 1dmx s ARG 246 Ca 0.05 1.08 -0.12 0.00 -0.13 0.00 0.00 55.73 56.61 1dmx s ARG 246 Cb -0.08 -2.23 -0.02 0.00 -1.56 0.00 0.00 34.95 31.06 1dmx s ARG 246 CO 0.02 -0.00 1.04 -1.25 -0.81 0.00 0.00 175.30 174.30 1dmx s PRO 247 N -3.12 3.31 0.40 5.12 0.04 -1.26 -4.78 135.00 134.70 1dmx s PRO 247 Ca 0.61 0.92 -0.25 0.00 0.04 0.00 0.00 61.00 62.32 1dmx s PRO 247 Cb -0.09 -2.04 -0.11 0.00 0.04 0.00 0.00 34.50 32.29 1dmx s PRO 247 CO 0.14 -0.80 0.95 1.28 0.04 0.00 0.00 177.00 178.60 1dmx n LEU 248 N -2.71 2.12 -4.44 -3.56 4.32 -1.26 -4.35 117.00 107.12 1dmx n LEU 248 Ca 0.07 1.04 -0.25 0.00 -0.02 0.00 0.00 56.01 56.86 1dmx n LEU 248 Cb 0.54 -1.31 -0.11 0.00 -1.62 0.00 0.00 43.42 40.92 1dmx n LEU 248 CO 0.54 -1.65 -0.50 -1.10 -1.22 0.00 0.00 177.39 173.46 1dmx s GLN 249 N -1.88 1.58 0.34 3.23 -1.52 0.24 -4.94 119.66 116.70 1dmx s GLN 249 Ca 0.62 -1.64 -0.28 0.00 -1.95 0.00 0.00 55.36 52.11 1dmx s GLN 249 Cb -0.59 -1.75 -0.10 0.00 -0.22 0.00 0.00 33.01 30.35 1dmx s GLN 249 CO 0.57 0.35 1.24 -1.25 -0.25 0.00 0.00 175.29 175.96 1dmx s PRO 250 N -3.12 4.33 0.35 2.91 0.04 -1.26 -4.41 135.00 133.84 1dmx s PRO 250 Ca 0.25 2.07 0.11 0.00 0.04 0.00 0.00 61.00 63.47 1dmx s PRO 250 Cb -0.06 -3.00 0.66 0.00 0.04 0.00 0.00 34.50 32.14 1dmx s PRO 250 CO 0.12 -0.16 1.81 1.25 0.04 0.00 0.00 177.00 180.06 1dmx h LEU 251 N 3.28 0.09 0.00 -3.56 5.85 -1.93 -3.44 115.31 115.59 1dmx h LEU 251 Ca -0.49 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1dmx h LEU 251 Cb 1.23 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1dmx h LEU 251 CO 0.65 0.44 0.00 0.54 -0.34 0.00 0.00 178.44 179.73 1dmx n ARG 252 N -4.10 0.00 -0.84 1.25 5.12 -1.26 -2.62 116.66 114.21 1dmx n ARG 252 Ca -0.02 0.00 -0.06 0.00 -1.93 0.00 0.00 57.85 55.85 1dmx n ARG 252 Cb 0.41 0.00 0.21 0.00 -1.16 0.00 0.00 32.46 31.92 1dmx n ARG 252 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1dmx n ASP 253 N 5.59 3.11 -4.84 0.55 8.00 -1.26 -5.03 116.55 122.68 1dmx n ASP 253 Ca 0.00 -3.58 -0.32 0.00 0.71 0.00 0.00 54.79 51.59 1dmx n ASP 253 Cb 0.00 -0.67 -0.03 0.00 -0.02 0.00 0.00 41.12 40.40 1dmx n ASP 253 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1dmx s ARG 254 N -3.17 3.86 -0.48 -1.24 0.52 -1.08 -5.02 118.95 112.34 1dmx s ARG 254 Ca 0.47 1.00 -0.21 0.00 -0.52 0.00 0.00 55.73 56.47 1dmx s ARG 254 Cb 0.41 -2.12 0.04 0.00 0.52 0.00 0.00 34.95 33.80 1dmx s ARG 254 CO 0.04 -0.35 0.68 -1.59 0.02 0.00 0.00 175.30 174.11 1dmx s LYS 255 N -4.05 3.23 -0.76 3.54 -2.85 -1.26 -5.00 119.74 112.59 1dmx s LYS 255 Ca 0.60 -0.54 -0.19 0.00 -1.00 0.00 0.00 55.97 54.84 1dmx s LYS 255 Cb -0.11 -4.02 0.13 0.00 -2.06 0.00 0.00 37.83 31.77 1dmx s LYS 255 CO 0.32 -1.16 0.90 -1.17 0.10 0.00 0.00 175.35 174.34 1dmx s LEU 256 N 2.93 5.33 -0.05 2.77 2.96 -1.26 -4.53 118.68 126.84 1dmx s LEU 256 Ca 0.21 -1.77 -0.04 0.00 -0.22 0.00 0.00 54.13 52.31 1dmx s LEU 256 Cb -0.16 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.15 1dmx s LEU 256 CO 0.17 -1.06 0.16 0.00 -1.32 0.00 0.00 176.35 174.30 1dmx s ARG 257 N 2.51 3.43 0.16 1.98 1.70 -0.75 -1.79 118.95 126.19 1dmx s ARG 257 Ca 0.21 -0.26 0.06 0.00 -0.47 0.00 0.00 55.73 55.27 1dmx s ARG 257 Cb -0.14 -3.12 -0.04 0.00 -0.57 0.00 0.00 34.95 31.08 1dmx s ARG 257 CO -0.01 0.71 0.08 -1.54 -1.08 0.00 0.00 175.30 173.47 1dmx s SER 258 N -1.60 5.26 0.00 -2.89 1.04 -0.04 -0.66 113.70 114.81 1dmx s SER 258 Ca 0.23 -0.21 0.26 0.00 0.48 0.00 0.00 55.95 56.71 1dmx s SER 258 Cb -0.12 -1.30 0.64 0.00 0.10 0.00 0.00 66.02 65.34 1dmx s SER 258 CO 0.13 0.08 1.49 -1.54 0.98 0.00 0.00 173.24 174.39 1dmx n SER 259 N -0.20 1.14 -4.59 7.02 3.41 -0.78 -1.42 113.62 118.20 1dmx n SER 259 Ca -0.09 -0.95 -0.27 0.00 -0.26 0.00 0.00 58.87 57.30 1dmx n SER 259 Cb 0.55 0.19 -0.11 0.00 -0.26 0.00 0.00 64.21 64.58 1dmx n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1dmx s PHE 260 N -2.52 2.45 0.00 7.33 -0.71 -1.26 -4.91 117.98 118.36 1dmx s PHE 260 Ca 0.23 -0.68 0.00 0.00 -1.04 0.00 0.00 56.93 55.44 1dmx s PHE 260 Cb 0.19 -1.69 0.00 0.00 -1.21 0.00 0.00 43.02 40.31 1dmx s PHE 260 CO 0.54 0.42 0.22 2.89 -1.34 0.00 0.00 175.22 177.94