#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ubg n ALA 2 N 0.00 0.00 -2.42 3.17 0.00 -1.26 -5.13 120.51 114.87 1ubg n ALA 2 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1ubg n ALA 2 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.31 1ubg n ALA 2 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1ubg s GLN 3 N 0.00 1.57 0.50 0.00 -2.07 -1.26 -5.14 119.66 113.27 1ubg s GLN 3 Ca 0.00 -1.03 0.09 0.00 -1.82 0.00 0.00 55.36 52.59 1ubg s GLN 3 Cb 0.00 -1.73 0.05 0.00 -1.09 0.00 0.00 33.01 30.24 1ubg s GLN 3 CO 0.00 0.44 0.64 -1.14 -1.32 0.00 0.00 175.29 173.91 1ubg s GLN 4 N -1.24 2.50 0.00 9.60 2.00 -1.26 -5.09 119.66 126.17 1ubg s GLN 4 Ca 0.10 -1.53 0.00 0.00 -2.00 0.00 0.00 55.36 51.92 1ubg s GLN 4 Cb -0.09 -2.61 0.00 0.00 0.80 0.00 0.00 33.01 31.11 1ubg s GLN 4 CO 0.02 -0.57 0.00 0.00 -0.50 0.00 0.00 175.29 174.24 1ubg n ALA 5 N -1.99 0.55 -1.38 1.58 0.00 -1.26 -5.05 120.51 112.96 1ubg n ALA 5 Ca 0.10 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 53.08 1ubg n ALA 5 Cb 0.61 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.04 1ubg n ALA 5 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1ubg n PRO 6 N 0.00 0.03 -1.71 0.00 -0.04 -1.26 -4.82 135.00 127.21 1ubg n PRO 6 Ca 0.00 0.01 -0.43 0.00 -0.04 0.00 0.00 63.50 63.04 1ubg n PRO 6 Cb 0.00 -1.02 -0.03 0.00 -0.04 0.00 0.00 33.50 32.41 1ubg n PRO 6 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ubg n ASP 7 N 2.06 3.51 -0.04 3.54 2.03 -1.26 -4.64 116.55 121.74 1ubg n ASP 7 Ca 0.16 1.11 -0.01 0.00 0.52 0.00 0.00 54.79 56.57 1ubg n ASP 7 Cb 0.29 -1.52 -0.01 0.00 -0.72 0.00 0.00 41.12 39.17 1ubg n ASP 7 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1ubg n ARG 8 N 2.94 -0.04 -0.36 -0.67 1.85 -1.26 0.58 116.66 119.70 1ubg n ARG 8 Ca 0.13 0.39 0.01 0.00 -1.00 0.00 0.00 57.85 57.39 1ubg n ARG 8 Cb 0.33 -0.58 0.07 0.00 -1.05 0.00 0.00 32.46 31.23 1ubg n ARG 8 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1ubg n GLU 9 N -2.93 -0.17 0.07 2.89 -0.58 -1.26 0.52 120.64 119.17 1ubg n GLU 9 Ca 0.00 1.46 0.09 0.00 -0.42 0.00 0.00 57.16 58.29 1ubg n GLU 9 Cb 0.03 -2.17 0.38 0.00 -0.57 0.00 0.00 31.44 29.10 1ubg n GLU 9 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1ubg n LYS 10 N -5.45 0.09 -0.04 3.49 4.81 0.20 -2.40 118.16 118.87 1ubg n LYS 10 Ca 0.12 0.38 -0.00 0.00 -0.87 0.00 0.00 58.31 57.94 1ubg n LYS 10 Cb 0.41 -1.70 -0.11 0.00 0.02 0.00 0.00 35.03 33.66 1ubg n LYS 10 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ubg n ALA 11 N -1.64 2.07 0.05 3.14 0.00 0.18 -4.16 120.51 120.15 1ubg n ALA 11 Ca 0.02 -0.61 -0.12 0.00 0.00 0.00 0.00 53.44 52.72 1ubg n ALA 11 Cb 0.16 -0.24 -0.09 0.00 0.00 0.00 0.00 19.45 19.29 1ubg n ALA 11 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ubg h LEU 12 N 0.00 -0.14 0.00 0.00 5.85 0.09 -2.64 115.31 118.48 1ubg h LEU 12 Ca -0.19 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.16 1ubg h LEU 12 Cb 1.26 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.32 1ubg h LEU 12 CO 0.01 0.33 0.00 -0.62 -0.34 0.00 0.00 178.44 177.82 1ubg n GLU 13 N -4.95 0.47 0.11 1.25 1.02 -1.01 0.19 120.64 117.72 1ubg n GLU 13 Ca -0.09 0.04 -0.21 0.00 -0.02 0.00 0.00 57.16 56.89 1ubg n GLU 13 Cb 0.25 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 30.02 1ubg n GLU 13 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1ubg h LEU 14 N 0.00 0.64 0.10 -4.62 7.12 -1.67 -2.67 115.31 114.21 1ubg h LEU 14 Ca 0.00 -0.76 -0.25 0.00 0.13 0.00 0.00 57.88 57.01 1ubg h LEU 14 Cb 0.16 -0.21 -0.01 0.00 -0.53 0.00 0.00 40.66 40.08 1ubg h LEU 14 CO 0.00 1.61 -1.27 0.00 -0.13 0.00 0.00 178.44 178.64 1ubg h ALA 15 N 0.30 0.16 0.00 1.25 0.00 -1.04 -3.07 119.26 116.87 1ubg h ALA 15 Ca -0.24 -1.04 0.00 0.00 0.00 0.00 0.00 54.91 53.62 1ubg h ALA 15 Cb 2.09 0.46 0.00 0.00 0.00 0.00 0.00 17.79 20.34 1ubg h ALA 15 CO 0.23 0.74 0.35 1.98 0.00 0.00 0.00 179.25 182.55 1ubg h MET 16 N -0.43 0.00 0.01 0.00 1.85 0.20 0.84 114.93 117.40 1ubg h MET 16 Ca -0.28 0.00 -0.13 0.00 -0.61 0.00 0.00 59.70 58.68 1ubg h MET 16 Cb 1.65 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.67 1ubg h MET 16 CO 0.03 0.00 -0.69 0.00 -0.40 0.00 0.00 176.91 175.85 1ubg h ALA 17 N 1.28 0.13 -0.83 0.39 0.00 -1.53 -3.30 119.26 115.39 1ubg h ALA 17 Ca 0.00 -0.86 0.19 0.00 0.00 0.00 0.00 54.91 54.24 1ubg h ALA 17 Cb 0.71 0.36 -0.15 0.00 0.00 0.00 0.00 17.79 18.70 1ubg h ALA 17 CO 0.00 0.38 -0.09 1.96 0.00 0.00 0.00 179.25 181.51 1ubg h GLN 18 N -0.92 0.04 -0.00 0.00 1.08 0.66 -1.72 115.11 114.24 1ubg h GLN 18 Ca -0.18 -0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.03 1ubg h GLN 18 Cb 1.22 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.60 1ubg h GLN 18 CO -0.08 0.03 -0.37 0.82 -0.95 0.00 0.00 178.83 178.27 1ubg h ILE 19 N 0.04 0.00 -0.72 2.54 2.04 -0.92 -2.29 117.51 118.19 1ubg h ILE 19 Ca 0.44 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.44 1ubg h ILE 19 Cb 0.77 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.71 1ubg h ILE 19 CO -0.80 0.00 -0.20 0.44 0.00 0.00 0.00 178.15 177.59 1ubg h ASP 20 N -0.47 -0.73 0.02 1.72 3.32 -1.40 0.48 116.42 119.36 1ubg h ASP 20 Ca 0.01 0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 1ubg h ASP 20 Cb 0.50 0.47 -0.00 0.00 0.22 0.00 0.00 39.33 40.52 1ubg h ASP 20 CO -0.25 -0.25 -0.00 0.11 -1.72 0.00 0.00 179.24 177.13 1ubg h LYS 21 N -0.02 0.00 0.00 3.56 6.56 -1.12 1.02 116.57 126.58 1ubg h LYS 21 Ca 0.34 0.00 -0.36 0.00 -1.06 0.00 0.00 60.65 59.57 1ubg h LYS 21 Cb 0.54 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 32.13 1ubg h LYS 21 CO -0.75 0.00 -2.36 0.09 -2.06 0.00 0.00 179.45 174.37 1ubg n ASN 22 N -3.15 1.03 0.00 0.86 3.02 0.14 -4.71 115.26 112.45 1ubg n ASN 22 Ca -0.03 -0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.46 1ubg n ASN 22 Cb 0.08 0.40 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1ubg n ASN 22 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1ubg n PHE 23 N -2.93 0.00 0.00 3.10 3.72 0.46 -5.10 117.46 116.71 1ubg n PHE 23 Ca -0.37 -0.07 0.00 0.00 -0.05 0.00 0.00 57.45 56.97 1ubg n PHE 23 Cb 1.06 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.59 1ubg n PHE 23 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ubg n GLY 24 N -0.07 -0.23 0.05 1.37 0.00 0.35 -4.77 105.19 101.89 1ubg n GLY 24 Ca 0.00 -2.23 -0.02 0.00 0.00 0.00 0.00 46.02 43.77 1ubg n GLY 24 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ubg h LYS 25 N 4.44 0.00 0.00 1.61 1.79 -1.92 -3.31 116.57 119.17 1ubg h LYS 25 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1ubg h LYS 25 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1ubg h LYS 25 CO 0.00 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 178.78 1ubg n GLY 26 N 1.74 -0.19 0.29 3.86 0.00 -1.22 -3.73 105.19 105.94 1ubg n GLY 26 Ca -0.03 -0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.05 1ubg n GLY 26 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ubg h SER 27 N 0.00 -0.09 -3.53 1.61 0.02 -1.86 -3.41 113.55 106.29 1ubg h SER 27 Ca 0.00 0.18 -0.42 0.00 -0.84 0.00 0.00 61.79 60.72 1ubg h SER 27 Cb 0.00 0.27 -0.33 0.00 0.14 0.00 0.00 62.40 62.48 1ubg h SER 27 CO 0.00 -0.13 -0.78 -0.69 -1.14 0.00 0.00 176.83 174.09 1ubg s VAL 28 N -6.01 0.63 0.01 2.27 1.01 -1.24 -5.07 120.40 111.99 1ubg s VAL 28 Ca -0.13 -0.20 -0.09 0.00 0.00 0.00 0.00 61.98 61.56 1ubg s VAL 28 Cb 0.24 -0.62 0.00 0.00 0.00 0.00 0.00 36.38 36.00 1ubg s VAL 28 CO 0.76 0.23 0.18 -0.04 0.00 0.00 0.00 175.10 176.24 1ubg s MET 29 N 0.71 0.57 -0.39 2.72 1.00 -1.26 -5.08 119.30 117.58 1ubg s MET 29 Ca -0.10 -0.44 -0.14 0.00 0.00 0.00 0.00 55.69 55.01 1ubg s MET 29 Cb -0.13 0.24 0.01 0.00 0.00 0.00 0.00 34.83 34.95 1ubg s MET 29 CO 0.01 -0.15 0.27 1.03 0.00 0.00 0.00 175.02 176.18 1ubg s ARG 30 N -1.72 3.10 0.58 2.03 1.81 -1.26 -4.94 118.95 118.56 1ubg s ARG 30 Ca -0.12 -0.92 0.13 0.00 -1.72 0.00 0.00 55.73 53.10 1ubg s ARG 30 Cb -0.05 -3.91 0.45 0.00 -0.45 0.00 0.00 34.95 30.99 1ubg s ARG 30 CO 0.00 -0.66 1.07 1.28 -0.68 0.00 0.00 175.30 176.31 1ubg n LEU 31 N 5.13 0.00 0.09 2.53 4.77 -1.26 -0.80 117.00 127.47 1ubg n LEU 31 Ca -0.12 0.59 -0.17 0.00 -0.03 0.00 0.00 56.01 56.29 1ubg n LEU 31 Cb 0.48 -0.13 -0.14 0.00 -2.33 0.00 0.00 43.42 41.30 1ubg n LEU 31 CO 0.39 -0.59 -0.14 1.23 -1.33 0.00 0.00 177.39 176.95 1ubg h GLY 32 N 0.00 0.32 -4.15 -0.72 0.00 -2.00 -3.47 103.07 93.05 1ubg h GLY 32 Ca 0.24 -0.82 -0.61 0.00 0.00 0.00 0.00 47.33 46.14 1ubg h GLY 32 CO -0.00 0.72 -1.01 1.18 0.00 0.00 0.00 176.54 177.42 1ubg n GLU 33 N -3.52 0.02 -0.07 4.80 -0.58 0.02 -4.90 120.64 116.42 1ubg n GLU 33 Ca -0.11 0.01 -0.10 0.00 -0.42 0.00 0.00 57.16 56.54 1ubg n GLU 33 Cb 1.03 -1.03 -0.15 0.00 -0.57 0.00 0.00 31.44 30.73 1ubg n GLU 33 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1ubg n GLU 34 N 1.36 0.67 0.00 3.49 -0.58 -1.26 -4.81 120.64 119.51 1ubg n GLU 34 Ca 0.10 0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.96 1ubg n GLU 34 Cb 0.43 -1.63 0.00 0.00 -0.57 0.00 0.00 31.44 29.67 1ubg n GLU 34 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 1ubg n VAL 35 N -2.91 0.00 -0.18 2.62 3.14 -1.26 -4.90 118.33 114.84 1ubg n VAL 35 Ca -0.27 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.11 1ubg n VAL 35 Cb 1.11 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.89 1ubg n VAL 35 CO 0.00 0.00 0.00 -2.11 -6.46 0.00 0.00 176.83 168.26 1ubg n ARG 36 N 0.39 0.00 -3.09 1.45 1.85 -1.26 -4.97 116.66 111.03 1ubg n ARG 36 Ca 0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 57.85 56.65 1ubg n ARG 36 Cb 0.00 -0.18 -0.04 0.00 -1.05 0.00 0.00 32.46 31.19 1ubg n ARG 36 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1ubg n GLN 37 N -0.75 0.71 -1.71 2.89 1.13 -1.26 -5.02 117.38 113.37 1ubg n GLN 37 Ca 0.00 -2.87 -0.42 0.00 -1.94 0.00 0.00 57.00 51.77 1ubg n GLN 37 Cb 0.21 -1.28 -0.03 0.00 0.11 0.00 0.00 30.24 29.25 1ubg n GLN 37 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 1ubg s PRO 38 N -0.71 4.14 0.00 -1.09 0.02 -1.26 -4.80 135.00 131.31 1ubg s PRO 38 Ca 0.34 2.58 0.00 0.00 0.02 0.00 0.00 61.00 63.95 1ubg s PRO 38 Cb 0.18 -3.87 0.00 0.00 0.02 0.00 0.00 34.50 30.83 1ubg s PRO 38 CO -0.14 -0.89 0.00 0.44 -0.33 0.00 0.00 177.00 176.07 1ubg n ILE 39 N 5.15 0.00 -3.94 2.83 -6.64 -1.26 -4.63 119.36 110.87 1ubg n ILE 39 Ca 0.19 0.00 -0.14 0.00 -1.77 0.00 0.00 62.75 61.03 1ubg n ILE 39 Cb 0.40 -0.76 -0.14 0.00 -1.44 0.00 0.00 39.64 37.69 1ubg n ILE 39 CO 0.00 0.00 0.00 -0.94 -1.77 0.00 0.00 176.55 173.84 1ubg s SER 40 N 1.52 0.20 0.00 7.28 1.04 -1.26 -5.14 113.70 117.34 1ubg s SER 40 Ca 0.00 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.41 1ubg s SER 40 Cb 0.00 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.08 1ubg s SER 40 CO 0.00 -0.00 0.00 0.55 0.98 0.00 0.00 173.24 174.77 1ubg n VAL 41 N 3.22 0.00 -3.11 5.02 3.14 -1.26 -4.47 118.33 120.87 1ubg n VAL 41 Ca -0.15 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 60.83 1ubg n VAL 41 Cb 0.58 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 33.30 1ubg n VAL 41 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1ubg s ILE 42 N 0.00 5.04 0.58 1.55 1.01 0.23 -4.84 121.20 124.76 1ubg s ILE 42 Ca 0.00 1.24 -0.20 0.00 0.00 0.00 0.00 60.65 61.70 1ubg s ILE 42 Cb 0.00 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 1ubg s ILE 42 CO 0.00 0.16 1.24 -2.84 0.00 0.00 0.00 174.94 173.50 1ubg s PRO 43 N 1.51 3.02 -0.19 2.79 0.02 -1.26 -0.09 135.00 140.80 1ubg s PRO 43 Ca 0.31 1.92 0.16 0.00 0.02 0.00 0.00 61.00 63.41 1ubg s PRO 43 Cb -0.16 -2.01 0.61 0.00 0.02 0.00 0.00 34.50 32.95 1ubg s PRO 43 CO 0.12 -1.20 1.51 0.25 -0.33 0.00 0.00 177.00 177.36 1ubg n THR 44 N -1.44 2.37 0.00 0.99 -2.24 -1.26 -4.54 114.28 108.16 1ubg n THR 44 Ca 0.13 -1.71 0.00 0.00 -2.27 0.00 0.00 64.05 60.20 1ubg n THR 44 Cb 0.49 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 1ubg n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ubg n GLY 45 N -0.13 1.67 3.24 3.38 0.00 -1.26 -4.81 105.19 107.27 1ubg n GLY 45 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 1ubg n GLY 45 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ubg s SER 46 N -0.90 5.46 0.38 1.61 0.15 -1.26 -4.70 113.70 114.44 1ubg s SER 46 Ca 0.00 -1.48 0.10 0.00 0.70 0.00 0.00 55.95 55.27 1ubg s SER 46 Cb 0.00 -1.92 0.87 0.00 -1.71 0.00 0.00 66.02 63.26 1ubg s SER 46 CO 0.00 -0.47 1.92 -0.29 1.20 0.00 0.00 173.24 175.60 1ubg h ILE 47 N 6.17 0.89 0.08 6.45 6.09 -1.91 -0.07 117.51 135.20 1ubg h ILE 47 Ca -0.21 -0.21 0.01 0.00 -1.37 0.00 0.00 64.86 63.07 1ubg h ILE 47 Cb 1.08 0.22 -0.04 0.00 0.47 0.00 0.00 36.82 38.55 1ubg h ILE 47 CO 0.70 0.11 -0.39 -1.28 -3.07 0.00 0.00 178.15 174.22 1ubg h SER 48 N 0.62 -1.18 0.10 2.19 0.87 -1.86 -1.99 113.55 112.30 1ubg h SER 48 Ca 0.37 0.12 -0.00 0.00 -1.23 0.00 0.00 61.79 61.05 1ubg h SER 48 Cb 0.58 0.44 0.00 0.00 -0.44 0.00 0.00 62.40 62.98 1ubg h SER 48 CO -0.14 -0.41 -0.05 0.25 -0.53 0.00 0.00 176.83 175.95 1ubg h LEU 49 N -0.55 -0.11 0.00 2.23 5.85 -1.48 -3.16 115.31 118.09 1ubg h LEU 49 Ca -0.00 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1ubg h LEU 49 Cb 0.56 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.62 1ubg h LEU 49 CO -0.22 -0.00 0.00 -0.90 -0.34 0.00 0.00 178.44 176.98 1ubg n ASP 50 N -5.11 0.00 -0.34 1.25 5.68 -0.17 -0.03 116.55 117.84 1ubg n ASP 50 Ca -0.08 -0.15 0.12 0.00 -0.50 0.00 0.00 54.79 54.18 1ubg n ASP 50 Cb 0.11 -0.20 0.19 0.00 -1.14 0.00 0.00 41.12 40.08 1ubg n ASP 50 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 1ubg n VAL 51 N -1.20 0.00 -0.10 2.12 0.24 -0.76 -0.55 118.33 118.09 1ubg n VAL 51 Ca 0.10 -0.17 -0.09 0.00 -2.04 0.00 0.00 64.34 62.13 1ubg n VAL 51 Cb 0.11 0.79 -0.16 0.00 -1.47 0.00 0.00 33.84 33.12 1ubg n VAL 51 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ubg n ALA 52 N -0.44 1.54 0.44 2.33 0.00 0.96 -3.99 120.51 121.34 1ubg n ALA 52 Ca 0.10 -1.29 0.06 0.00 0.00 0.00 0.00 53.44 52.31 1ubg n ALA 52 Cb 0.40 -0.18 0.27 0.00 0.00 0.00 0.00 19.45 19.93 1ubg n ALA 52 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ubg n LEU 53 N -2.72 0.00 0.00 0.00 4.77 -0.08 -4.77 117.00 114.20 1ubg n LEU 53 Ca -0.32 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1ubg n LEU 53 Cb 1.13 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.74 1ubg n LEU 53 CO 0.42 -0.28 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 1ubg n GLY 54 N -0.24 1.31 1.32 -0.72 0.00 -1.25 -4.79 105.19 100.82 1ubg n GLY 54 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.06 1ubg n GLY 54 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ubg n ILE 55 N -2.00 0.00 -0.88 -0.61 -5.35 -1.25 -4.97 119.36 104.29 1ubg n ILE 55 Ca 0.00 -0.67 0.00 0.00 -0.27 0.00 0.00 62.75 61.81 1ubg n ILE 55 Cb 0.00 0.83 0.00 0.00 -1.74 0.00 0.00 39.64 38.73 1ubg n ILE 55 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ubg n GLY 56 N 0.33 0.52 0.00 3.28 0.00 0.29 -4.79 105.19 104.82 1ubg n GLY 56 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1ubg n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ubg n GLY 57 N -1.82 -0.50 3.70 -0.02 0.00 -1.19 -4.26 105.19 101.10 1ubg n GLY 57 Ca 0.00 -1.48 -0.42 0.00 0.00 0.00 0.00 46.02 44.12 1ubg n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ubg s LEU 58 N 0.00 4.36 -0.52 0.99 1.43 0.87 -4.61 118.68 121.19 1ubg s LEU 58 Ca 0.00 2.42 -0.27 0.00 -1.03 0.00 0.00 54.13 55.25 1ubg s LEU 58 Cb 0.00 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.61 1ubg s LEU 58 CO 0.00 -0.79 1.96 -2.16 0.23 0.00 0.00 176.35 175.59 1ubg s PRO 59 N 1.86 2.68 0.24 1.29 0.04 -1.26 0.76 135.00 140.60 1ubg s PRO 59 Ca 0.69 0.96 -0.30 0.00 0.04 0.00 0.00 61.00 62.39 1ubg s PRO 59 Cb -0.39 -4.39 -0.15 0.00 0.04 0.00 0.00 34.50 29.62 1ubg s PRO 59 CO 0.31 -2.65 1.04 0.54 0.04 0.00 0.00 177.00 176.28 1ubg n ARG 60 N 8.99 1.19 -0.98 4.56 1.74 -1.26 -2.65 116.66 128.25 1ubg n ARG 60 Ca 0.24 0.42 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 1ubg n ARG 60 Cb 0.51 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 1ubg n ARG 60 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ubg n GLY 61 N 1.59 1.19 3.22 -0.13 0.00 -1.25 -4.84 105.19 104.97 1ubg n GLY 61 Ca 0.12 -0.44 -0.12 0.00 0.00 0.00 0.00 46.02 45.58 1ubg n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ubg s ARG 62 N -2.46 0.38 -0.09 1.61 1.81 -1.08 -4.76 118.95 114.35 1ubg s ARG 62 Ca 0.00 0.54 -0.30 0.00 -1.72 0.00 0.00 55.73 54.25 1ubg s ARG 62 Cb 0.00 0.12 -0.04 0.00 -0.45 0.00 0.00 34.95 34.58 1ubg s ARG 62 CO 0.00 -0.08 1.43 0.54 -0.68 0.00 0.00 175.30 176.51 1ubg s VAL 63 N 0.51 3.92 -0.14 3.52 0.11 -1.26 -1.93 120.40 125.13 1ubg s VAL 63 Ca -0.03 1.16 0.00 0.00 -2.93 0.00 0.00 61.98 60.18 1ubg s VAL 63 Cb -0.04 -3.75 -0.01 0.00 -1.53 0.00 0.00 36.38 31.05 1ubg s VAL 63 CO -0.03 -0.08 -0.14 -0.63 -3.33 0.00 0.00 175.10 170.89 1ubg s ILE 64 N 3.48 2.88 -0.13 7.04 1.01 0.55 -1.14 121.20 134.90 1ubg s ILE 64 Ca 0.63 -0.71 -0.03 0.00 0.00 0.00 0.00 60.65 60.54 1ubg s ILE 64 Cb -0.28 -2.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.95 1ubg s ILE 64 CO 0.22 0.52 -0.03 -0.70 0.00 0.00 0.00 174.94 174.95 1ubg s GLU 65 N 0.54 3.43 -0.51 2.79 2.12 -0.83 -0.76 118.70 125.48 1ubg s GLU 65 Ca -0.09 -0.49 0.03 0.00 0.36 0.00 0.00 54.97 54.78 1ubg s GLU 65 Cb -0.16 -2.86 0.15 0.00 0.26 0.00 0.00 34.13 31.52 1ubg s GLU 65 CO 0.04 0.39 0.33 0.42 -0.54 0.00 0.00 175.26 175.90 1ubg s ILE 66 N -0.04 1.63 0.62 -3.70 1.01 -0.27 -0.47 121.20 119.98 1ubg s ILE 66 Ca 0.02 -3.09 -0.05 0.00 0.00 0.00 0.00 60.65 57.53 1ubg s ILE 66 Cb -0.13 -2.11 0.03 0.00 0.01 0.00 0.00 42.46 40.26 1ubg s ILE 66 CO 0.02 -1.00 0.92 -0.72 0.00 0.00 0.00 174.94 174.16 1ubg s TYR 67 N -0.25 3.05 0.00 3.97 1.13 -0.91 -2.93 117.35 121.42 1ubg s TYR 67 Ca 0.23 0.44 0.00 0.00 -1.41 0.00 0.00 57.07 56.33 1ubg s TYR 67 Cb -0.12 -2.91 0.00 0.00 -1.10 0.00 0.00 41.96 37.83 1ubg s TYR 67 CO -0.09 -1.05 0.00 0.41 -2.51 0.00 0.00 175.55 172.31 1ubg n GLY 68 N -2.66 4.34 2.69 5.49 0.00 -1.18 -2.17 105.19 111.69 1ubg n GLY 68 Ca 0.06 -0.52 -0.06 0.00 0.00 0.00 0.00 46.02 45.50 1ubg n GLY 68 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ubg n PRO 69 N -1.26 0.00 -3.05 1.61 -0.02 -1.26 -3.43 135.00 127.59 1ubg n PRO 69 Ca 0.00 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.09 1ubg n PRO 69 Cb 0.00 -0.96 -0.06 0.00 -0.02 0.00 0.00 33.50 32.46 1ubg n PRO 69 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ubg s GLU 70 N -1.93 4.47 -0.81 -0.52 2.02 -1.26 -4.22 118.70 116.46 1ubg s GLU 70 Ca 0.05 1.04 -0.02 0.00 0.02 0.00 0.00 54.97 56.06 1ubg s GLU 70 Cb 0.02 -3.27 -0.02 0.00 0.10 0.00 0.00 34.13 30.95 1ubg s GLU 70 CO 0.10 0.54 0.69 0.43 0.02 0.00 0.00 175.26 177.04 1ubg n SER 71 N 1.82 -3.67 0.00 -0.19 7.64 -1.26 -4.97 113.62 112.99 1ubg n SER 71 Ca -0.06 -0.48 0.00 0.00 1.01 0.00 0.00 58.87 59.34 1ubg n SER 71 Cb 0.49 -3.85 0.00 0.00 -1.01 0.00 0.00 64.21 59.84 1ubg n SER 71 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1ubg n SER 72 N -2.63 0.34 0.00 6.43 3.41 -1.26 -4.87 113.62 115.03 1ubg n SER 72 Ca -0.13 -0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.27 1ubg n SER 72 Cb 0.60 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 65.03 1ubg n SER 72 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ubg n GLY 73 N 0.58 4.04 0.00 5.00 0.00 -1.26 -4.52 105.19 109.03 1ubg n GLY 73 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1ubg n GLY 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ubg n LYS 74 N 0.00 0.00 -0.10 1.61 4.01 -1.26 0.61 118.16 123.04 1ubg n LYS 74 Ca 0.00 0.00 -0.08 0.00 -0.51 0.00 0.00 58.31 57.72 1ubg n LYS 74 Cb 0.00 0.00 -0.00 0.00 -0.51 0.00 0.00 35.03 34.52 1ubg n LYS 74 CO 0.00 0.00 0.00 1.79 -1.11 0.00 0.00 177.40 178.08 1ubg h THR 75 N 0.00 1.01 -1.08 -0.18 1.35 -1.96 0.58 112.91 112.63 1ubg h THR 75 Ca 0.00 -0.13 0.30 0.00 -0.55 0.00 0.00 66.41 66.03 1ubg h THR 75 Cb 0.00 0.60 -0.11 0.00 -1.73 0.00 0.00 68.15 66.91 1ubg h THR 75 CO 0.00 0.07 0.67 0.74 -0.25 0.00 0.00 175.52 176.75 1ubg h THR 76 N 0.38 0.42 0.49 6.82 2.02 -0.25 2.41 112.91 125.20 1ubg h THR 76 Ca 0.14 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1ubg h THR 76 Cb 0.02 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.47 1ubg h THR 76 CO -0.08 0.07 -0.24 0.58 0.37 0.00 0.00 175.52 176.22 1ubg h VAL 77 N 0.36 0.00 -0.58 3.16 2.07 0.07 -2.24 116.25 119.08 1ubg h VAL 77 Ca 0.67 -0.29 0.05 0.00 0.82 0.00 0.00 66.70 67.95 1ubg h VAL 77 Cb 1.68 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.38 1ubg h VAL 77 CO -0.40 0.00 -0.34 0.00 0.02 0.00 0.00 177.57 176.85 1ubg n ALA 78 N -2.56 -0.37 -0.23 1.67 0.00 0.39 0.47 120.51 119.89 1ubg n ALA 78 Ca -0.08 0.49 -0.04 0.00 0.00 0.00 0.00 53.44 53.81 1ubg n ALA 78 Cb 0.26 0.12 0.02 0.00 0.00 0.00 0.00 19.45 19.85 1ubg n ALA 78 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ubg h LEU 79 N 0.00 -1.09 -0.25 0.00 3.38 0.34 0.45 115.31 118.14 1ubg h LEU 79 Ca 0.09 0.23 0.06 0.00 0.09 0.00 0.00 57.88 58.35 1ubg h LEU 79 Cb 0.24 0.57 -0.06 0.00 0.09 0.00 0.00 40.66 41.50 1ubg h LEU 79 CO -0.54 -0.29 -0.14 0.45 0.09 0.00 0.00 178.44 178.01 1ubg h HIS 80 N -0.12 -0.33 -0.94 1.13 3.86 0.01 0.30 115.15 119.05 1ubg h HIS 80 Ca 0.27 0.03 0.26 0.00 -1.16 0.00 0.00 60.37 59.76 1ubg h HIS 80 Cb 0.55 0.19 -0.17 0.00 1.06 0.00 0.00 27.41 29.04 1ubg h HIS 80 CO -0.65 -0.21 0.08 0.00 0.86 0.00 0.00 177.93 178.02 1ubg h ALA 81 N 1.08 1.18 0.55 2.45 0.00 0.45 -0.37 119.26 124.60 1ubg h ALA 81 Ca 0.14 0.31 -0.03 0.00 0.00 0.00 0.00 54.91 55.33 1ubg h ALA 81 Cb 0.32 0.52 0.01 0.00 0.00 0.00 0.00 17.79 18.63 1ubg h ALA 81 CO -0.32 -0.55 -0.26 0.28 0.00 0.00 0.00 179.25 178.39 1ubg h VAL 82 N 0.05 0.00 -0.65 0.00 2.07 0.10 -2.98 116.25 114.84 1ubg h VAL 82 Ca 0.58 -0.14 0.11 0.00 0.82 0.00 0.00 66.70 68.06 1ubg h VAL 82 Cb 1.19 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.85 1ubg h VAL 82 CO -0.84 0.00 -0.23 0.00 0.02 0.00 0.00 177.57 176.52 1ubg n ALA 83 N -2.48 -0.02 -0.10 1.67 0.00 0.82 -0.70 120.51 119.69 1ubg n ALA 83 Ca -0.09 0.66 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1ubg n ALA 83 Cb 0.29 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.42 1ubg n ALA 83 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ubg n ASN 84 N -4.98 0.00 0.17 0.00 4.13 -0.53 0.26 115.26 114.32 1ubg n ASN 84 Ca 0.08 0.85 0.06 0.00 1.68 0.00 0.00 54.58 57.24 1ubg n ASN 84 Cb 0.28 -0.45 0.32 0.00 -1.54 0.00 0.00 39.78 38.39 1ubg n ASN 84 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ubg h ALA 85 N -2.00 1.26 0.01 5.41 0.00 -1.32 0.45 119.26 123.08 1ubg h ALA 85 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1ubg h ALA 85 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1ubg h ALA 85 CO 0.00 -0.26 -0.96 0.37 0.00 0.00 0.00 179.25 178.41 1ubg h GLN 86 N 0.00 0.03 -0.00 0.00 4.15 -0.77 0.21 115.11 118.73 1ubg h GLN 86 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1ubg h GLN 86 Cb 0.75 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.46 1ubg h GLN 86 CO 0.00 1.03 0.00 0.00 -1.93 0.00 0.00 178.83 177.93 1ubg n ALA 87 N -3.15 2.14 -2.14 3.38 0.00 0.15 -2.39 120.51 118.51 1ubg n ALA 87 Ca -0.25 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.15 1ubg n ALA 87 Cb 0.66 -1.00 0.09 0.00 0.00 0.00 0.00 19.45 19.20 1ubg n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ubg n ALA 88 N -0.50 3.51 0.00 0.00 0.00 -0.65 -4.95 120.51 117.93 1ubg n ALA 88 Ca 0.00 -3.10 0.00 0.00 0.00 0.00 0.00 53.44 50.34 1ubg n ALA 88 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1ubg n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ubg n GLY 89 N -0.54 2.95 3.70 0.00 0.00 -1.00 -5.00 105.19 105.29 1ubg n GLY 89 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1ubg n GLY 89 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ubg s GLY 90 N -1.81 1.83 -0.21 -0.02 0.00 0.75 -4.95 107.32 102.92 1ubg s GLY 90 Ca 0.00 0.61 0.02 0.00 0.00 0.00 0.00 44.72 45.34 1ubg s GLY 90 CO 0.00 1.01 -0.15 -0.42 0.00 0.00 0.00 173.10 173.54 1ubg s ILE 91 N -2.55 2.01 -0.22 0.90 1.01 -1.26 -4.11 121.20 116.98 1ubg s ILE 91 Ca 0.67 -1.17 -0.08 0.00 0.00 0.00 0.00 60.65 60.08 1ubg s ILE 91 Cb -0.23 -1.96 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 1ubg s ILE 91 CO 0.55 0.29 0.08 0.00 0.00 0.00 0.00 174.94 175.86 1ubg s ALA 92 N 1.25 3.31 -0.04 9.38 0.00 -1.26 -2.12 121.76 132.27 1ubg s ALA 92 Ca -0.01 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 50.91 1ubg s ALA 92 Cb -0.16 -2.06 -0.05 0.00 0.00 0.00 0.00 23.12 20.86 1ubg s ALA 92 CO -0.09 -0.21 0.25 0.00 0.00 0.00 0.00 175.76 175.70 1ubg s ALA 93 N 1.10 3.83 -0.17 0.00 0.00 -0.76 -2.88 121.76 122.88 1ubg s ALA 93 Ca 0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 51.96 51.48 1ubg s ALA 93 Cb -0.14 -2.10 0.04 0.00 0.00 0.00 0.00 23.12 20.93 1ubg s ALA 93 CO 0.03 0.60 -0.04 0.12 0.00 0.00 0.00 175.76 176.47 1ubg s PHE 94 N -1.15 1.67 -0.75 0.00 2.19 0.23 -1.71 117.98 118.46 1ubg s PHE 94 Ca 0.22 -1.08 -0.19 0.00 0.33 0.00 0.00 56.93 56.20 1ubg s PHE 94 Cb -0.13 -1.30 0.12 0.00 -1.31 0.00 0.00 43.02 40.40 1ubg s PHE 94 CO 0.11 -0.62 0.91 0.42 1.83 0.00 0.00 175.22 177.87 1ubg s ILE 95 N 1.64 4.76 -0.08 3.12 1.09 0.04 -1.82 121.20 129.96 1ubg s ILE 95 Ca 0.00 -1.20 -0.29 0.00 -1.10 0.00 0.00 60.65 58.06 1ubg s ILE 95 Cb -0.16 -4.63 -0.02 0.00 -1.06 0.00 0.00 42.46 36.60 1ubg s ILE 95 CO -0.08 -1.32 0.99 -0.62 -0.10 0.00 0.00 174.94 173.81 1ubg s ASP 96 N 3.49 7.26 0.00 3.58 2.15 0.76 -1.29 116.67 132.63 1ubg s ASP 96 Ca 0.22 1.55 0.00 0.00 0.43 0.00 0.00 52.55 54.74 1ubg s ASP 96 Cb -0.15 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 1ubg s ASP 96 CO 0.00 -0.38 0.23 0.00 -0.17 0.00 0.00 175.17 174.85 1ubg n ALA 97 N 4.67 1.05 -0.01 3.66 0.00 -1.23 -4.00 120.51 124.65 1ubg n ALA 97 Ca 0.08 -0.23 0.08 0.00 0.00 0.00 0.00 53.44 53.36 1ubg n ALA 97 Cb 0.49 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.80 1ubg n ALA 97 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ubg n GLU 98 N -0.01 0.61 -3.73 0.00 -0.58 -1.25 -4.88 120.64 110.79 1ubg n GLU 98 Ca 0.00 -0.16 -0.26 0.00 -0.42 0.00 0.00 57.16 56.32 1ubg n GLU 98 Cb 0.16 -1.45 0.06 0.00 -0.57 0.00 0.00 31.44 29.64 1ubg n GLU 98 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1ubg n HIS 99 N -2.19 -2.59 -3.24 -0.32 8.25 -1.26 -4.94 115.22 108.93 1ubg n HIS 99 Ca -0.05 0.96 -0.20 0.00 -0.26 0.00 0.00 57.72 58.17 1ubg n HIS 99 Cb 0.53 -4.58 -0.07 0.00 1.12 0.00 0.00 29.99 26.99 1ubg n HIS 99 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ubg s ALA 100 N -3.33 0.22 -0.03 -1.41 0.00 -1.26 -5.10 121.76 110.85 1ubg s ALA 100 Ca 0.58 -1.68 0.02 0.00 0.00 0.00 0.00 51.96 50.88 1ubg s ALA 100 Cb -0.27 -1.94 0.01 0.00 0.00 0.00 0.00 23.12 20.92 1ubg s ALA 100 CO 0.78 -2.07 -0.07 -1.17 0.00 0.00 0.00 175.76 173.22 1ubg s LEU 101 N 0.55 1.66 -0.46 0.00 2.96 -1.26 -5.10 118.68 117.03 1ubg s LEU 101 Ca 0.29 -0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 54.02 1ubg s LEU 101 Cb -0.02 -0.46 0.12 0.00 0.50 0.00 0.00 46.19 46.34 1ubg s LEU 101 CO -0.12 0.02 0.26 -0.62 -1.32 0.00 0.00 176.35 174.57 1ubg s ASP 102 N 0.39 5.26 0.23 3.68 -1.08 -1.26 -4.98 116.67 118.91 1ubg s ASP 102 Ca -0.05 -2.23 -0.08 0.00 -0.52 0.00 0.00 52.55 49.67 1ubg s ASP 102 Cb -0.10 -1.84 0.39 0.00 -1.46 0.00 0.00 42.92 39.92 1ubg s ASP 102 CO 0.00 -0.51 1.67 -0.65 0.52 0.00 0.00 175.17 176.20 1ubg h PRO 103 N 7.81 0.17 0.00 4.34 0.11 -1.99 0.23 132.00 142.67 1ubg h PRO 103 Ca -0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1ubg h PRO 103 Cb 1.02 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1ubg h PRO 103 CO 0.71 0.11 0.00 0.39 -0.21 0.00 0.00 178.00 179.00 1ubg n GLU 104 N -5.24 0.01 -0.07 1.05 1.02 -1.26 0.20 120.64 116.34 1ubg n GLU 104 Ca 0.12 0.48 -0.07 0.00 -0.02 0.00 0.00 57.16 57.67 1ubg n GLU 104 Cb 0.42 -1.52 -0.05 0.00 -0.02 0.00 0.00 31.44 30.28 1ubg n GLU 104 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 1ubg h TYR 105 N 0.00 0.00 -0.81 -0.32 3.20 -0.99 -2.50 116.97 115.55 1ubg h TYR 105 Ca 0.00 0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.07 1ubg h TYR 105 Cb 0.03 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.25 1ubg h TYR 105 CO 0.00 0.42 0.56 0.00 -1.64 0.00 0.00 178.16 177.50 1ubg h ALA 106 N -0.73 2.43 0.59 1.82 0.00 -0.17 -0.53 119.26 122.66 1ubg h ALA 106 Ca -0.05 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1ubg h ALA 106 Cb 0.54 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1ubg h ALA 106 CO -0.03 -0.67 -0.28 1.57 0.00 0.00 0.00 179.25 179.84 1ubg h LYS 107 N 0.22 -0.76 -0.15 0.00 5.09 0.23 0.68 116.57 121.88 1ubg h LYS 107 Ca 0.40 0.05 0.04 0.00 0.09 0.00 0.00 60.65 61.24 1ubg h LYS 107 Cb 1.25 0.17 -0.01 0.00 0.10 0.00 0.00 32.23 33.75 1ubg h LYS 107 CO -0.09 -0.45 0.30 0.87 -2.09 0.00 0.00 179.45 177.99 1ubg h LYS 108 N -0.98 0.00 -0.00 0.07 1.57 -0.64 0.25 116.57 116.84 1ubg h LYS 108 Ca -0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1ubg h LYS 108 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1ubg h LYS 108 CO 0.13 0.00 -0.31 1.28 -0.57 0.00 0.00 179.45 179.98 1ubg n LEU 109 N -3.32 0.67 0.00 2.94 4.77 -0.83 -4.90 117.00 116.32 1ubg n LEU 109 Ca 0.01 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1ubg n LEU 109 Cb 0.40 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1ubg n LEU 109 CO 0.21 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1ubg n GLY 110 N 1.40 1.27 3.79 -0.72 0.00 0.87 -4.89 105.19 106.91 1ubg n GLY 110 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1ubg n GLY 110 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ubg s VAL 111 N -2.00 4.83 -0.76 1.61 1.01 0.21 -4.61 120.40 120.69 1ubg s VAL 111 Ca 0.00 1.22 -0.19 0.00 0.00 0.00 0.00 61.98 63.01 1ubg s VAL 111 Cb 0.00 -3.91 0.12 0.00 0.00 0.00 0.00 36.38 32.59 1ubg s VAL 111 CO 0.00 0.49 0.93 -0.62 0.00 0.00 0.00 175.10 175.90 1ubg s ASP 112 N -0.67 6.41 0.07 3.32 2.15 -1.26 -4.38 116.67 122.30 1ubg s ASP 112 Ca 0.30 -1.69 -0.29 0.00 0.43 0.00 0.00 52.55 51.30 1ubg s ASP 112 Cb -0.19 -2.36 -0.18 0.00 -0.30 0.00 0.00 42.92 39.90 1ubg s ASP 112 CO 0.18 -1.12 1.60 0.71 -0.17 0.00 0.00 175.17 176.37 1ubg h THR 113 N 5.79 0.56 -1.08 1.71 1.35 -1.93 -2.56 112.91 116.74 1ubg h THR 113 Ca -0.08 -0.09 0.29 0.00 -0.55 0.00 0.00 66.41 65.99 1ubg h THR 113 Cb 1.05 0.61 -0.08 0.00 -1.73 0.00 0.00 68.15 68.00 1ubg h THR 113 CO 1.09 0.02 0.73 0.44 -0.25 0.00 0.00 175.52 177.54 1ubg h ASP 114 N -0.65 0.29 -0.60 5.36 3.32 -2.02 1.87 116.42 124.00 1ubg h ASP 114 Ca -0.06 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ubg h ASP 114 Cb 0.48 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1ubg h ASP 114 CO 0.10 0.05 0.00 -1.54 -1.72 0.00 0.00 179.24 176.13 1ubg n SER 115 N -4.48 4.47 -4.78 6.45 3.41 -1.11 -4.89 113.62 112.69 1ubg n SER 115 Ca 0.25 -2.43 -0.38 0.00 -0.26 0.00 0.00 58.87 56.06 1ubg n SER 115 Cb 1.01 -0.56 -0.06 0.00 -0.26 0.00 0.00 64.21 64.33 1ubg n SER 115 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1ubg s LEU 116 N -1.77 4.37 -0.28 1.04 0.20 0.64 -4.74 118.68 118.14 1ubg s LEU 116 Ca 0.47 0.85 -0.19 0.00 0.69 0.00 0.00 54.13 55.96 1ubg s LEU 116 Cb 0.31 -2.60 -0.02 0.00 -0.43 0.00 0.00 46.19 43.44 1ubg s LEU 116 CO 0.22 0.17 0.57 -0.76 -0.29 0.00 0.00 176.35 176.26 1ubg s LEU 117 N -0.23 4.11 0.18 -0.68 1.43 -1.14 -5.00 118.68 117.35 1ubg s LEU 117 Ca 0.24 0.47 0.08 0.00 -1.03 0.00 0.00 54.13 53.89 1ubg s LEU 117 Cb -0.16 -2.73 -0.04 0.00 0.03 0.00 0.00 46.19 43.29 1ubg s LEU 117 CO 0.11 -0.38 -0.04 -0.69 0.23 0.00 0.00 176.35 175.59 1ubg s VAL 118 N 2.44 3.50 -0.16 -1.59 1.01 -1.26 0.75 120.40 125.09 1ubg s VAL 118 Ca 0.23 -1.54 -0.13 0.00 0.00 0.00 0.00 61.98 60.54 1ubg s VAL 118 Cb -0.15 -2.76 0.04 0.00 0.00 0.00 0.00 36.38 33.52 1ubg s VAL 118 CO 0.10 -0.12 0.41 -0.55 0.00 0.00 0.00 175.10 174.94 1ubg s SER 119 N -2.93 -0.45 -0.61 3.32 0.15 -0.75 -4.91 113.70 107.52 1ubg s SER 119 Ca 0.27 0.83 0.06 0.00 0.70 0.00 0.00 55.95 57.81 1ubg s SER 119 Cb -0.09 0.81 0.23 0.00 -1.71 0.00 0.00 66.02 65.26 1ubg s SER 119 CO 0.17 -0.16 0.66 0.00 1.20 0.00 0.00 173.24 175.11 1ubg n GLN 120 N 3.24 2.06 -0.74 5.44 6.02 -1.26 -0.17 117.38 131.97 1ubg n GLN 120 Ca -0.16 -4.38 -0.04 0.00 -0.01 0.00 0.00 57.00 52.41 1ubg n GLN 120 Cb 0.57 -2.09 0.00 0.00 1.02 0.00 0.00 30.24 29.74 1ubg n GLN 120 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1ubg n PRO 121 N 1.19 0.00 0.00 -1.09 -0.02 -1.26 -4.98 135.00 128.84 1ubg n PRO 121 Ca 0.27 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1ubg n PRO 121 Cb 0.42 -0.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.94 1ubg n PRO 121 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1ubg n ASP 122 N 2.92 2.97 -4.14 2.55 8.00 -1.26 -5.02 116.55 122.57 1ubg n ASP 122 Ca -0.00 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.32 1ubg n ASP 122 Cb 0.08 0.41 -0.12 0.00 -0.02 0.00 0.00 41.12 41.46 1ubg n ASP 122 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1ubg s THR 123 N -1.44 1.00 -1.19 -3.53 -4.23 -1.26 -4.99 115.64 100.00 1ubg s THR 123 Ca 0.00 -1.17 0.09 0.00 -1.18 0.00 0.00 61.69 59.43 1ubg s THR 123 Cb 0.00 -0.96 0.11 0.00 1.34 0.00 0.00 72.50 72.98 1ubg s THR 123 CO 0.00 -0.19 1.22 0.61 -0.54 0.00 0.00 174.62 175.73 1ubg n GLY 124 N 1.50 -0.70 0.07 3.99 0.00 0.17 -2.16 105.19 108.05 1ubg n GLY 124 Ca -0.20 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 45.69 1ubg n GLY 124 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ubg h GLU 125 N 0.00 0.00 -0.59 1.61 5.08 -1.87 -3.30 114.58 115.51 1ubg h GLU 125 Ca 0.00 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.48 1ubg h GLU 125 Cb 0.12 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.26 1ubg h GLU 125 CO 0.00 0.41 -0.06 0.37 -1.00 0.00 0.00 179.01 178.73 1ubg h GLN 126 N -1.00 0.06 -0.28 2.33 4.15 -1.89 -2.29 115.11 116.20 1ubg h GLN 126 Ca -0.08 -0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.38 1ubg h GLN 126 Cb 0.63 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 28.23 1ubg h GLN 126 CO -0.05 0.04 -0.54 0.00 -1.93 0.00 0.00 178.83 176.36 1ubg h ALA 127 N 1.56 -0.82 -0.23 3.38 0.00 -1.59 0.41 119.26 121.96 1ubg h ALA 127 Ca 0.30 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.25 1ubg h ALA 127 Cb 0.48 1.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1ubg h ALA 127 CO -0.55 -1.05 0.22 -0.07 0.00 0.00 0.00 179.25 177.79 1ubg h LEU 128 N -0.47 0.00 0.04 0.00 3.38 -1.50 -0.64 115.31 116.12 1ubg h LEU 128 Ca 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ubg h LEU 128 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ubg h LEU 128 CO -0.51 0.00 -0.02 -0.33 0.09 0.00 0.00 178.44 177.67 1ubg h GLU 129 N 0.00 -0.06 -0.01 1.13 4.39 -0.13 0.35 114.58 120.25 1ubg h GLU 129 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1ubg h GLU 129 Cb 0.54 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1ubg h GLU 129 CO -0.00 0.56 0.01 -0.84 -1.16 0.00 0.00 179.01 177.58 1ubg h ILE 130 N -0.92 0.43 0.00 3.13 3.07 0.21 0.43 117.51 123.86 1ubg h ILE 130 Ca -0.01 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.40 1ubg h ILE 130 Cb 0.64 0.99 0.00 0.00 -0.27 0.00 0.00 36.82 38.19 1ubg h ILE 130 CO 0.01 0.00 -0.77 0.00 -1.05 0.00 0.00 178.15 176.34 1ubg n ALA 131 N -2.28 3.41 0.03 0.16 0.00 -0.30 -2.29 120.51 119.24 1ubg n ALA 131 Ca -0.03 -0.36 -0.18 0.00 0.00 0.00 0.00 53.44 52.87 1ubg n ALA 131 Cb 0.09 -1.05 -0.14 0.00 0.00 0.00 0.00 19.45 18.34 1ubg n ALA 131 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1ubg h ASP 132 N 0.00 0.38 0.72 0.00 1.82 0.20 -3.16 116.42 116.38 1ubg h ASP 132 Ca 0.00 -0.68 0.00 0.00 -0.39 0.00 0.00 57.03 55.96 1ubg h ASP 132 Cb 0.65 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.54 1ubg h ASP 132 CO 0.00 1.59 -0.56 1.15 -1.61 0.00 0.00 179.24 179.81 1ubg n MET 133 N -3.42 0.17 0.15 0.28 0.00 0.19 -2.58 117.12 111.91 1ubg n MET 133 Ca -0.24 0.05 0.10 0.00 0.00 0.00 0.00 57.70 57.61 1ubg n MET 133 Cb 1.05 -1.60 0.07 0.00 0.00 0.00 0.00 33.22 32.74 1ubg n MET 133 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 1ubg h LEU 134 N 0.00 0.00 0.00 3.17 5.85 -1.57 -3.24 115.31 119.52 1ubg h LEU 134 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ubg h LEU 134 Cb 0.64 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1ubg h LEU 134 CO 0.00 0.07 -1.54 0.55 -0.34 0.00 0.00 178.44 177.18 1ubg n VAL 135 N -2.91 0.19 0.17 1.05 3.14 -1.19 -4.00 118.33 114.77 1ubg n VAL 135 Ca 0.01 -0.45 0.04 0.00 -2.96 0.00 0.00 64.34 60.99 1ubg n VAL 135 Cb 0.57 -0.00 0.24 0.00 -1.06 0.00 0.00 33.84 33.60 1ubg n VAL 135 CO 0.00 0.00 0.00 0.03 -6.46 0.00 0.00 176.83 170.40 1ubg h ARG 136 N 0.00 0.00 0.00 1.45 3.08 -1.52 -2.90 114.38 114.49 1ubg h ARG 136 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1ubg h ARG 136 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.98 1ubg h ARG 136 CO 0.00 0.43 0.00 -1.13 -1.07 0.00 0.00 179.97 178.20 1ubg n SER 137 N -3.45 0.00 -0.39 7.04 3.41 -1.23 -4.85 113.62 114.15 1ubg n SER 137 Ca 0.00 0.47 -0.05 0.00 -0.26 0.00 0.00 58.87 59.04 1ubg n SER 137 Cb 0.58 -0.48 -0.02 0.00 -0.26 0.00 0.00 64.21 64.02 1ubg n SER 137 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ubg n GLY 138 N -0.35 0.47 0.11 5.00 0.00 -1.10 -4.82 105.19 104.50 1ubg n GLY 138 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1ubg n GLY 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ubg h ALA 139 N 0.02 -0.04 -2.36 4.61 0.00 -1.85 -3.45 119.26 116.18 1ubg h ALA 139 Ca -0.10 -0.73 -0.49 0.00 0.00 0.00 0.00 54.91 53.59 1ubg h ALA 139 Cb 1.05 0.15 0.06 0.00 0.00 0.00 0.00 17.79 19.04 1ubg h ALA 139 CO 0.15 0.39 0.38 -0.51 0.00 0.00 0.00 179.25 179.66 1ubg s LEU 140 N -7.88 3.55 0.02 0.00 2.01 -1.26 -4.33 118.68 110.79 1ubg s LEU 140 Ca -0.15 1.86 -0.03 0.00 0.01 0.00 0.00 54.13 55.81 1ubg s LEU 140 Cb 0.01 -4.54 -0.02 0.00 0.01 0.00 0.00 46.19 41.65 1ubg s LEU 140 CO 0.80 -1.15 -0.07 0.47 1.01 0.00 0.00 176.35 177.42 1ubg n ASP 141 N -1.89 1.06 -4.45 2.29 9.92 -0.90 -4.71 116.55 117.87 1ubg n ASP 141 Ca 0.09 0.15 -0.35 0.00 -0.53 0.00 0.00 54.79 54.15 1ubg n ASP 141 Cb 0.53 -0.36 -0.12 0.00 -0.64 0.00 0.00 41.12 40.52 1ubg n ASP 141 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1ubg s ILE 142 N -2.17 4.01 -0.08 0.53 1.10 -1.26 -1.13 121.20 122.21 1ubg s ILE 142 Ca -0.06 -0.29 0.02 0.00 -0.51 0.00 0.00 60.65 59.81 1ubg s ILE 142 Cb 0.01 -2.82 0.01 0.00 0.15 0.00 0.00 42.46 39.82 1ubg s ILE 142 CO 0.09 0.42 -0.13 -0.51 -2.11 0.00 0.00 174.94 172.70 1ubg s ILE 143 N 1.08 1.24 -0.15 2.00 2.07 -1.13 -1.83 121.20 124.48 1ubg s ILE 143 Ca 0.02 -0.53 0.02 0.00 -1.41 0.00 0.00 60.65 58.75 1ubg s ILE 143 Cb -0.14 -1.13 0.02 0.00 0.13 0.00 0.00 42.46 41.33 1ubg s ILE 143 CO 0.02 0.38 -0.19 0.54 -1.91 0.00 0.00 174.94 173.78 1ubg s VAL 144 N 0.73 1.91 -0.31 4.00 0.11 -0.70 -1.19 120.40 124.95 1ubg s VAL 144 Ca -0.13 -0.87 -0.15 0.00 -2.93 0.00 0.00 61.98 57.90 1ubg s VAL 144 Cb -0.16 -1.72 -0.02 0.00 -1.53 0.00 0.00 36.38 32.95 1ubg s VAL 144 CO 0.03 0.52 0.35 -0.63 -3.33 0.00 0.00 175.10 172.04 1ubg s ILE 145 N 1.09 5.18 -0.48 7.04 1.09 -0.16 -0.78 121.20 134.17 1ubg s ILE 145 Ca -0.01 0.23 -0.24 0.00 -1.10 0.00 0.00 60.65 59.53 1ubg s ILE 145 Cb -0.14 -3.76 0.03 0.00 -1.06 0.00 0.00 42.46 37.53 1ubg s ILE 145 CO -0.07 0.02 0.84 -0.62 -0.10 0.00 0.00 174.94 175.01 1ubg s ASP 146 N 1.71 6.39 0.00 3.58 -1.08 -0.41 -2.75 116.67 124.11 1ubg s ASP 146 Ca 0.12 -0.19 0.00 0.00 -0.52 0.00 0.00 52.55 51.96 1ubg s ASP 146 Cb -0.16 -2.41 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 1ubg s ASP 146 CO 0.11 -1.03 0.00 -1.20 0.52 0.00 0.00 175.17 173.57 1ubg n SER 147 N 6.98 -0.58 0.00 -0.34 7.64 -0.93 -3.54 113.62 122.85 1ubg n SER 147 Ca 0.02 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.96 1ubg n SER 147 Cb 0.48 -0.29 0.25 0.00 -1.01 0.00 0.00 64.21 63.64 1ubg n SER 147 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1ubg n VAL 148 N 0.38 1.16 -0.04 0.44 0.31 0.19 -2.77 118.33 117.99 1ubg n VAL 148 Ca 0.00 0.29 -0.19 0.00 -0.01 0.00 0.00 64.34 64.42 1ubg n VAL 148 Cb 0.00 -1.09 -0.13 0.00 -0.91 0.00 0.00 33.84 31.71 1ubg n VAL 148 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ubg n ALA 149 N -1.48 1.10 1.34 3.52 0.00 -1.26 -4.19 120.51 119.53 1ubg n ALA 149 Ca 0.03 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.70 1ubg n ALA 149 Cb 0.13 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.08 1ubg n ALA 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ubg n ALA 150 N -3.05 2.24 -2.42 0.00 0.00 -1.11 -4.44 120.51 111.72 1ubg n ALA 150 Ca -0.36 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.66 1ubg n ALA 150 Cb 1.03 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 19.49 1ubg n ALA 150 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ubg n LEU 151 N -0.35 6.73 -4.69 0.00 4.32 -1.25 -4.80 117.00 116.97 1ubg n LEU 151 Ca 0.00 -4.77 -0.41 0.00 -0.02 0.00 0.00 56.01 50.81 1ubg n LEU 151 Cb 0.05 -1.43 -0.04 0.00 -1.62 0.00 0.00 43.42 40.38 1ubg n LEU 151 CO 0.00 1.49 0.57 0.68 -1.22 0.00 0.00 177.39 178.91 1ubg s VAL 152 N -0.32 4.92 1.37 4.08 -7.23 -1.26 -4.44 120.40 117.53 1ubg s VAL 152 Ca 0.39 1.65 -0.20 0.00 -1.81 0.00 0.00 61.98 62.02 1ubg s VAL 152 Cb 0.10 -4.14 0.35 0.00 0.56 0.00 0.00 36.38 33.25 1ubg s VAL 152 CO 0.01 0.11 0.92 -2.65 -0.31 0.00 0.00 175.10 173.18 1ubg n PRO 153 N 4.62 -3.99 0.41 4.82 -0.02 -1.26 -0.66 135.00 138.92 1ubg n PRO 153 Ca 0.03 -1.17 -0.18 0.00 -2.02 0.00 0.00 63.50 60.16 1ubg n PRO 153 Cb 0.50 -2.01 -0.09 0.00 -0.02 0.00 0.00 33.50 31.87 1ubg n PRO 153 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ubg h ARG 154 N -3.30 -1.10 -6.49 -0.52 3.08 -1.95 -3.29 114.38 100.82 1ubg h ARG 154 Ca -0.50 0.07 -0.57 0.00 0.07 0.00 0.00 59.98 59.06 1ubg h ARG 154 Cb 1.34 0.25 0.05 0.00 0.08 0.00 0.00 29.97 31.69 1ubg h ARG 154 CO 0.35 -0.73 0.92 0.00 -1.07 0.00 0.00 179.97 179.43 1ubg n ALA 155 N -2.68 1.62 -2.11 0.04 0.00 -1.26 -4.81 120.51 111.30 1ubg n ALA 155 Ca -0.14 0.40 -0.21 0.00 0.00 0.00 0.00 53.44 53.49 1ubg n ALA 155 Cb 0.47 -2.43 0.04 0.00 0.00 0.00 0.00 19.45 17.53 1ubg n ALA 155 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1ubg s GLU 156 N 1.66 2.32 0.04 0.00 -1.05 -1.24 -5.03 118.70 115.40 1ubg s GLU 156 Ca 0.81 -1.71 0.00 0.00 -0.15 0.00 0.00 54.97 53.92 1ubg s GLU 156 Cb -0.63 -2.53 0.00 0.00 -0.44 0.00 0.00 34.13 30.53 1ubg s GLU 156 CO 0.39 -0.78 0.00 1.51 0.95 0.00 0.00 175.26 177.33 1ubg n ILE 157 N -2.12 -0.18 -3.70 1.83 3.06 -1.26 -4.84 119.36 112.16 1ubg n ILE 157 Ca 0.12 0.10 -0.37 0.00 -2.50 0.00 0.00 62.75 60.09 1ubg n ILE 157 Cb 0.62 -0.16 -0.10 0.00 0.54 0.00 0.00 39.64 40.54 1ubg n ILE 157 CO 0.00 0.00 0.00 -1.83 -2.50 0.00 0.00 176.55 172.22 1ubg s GLU 158 N -3.84 2.37 0.00 9.51 4.04 -1.26 -4.52 118.70 124.99 1ubg s GLU 158 Ca 0.00 -2.12 0.00 0.00 0.04 0.00 0.00 54.97 52.89 1ubg s GLU 158 Cb 0.00 -3.74 0.00 0.00 0.02 0.00 0.00 34.13 30.41 1ubg s GLU 158 CO 0.00 -1.14 0.00 0.41 -1.84 0.00 0.00 175.26 172.69 1ubg n GLY 159 N 4.18 0.68 0.00 -3.83 0.00 -1.26 -5.15 105.19 99.82 1ubg n GLY 159 Ca 0.01 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1ubg n GLY 159 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ubg n GLU 160 N 0.00 0.00 -1.17 1.61 2.13 -1.26 -5.19 120.64 116.76 1ubg n GLU 160 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1ubg n GLU 160 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1ubg n GLU 160 CO 0.00 0.00 0.00 -0.12 -0.41 0.00 0.00 177.13 176.60 1ubg n MET 161 N 0.00 0.00 0.00 5.31 1.56 -1.26 -4.86 117.12 117.87 1ubg n MET 161 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1ubg n MET 161 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 1ubg n MET 161 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1ubg n GLY 162 N 0.00 2.49 0.09 -5.12 0.00 -1.26 -5.06 105.19 96.33 1ubg n GLY 162 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1ubg n GLY 162 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ubg n ASP 163 N 0.00 -2.27 0.00 1.61 9.92 -1.26 -4.76 116.55 119.79 1ubg n ASP 163 Ca 0.00 0.06 0.00 0.00 -0.53 0.00 0.00 54.79 54.32 1ubg n ASP 163 Cb 0.00 0.71 0.00 0.00 -0.64 0.00 0.00 41.12 41.19 1ubg n ASP 163 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 1ubg n SER 164 N -0.50 -0.14 -3.35 -2.24 3.41 -1.26 -4.53 113.62 105.02 1ubg n SER 164 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.58 1ubg n SER 164 Cb 0.00 -0.35 0.02 0.00 -0.26 0.00 0.00 64.21 63.62 1ubg n SER 164 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1ubg s HIS 165 N -0.08 0.08 0.00 7.33 3.76 -1.26 -5.18 115.29 119.94 1ubg s HIS 165 Ca 0.00 -0.48 0.00 0.00 -0.15 0.00 0.00 55.06 54.43 1ubg s HIS 165 Cb 0.00 0.70 0.00 0.00 1.11 0.00 0.00 32.58 34.39 1ubg s HIS 165 CO 0.00 -0.93 0.00 1.33 -0.85 0.00 0.00 174.74 174.29 1ubg n VAL 166 N -0.72 0.00 -0.88 -0.90 0.24 -1.26 -4.51 118.33 110.30 1ubg n VAL 166 Ca -0.03 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.86 1ubg n VAL 166 Cb 0.59 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.88 1ubg n VAL 166 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ubg n GLY 167 N -0.03 -0.10 0.00 7.63 0.00 -1.26 -4.59 105.19 106.85 1ubg n GLY 167 Ca 0.00 0.77 0.00 0.00 0.00 0.00 0.00 46.02 46.79 1ubg n GLY 167 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ubg n LEU 168 N 5.11 0.00 0.00 0.99 4.77 -1.26 -4.82 117.00 121.80 1ubg n LEU 168 Ca 0.38 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 1ubg n LEU 168 Cb -0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1ubg n LEU 168 CO 0.61 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.67 1ubg n GLN 169 N 0.00 0.00 -1.52 3.23 6.02 -1.26 -3.42 117.38 120.43 1ubg n GLN 169 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.84 1ubg n GLN 169 Cb 0.00 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.15 1ubg n GLN 169 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ubg n ALA 170 N -0.05 0.51 0.00 -1.58 0.00 -1.26 0.75 120.51 118.89 1ubg n ALA 170 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.09 1ubg n ALA 170 Cb 0.00 -2.94 0.00 0.00 0.00 0.00 0.00 19.45 16.51 1ubg n ALA 170 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1ubg n ARG 171 N 7.71 0.00 -0.30 0.00 0.00 -1.22 -4.81 116.66 118.04 1ubg n ARG 171 Ca 0.49 0.00 0.06 0.00 -0.00 0.00 0.00 57.85 58.40 1ubg n ARG 171 Cb 0.37 0.00 0.21 0.00 -0.00 0.00 0.00 32.46 33.04 1ubg n ARG 171 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1ubg h LEU 172 N 0.00 0.60 0.57 2.89 5.85 0.13 3.54 115.31 128.89 1ubg h LEU 172 Ca 0.00 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1ubg h LEU 172 Cb 0.00 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 41.01 1ubg h LEU 172 CO 0.00 0.29 -0.27 0.24 -0.34 0.00 0.00 178.44 178.35 1ubg h MET 173 N 0.70 -0.74 -0.93 1.25 2.86 -1.85 0.34 114.93 116.56 1ubg h MET 173 Ca 0.45 0.05 0.21 0.00 -2.06 0.00 0.00 59.70 58.35 1ubg h MET 173 Cb 0.56 0.17 -0.18 0.00 0.06 0.00 0.00 31.60 32.22 1ubg h MET 173 CO -0.32 -0.49 -0.15 0.43 1.06 0.00 0.00 176.91 177.44 1ubg n SER 174 N -4.59 -0.26 0.00 1.22 7.64 -0.07 0.35 113.62 117.92 1ubg n SER 174 Ca -0.10 1.60 0.00 0.00 1.01 0.00 0.00 58.87 61.38 1ubg n SER 174 Cb 0.30 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1ubg n SER 174 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ubg n GLN 175 N -5.47 0.00 -0.33 1.43 1.13 1.16 -2.38 117.38 112.92 1ubg n GLN 175 Ca 0.17 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.19 1ubg n GLN 175 Cb 0.55 -0.96 -0.02 0.00 0.11 0.00 0.00 30.24 29.93 1ubg n GLN 175 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ubg n ALA 176 N -0.55 -0.29 -0.17 -1.58 0.00 0.12 -1.25 120.51 116.79 1ubg n ALA 176 Ca 0.00 0.76 -0.11 0.00 0.00 0.00 0.00 53.44 54.09 1ubg n ALA 176 Cb 0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 19.45 19.11 1ubg n ALA 176 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ubg h LEU 177 N 0.00 -1.65 0.14 0.00 -0.00 -0.19 1.24 115.31 114.85 1ubg h LEU 177 Ca 0.21 0.22 0.00 0.00 -0.00 0.00 0.00 57.88 58.32 1ubg h LEU 177 Cb 0.42 0.69 -0.03 0.00 -0.00 0.00 0.00 40.66 41.74 1ubg h LEU 177 CO -0.79 -0.31 -0.34 -0.09 -0.00 0.00 0.00 178.44 176.91 1ubg h ARG 178 N -0.27 -0.50 -0.42 1.13 2.43 -0.80 0.98 114.38 116.93 1ubg h ARG 178 Ca 0.08 0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.40 1ubg h ARG 178 Cb 0.48 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 1ubg h ARG 178 CO -0.57 -0.34 0.57 -0.22 -1.51 0.00 0.00 179.97 177.91 1ubg h LYS 179 N -0.52 0.00 0.03 0.20 3.64 -1.01 -1.74 116.57 117.17 1ubg h LYS 179 Ca -0.01 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.00 1ubg h LYS 179 Cb 0.50 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.27 1ubg h LYS 179 CO -0.15 0.00 -2.22 -0.12 -2.27 0.00 0.00 179.45 174.69 1ubg n MET 180 N -3.44 0.68 -0.27 1.90 1.56 0.42 -4.27 117.12 113.71 1ubg n MET 180 Ca 0.08 0.16 0.00 0.00 -0.27 0.00 0.00 57.70 57.67 1ubg n MET 180 Cb 0.74 -1.61 0.13 0.00 2.15 0.00 0.00 33.22 34.63 1ubg n MET 180 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 1ubg h THR 181 N 0.02 0.99 0.00 1.12 2.02 0.18 0.24 112.91 117.47 1ubg h THR 181 Ca -0.49 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.41 1ubg h THR 181 Cb 2.04 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.55 1ubg h THR 181 CO 0.01 0.15 0.00 0.61 0.37 0.00 0.00 175.52 176.66 1ubg n GLY 182 N -1.31 -1.74 0.17 2.16 0.00 -1.07 -3.45 105.19 99.96 1ubg n GLY 182 Ca 0.11 0.06 -0.04 0.00 0.00 0.00 0.00 46.02 46.14 1ubg n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ubg n ALA 183 N -2.61 -0.26 0.00 4.61 0.00 -1.22 -2.27 120.51 118.75 1ubg n ALA 183 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1ubg n ALA 183 Cb 0.00 0.17 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1ubg n ALA 183 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ubg n LEU 184 N -3.91 0.00 -0.93 0.00 4.77 0.84 0.02 117.00 117.80 1ubg n LEU 184 Ca 0.01 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.04 1ubg n LEU 184 Cb 0.11 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.33 1ubg n LEU 184 CO -0.07 0.00 0.25 0.59 -1.33 0.00 0.00 177.39 176.83 1ubg n ASN 185 N -2.10 1.43 -0.03 -1.43 3.02 -0.96 -1.33 115.26 113.86 1ubg n ASN 185 Ca 0.00 -3.15 -0.07 0.00 -0.03 0.00 0.00 54.58 51.33 1ubg n ASN 185 Cb 0.00 -0.44 -0.13 0.00 -0.61 0.00 0.00 39.78 38.60 1ubg n ASN 185 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ubg n ASN 186 N -0.50 0.68 0.11 6.41 5.03 0.10 -3.56 115.26 123.54 1ubg n ASN 186 Ca 0.14 0.32 0.03 0.00 0.87 0.00 0.00 54.58 55.94 1ubg n ASN 186 Cb 0.86 0.23 0.01 0.00 -1.02 0.00 0.00 39.78 39.86 1ubg n ASN 186 CO 0.00 0.00 0.00 0.77 -1.83 0.00 0.00 177.26 176.20 1ubg h SER 187 N 0.00 0.00 -1.55 6.41 4.64 -1.72 -3.48 113.55 117.85 1ubg h SER 187 Ca -0.31 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.88 1ubg h SER 187 Cb 1.96 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 64.07 1ubg h SER 187 CO 0.06 0.43 -0.18 0.61 -0.87 0.00 0.00 176.83 176.88 1ubg n GLY 188 N 1.26 0.27 3.33 -0.77 0.00 -1.20 -5.00 105.19 103.07 1ubg n GLY 188 Ca -0.01 -0.53 -0.46 0.00 0.00 0.00 0.00 46.02 45.02 1ubg n GLY 188 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ubg s THR 189 N -2.64 5.34 0.40 2.61 2.01 -0.45 -3.75 115.64 119.17 1ubg s THR 189 Ca 0.07 -1.87 -0.26 0.00 0.31 0.00 0.00 61.69 59.94 1ubg s THR 189 Cb -0.03 -4.41 -0.09 0.00 0.01 0.00 0.00 72.50 67.98 1ubg s THR 189 CO 0.09 -0.97 1.32 0.28 -0.69 0.00 0.00 174.62 174.65 1ubg s THR 190 N 1.10 2.57 0.07 -0.82 -1.32 -0.28 -4.58 115.64 112.39 1ubg s THR 190 Ca 0.10 0.52 0.09 0.00 -1.21 0.00 0.00 61.69 61.19 1ubg s THR 190 Cb -0.21 -3.31 -0.03 0.00 -1.51 0.00 0.00 72.50 67.44 1ubg s THR 190 CO -0.02 0.08 -0.23 0.00 -2.21 0.00 0.00 174.62 172.24 1ubg s ALA 191 N -1.24 2.44 -0.05 11.08 0.00 -0.81 -2.82 121.76 130.35 1ubg s ALA 191 Ca 0.56 -1.30 0.03 0.00 0.00 0.00 0.00 51.96 51.25 1ubg s ALA 191 Cb -0.39 -0.56 0.01 0.00 0.00 0.00 0.00 23.12 22.18 1ubg s ALA 191 CO 0.50 0.55 -0.14 0.42 0.00 0.00 0.00 175.76 177.10 1ubg s ILE 192 N -0.94 1.20 -0.17 0.00 1.01 -0.34 0.21 121.20 122.17 1ubg s ILE 192 Ca 0.14 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 60.25 1ubg s ILE 192 Cb -0.10 -1.06 0.02 0.00 0.01 0.00 0.00 42.46 41.32 1ubg s ILE 192 CO 0.05 0.36 -0.20 -0.36 0.00 0.00 0.00 174.94 174.79 1ubg s PHE 193 N 0.38 2.75 -0.07 3.97 0.08 0.06 -0.99 117.98 124.17 1ubg s PHE 193 Ca -0.09 -1.60 -0.23 0.00 0.12 0.00 0.00 56.93 55.12 1ubg s PHE 193 Cb -0.13 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 1ubg s PHE 193 CO 0.03 -0.78 0.70 0.42 -0.10 0.00 0.00 175.22 175.49 1ubg s ILE 194 N 1.22 5.05 0.34 0.64 1.09 -1.11 -1.12 121.20 127.30 1ubg s ILE 194 Ca 0.03 1.45 0.04 0.00 -1.10 0.00 0.00 60.65 61.07 1ubg s ILE 194 Cb -0.13 -4.04 -0.06 0.00 -1.06 0.00 0.00 42.46 37.16 1ubg s ILE 194 CO -0.11 0.25 0.05 0.21 -0.10 0.00 0.00 174.94 175.24 1ubg s ASN 195 N 0.80 2.59 -0.30 3.58 3.84 -1.15 -0.64 114.94 123.67 1ubg s ASN 195 Ca 0.38 -1.39 -0.33 0.00 0.21 0.00 0.00 52.86 51.73 1ubg s ASN 195 Cb -0.18 -0.10 0.18 0.00 -0.55 0.00 0.00 41.25 40.60 1ubg s ASN 195 CO 0.18 -0.60 1.40 0.00 -2.79 0.00 0.00 177.10 175.29 1ubg s GLN 196 N -3.86 0.00 0.04 0.43 -2.07 -1.26 -3.09 119.66 109.84 1ubg s GLN 196 Ca 0.36 -0.00 0.00 0.00 -1.82 0.00 0.00 55.36 53.90 1ubg s GLN 196 Cb 0.09 0.00 0.00 0.00 -1.09 0.00 0.00 33.01 32.01 1ubg s GLN 196 CO 0.16 -0.00 0.00 1.28 -1.32 0.00 0.00 175.29 175.41 1ubg n LEU 197 N 0.29 -0.07 -0.23 2.60 4.77 -1.22 -4.85 117.00 118.28 1ubg n LEU 197 Ca 0.03 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 1ubg n LEU 197 Cb 0.58 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1ubg n LEU 197 CO 0.07 -0.23 0.00 -2.11 -1.33 0.00 0.00 177.39 173.78 1ubg n ARG 198 N -2.63 0.00 -1.50 3.23 0.00 -1.26 -4.79 116.66 109.71 1ubg n ARG 198 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1ubg n ARG 198 Cb 0.05 -1.17 0.00 0.00 -0.00 0.00 0.00 32.46 31.34 1ubg n ARG 198 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1ubg n GLU 199 N -0.24 0.00 0.00 2.89 -0.00 -1.26 -3.69 120.64 118.34 1ubg n GLU 199 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 1ubg n GLU 199 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.67 1ubg n GLU 199 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1ubg n LYS 200 N 0.00 0.00 0.00 3.44 5.02 -1.26 -4.96 118.16 120.40 1ubg n LYS 200 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1ubg n LYS 200 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1ubg n LYS 200 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1ubg n ILE 201 N 0.00 0.00 0.00 -0.18 5.41 -1.26 -5.15 119.36 118.18 1ubg n ILE 201 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1ubg n ILE 201 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1ubg n ILE 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ubg n GLY 202 N 0.00 1.20 3.47 7.39 0.00 -1.26 -5.12 105.19 110.87 1ubg n GLY 202 Ca 0.00 -0.09 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 1ubg n GLY 202 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ubg s VAL 203 N -1.46 4.41 0.11 1.61 1.01 -1.26 -4.53 120.40 120.29 1ubg s VAL 203 Ca 0.00 -0.23 0.06 0.00 0.00 0.00 0.00 61.98 61.81 1ubg s VAL 203 Cb 0.00 -4.61 -0.04 0.00 0.00 0.00 0.00 36.38 31.74 1ubg s VAL 203 CO 0.00 -1.30 -0.15 -0.04 0.00 0.00 0.00 175.10 173.61 1ubg s MET 204 N 3.86 0.99 0.00 2.72 -1.94 -1.24 -3.54 119.30 120.15 1ubg s MET 204 Ca 0.23 -1.17 0.00 0.00 -1.71 0.00 0.00 55.69 53.04 1ubg s MET 204 Cb -0.16 -0.95 0.00 0.00 2.01 0.00 0.00 34.83 35.73 1ubg s MET 204 CO 0.12 0.19 0.00 1.19 -0.01 0.00 0.00 175.02 176.52 1ubg n PHE 205 N 0.76 0.00 -3.28 -0.03 0.99 -1.26 -4.80 117.46 109.84 1ubg n PHE 205 Ca -0.17 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 56.86 1ubg n PHE 205 Cb 0.56 0.00 -0.08 0.00 -1.00 0.00 0.00 39.48 38.96 1ubg n PHE 205 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.76 176.96 1ubg s GLY 206 N 0.00 1.85 -0.92 1.37 0.00 -1.26 -4.02 107.32 104.34 1ubg s GLY 206 Ca 0.00 -1.24 -0.04 0.00 0.00 0.00 0.00 44.72 43.44 1ubg s GLY 206 CO 0.00 1.21 0.82 1.44 0.00 0.00 0.00 173.10 176.57 1ubg n SER 207 N 5.69 -6.78 0.00 1.64 7.64 -1.26 -4.98 113.62 115.58 1ubg n SER 207 Ca -0.06 -0.50 0.00 0.00 1.01 0.00 0.00 58.87 59.32 1ubg n SER 207 Cb 0.48 -5.04 0.00 0.00 -1.01 0.00 0.00 64.21 58.64 1ubg n SER 207 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1ubg n PRO 208 N -2.74 0.21 -0.46 1.43 -0.02 -1.26 -4.83 135.00 127.33 1ubg n PRO 208 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1ubg n PRO 208 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.06 1ubg n PRO 208 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1ubg n GLU 209 N 0.00 1.63 0.00 -0.52 2.13 -1.23 -4.46 120.64 118.19 1ubg n GLU 209 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1ubg n GLU 209 Cb 0.00 -0.61 0.00 0.00 0.27 0.00 0.00 31.44 31.10 1ubg n GLU 209 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1ubg n THR 210 N -2.24 0.00 -1.94 6.31 5.66 -1.26 -4.90 114.28 115.91 1ubg n THR 210 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1ubg n THR 210 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1ubg n THR 210 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1ubg n THR 211 N 0.00 0.00 -0.17 1.09 -2.24 -1.26 -4.95 114.28 106.75 1ubg n THR 211 Ca 0.00 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.74 1ubg n THR 211 Cb 0.00 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.19 1ubg n THR 211 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ubg n THR 212 N 0.11 -0.27 0.00 4.28 -2.24 -1.26 -2.20 114.28 112.70 1ubg n THR 212 Ca 0.00 0.97 0.00 0.00 -2.27 0.00 0.00 64.05 62.75 1ubg n THR 212 Cb 0.00 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 1ubg n THR 212 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ubg n GLY 213 N -1.10 0.99 0.00 3.38 0.00 -1.26 -4.06 105.19 103.14 1ubg n GLY 213 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1ubg n GLY 213 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ubg n GLY 214 N 0.85 0.00 0.00 -0.02 0.00 -0.94 -3.89 105.19 101.20 1ubg n GLY 214 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ubg n GLY 214 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ubg n LYS 215 N 0.00 0.00 -0.02 1.61 5.02 -1.26 -0.56 118.16 122.96 1ubg n LYS 215 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1ubg n LYS 215 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1ubg n LYS 215 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ubg n ALA 216 N 0.00 -0.03 -0.33 7.82 0.00 -1.25 0.40 120.51 127.12 1ubg n ALA 216 Ca 0.00 0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.61 1ubg n ALA 216 Cb 0.00 0.40 0.36 0.00 0.00 0.00 0.00 19.45 20.21 1ubg n ALA 216 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ubg h LEU 217 N 0.00 0.71 -0.82 0.00 5.85 -1.00 0.73 115.31 120.78 1ubg h LEU 217 Ca 0.01 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1ubg h LEU 217 Cb 0.02 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1ubg h LEU 217 CO -0.04 0.27 0.00 1.17 -0.34 0.00 0.00 178.44 179.50 1ubg n LYS 218 N -4.70 0.13 -0.03 1.25 0.00 0.16 -1.12 118.16 113.85 1ubg n LYS 218 Ca 0.22 0.50 -0.03 0.00 0.00 0.00 0.00 58.31 59.00 1ubg n LYS 218 Cb 0.59 -1.82 -0.06 0.00 0.00 0.00 0.00 35.03 33.74 1ubg n LYS 218 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1ubg n PHE 219 N -2.07 0.00 0.11 5.64 3.72 0.22 -4.65 117.46 120.43 1ubg n PHE 219 Ca 0.01 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.21 1ubg n PHE 219 Cb 0.12 -0.36 -0.15 0.00 -0.94 0.00 0.00 39.48 38.14 1ubg n PHE 219 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 176.76 178.59 1ubg h TYR 220 N 0.00 0.70 -1.95 1.38 0.05 -0.35 -3.46 116.97 113.34 1ubg h TYR 220 Ca -0.19 -0.51 -0.65 0.00 0.05 0.00 0.00 58.73 57.43 1ubg h TYR 220 Cb 1.37 -0.03 0.08 0.00 1.01 0.00 0.00 36.73 39.16 1ubg h TYR 220 CO 0.00 1.44 0.25 0.00 -1.05 0.00 0.00 178.16 178.81 1ubg n ALA 221 N -2.66 -0.80 0.78 3.88 0.00 -0.27 -4.74 120.51 116.71 1ubg n ALA 221 Ca -0.14 0.46 0.11 0.00 0.00 0.00 0.00 53.44 53.86 1ubg n ALA 221 Cb 1.06 -2.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.48 1ubg n ALA 221 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ubg n SER 222 N 1.97 0.71 -3.72 0.00 7.64 -0.29 -4.89 113.62 115.04 1ubg n SER 222 Ca 0.15 -0.54 -0.14 0.00 1.01 0.00 0.00 58.87 59.35 1ubg n SER 222 Cb 0.25 0.89 -0.09 0.00 -1.01 0.00 0.00 64.21 64.25 1ubg n SER 222 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1ubg s VAL 223 N -3.10 0.03 -0.04 0.44 1.01 -1.24 -0.99 120.40 116.51 1ubg s VAL 223 Ca 0.06 -0.26 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 1ubg s VAL 223 Cb 0.16 -0.66 0.03 0.00 0.00 0.00 0.00 36.38 35.91 1ubg s VAL 223 CO 0.82 -0.14 0.08 -0.13 0.00 0.00 0.00 175.10 175.73 1ubg s ARG 224 N -0.82 -0.01 -0.18 2.72 0.52 -0.93 -1.96 118.95 118.29 1ubg s ARG 224 Ca -0.09 0.31 -0.01 0.00 -0.52 0.00 0.00 55.73 55.42 1ubg s ARG 224 Cb -0.04 -0.29 -0.00 0.00 0.52 0.00 0.00 34.95 35.14 1ubg s ARG 224 CO 0.04 -0.22 -0.12 -0.51 0.02 0.00 0.00 175.30 174.52 1ubg s LEU 225 N 1.45 2.62 -0.96 2.53 1.02 0.38 -2.71 118.68 123.01 1ubg s LEU 225 Ca -0.05 -0.44 -0.15 0.00 0.02 0.00 0.00 54.13 53.52 1ubg s LEU 225 Cb -0.12 -1.62 0.19 0.00 0.02 0.00 0.00 46.19 44.66 1ubg s LEU 225 CO -0.04 0.05 1.04 -0.62 0.02 0.00 0.00 176.35 176.80 1ubg s ASP 226 N 1.02 6.86 -0.66 2.29 -1.08 -1.22 -2.13 116.67 121.75 1ubg s ASP 226 Ca -0.01 -2.68 -0.22 0.00 -0.52 0.00 0.00 52.55 49.12 1ubg s ASP 226 Cb -0.15 -2.30 0.07 0.00 -1.46 0.00 0.00 42.92 39.09 1ubg s ASP 226 CO -0.02 -0.71 0.96 -0.69 0.52 0.00 0.00 175.17 175.23 1ubg s VAL 227 N 0.93 4.35 -0.04 1.11 1.01 -0.92 -2.22 120.40 124.61 1ubg s VAL 227 Ca 0.28 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 61.92 1ubg s VAL 227 Cb -0.07 -4.68 -0.01 0.00 0.00 0.00 0.00 36.38 31.61 1ubg s VAL 227 CO -0.08 -1.45 -0.25 -0.13 0.00 0.00 0.00 175.10 173.20 1ubg s ARG 228 N 4.00 2.32 0.18 2.72 0.52 -0.90 -4.24 118.95 123.56 1ubg s ARG 228 Ca 0.22 -0.89 -0.30 0.00 -0.52 0.00 0.00 55.73 54.24 1ubg s ARG 228 Cb -0.17 -2.06 -0.09 0.00 0.52 0.00 0.00 34.95 33.16 1ubg s ARG 228 CO 0.10 0.43 1.32 0.50 0.02 0.00 0.00 175.30 177.67 1ubg s ARG 229 N -0.30 4.37 -0.16 3.54 3.52 -1.26 -2.00 118.95 126.66 1ubg s ARG 229 Ca 0.01 2.06 -0.03 0.00 -0.13 0.00 0.00 55.73 57.63 1ubg s ARG 229 Cb -0.12 -3.20 -0.09 0.00 -1.56 0.00 0.00 34.95 29.97 1ubg s ARG 229 CO 0.02 -0.29 -0.18 1.51 -0.81 0.00 0.00 175.30 175.55 1ubg n ILE 230 N 2.87 0.92 -3.68 4.11 3.06 -0.87 -4.92 119.36 120.86 1ubg n ILE 230 Ca 0.07 -0.30 -0.13 0.00 -2.50 0.00 0.00 62.75 59.90 1ubg n ILE 230 Cb 0.43 -1.37 -0.06 0.00 0.54 0.00 0.00 39.64 39.17 1ubg n ILE 230 CO 0.00 0.00 0.00 -1.61 -2.50 0.00 0.00 176.55 172.44 1ubg s GLU 231 N -2.32 0.90 -0.57 9.51 2.02 -1.24 -5.02 118.70 121.98 1ubg s GLU 231 Ca -0.23 -0.37 -0.22 0.00 0.02 0.00 0.00 54.97 54.17 1ubg s GLU 231 Cb 0.07 0.40 0.06 0.00 0.10 0.00 0.00 34.13 34.76 1ubg s GLU 231 CO 0.34 -0.30 0.84 0.99 0.02 0.00 0.00 175.26 177.14 1ubg s THR 232 N -2.45 4.55 -0.70 3.63 2.01 -1.26 -1.10 115.64 120.32 1ubg s THR 232 Ca -0.05 -0.26 -0.30 0.00 0.31 0.00 0.00 61.69 61.39 1ubg s THR 232 Cb -0.01 -4.51 -0.14 0.00 0.01 0.00 0.00 72.50 67.85 1ubg s THR 232 CO -0.02 -1.13 2.51 0.18 -0.69 0.00 0.00 174.62 175.47 1ubg n LEU 233 N 7.06 1.37 -4.70 4.42 7.99 -0.04 -4.92 117.00 128.19 1ubg n LEU 233 Ca -0.03 -0.07 -0.30 0.00 -0.01 0.00 0.00 56.01 55.59 1ubg n LEU 233 Cb 0.46 -1.24 0.14 0.00 -0.11 0.00 0.00 43.42 42.67 1ubg n LEU 233 CO 0.61 -1.08 0.67 -1.59 -1.51 0.00 0.00 177.39 174.48 1ubg s LYS 234 N 8.31 1.28 -0.27 3.23 -2.85 -1.26 -1.15 119.74 127.03 1ubg s LYS 234 Ca 1.17 1.20 0.21 0.00 -1.00 0.00 0.00 55.97 57.55 1ubg s LYS 234 Cb -0.76 -1.78 0.49 0.00 -2.06 0.00 0.00 37.83 33.72 1ubg s LYS 234 CO 0.40 -2.33 1.18 -0.25 0.10 0.00 0.00 175.35 174.44 1ubg n ASP 235 N -3.99 1.08 0.00 0.03 9.92 -1.25 -4.12 116.55 118.21 1ubg n ASP 235 Ca 0.09 -2.07 0.00 0.00 -0.53 0.00 0.00 54.79 52.28 1ubg n ASP 235 Cb 0.53 -0.29 0.00 0.00 -0.64 0.00 0.00 41.12 40.72 1ubg n ASP 235 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ubg n GLY 236 N -0.73 1.14 0.00 0.44 0.00 -1.26 -4.56 105.19 100.21 1ubg n GLY 236 Ca 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ubg n GLY 236 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ubg n THR 237 N 0.00 0.00 -0.05 2.61 5.66 -1.26 -4.96 114.28 116.28 1ubg n THR 237 Ca 0.00 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.99 1ubg n THR 237 Cb 0.00 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1ubg n THR 237 CO 0.00 0.00 0.00 -2.24 -3.05 0.00 0.00 175.07 169.78 1ubg h ASP 238 N 0.00 0.00 0.00 1.09 3.04 -1.97 -3.50 116.42 115.08 1ubg h ASP 238 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1ubg h ASP 238 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 1ubg h ASP 238 CO 0.00 0.48 0.00 0.00 -2.04 0.00 0.00 179.24 177.68 1ubg n ALA 239 N -2.86 0.00 0.11 4.15 0.00 -1.26 -3.86 120.51 116.79 1ubg n ALA 239 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.21 1ubg n ALA 239 Cb 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.36 1ubg n ALA 239 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1ubg h VAL 240 N 0.00 1.23 0.00 0.00 -1.51 -1.29 -3.45 116.25 111.23 1ubg h VAL 240 Ca 0.00 -2.74 0.00 0.00 -1.23 0.00 0.00 66.70 62.73 1ubg h VAL 240 Cb 0.00 2.93 0.00 0.00 -2.13 0.00 0.00 31.29 32.09 1ubg h VAL 240 CO 0.00 0.84 0.00 0.61 -1.23 0.00 0.00 177.57 177.79 1ubg n GLY 241 N 1.71 3.03 2.93 5.19 0.00 -1.20 0.75 105.19 117.60 1ubg n GLY 241 Ca -0.17 -0.36 -0.11 0.00 0.00 0.00 0.00 46.02 45.38 1ubg n GLY 241 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ubg s ASN 242 N 2.00 0.05 0.01 1.61 0.02 0.14 -0.86 114.94 117.91 1ubg s ASN 242 Ca 0.00 -0.11 -0.14 0.00 -1.02 0.00 0.00 52.86 51.59 1ubg s ASN 242 Cb 0.00 0.07 -0.06 0.00 0.02 0.00 0.00 41.25 41.28 1ubg s ASN 242 CO 0.00 -0.10 0.41 -0.60 0.02 0.00 0.00 177.10 176.83 1ubg s ARG 243 N -0.43 3.91 -0.02 -0.60 3.52 -0.26 -1.00 118.95 124.06 1ubg s ARG 243 Ca -0.05 0.40 0.07 0.00 -0.13 0.00 0.00 55.73 56.02 1ubg s ARG 243 Cb -0.03 -3.19 -0.02 0.00 -1.56 0.00 0.00 34.95 30.15 1ubg s ARG 243 CO -0.00 0.67 -0.23 0.99 -0.81 0.00 0.00 175.30 175.92 1ubg s THR 244 N -1.12 1.84 -0.08 4.11 2.01 0.76 -2.05 115.64 121.11 1ubg s THR 244 Ca 0.25 -0.99 0.01 0.00 0.31 0.00 0.00 61.69 61.27 1ubg s THR 244 Cb -0.16 -1.53 -0.03 0.00 0.01 0.00 0.00 72.50 70.79 1ubg s THR 244 CO 0.14 0.52 -0.09 -0.60 -0.69 0.00 0.00 174.62 173.90 1ubg s ARG 245 N -0.48 2.82 -0.18 4.92 3.52 -0.85 -2.02 118.95 126.68 1ubg s ARG 245 Ca 0.07 -0.59 -0.00 0.00 -0.13 0.00 0.00 55.73 55.08 1ubg s ARG 245 Cb -0.10 -2.57 0.05 0.00 -1.56 0.00 0.00 34.95 30.77 1ubg s ARG 245 CO -0.00 0.58 -0.05 0.08 -0.81 0.00 0.00 175.30 175.10 1ubg s VAL 246 N -0.60 1.21 -0.87 7.11 1.01 0.78 -2.12 120.40 126.93 1ubg s VAL 246 Ca 0.09 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.21 1ubg s VAL 246 Cb -0.12 -1.42 0.22 0.00 0.00 0.00 0.00 36.38 35.07 1ubg s VAL 246 CO 0.02 0.07 0.79 -0.75 0.00 0.00 0.00 175.10 175.22 1ubg s LYS 247 N 1.57 3.47 -0.56 2.72 2.20 -0.94 -2.32 119.74 125.88 1ubg s LYS 247 Ca -0.01 -2.83 -0.24 0.00 -0.36 0.00 0.00 55.97 52.52 1ubg s LYS 247 Cb -0.16 -4.22 -0.25 0.00 -1.51 0.00 0.00 37.83 31.69 1ubg s LYS 247 CO -0.07 -1.25 1.74 1.55 -0.36 0.00 0.00 175.35 176.96 1ubg n VAL 248 N 3.22 0.00 0.31 4.02 3.14 -1.18 -3.38 118.33 124.45 1ubg n VAL 248 Ca 0.17 -0.08 0.03 0.00 -2.96 0.00 0.00 64.34 61.50 1ubg n VAL 248 Cb 0.41 -1.70 0.16 0.00 -1.06 0.00 0.00 33.84 31.66 1ubg n VAL 248 CO 0.00 0.00 0.00 1.33 -6.46 0.00 0.00 176.83 171.70 1ubg n VAL 249 N 7.66 0.90 -3.37 1.55 0.24 -1.10 -2.27 118.33 121.94 1ubg n VAL 249 Ca 0.37 0.23 -0.10 0.00 -2.04 0.00 0.00 64.34 62.79 1ubg n VAL 249 Cb 0.44 -1.12 -0.08 0.00 -1.47 0.00 0.00 33.84 31.61 1ubg n VAL 249 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1ubg s LYS 250 N -2.57 0.33 -0.24 7.34 2.20 -1.25 -4.70 119.74 120.85 1ubg s LYS 250 Ca 0.06 0.43 -0.00 0.00 -0.36 0.00 0.00 55.97 56.10 1ubg s LYS 250 Cb 0.04 -0.56 0.07 0.00 -1.51 0.00 0.00 37.83 35.87 1ubg s LYS 250 CO 0.10 -0.69 -0.01 1.21 -0.36 0.00 0.00 175.35 175.60 1ubg s ASN 251 N 2.51 3.71 0.00 1.43 3.84 -1.26 -2.18 114.94 122.99 1ubg s ASN 251 Ca 0.12 -1.21 0.25 0.00 0.21 0.00 0.00 52.86 52.23 1ubg s ASN 251 Cb -0.15 -1.03 0.55 0.00 -0.55 0.00 0.00 41.25 40.07 1ubg s ASN 251 CO -0.17 -0.28 1.44 0.29 -2.79 0.00 0.00 177.10 175.58 1ubg n LYS 252 N 4.76 0.31 -0.25 0.43 4.76 -0.16 -3.96 118.16 124.05 1ubg n LYS 252 Ca -0.09 -0.19 0.10 0.00 -2.87 0.00 0.00 58.31 55.27 1ubg n LYS 252 Cb 0.44 -1.50 0.23 0.00 -1.84 0.00 0.00 35.03 32.37 1ubg n LYS 252 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 1ubg n VAL 253 N -1.19 0.76 -2.84 -0.18 3.14 -1.26 -3.40 118.33 113.36 1ubg n VAL 253 Ca 0.08 -0.88 0.00 0.00 -2.96 0.00 0.00 64.34 60.58 1ubg n VAL 253 Cb 0.34 0.72 0.00 0.00 -1.06 0.00 0.00 33.84 33.85 1ubg n VAL 253 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1ubg n SER 254 N 1.32 0.00 -4.77 6.55 3.41 -1.25 -4.92 113.62 113.96 1ubg n SER 254 Ca 0.19 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.40 1ubg n SER 254 Cb 0.56 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.45 1ubg n SER 254 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1ubg s PRO 255 N -0.90 4.68 0.00 4.33 0.04 -1.26 -4.74 135.00 137.15 1ubg s PRO 255 Ca 0.00 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.33 1ubg s PRO 255 Cb 0.00 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1ubg s PRO 255 CO 0.00 0.55 0.00 -0.35 0.04 0.00 0.00 177.00 177.24 1ubg n PRO 256 N 1.57 0.61 -0.58 0.56 -0.04 -1.26 -4.64 135.00 131.21 1ubg n PRO 256 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1ubg n PRO 256 Cb 0.48 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 1ubg n PRO 256 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1ubg n PHE 257 N -1.39 0.00 -1.47 0.54 3.72 -0.96 -4.99 117.46 112.90 1ubg n PHE 257 Ca 0.00 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.10 1ubg n PHE 257 Cb 0.00 -0.99 0.22 0.00 -0.94 0.00 0.00 39.48 37.76 1ubg n PHE 257 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1ubg s LYS 258 N -0.61 -0.44 -0.03 -1.08 3.01 -1.26 -4.86 119.74 114.47 1ubg s LYS 258 Ca 0.00 -0.25 -0.29 0.00 -1.01 0.00 0.00 55.97 54.42 1ubg s LYS 258 Cb 0.00 -1.71 0.09 0.00 -1.01 0.00 0.00 37.83 35.21 1ubg s LYS 258 CO 0.00 -3.16 0.80 1.14 0.51 0.00 0.00 175.35 174.65 1ubg s GLN 259 N -5.65 0.92 0.07 1.68 -2.07 -1.26 -3.10 119.66 110.25 1ubg s GLN 259 Ca 0.73 -0.05 0.01 0.00 -1.82 0.00 0.00 55.36 54.22 1ubg s GLN 259 Cb -0.07 0.43 -0.04 0.00 -1.09 0.00 0.00 33.01 32.24 1ubg s GLN 259 CO 0.55 -0.34 -0.05 0.00 -1.32 0.00 0.00 175.29 174.12 1ubg s ALA 260 N -2.15 0.73 0.26 2.60 0.00 -0.98 -4.95 121.76 117.27 1ubg s ALA 260 Ca -0.02 -1.20 0.05 0.00 0.00 0.00 0.00 51.96 50.78 1ubg s ALA 260 Cb -0.01 0.19 -0.05 0.00 0.00 0.00 0.00 23.12 23.24 1ubg s ALA 260 CO -0.01 -0.26 -0.02 -1.21 0.00 0.00 0.00 175.76 174.26 1ubg s GLU 261 N -3.52 1.44 0.00 0.00 2.02 -1.26 -0.15 118.70 117.23 1ubg s GLU 261 Ca 0.07 -1.73 0.00 0.00 0.02 0.00 0.00 54.97 53.32 1ubg s GLU 261 Cb 0.04 -0.82 0.00 0.00 0.10 0.00 0.00 34.13 33.45 1ubg s GLU 261 CO -0.06 -0.06 0.00 1.97 0.02 0.00 0.00 175.26 177.13 1ubg n PHE 262 N -0.50 0.00 -4.08 1.61 1.16 -0.86 -4.65 117.46 110.14 1ubg n PHE 262 Ca -0.05 0.00 -0.23 0.00 -1.87 0.00 0.00 57.45 55.30 1ubg n PHE 262 Cb 0.64 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.47 1ubg n PHE 262 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1ubg s ASP 263 N 0.00 5.68 -0.19 5.98 -0.00 -1.26 -0.17 116.67 126.70 1ubg s ASP 263 Ca 0.00 -0.16 -0.02 0.00 -0.00 0.00 0.00 52.55 52.36 1ubg s ASP 263 Cb 0.00 -1.50 0.06 0.00 -0.00 0.00 0.00 42.92 41.48 1ubg s ASP 263 CO 0.00 -0.02 0.02 -0.63 -0.00 0.00 0.00 175.17 174.54 1ubg s ILE 264 N -2.03 0.68 0.06 0.77 1.01 -0.17 -1.91 121.20 119.60 1ubg s ILE 264 Ca 0.33 -0.61 -0.26 0.00 0.00 0.00 0.00 60.65 60.11 1ubg s ILE 264 Cb -0.09 -1.12 -0.06 0.00 0.01 0.00 0.00 42.46 41.21 1ubg s ILE 264 CO 0.25 -0.15 0.80 -0.76 0.00 0.00 0.00 174.94 175.08 1ubg s LEU 265 N 1.79 4.46 -0.41 2.97 2.01 -0.42 -0.68 118.68 128.40 1ubg s LEU 265 Ca -0.01 1.50 -0.39 0.00 0.01 0.00 0.00 54.13 55.24 1ubg s LEU 265 Cb -0.17 -3.29 -0.15 0.00 0.01 0.00 0.00 46.19 42.60 1ubg s LEU 265 CO -0.08 0.01 2.15 -1.22 1.01 0.00 0.00 176.35 178.22 1ubg n TYR 266 N 2.78 1.43 -2.80 0.29 4.01 0.23 -2.65 117.16 120.45 1ubg n TYR 266 Ca -0.02 0.50 -0.02 0.00 -0.16 0.00 0.00 57.90 58.20 1ubg n TYR 266 Cb 0.50 -2.43 0.00 0.00 -0.31 0.00 0.00 39.34 37.11 1ubg n TYR 266 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ubg n GLY 267 N 6.87 -3.37 0.00 2.72 0.00 -1.26 -4.86 105.19 105.29 1ubg n GLY 267 Ca 0.47 0.56 0.00 0.00 0.00 0.00 0.00 46.02 47.04 1ubg n GLY 267 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1ubg n GLN 268 N 0.60 0.00 0.00 1.61 7.27 -1.08 -5.15 117.38 120.63 1ubg n GLN 268 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.09 1ubg n GLN 268 Cb 0.13 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.78 1ubg n GLN 268 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ubg n GLY 269 N 0.00 -1.79 3.64 1.69 0.00 -1.18 -4.70 105.19 102.85 1ubg n GLY 269 Ca 0.00 -1.96 -0.43 0.00 0.00 0.00 0.00 46.02 43.63 1ubg n GLY 269 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ubg s ILE 270 N 0.00 4.03 -0.60 -0.61 1.01 -1.26 -1.30 121.20 122.48 1ubg s ILE 270 Ca 0.00 1.19 -0.26 0.00 0.00 0.00 0.00 60.65 61.58 1ubg s ILE 270 Cb 0.00 -3.96 -0.06 0.00 0.01 0.00 0.00 42.46 38.45 1ubg s ILE 270 CO 0.00 -0.32 2.20 -0.55 0.00 0.00 0.00 174.94 176.27 1ubg s SER 271 N 2.98 4.68 0.15 3.58 0.15 -0.80 -4.85 113.70 119.59 1ubg s SER 271 Ca 0.61 0.59 -0.20 0.00 0.70 0.00 0.00 55.95 57.65 1ubg s SER 271 Cb -0.21 -2.52 0.04 0.00 -1.71 0.00 0.00 66.02 61.62 1ubg s SER 271 CO 0.23 -2.84 1.66 -0.09 1.20 0.00 0.00 173.24 173.40 1ubg h ARG 272 N 16.73 -0.11 0.00 5.44 2.43 -1.91 -1.03 114.38 135.93 1ubg h ARG 272 Ca -0.19 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 1ubg h ARG 272 Cb 1.18 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 1ubg h ARG 272 CO 1.16 -0.08 0.00 0.39 -1.51 0.00 0.00 179.97 179.94 1ubg n GLU 273 N -5.32 0.00 -0.47 0.20 4.71 -1.26 -1.79 120.64 116.71 1ubg n GLU 273 Ca -0.00 0.55 0.40 0.00 -0.01 0.00 0.00 57.16 58.09 1ubg n GLU 273 Cb 0.23 -1.35 0.68 0.00 -1.01 0.00 0.00 31.44 29.99 1ubg n GLU 273 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 1ubg h GLY 274 N 0.00 1.39 2.00 0.62 0.00 -1.84 1.52 103.07 106.76 1ubg h GLY 274 Ca 0.00 -0.10 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 1ubg h GLY 274 CO 0.00 -0.48 -0.29 0.23 0.00 0.00 0.00 176.54 176.00 1ubg h SER 275 N 0.02 0.00 0.91 0.19 0.87 -0.51 -2.33 113.55 112.69 1ubg h SER 275 Ca 0.88 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 61.21 1ubg h SER 275 Cb 2.80 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 64.73 1ubg h SER 275 CO -0.47 0.29 -1.08 -0.07 -0.53 0.00 0.00 176.83 174.96 1ubg h LEU 276 N 0.00 0.08 0.20 2.23 -0.00 0.30 -2.32 115.31 115.80 1ubg h LEU 276 Ca -0.00 -0.09 -0.01 0.00 -0.00 0.00 0.00 57.88 57.78 1ubg h LEU 276 Cb 0.69 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 41.32 1ubg h LEU 276 CO 0.04 1.07 -0.10 0.40 -0.00 0.00 0.00 178.44 179.85 1ubg h ILE 277 N 0.01 0.89 0.01 1.22 2.04 -1.29 2.45 117.51 122.84 1ubg h ILE 277 Ca -0.05 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1ubg h ILE 277 Cb 1.82 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 39.20 1ubg h ILE 277 CO 0.14 0.16 -0.04 0.44 0.00 0.00 0.00 178.15 178.85 1ubg h ASP 278 N -0.65 -0.12 -0.30 1.72 3.32 -1.52 0.40 116.42 119.27 1ubg h ASP 278 Ca -0.03 0.01 0.07 0.00 0.02 0.00 0.00 57.03 57.10 1ubg h ASP 278 Cb 0.47 0.04 -0.07 0.00 0.22 0.00 0.00 39.33 39.99 1ubg h ASP 278 CO 0.05 -0.04 -0.17 0.24 -1.72 0.00 0.00 179.24 177.59 1ubg h MET 279 N -0.06 -0.13 -0.80 3.56 2.86 -1.49 -0.94 114.93 117.94 1ubg h MET 279 Ca -0.00 0.01 0.23 0.00 -2.06 0.00 0.00 59.70 57.88 1ubg h MET 279 Cb 0.06 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 1ubg h MET 279 CO -0.02 -0.09 0.74 0.78 1.06 0.00 0.00 176.91 179.38 1ubg h GLY 280 N -0.14 0.00 0.11 8.32 0.00 0.47 -2.06 103.07 109.77 1ubg h GLY 280 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.11 1ubg h GLY 280 CO -0.38 0.00 -2.38 3.33 0.00 0.00 0.00 176.54 177.11 1ubg n VAL 281 N -3.76 1.51 1.06 4.60 0.24 0.14 0.64 118.33 122.76 1ubg n VAL 281 Ca 0.17 -0.64 0.01 0.00 -2.04 0.00 0.00 64.34 61.84 1ubg n VAL 281 Cb 1.02 -1.28 0.08 0.00 -1.47 0.00 0.00 33.84 32.19 1ubg n VAL 281 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1ubg n GLU 282 N -3.19 0.53 -0.38 7.34 2.13 -0.47 -1.20 120.64 125.40 1ubg n GLU 282 Ca -0.41 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.41 1ubg n GLU 282 Cb 1.03 -1.08 0.00 0.00 0.27 0.00 0.00 31.44 31.66 1ubg n GLU 282 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1ubg n HIS 283 N -0.58 0.00 0.00 4.31 8.25 -1.02 -5.04 115.22 121.14 1ubg n HIS 283 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1ubg n HIS 283 Cb 0.01 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1ubg n HIS 283 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ubg n GLY 284 N 0.00 1.55 0.25 -1.41 0.00 -0.34 -4.82 105.19 100.43 1ubg n GLY 284 Ca 0.00 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.12 1ubg n GLY 284 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1ubg n PHE 285 N 0.00 0.00 -4.22 1.61 1.16 -1.18 -3.58 117.46 111.25 1ubg n PHE 285 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.25 1ubg n PHE 285 Cb 0.00 -0.12 -0.16 0.00 -1.61 0.00 0.00 39.48 37.59 1ubg n PHE 285 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1ubg s ILE 286 N -3.18 2.11 0.14 1.97 1.01 0.21 -3.93 121.20 119.53 1ubg s ILE 286 Ca -0.01 -0.93 -0.05 0.00 0.00 0.00 0.00 60.65 59.65 1ubg s ILE 286 Cb 0.07 -1.88 -0.06 0.00 0.01 0.00 0.00 42.46 40.60 1ubg s ILE 286 CO 0.22 0.54 0.39 -0.13 0.00 0.00 0.00 174.94 175.96 1ubg s ARG 287 N 1.21 3.64 0.00 2.79 0.52 -0.07 -4.18 118.95 122.85 1ubg s ARG 287 Ca 0.03 -0.05 0.00 0.00 -0.52 0.00 0.00 55.73 55.18 1ubg s ARG 287 Cb -0.14 -2.84 0.00 0.00 0.52 0.00 0.00 34.95 32.49 1ubg s ARG 287 CO -0.11 0.46 0.00 0.36 0.02 0.00 0.00 175.30 176.04 1ubg n LYS 288 N 0.12 1.75 -2.10 3.54 -0.00 -1.26 0.43 118.16 120.65 1ubg n LYS 288 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.28 1ubg n LYS 288 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.55 1ubg n LYS 288 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 1ubg n SER 289 N 0.00 -7.45 0.00 -5.58 7.64 -1.26 -4.72 113.62 102.25 1ubg n SER 289 Ca 0.00 1.46 0.00 0.00 1.01 0.00 0.00 58.87 61.34 1ubg n SER 289 Cb 0.00 -4.48 0.00 0.00 -1.01 0.00 0.00 64.21 58.72 1ubg n SER 289 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ubg n GLY 290 N 1.89 0.88 2.48 0.23 0.00 -1.26 -4.34 105.19 105.07 1ubg n GLY 290 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1ubg n GLY 290 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ubg n SER 291 N 0.00 -4.66 -4.16 1.61 7.64 -1.26 -4.96 113.62 107.83 1ubg n SER 291 Ca 0.00 0.16 -0.36 0.00 1.01 0.00 0.00 58.87 59.68 1ubg n SER 291 Cb 0.00 -2.73 -0.12 0.00 -1.01 0.00 0.00 64.21 60.34 1ubg n SER 291 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1ubg s TRP 292 N -1.95 3.44 0.23 1.43 0.52 -1.26 -1.67 118.94 119.67 1ubg s TRP 292 Ca 0.00 -2.09 -0.30 0.00 0.02 0.00 0.00 56.10 53.73 1ubg s TRP 292 Cb 0.00 -2.78 -0.09 0.00 -1.15 0.00 0.00 33.47 29.45 1ubg s TRP 292 CO 0.00 -0.89 1.19 -0.06 0.02 0.00 0.00 176.95 177.21 1ubg s PHE 293 N 1.22 3.42 -0.04 -1.98 0.08 -0.94 -4.45 117.98 115.29 1ubg s PHE 293 Ca 0.03 1.49 -0.02 0.00 0.12 0.00 0.00 56.93 58.56 1ubg s PHE 293 Cb -0.22 -3.42 0.03 0.00 -0.57 0.00 0.00 43.02 38.84 1ubg s PHE 293 CO -0.02 -1.11 0.06 -0.08 -0.10 0.00 0.00 175.22 173.97 1ubg s THR 294 N -0.48 -0.11 -0.83 0.64 -1.32 0.17 -0.68 115.64 113.03 1ubg s THR 294 Ca 0.50 0.37 -0.22 0.00 -1.21 0.00 0.00 61.69 61.13 1ubg s THR 294 Cb -0.33 -0.15 0.07 0.00 -1.51 0.00 0.00 72.50 70.58 1ubg s THR 294 CO 0.40 0.16 1.17 -0.47 -2.21 0.00 0.00 174.62 173.67 1ubg s TYR 295 N 1.93 2.69 -0.22 9.09 5.04 0.31 -0.89 117.35 135.30 1ubg s TYR 295 Ca 0.02 -0.75 -0.19 0.00 -2.44 0.00 0.00 57.07 53.71 1ubg s TYR 295 Cb -0.12 -4.44 0.03 0.00 0.35 0.00 0.00 41.96 37.77 1ubg s TYR 295 CO -0.03 -1.75 0.33 -0.85 -1.34 0.00 0.00 175.55 171.90 1ubg n GLU 296 N 7.97 -1.02 0.00 4.97 0.28 -1.25 -2.83 120.64 128.76 1ubg n GLU 296 Ca 0.13 0.95 0.00 0.00 -0.16 0.00 0.00 57.16 58.08 1ubg n GLU 296 Cb 0.48 -1.30 0.00 0.00 1.43 0.00 0.00 31.44 32.05 1ubg n GLU 296 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ubg n GLY 297 N 0.39 2.05 3.75 -1.84 0.00 -1.26 -4.95 105.19 103.32 1ubg n GLY 297 Ca -0.04 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 1ubg n GLY 297 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ubg s GLU 298 N 0.00 4.22 0.57 1.61 2.02 -1.13 -4.99 118.70 121.00 1ubg s GLU 298 Ca 0.00 2.39 -0.01 0.00 0.02 0.00 0.00 54.97 57.37 1ubg s GLU 298 Cb 0.00 -3.07 0.03 0.00 0.10 0.00 0.00 34.13 31.19 1ubg s GLU 298 CO 0.00 -0.46 0.82 1.14 0.02 0.00 0.00 175.26 176.78 1ubg s GLN 299 N -0.74 2.59 -0.07 1.61 -2.07 -1.26 0.12 119.66 119.83 1ubg s GLN 299 Ca 0.58 -0.55 0.00 0.00 -1.82 0.00 0.00 55.36 53.58 1ubg s GLN 299 Cb -0.44 -2.41 -0.05 0.00 -1.09 0.00 0.00 33.01 29.03 1ubg s GLN 299 CO 0.48 -0.75 -0.07 1.28 -1.32 0.00 0.00 175.29 174.91 1ubg n LEU 300 N -2.45 2.77 0.00 2.60 7.99 0.14 -4.66 117.00 123.39 1ubg n LEU 300 Ca 0.07 -0.03 0.00 0.00 -0.01 0.00 0.00 56.01 56.04 1ubg n LEU 300 Cb 0.59 -0.25 0.00 0.00 -0.11 0.00 0.00 43.42 43.66 1ubg n LEU 300 CO 0.48 0.58 0.00 0.61 -1.51 0.00 0.00 177.39 177.54 1ubg n GLY 301 N 3.10 -1.82 3.04 -0.72 0.00 -1.22 -4.42 105.19 103.16 1ubg n GLY 301 Ca -0.13 -1.17 -0.34 0.00 0.00 0.00 0.00 46.02 44.39 1ubg n GLY 301 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ubg s GLN 302 N -1.68 2.48 0.00 1.61 -0.21 -1.26 -2.22 119.66 118.37 1ubg s GLN 302 Ca 0.00 -2.71 0.00 0.00 0.02 0.00 0.00 55.36 52.67 1ubg s GLN 302 Cb 0.00 -3.62 0.00 0.00 1.00 0.00 0.00 33.01 30.39 1ubg s GLN 302 CO 0.00 -1.18 0.00 0.41 -2.12 0.00 0.00 175.29 172.40 1ubg n GLY 303 N 3.12 1.78 0.00 3.09 0.00 -0.67 -4.73 105.19 107.78 1ubg n GLY 303 Ca 0.10 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1ubg n GLY 303 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ubg n LYS 304 N 0.46 0.00 -0.33 1.61 3.00 -1.26 0.94 118.16 122.58 1ubg n LYS 304 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 58.31 58.37 1ubg n LYS 304 Cb 0.00 0.00 0.25 0.00 0.00 0.00 0.00 35.03 35.28 1ubg n LYS 304 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 1ubg h GLU 305 N 0.00 0.96 -0.34 1.64 4.57 -1.97 0.60 114.58 120.04 1ubg h GLU 305 Ca 0.00 -0.06 -0.12 0.00 -1.18 0.00 0.00 59.36 58.00 1ubg h GLU 305 Cb 0.00 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 1ubg h GLU 305 CO 0.00 0.63 -0.30 -0.91 -1.18 0.00 0.00 179.01 177.26 1ubg h ASN 306 N 0.99 0.74 1.78 1.04 2.35 0.28 0.15 115.58 122.90 1ubg h ASN 306 Ca 0.45 -0.29 -0.03 0.00 -0.55 0.00 0.00 56.30 55.88 1ubg h ASN 306 Cb 0.39 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.55 1ubg h ASN 306 CO -0.21 0.99 -0.12 0.00 -1.65 0.00 0.00 177.43 176.44 1ubg h ALA 307 N 1.06 0.93 0.03 -0.83 0.00 -1.38 -2.53 119.26 116.53 1ubg h ALA 307 Ca 0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ubg h ALA 307 Cb 0.81 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1ubg h ALA 307 CO 0.07 0.15 -0.02 -0.09 0.00 0.00 0.00 179.25 179.36 1ubg h ARG 308 N 0.00 -0.04 -0.74 0.00 2.43 0.11 -1.78 114.38 114.35 1ubg h ARG 308 Ca -0.00 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 1ubg h ARG 308 Cb 1.04 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.57 1ubg h ARG 308 CO 0.02 0.38 0.25 0.87 -1.51 0.00 0.00 179.97 179.97 1ubg h LYS 309 N -0.47 1.12 -0.46 0.20 1.57 -0.69 0.50 116.57 118.35 1ubg h LYS 309 Ca -0.00 -0.22 0.09 0.00 -1.87 0.00 0.00 60.65 58.65 1ubg h LYS 309 Cb 0.44 -0.17 -0.09 0.00 0.08 0.00 0.00 32.23 32.48 1ubg h LYS 309 CO 0.01 0.94 -0.14 0.35 -0.57 0.00 0.00 179.45 180.04 1ubg h PHE 310 N 1.09 -0.31 -0.13 -1.35 3.04 -1.30 0.32 116.94 118.30 1ubg h PHE 310 Ca 0.24 0.04 -0.10 0.00 3.98 0.00 0.00 57.97 62.13 1ubg h PHE 310 Cb 0.27 0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.98 1ubg h PHE 310 CO 0.02 -0.22 -0.37 -0.07 -2.02 0.00 0.00 178.31 175.65 1ubg h LEU 311 N -0.03 0.28 0.50 0.59 3.38 -0.90 0.40 115.31 119.53 1ubg h LEU 311 Ca 0.22 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1ubg h LEU 311 Cb 0.37 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1ubg h LEU 311 CO -0.49 0.63 -0.29 -0.07 0.09 0.00 0.00 178.44 178.31 1ubg h LEU 312 N 0.23 -0.71 0.00 1.67 -0.00 0.17 -3.16 115.31 113.52 1ubg h LEU 312 Ca 0.03 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.94 1ubg h LEU 312 Cb 0.76 0.20 0.00 0.00 -0.00 0.00 0.00 40.66 41.63 1ubg h LEU 312 CO 0.06 -0.46 -0.09 1.05 -0.00 0.00 0.00 178.44 178.99 1ubg h GLU 313 N -0.74 0.00 -3.18 1.13 4.11 -0.46 -3.38 114.58 112.06 1ubg h GLU 313 Ca -0.06 0.00 -0.73 0.00 0.07 0.00 0.00 59.36 58.64 1ubg h GLU 313 Cb 0.59 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 29.51 1ubg h GLU 313 CO 0.07 0.00 0.12 0.09 0.07 0.00 0.00 179.01 179.36 1ubg n ASN 314 N -2.95 4.80 -0.15 3.06 3.02 0.14 -4.87 115.26 118.30 1ubg n ASN 314 Ca 0.04 -3.19 -0.03 0.00 -0.03 0.00 0.00 54.58 51.36 1ubg n ASN 314 Cb 0.52 -1.12 0.17 0.00 -0.61 0.00 0.00 39.78 38.74 1ubg n ASN 314 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1ubg h THR 315 N 3.76 1.23 -0.44 3.41 2.02 -1.76 -2.37 112.91 118.76 1ubg h THR 315 Ca 0.18 -0.83 0.05 0.00 0.77 0.00 0.00 66.41 66.58 1ubg h THR 315 Cb 0.77 0.63 -0.08 0.00 -1.74 0.00 0.00 68.15 67.73 1ubg h THR 315 CO 0.97 0.31 -0.52 -2.24 0.37 0.00 0.00 175.52 174.41 1ubg h ASP 316 N 0.85 -1.77 0.07 4.18 2.03 -1.92 0.35 116.42 120.21 1ubg h ASP 316 Ca 0.19 0.24 -0.00 0.00 -0.73 0.00 0.00 57.03 56.72 1ubg h ASP 316 Cb 0.29 0.73 0.00 0.00 -0.83 0.00 0.00 39.33 39.53 1ubg h ASP 316 CO -0.00 -0.36 -0.03 1.62 -1.03 0.00 0.00 179.24 179.44 1ubg h VAL 317 N -0.33 1.09 -0.98 4.15 3.04 -1.95 -3.09 116.25 118.18 1ubg h VAL 317 Ca 0.08 -0.54 0.09 0.00 -1.01 0.00 0.00 66.70 65.32 1ubg h VAL 317 Cb 0.53 1.44 -0.12 0.00 -2.01 0.00 0.00 31.29 31.13 1ubg h VAL 317 CO -0.59 0.13 -0.57 0.00 -1.01 0.00 0.00 177.57 175.53 1ubg h ALA 318 N 0.58 -0.49 -0.80 3.17 0.00 -0.76 0.52 119.26 121.47 1ubg h ALA 318 Ca -0.01 0.13 0.18 0.00 0.00 0.00 0.00 54.91 55.21 1ubg h ALA 318 Cb 0.29 1.34 -0.11 0.00 0.00 0.00 0.00 17.79 19.31 1ubg h ALA 318 CO 0.02 -0.94 0.28 -0.91 0.00 0.00 0.00 179.25 177.70 1ubg h ASN 319 N -0.01 0.19 0.09 0.00 2.35 -0.35 -0.11 115.58 117.73 1ubg h ASN 319 Ca 0.17 0.14 0.02 0.00 -0.55 0.00 0.00 56.30 56.08 1ubg h ASN 319 Cb 0.43 0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.90 1ubg h ASN 319 CO -0.93 0.01 -0.51 -0.33 -1.65 0.00 0.00 177.43 174.01 1ubg h GLU 320 N 0.36 -0.70 0.05 0.81 3.07 0.10 0.63 114.58 118.91 1ubg h GLU 320 Ca 0.47 0.05 0.03 0.00 -0.50 0.00 0.00 59.36 59.40 1ubg h GLU 320 Cb 0.82 0.16 -0.05 0.00 -0.84 0.00 0.00 28.75 28.84 1ubg h GLU 320 CO -0.50 -0.46 -0.32 0.82 -1.40 0.00 0.00 179.01 177.15 1ubg h ILE 321 N -0.72 0.31 -0.83 3.13 5.03 -0.48 1.00 117.51 124.95 1ubg h ILE 321 Ca 0.00 0.00 0.20 0.00 -0.12 0.00 0.00 64.86 64.94 1ubg h ILE 321 Cb 0.74 0.31 -0.12 0.00 -3.03 0.00 0.00 36.82 34.72 1ubg h ILE 321 CO -0.30 0.00 0.27 -0.08 -0.68 0.00 0.00 178.15 177.36 1ubg h GLU 322 N -0.50 0.31 0.00 2.37 4.81 -0.71 0.31 114.58 121.16 1ubg h GLU 322 Ca 0.05 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1ubg h GLU 322 Cb 0.57 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1ubg h GLU 322 CO -0.23 0.20 0.00 1.63 -0.73 0.00 0.00 179.01 179.88 1ubg n LYS 323 N -5.12 0.00 -0.25 1.92 5.02 0.22 0.33 118.16 120.28 1ubg n LYS 323 Ca 0.19 0.13 0.20 0.00 -2.02 0.00 0.00 58.31 56.80 1ubg n LYS 323 Cb 0.57 -1.11 0.37 0.00 -0.02 0.00 0.00 35.03 34.84 1ubg n LYS 323 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1ubg n LYS 324 N -0.85 -0.05 -0.09 1.97 0.00 0.32 0.37 118.16 119.83 1ubg n LYS 324 Ca 0.00 1.08 -0.11 0.00 -0.00 0.00 0.00 58.31 59.28 1ubg n LYS 324 Cb 0.00 -1.86 -0.04 0.00 -0.00 0.00 0.00 35.03 33.13 1ubg n LYS 324 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 1ubg h ILE 325 N 0.00 1.25 -0.22 0.58 2.04 -0.28 -2.63 117.51 118.25 1ubg h ILE 325 Ca 0.58 -0.88 0.02 0.00 1.00 0.00 0.00 64.86 65.58 1ubg h ILE 325 Cb 1.44 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 38.78 1ubg h ILE 325 CO -0.63 0.28 -0.22 0.11 0.00 0.00 0.00 178.15 177.69 1ubg h LYS 326 N 0.25 -0.10 0.00 2.37 1.79 1.14 -1.94 116.57 120.08 1ubg h LYS 326 Ca 0.08 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1ubg h LYS 326 Cb 0.40 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 1ubg h LYS 326 CO 0.01 -0.07 0.00 0.39 -1.08 0.00 0.00 179.45 178.70 1ubg n GLU 327 N -3.77 0.21 0.00 3.15 1.02 -1.09 -0.39 120.64 119.78 1ubg n GLU 327 Ca -0.01 0.26 0.09 0.00 -0.02 0.00 0.00 57.16 57.48 1ubg n GLU 327 Cb 0.12 -1.79 0.45 0.00 -0.02 0.00 0.00 31.44 30.20 1ubg n GLU 327 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1ubg n LYS 328 N -2.17 0.28 0.00 3.49 3.00 -0.77 -4.30 118.16 117.69 1ubg n LYS 328 Ca 0.05 0.11 0.00 0.00 -0.00 0.00 0.00 58.31 58.47 1ubg n LYS 328 Cb 0.36 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.89 1ubg n LYS 328 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1ubg n LEU 329 N -1.26 0.03 0.00 3.14 4.77 -0.56 -5.07 117.00 118.05 1ubg n LEU 329 Ca 0.09 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1ubg n LEU 329 Cb 0.13 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1ubg n LEU 329 CO 0.13 -0.51 0.00 0.61 -1.33 0.00 0.00 177.39 176.29