#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ubk s MET 2 N 0.00 0.03 0.00 3.23 0.23 -1.26 -4.83 119.30 116.70 1ubk s MET 2 Ca 0.00 0.04 0.00 0.00 -1.03 0.00 0.00 55.69 54.70 1ubk s MET 2 Cb 0.00 0.01 0.00 0.00 -1.53 0.00 0.00 34.83 33.31 1ubk s MET 2 CO 0.00 -0.00 0.00 0.41 -2.03 0.00 0.00 175.02 173.40 1ubk n GLY 3 N 2.03 2.20 0.00 3.16 0.00 -1.26 -4.98 105.19 106.34 1ubk n GLY 3 Ca -0.12 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1ubk n GLY 3 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ubk n PRO 4 N 0.00 3.42 0.00 1.61 -0.02 -1.26 -4.77 135.00 133.99 1ubk n PRO 4 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1ubk n PRO 4 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1ubk n PRO 4 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1ubk n ARG 5 N 0.00 0.00 -3.23 -0.52 3.00 -1.26 -4.66 116.66 109.98 1ubk n ARG 5 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.47 1ubk n ARG 5 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 32.40 1ubk n ARG 5 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 1ubk s ARG 6 N 0.00 4.20 0.28 -0.14 0.52 -1.26 -5.03 118.95 117.52 1ubk s ARG 6 Ca 0.00 0.75 -0.29 0.00 -0.52 0.00 0.00 55.73 55.67 1ubk s ARG 6 Cb 0.00 -3.12 -0.10 0.00 0.52 0.00 0.00 34.95 32.25 1ubk s ARG 6 CO 0.00 0.56 1.40 -1.25 0.02 0.00 0.00 175.30 176.03 1ubk s PRO 7 N -1.43 4.28 -0.02 3.54 0.04 -1.26 -4.48 135.00 135.68 1ubk s PRO 7 Ca 0.34 2.29 -0.30 0.00 0.04 0.00 0.00 61.00 63.37 1ubk s PRO 7 Cb -0.18 -3.09 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 1ubk s PRO 7 CO 0.20 -0.36 1.01 0.45 0.04 0.00 0.00 177.00 178.34 1ubk s SER 8 N 0.08 7.31 -0.12 6.66 0.15 -1.26 -0.06 113.70 126.46 1ubk s SER 8 Ca 0.56 1.67 0.01 0.00 0.70 0.00 0.00 55.95 58.88 1ubk s SER 8 Cb -0.41 -2.57 -0.01 0.00 -1.71 0.00 0.00 66.02 61.32 1ubk s SER 8 CO 0.47 -0.32 -0.16 -0.69 1.20 0.00 0.00 173.24 173.74 1ubk s VAL 9 N 1.25 2.82 -0.27 4.45 1.01 0.20 -0.46 120.40 129.40 1ubk s VAL 9 Ca 0.52 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.69 1ubk s VAL 9 Cb -0.21 -2.16 -0.00 0.00 0.00 0.00 0.00 36.38 34.01 1ubk s VAL 9 CO 0.26 0.53 0.05 -0.69 0.00 0.00 0.00 175.10 175.25 1ubk s VAL 10 N 0.31 3.86 -0.23 2.92 1.01 -0.18 -0.38 120.40 127.71 1ubk s VAL 10 Ca -0.12 -0.58 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 1ubk s VAL 10 Cb -0.16 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 1ubk s VAL 10 CO 0.06 0.20 0.01 -0.47 0.00 0.00 0.00 175.10 174.90 1ubk s TYR 11 N 1.51 3.02 0.03 5.22 5.04 -0.36 -0.96 117.35 130.85 1ubk s TYR 11 Ca 0.04 -0.67 0.03 0.00 -2.44 0.00 0.00 57.07 54.02 1ubk s TYR 11 Cb -0.16 -2.15 -0.04 0.00 0.35 0.00 0.00 41.96 39.96 1ubk s TYR 11 CO 0.01 -0.43 -0.01 -0.51 -1.34 0.00 0.00 175.55 173.28 1ubk s LEU 12 N 1.45 3.46 -0.23 6.97 1.43 0.10 -4.17 118.68 127.70 1ubk s LEU 12 Ca 0.05 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1ubk s LEU 12 Cb -0.15 -2.07 0.03 0.00 0.03 0.00 0.00 46.19 44.04 1ubk s LEU 12 CO 0.00 0.24 -0.12 -1.00 0.23 0.00 0.00 176.35 175.70 1ubk s HIS 13 N -1.16 3.01 0.00 0.29 3.76 -1.26 -0.95 115.29 118.98 1ubk s HIS 13 Ca 0.22 -1.72 0.00 0.00 -0.15 0.00 0.00 55.06 53.41 1ubk s HIS 13 Cb -0.12 -1.99 0.00 0.00 1.11 0.00 0.00 32.58 31.59 1ubk s HIS 13 CO 0.13 -0.78 0.00 0.09 -0.85 0.00 0.00 174.74 173.33 1ubk n ASN 14 N 4.61 0.00 -4.47 1.40 3.02 0.53 -4.96 115.26 115.39 1ubk n ASN 14 Ca -0.18 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 53.94 1ubk n ASN 14 Cb 0.47 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.60 1ubk n ASN 14 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ubk s ALA 15 N -2.96 3.16 0.19 5.41 0.00 0.07 -4.89 121.76 122.75 1ubk s ALA 15 Ca 0.00 -1.64 -0.13 0.00 0.00 0.00 0.00 51.96 50.19 1ubk s ALA 15 Cb 0.00 -3.76 0.01 0.00 0.00 0.00 0.00 23.12 19.36 1ubk s ALA 15 CO 0.00 -2.56 0.42 -1.83 0.00 0.00 0.00 175.76 171.79 1ubk s GLU 16 N 3.86 1.33 0.00 0.00 4.04 -1.26 -1.48 118.70 125.18 1ubk s GLU 16 Ca 0.24 -1.07 0.14 0.00 0.04 0.00 0.00 54.97 54.32 1ubk s GLU 16 Cb -0.16 0.45 0.01 0.00 0.02 0.00 0.00 34.13 34.45 1ubk s GLU 16 CO 0.13 -0.53 0.80 0.00 -1.84 0.00 0.00 175.26 173.81 1ubk n THR 18 N -0.08 0.00 0.09 0.00 -1.04 -1.26 -4.89 114.28 107.10 1ubk n THR 18 Ca 0.06 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.08 1ubk n THR 18 Cb 0.30 -0.16 0.35 0.00 -1.82 0.00 0.00 70.33 69.00 1ubk n THR 18 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1ubk h GLY 19 N 0.00 0.32 0.95 3.41 0.00 -1.99 0.08 103.07 105.84 1ubk h GLY 19 Ca 0.00 -0.21 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 1ubk h GLY 19 CO 0.00 0.19 -0.09 0.00 0.00 0.00 0.00 176.54 176.64 1ubk h SER 21 N 0.49 0.45 -0.85 0.00 0.02 -1.86 -1.94 113.55 109.87 1ubk h SER 21 Ca 0.09 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1ubk h SER 21 Cb 0.60 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 63.03 1ubk h SER 21 CO 0.04 0.31 0.56 -0.33 -1.14 0.00 0.00 176.83 176.27 1ubk h GLU 22 N 0.58 1.08 -0.76 3.45 4.39 -0.84 -2.05 114.58 120.43 1ubk h GLU 22 Ca 0.23 -0.06 0.02 0.00 0.34 0.00 0.00 59.36 59.89 1ubk h GLU 22 Cb 0.11 -0.24 -0.04 0.00 -0.10 0.00 0.00 28.75 28.47 1ubk h GLU 22 CO -0.14 0.71 0.50 0.66 -1.16 0.00 0.00 179.01 179.58 1ubk h SER 23 N 1.11 0.83 0.35 1.42 4.64 -0.31 -1.39 113.55 120.20 1ubk h SER 23 Ca 0.33 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 61.53 1ubk h SER 23 Cb -0.05 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 61.82 1ubk h SER 23 CO -0.08 0.59 -0.44 0.58 -0.87 0.00 0.00 176.83 176.60 1ubk h VAL 24 N 0.97 1.32 0.00 0.95 2.07 -0.99 -0.92 116.25 119.65 1ubk h VAL 24 Ca 0.29 -1.57 0.00 0.00 0.82 0.00 0.00 66.70 66.24 1ubk h VAL 24 Cb -0.03 1.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1ubk h VAL 24 CO -0.07 0.46 0.00 -0.07 0.02 0.00 0.00 177.57 177.90 1ubk h LEU 25 N 0.10 0.00 -0.77 2.57 3.38 -0.99 -1.15 115.31 118.44 1ubk h LEU 25 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ubk h LEU 25 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1ubk h LEU 25 CO 0.06 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.13 1ubk n ARG 26 N -2.64 1.51 -1.60 1.13 5.12 -0.35 -4.68 116.66 115.15 1ubk n ARG 26 Ca -0.01 -0.77 -0.46 0.00 -1.93 0.00 0.00 57.85 54.68 1ubk n ARG 26 Cb 0.12 -1.39 -0.03 0.00 -1.16 0.00 0.00 32.46 30.01 1ubk n ARG 26 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ubk n ALA 27 N -0.03 -0.29 -3.76 7.54 0.00 -0.43 -4.94 120.51 118.59 1ubk n ALA 27 Ca 0.17 0.42 -0.25 0.00 0.00 0.00 0.00 53.44 53.78 1ubk n ALA 27 Cb 0.26 -2.06 -0.17 0.00 0.00 0.00 0.00 19.45 17.49 1ubk n ALA 27 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ubk s PHE 28 N -0.55 1.34 -0.90 0.00 5.36 -1.26 -3.97 117.98 118.00 1ubk s PHE 28 Ca 0.66 -0.59 -0.07 0.00 -0.96 0.00 0.00 56.93 55.97 1ubk s PHE 28 Cb -0.76 -1.10 -0.00 0.00 -0.34 0.00 0.00 43.02 40.81 1ubk s PHE 28 CO 0.55 -0.41 0.69 0.39 -1.46 0.00 0.00 175.22 174.98 1ubk n GLU 29 N 4.61 -1.35 -3.07 10.12 1.02 -1.26 -4.61 120.64 126.10 1ubk n GLU 29 Ca -0.16 0.88 -0.34 0.00 -0.02 0.00 0.00 57.16 57.53 1ubk n GLU 29 Cb 0.50 -3.87 -0.06 0.00 -0.02 0.00 0.00 31.44 27.99 1ubk n GLU 29 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1ubk s PRO 30 N -4.70 4.15 0.80 3.49 0.04 -1.26 -5.19 135.00 132.33 1ubk s PRO 30 Ca 0.15 0.83 -0.12 0.00 0.04 0.00 0.00 61.00 61.90 1ubk s PRO 30 Cb -0.05 -2.58 0.07 0.00 0.04 0.00 0.00 34.50 31.97 1ubk s PRO 30 CO 0.84 0.23 1.16 0.71 0.04 0.00 0.00 177.00 179.98 1ubk s TYR 31 N -1.82 2.99 0.35 0.56 1.51 -1.26 -4.71 117.35 114.96 1ubk s TYR 31 Ca 0.51 0.84 0.19 0.00 -1.01 0.00 0.00 57.07 57.59 1ubk s TYR 31 Cb -0.13 -3.39 0.99 0.00 -0.11 0.00 0.00 41.96 39.32 1ubk s TYR 31 CO 0.19 -1.71 1.91 0.97 -1.11 0.00 0.00 175.55 175.80 1ubk h ILE 32 N -1.01 0.94 -0.30 2.71 6.09 -1.84 -1.21 117.51 122.89 1ubk h ILE 32 Ca -0.46 -1.00 -0.05 0.00 -1.37 0.00 0.00 64.86 61.98 1ubk h ILE 32 Cb 1.31 1.58 -0.01 0.00 0.47 0.00 0.00 36.82 40.17 1ubk h ILE 32 CO 0.65 0.26 -0.00 -2.24 -3.07 0.00 0.00 178.15 173.75 1ubk h ASP 33 N 0.00 0.52 -0.62 2.19 2.03 -1.94 -1.37 116.42 117.23 1ubk h ASP 33 Ca -0.00 -0.31 0.07 0.00 -0.73 0.00 0.00 57.03 56.06 1ubk h ASP 33 Cb 0.56 -0.14 -0.06 0.00 -0.83 0.00 0.00 39.33 38.86 1ubk h ASP 33 CO 0.03 0.70 0.30 0.74 -1.03 0.00 0.00 179.24 179.99 1ubk h THR 34 N 0.32 0.88 -0.66 1.15 2.02 -1.80 0.16 112.91 114.99 1ubk h THR 34 Ca 0.08 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1ubk h THR 34 Cb 0.44 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1ubk h THR 34 CO 0.02 0.10 0.41 -0.07 0.37 0.00 0.00 175.52 176.35 1ubk h LEU 35 N 0.55 0.78 0.00 2.58 3.38 -0.90 0.11 115.31 121.81 1ubk h LEU 35 Ca 0.30 -0.05 -0.20 0.00 0.09 0.00 0.00 57.88 58.02 1ubk h LEU 35 Cb 0.27 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1ubk h LEU 35 CO -0.23 0.59 -0.99 0.40 0.09 0.00 0.00 178.44 178.30 1ubk h ILE 36 N 0.90 1.45 0.00 1.22 5.03 -0.83 -1.21 117.51 124.07 1ubk h ILE 36 Ca 0.24 -3.10 -0.36 0.00 -0.12 0.00 0.00 64.86 61.52 1ubk h ILE 36 Cb -0.06 2.71 -0.07 0.00 -3.03 0.00 0.00 36.82 36.38 1ubk h ILE 36 CO -0.05 0.83 -2.28 0.18 -0.68 0.00 0.00 178.15 176.15 1ubk n LEU 37 N -3.29 0.38 -0.03 1.44 4.32 0.01 -4.57 117.00 115.27 1ubk n LEU 37 Ca -0.02 0.06 -0.05 0.00 -0.02 0.00 0.00 56.01 55.99 1ubk n LEU 37 Cb 0.91 0.33 -0.02 0.00 -1.62 0.00 0.00 43.42 43.02 1ubk n LEU 37 CO 0.46 0.52 -0.68 0.47 -1.22 0.00 0.00 177.39 176.93 1ubk n ASP 38 N -2.84 1.52 0.08 -1.43 8.00 0.31 -4.85 116.55 117.33 1ubk n ASP 38 Ca -0.31 0.03 -0.22 0.00 0.71 0.00 0.00 54.79 55.00 1ubk n ASP 38 Cb 1.13 -0.14 -0.14 0.00 -0.02 0.00 0.00 41.12 41.96 1ubk n ASP 38 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1ubk h THR 39 N -0.13 1.34 -4.44 -3.53 2.02 -1.21 -3.48 112.91 103.47 1ubk h THR 39 Ca -0.13 -2.47 -0.22 0.00 0.77 0.00 0.00 66.41 64.36 1ubk h THR 39 Cb 1.14 2.83 -0.15 0.00 -1.74 0.00 0.00 68.15 70.23 1ubk h THR 39 CO -0.06 0.74 -0.63 -0.76 0.37 0.00 0.00 175.52 175.17 1ubk s LEU 40 N -7.89 1.49 -0.29 2.58 2.01 -0.47 -4.30 118.68 111.82 1ubk s LEU 40 Ca -0.11 -1.30 0.01 0.00 0.01 0.00 0.00 54.13 52.74 1ubk s LEU 40 Cb 0.04 0.31 0.06 0.00 0.01 0.00 0.00 46.19 46.61 1ubk s LEU 40 CO 0.91 -0.77 -0.03 -0.55 1.01 0.00 0.00 176.35 176.91 1ubk s SER 41 N -3.12 4.70 -0.63 2.29 0.15 0.92 -4.34 113.70 113.67 1ubk s SER 41 Ca 0.32 -1.46 -0.24 0.00 0.70 0.00 0.00 55.95 55.27 1ubk s SER 41 Cb 0.07 -1.64 0.05 0.00 -1.71 0.00 0.00 66.02 62.80 1ubk s SER 41 CO 0.07 -0.26 1.02 -0.22 1.20 0.00 0.00 173.24 175.06 1ubk s LEU 42 N 1.14 4.02 0.00 3.45 2.96 -1.26 -0.63 118.68 128.37 1ubk s LEU 42 Ca -0.05 -0.61 0.20 0.00 -0.22 0.00 0.00 54.13 53.46 1ubk s LEU 42 Cb -0.20 -2.63 -0.13 0.00 0.50 0.00 0.00 46.19 43.73 1ubk s LEU 42 CO -0.04 -1.43 0.93 0.47 -1.32 0.00 0.00 176.35 174.96 1ubk n ASP 43 N 7.94 1.38 -3.67 3.68 10.43 0.49 -4.82 116.55 131.98 1ubk n ASP 43 Ca -0.00 -1.19 -0.10 0.00 2.57 0.00 0.00 54.79 56.07 1ubk n ASP 43 Cb 0.47 0.77 -0.09 0.00 1.84 0.00 0.00 41.12 44.11 1ubk n ASP 43 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 1ubk s TYR 44 N -2.65 -0.80 -0.30 1.24 5.04 -1.22 -4.69 117.35 113.96 1ubk s TYR 44 Ca 0.12 1.68 -0.05 0.00 -2.44 0.00 0.00 57.07 56.38 1ubk s TYR 44 Cb 0.16 0.41 0.19 0.00 0.35 0.00 0.00 41.96 43.07 1ubk s TYR 44 CO 0.70 -0.41 0.84 -1.58 -1.34 0.00 0.00 175.55 173.76 1ubk s HIS 45 N 1.29 -1.07 0.49 4.97 2.46 -1.26 -1.22 115.29 120.95 1ubk s HIS 45 Ca -0.08 0.77 0.33 0.00 0.47 0.00 0.00 55.06 56.55 1ubk s HIS 45 Cb -0.06 0.24 1.80 0.00 -0.13 0.00 0.00 32.58 34.43 1ubk s HIS 45 CO -0.13 -0.62 2.19 0.93 -2.47 0.00 0.00 174.74 174.64 1ubk h GLU 46 N 7.72 0.00 -0.11 2.88 5.08 -1.95 -0.77 114.58 127.43 1ubk h GLU 46 Ca -0.09 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.10 1ubk h GLU 46 Cb 1.18 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1ubk h GLU 46 CO 0.03 0.05 -0.64 1.15 -1.00 0.00 0.00 179.01 178.59 1ubk h THR 47 N 0.00 1.36 0.00 1.13 2.02 -1.97 -3.37 112.91 112.08 1ubk h THR 47 Ca -0.00 -2.00 0.00 0.00 0.77 0.00 0.00 66.41 65.18 1ubk h THR 47 Cb 0.18 1.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 1ubk h THR 47 CO 0.01 0.60 0.00 2.30 0.37 0.00 0.00 175.52 178.80 1ubk n ILE 48 N -3.88 0.00 -2.32 3.11 -5.35 -0.96 -5.06 119.36 104.90 1ubk n ILE 48 Ca -0.03 -0.42 -0.34 0.00 -0.27 0.00 0.00 62.75 61.68 1ubk n ILE 48 Cb 0.65 1.07 -0.01 0.00 -1.74 0.00 0.00 39.64 39.61 1ubk n ILE 48 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ubk s MET 49 N -0.49 3.49 0.05 6.28 0.23 -0.34 -4.96 119.30 123.57 1ubk s MET 49 Ca 0.00 1.48 -0.18 0.00 -1.03 0.00 0.00 55.69 55.95 1ubk s MET 49 Cb 0.00 -2.04 -0.14 0.00 -1.53 0.00 0.00 34.83 31.13 1ubk s MET 49 CO 0.00 -0.71 1.34 0.00 -2.03 0.00 0.00 175.02 173.61 1ubk h ALA 50 N 1.21 0.27 -2.48 3.16 0.00 -1.96 -3.45 119.26 116.00 1ubk h ALA 50 Ca -0.49 -0.38 -0.49 0.00 0.00 0.00 0.00 54.91 53.54 1ubk h ALA 50 Cb 1.24 -0.05 0.06 0.00 0.00 0.00 0.00 17.79 19.04 1ubk h ALA 50 CO 0.58 0.24 0.41 0.00 0.00 0.00 0.00 179.25 180.47 1ubk s ALA 51 N -4.18 2.73 0.24 0.00 0.00 -1.26 -5.06 121.76 114.23 1ubk s ALA 51 Ca -0.13 0.70 0.03 0.00 0.00 0.00 0.00 51.96 52.56 1ubk s ALA 51 Cb 0.06 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 1ubk s ALA 51 CO 0.79 -0.69 0.02 0.00 0.00 0.00 0.00 175.76 175.88 1ubk s ALA 52 N -1.94 1.79 0.00 0.00 0.00 -1.26 -4.52 121.76 115.83 1ubk s ALA 52 Ca 0.70 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.87 1ubk s ALA 52 Cb -0.21 0.61 0.00 0.00 0.00 0.00 0.00 23.12 23.52 1ubk s ALA 52 CO 0.27 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1ubk n GLY 53 N -0.43 2.94 0.36 0.00 0.00 -1.26 -2.06 105.19 104.74 1ubk n GLY 53 Ca -0.04 -0.36 0.11 0.00 0.00 0.00 0.00 46.02 45.73 1ubk n GLY 53 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ubk h ASP 54 N 9.73 0.56 -0.04 1.61 3.32 -1.99 -0.56 116.42 129.05 1ubk h ASP 54 Ca 0.00 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 56.95 1ubk h ASP 54 Cb 0.00 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1ubk h ASP 54 CO 0.00 0.32 -0.34 0.00 -1.72 0.00 0.00 179.24 177.50 1ubk h ALA 55 N 1.62 0.96 -0.39 3.45 0.00 -1.81 0.39 119.26 123.48 1ubk h ALA 55 Ca 0.36 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1ubk h ALA 55 Cb 0.58 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1ubk h ALA 55 CO -0.14 0.61 -0.11 0.00 0.00 0.00 0.00 179.25 179.61 1ubk h ALA 56 N 1.19 0.54 -0.59 0.00 0.00 -0.64 -1.13 119.26 118.63 1ubk h ALA 56 Ca 0.05 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1ubk h ALA 56 Cb 0.80 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1ubk h ALA 56 CO 0.07 0.42 0.18 0.93 0.00 0.00 0.00 179.25 180.85 1ubk h GLU 57 N 0.58 0.89 -0.35 0.00 5.08 -0.88 -0.27 114.58 119.62 1ubk h GLU 57 Ca 0.10 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 58.19 1ubk h GLU 57 Cb 0.64 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1ubk h GLU 57 CO 0.04 0.77 -0.21 0.00 -1.00 0.00 0.00 179.01 178.61 1ubk h ALA 58 N 1.34 1.00 -0.76 3.43 0.00 -0.79 -1.12 119.26 122.36 1ubk h ALA 58 Ca 0.19 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ubk h ALA 58 Cb 0.25 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1ubk h ALA 58 CO -0.01 0.59 0.48 0.00 0.00 0.00 0.00 179.25 180.31 1ubk h ALA 59 N 1.19 0.97 -0.20 0.00 0.00 -0.38 -0.41 119.26 120.43 1ubk h ALA 59 Ca 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ubk h ALA 59 Cb 0.67 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1ubk h ALA 59 CO 0.05 0.41 0.08 1.25 0.00 0.00 0.00 179.25 181.05 1ubk h LEU 60 N 1.03 0.28 -0.66 0.00 5.85 -0.69 -1.75 115.31 119.37 1ubk h LEU 60 Ca 0.27 -0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.87 1ubk h LEU 60 Cb -0.07 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.85 1ubk h LEU 60 CO -0.05 0.36 0.41 -0.08 -0.34 0.00 0.00 178.44 178.73 1ubk h GLU 61 N 0.18 0.78 -0.70 1.25 4.81 -1.03 -0.39 114.58 119.47 1ubk h GLU 61 Ca 0.07 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 1ubk h GLU 61 Cb 0.16 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 1ubk h GLU 61 CO -0.01 0.51 0.27 0.37 -0.73 0.00 0.00 179.01 179.43 1ubk h GLN 62 N 0.80 1.06 -0.35 1.92 4.15 -0.89 -1.78 115.11 120.03 1ubk h GLN 62 Ca 0.27 -0.20 -0.06 0.00 0.77 0.00 0.00 58.65 59.43 1ubk h GLN 62 Cb 0.02 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.53 1ubk h GLN 62 CO -0.11 0.88 -0.01 0.00 -1.93 0.00 0.00 178.83 177.67 1ubk h ALA 63 N 1.12 0.47 -0.04 3.38 0.00 -0.85 -3.07 119.26 120.28 1ubk h ALA 63 Ca 0.23 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1ubk h ALA 63 Cb 0.23 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1ubk h ALA 63 CO -0.02 0.24 -0.52 -0.39 0.00 0.00 0.00 179.25 178.56 1ubk h VAL 64 N 0.42 1.37 -0.49 0.00 -1.51 -0.88 -2.89 116.25 112.27 1ubk h VAL 64 Ca 0.10 -1.80 0.00 0.00 -1.23 0.00 0.00 66.70 63.77 1ubk h VAL 64 Cb 0.47 1.93 0.00 0.00 -2.13 0.00 0.00 31.29 31.56 1ubk h VAL 64 CO 0.02 0.52 0.00 0.59 -1.23 0.00 0.00 177.57 177.47 1ubk n ASN 65 N -3.92 3.09 -4.74 4.19 3.02 -0.69 -4.90 115.26 111.31 1ubk n ASN 65 Ca -0.02 -2.14 -0.41 0.00 -0.03 0.00 0.00 54.58 51.98 1ubk n ASN 65 Cb 0.55 -0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 39.28 1ubk n ASN 65 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ubk s SER 66 N -0.90 6.82 0.15 6.41 0.15 -1.09 -4.88 113.70 120.36 1ubk s SER 66 Ca 0.35 2.48 0.17 0.00 0.70 0.00 0.00 55.95 59.65 1ubk s SER 66 Cb 0.20 -2.61 0.76 0.00 -1.71 0.00 0.00 66.02 62.66 1ubk s SER 66 CO 0.21 -0.59 1.52 -0.81 1.20 0.00 0.00 173.24 174.78 1ubk n PRO 67 N 2.61 0.10 0.05 5.44 -0.04 -1.26 -2.02 135.00 139.88 1ubk n PRO 67 Ca 0.07 0.41 0.13 0.00 -0.04 0.00 0.00 63.50 64.07 1ubk n PRO 67 Cb 0.42 -1.71 0.50 0.00 -0.04 0.00 0.00 33.50 32.67 1ubk n PRO 67 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1ubk n HIS 68 N -1.90 0.43 0.00 0.54 8.25 -1.26 -5.04 115.22 116.24 1ubk n HIS 68 Ca 0.02 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 1ubk n HIS 68 Cb 0.15 -0.71 0.00 0.00 1.12 0.00 0.00 29.99 30.55 1ubk n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ubk n GLY 69 N 1.21 -1.18 3.18 -1.41 0.00 -0.86 -4.96 105.19 101.17 1ubk n GLY 69 Ca 0.06 -1.56 -0.09 0.00 0.00 0.00 0.00 46.02 44.44 1ubk n GLY 69 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ubk s PHE 70 N -3.08 0.21 -0.14 1.61 -0.71 -1.26 -4.43 117.98 110.18 1ubk s PHE 70 Ca 0.00 -0.65 -0.07 0.00 -1.04 0.00 0.00 56.93 55.17 1ubk s PHE 70 Cb 0.00 -0.12 -0.04 0.00 -1.21 0.00 0.00 43.02 41.65 1ubk s PHE 70 CO 0.00 -0.51 0.11 0.42 -1.34 0.00 0.00 175.22 173.91 1ubk s ILE 71 N -3.79 5.29 -0.15 -4.49 1.01 0.39 -0.37 121.20 119.09 1ubk s ILE 71 Ca 0.05 0.13 -0.06 0.00 0.00 0.00 0.00 60.65 60.76 1ubk s ILE 71 Cb 0.05 -3.32 -0.04 0.00 0.01 0.00 0.00 42.46 39.16 1ubk s ILE 71 CO -0.10 0.57 0.07 0.00 0.00 0.00 0.00 174.94 175.47 1ubk s ALA 72 N -0.63 3.48 -0.13 9.38 0.00 -0.26 -1.01 121.76 132.59 1ubk s ALA 72 Ca 0.12 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.36 1ubk s ALA 72 Cb -0.12 -1.86 -0.01 0.00 0.00 0.00 0.00 23.12 21.14 1ubk s ALA 72 CO 0.02 0.34 -0.17 0.08 0.00 0.00 0.00 175.76 176.03 1ubk s VAL 73 N -0.12 2.63 -0.13 0.00 1.01 -0.13 -0.81 120.40 122.85 1ubk s VAL 73 Ca 0.07 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.28 1ubk s VAL 73 Cb -0.12 -2.08 0.01 0.00 0.00 0.00 0.00 36.38 34.18 1ubk s VAL 73 CO 0.01 0.53 -0.21 -0.69 0.00 0.00 0.00 175.10 174.74 1ubk s VAL 74 N 0.54 1.97 -0.12 2.92 1.01 -0.11 -0.72 120.40 125.90 1ubk s VAL 74 Ca -0.11 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 60.94 1ubk s VAL 74 Cb -0.16 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.46 1ubk s VAL 74 CO 0.04 0.53 -0.09 -0.70 0.00 0.00 0.00 175.10 174.88 1ubk s GLU 75 N 0.73 3.24 0.00 2.72 2.12 -0.12 -0.72 118.70 126.67 1ubk s GLU 75 Ca -0.10 -0.61 0.00 0.00 0.36 0.00 0.00 54.97 54.62 1ubk s GLU 75 Cb -0.16 -2.67 0.00 0.00 0.26 0.00 0.00 34.13 31.56 1ubk s GLU 75 CO 0.01 0.36 0.00 0.41 -0.54 0.00 0.00 175.26 175.49 1ubk n GLY 76 N 3.13 2.28 3.84 -1.50 0.00 -1.26 -0.34 105.19 111.33 1ubk n GLY 76 Ca -0.18 -1.75 -0.31 0.00 0.00 0.00 0.00 46.02 43.79 1ubk n GLY 76 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ubk s GLY 77 N 0.00 1.66 -0.32 -0.02 0.00 -0.55 -3.47 107.32 104.61 1ubk s GLY 77 Ca 0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 44.72 44.56 1ubk s GLY 77 CO 0.00 0.28 0.20 -0.42 0.00 0.00 0.00 173.10 173.16 1ubk s ILE 78 N -3.12 5.08 -0.16 0.90 1.01 0.30 -0.75 121.20 124.46 1ubk s ILE 78 Ca 0.58 -0.20 -0.29 0.00 0.00 0.00 0.00 60.65 60.73 1ubk s ILE 78 Cb -0.13 -3.57 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 1ubk s ILE 78 CO 0.54 0.07 1.23 -2.16 0.00 0.00 0.00 174.94 174.62 1ubk s PRO 79 N 1.70 4.25 -0.00 2.79 0.05 -1.26 -1.12 135.00 141.40 1ubk s PRO 79 Ca 0.06 1.63 0.13 0.00 0.05 0.00 0.00 61.00 62.86 1ubk s PRO 79 Cb -0.17 -3.73 -0.15 0.00 0.05 0.00 0.00 34.50 30.50 1ubk s PRO 79 CO 0.09 -0.67 0.49 0.25 0.05 0.00 0.00 177.00 177.22 1ubk n THR 80 N 5.28 0.00 -1.32 1.26 -2.24 -0.12 -4.24 114.28 112.90 1ubk n THR 80 Ca 0.13 -0.22 -0.34 0.00 -2.27 0.00 0.00 64.05 61.36 1ubk n THR 80 Cb 0.45 0.85 0.10 0.00 -2.10 0.00 0.00 70.33 69.64 1ubk n THR 80 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ubk s ALA 81 N -2.33 2.03 -1.54 6.98 0.00 -0.20 -3.19 121.76 123.51 1ubk s ALA 81 Ca 0.03 0.83 -0.10 0.00 0.00 0.00 0.00 51.96 52.72 1ubk s ALA 81 Cb 0.09 -3.46 0.08 0.00 0.00 0.00 0.00 23.12 19.83 1ubk s ALA 81 CO 0.53 -2.00 0.68 0.00 0.00 0.00 0.00 175.76 174.97 1ubk n ALA 82 N -2.95 -1.58 -1.88 0.00 0.00 -1.26 -0.96 120.51 111.87 1ubk n ALA 82 Ca 0.13 -0.07 -0.15 0.00 0.00 0.00 0.00 53.44 53.35 1ubk n ALA 82 Cb 0.50 -2.86 -0.03 0.00 0.00 0.00 0.00 19.45 17.06 1ubk n ALA 82 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1ubk n ASN 83 N -2.83 -4.64 0.00 0.00 5.15 -1.21 -2.57 115.26 109.16 1ubk n ASN 83 Ca -0.09 0.17 0.00 0.00 -0.60 0.00 0.00 54.58 54.05 1ubk n ASN 83 Cb 0.58 -3.63 0.00 0.00 -0.53 0.00 0.00 39.78 36.20 1ubk n ASN 83 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ubk n GLY 84 N -1.08 0.77 0.00 8.20 0.00 -0.13 -4.96 105.19 107.99 1ubk n GLY 84 Ca -0.16 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.94 1ubk n GLY 84 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ubk n ILE 85 N -2.22 0.77 0.61 -0.61 -6.64 -1.06 -2.72 119.36 107.48 1ubk n ILE 85 Ca 0.00 0.19 0.10 0.00 -1.77 0.00 0.00 62.75 61.27 1ubk n ILE 85 Cb 0.00 -0.88 0.42 0.00 -1.44 0.00 0.00 39.64 37.74 1ubk n ILE 85 CO 0.00 0.00 0.00 -1.22 -1.77 0.00 0.00 176.55 173.56 1ubk n TYR 86 N -1.50 0.19 -3.66 4.28 4.01 -1.26 -4.56 117.16 114.67 1ubk n TYR 86 Ca 0.04 0.07 -0.18 0.00 -0.16 0.00 0.00 57.90 57.67 1ubk n TYR 86 Cb 0.21 -0.61 -0.16 0.00 -0.31 0.00 0.00 39.34 38.46 1ubk n TYR 86 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1ubk s GLY 87 N -3.13 0.11 0.04 2.72 0.00 -1.10 -5.06 107.32 100.91 1ubk s GLY 87 Ca 0.09 0.40 0.03 0.00 0.00 0.00 0.00 44.72 45.24 1ubk s GLY 87 CO 0.37 1.61 -0.09 0.54 0.00 0.00 0.00 173.10 175.53 1ubk s LYS 88 N 2.25 0.62 -0.06 2.90 1.02 -1.26 -0.95 119.74 124.25 1ubk s LYS 88 Ca 0.04 -0.74 0.02 0.00 0.02 0.00 0.00 55.97 55.30 1ubk s LYS 88 Cb -0.12 -0.48 0.01 0.00 -0.52 0.00 0.00 37.83 36.73 1ubk s LYS 88 CO -0.05 0.10 -0.11 0.08 -0.92 0.00 0.00 175.35 174.45 1ubk s VAL 89 N -1.19 1.02 -1.39 3.17 1.01 -0.14 -4.74 120.40 118.15 1ubk s VAL 89 Ca -0.06 -0.41 -0.05 0.00 0.00 0.00 0.00 61.98 61.46 1ubk s VAL 89 Cb -0.09 -0.94 0.03 0.00 0.00 0.00 0.00 36.38 35.38 1ubk s VAL 89 CO 0.01 0.33 0.41 0.00 0.00 0.00 0.00 175.10 175.84 1ubk n ALA 90 N 3.85 -0.94 -1.45 5.51 0.00 -1.26 -1.13 120.51 125.08 1ubk n ALA 90 Ca -0.23 0.17 -0.16 0.00 0.00 0.00 0.00 53.44 53.22 1ubk n ALA 90 Cb 0.52 -2.93 -0.07 0.00 0.00 0.00 0.00 19.45 16.97 1ubk n ALA 90 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1ubk n ASN 91 N -2.27 -4.92 -4.61 0.00 4.05 -1.26 -5.01 115.26 101.23 1ubk n ASN 91 Ca -0.09 0.39 -0.34 0.00 0.45 0.00 0.00 54.58 54.99 1ubk n ASN 91 Cb 0.60 -3.80 -0.10 0.00 1.23 0.00 0.00 39.78 37.71 1ubk n ASN 91 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 1ubk s HIS 92 N -2.57 2.98 0.61 1.20 3.76 -0.29 -5.07 115.29 115.92 1ubk s HIS 92 Ca 0.00 0.04 -0.17 0.00 -0.15 0.00 0.00 55.06 54.78 1ubk s HIS 92 Cb 0.00 -1.70 -0.02 0.00 1.11 0.00 0.00 32.58 31.97 1ubk s HIS 92 CO 0.00 0.38 1.15 0.95 -0.85 0.00 0.00 174.74 176.36 1ubk s THR 93 N -0.89 3.00 0.34 1.30 -4.23 -1.26 -0.96 115.64 112.94 1ubk s THR 93 Ca 0.14 0.55 0.04 0.00 -1.18 0.00 0.00 61.69 61.24 1ubk s THR 93 Cb -0.11 -3.14 0.20 0.00 1.34 0.00 0.00 72.50 70.79 1ubk s THR 93 CO 0.04 -0.20 1.93 0.24 -0.54 0.00 0.00 174.62 176.08 1ubk h MET 94 N 0.58 0.63 -0.32 3.99 2.86 -1.26 -0.22 114.93 121.18 1ubk h MET 94 Ca -0.49 -0.10 0.01 0.00 -2.06 0.00 0.00 59.70 57.07 1ubk h MET 94 Cb 1.27 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.79 1ubk h MET 94 CO 0.55 0.54 0.19 1.25 1.06 0.00 0.00 176.91 180.50 1ubk h LEU 95 N 0.62 0.30 -0.57 1.22 6.46 -1.83 -0.20 115.31 121.31 1ubk h LEU 95 Ca 0.15 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.90 1ubk h LEU 95 Cb 0.18 -0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.02 1ubk h LEU 95 CO -0.01 0.22 0.31 -0.78 -0.62 0.00 0.00 178.44 177.56 1ubk h ASP 96 N 0.38 0.71 0.09 1.25 3.58 -1.70 0.47 116.42 121.19 1ubk h ASP 96 Ca 0.13 -0.09 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 1ubk h ASP 96 Cb 0.00 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 40.87 1ubk h ASP 96 CO -0.06 0.60 -0.04 0.40 -2.88 0.00 0.00 179.24 177.26 1ubk h ILE 97 N 0.77 0.93 -0.17 2.25 2.04 -0.86 -0.42 117.51 122.05 1ubk h ILE 97 Ca 0.20 -0.05 -0.11 0.00 1.00 0.00 0.00 64.86 65.90 1ubk h ILE 97 Cb 0.04 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1ubk h ILE 97 CO -0.03 0.01 -0.39 0.00 0.00 0.00 0.00 178.15 177.74 1ubk h SER 99 N 0.31 0.29 0.57 0.00 0.02 -0.60 -0.19 113.55 113.96 1ubk h SER 99 Ca 0.03 -0.04 -0.28 0.00 -0.84 0.00 0.00 61.79 60.66 1ubk h SER 99 Cb 0.83 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.28 1ubk h SER 99 CO 0.07 0.35 -1.47 0.03 -1.14 0.00 0.00 176.83 174.67 1ubk h ARG 100 N 0.31 0.13 0.07 3.45 3.08 -0.73 -3.40 114.38 117.29 1ubk h ARG 100 Ca 0.07 -0.22 -0.33 0.00 0.07 0.00 0.00 59.98 59.57 1ubk h ARG 100 Cb 0.22 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 1ubk h ARG 100 CO 0.01 0.93 -1.80 -0.89 -1.07 0.00 0.00 179.97 177.15 1ubk n ILE 101 N -3.33 1.67 -0.06 2.04 5.41 -0.24 -4.44 119.36 120.41 1ubk n ILE 101 Ca -0.13 -0.42 -0.03 0.00 1.00 0.00 0.00 62.75 63.17 1ubk n ILE 101 Cb 1.02 -1.83 0.22 0.00 -0.71 0.00 0.00 39.64 38.34 1ubk n ILE 101 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1ubk h LEU 102 N -0.35 0.63 -1.87 1.39 3.38 -1.25 -0.58 115.31 116.66 1ubk h LEU 102 Ca -0.42 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1ubk h LEU 102 Cb 1.76 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.34 1ubk h LEU 102 CO -0.05 0.71 0.00 -0.65 0.09 0.00 0.00 178.44 178.54 1ubk h PRO 103 N 0.63 0.00 0.00 1.13 0.11 -1.78 -2.27 132.00 129.82 1ubk h PRO 103 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1ubk h PRO 103 Cb 0.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.52 1ubk h PRO 103 CO 0.02 0.00 -0.62 1.63 -0.21 0.00 0.00 178.00 178.81 1ubk n LYS 104 N -2.57 0.16 -2.24 1.05 5.02 -0.23 -4.94 118.16 114.41 1ubk n LYS 104 Ca -0.01 0.03 -0.35 0.00 -2.02 0.00 0.00 58.31 55.96 1ubk n LYS 104 Cb 0.08 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 1ubk n LYS 104 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ubk s ALA 105 N -3.10 2.68 0.25 7.82 0.00 -0.86 -4.76 121.76 123.80 1ubk s ALA 105 Ca 0.08 0.83 0.07 0.00 0.00 0.00 0.00 51.96 52.94 1ubk s ALA 105 Cb 0.15 -3.36 0.28 0.00 0.00 0.00 0.00 23.12 20.20 1ubk s ALA 105 CO 0.72 -0.80 1.58 1.96 0.00 0.00 0.00 175.76 179.22 1ubk h GLN 106 N 1.16 0.14 -2.80 0.00 1.08 -1.04 -3.45 115.11 110.19 1ubk h GLN 106 Ca -0.50 -0.10 -0.10 0.00 -1.45 0.00 0.00 58.65 56.50 1ubk h GLN 106 Cb 1.26 0.02 -0.19 0.00 -0.05 0.00 0.00 27.48 28.51 1ubk h GLN 106 CO 0.57 0.71 -0.15 0.00 -0.95 0.00 0.00 178.83 179.01 1ubk s ALA 107 N -3.68 -1.02 -0.06 3.87 0.00 -1.26 -5.06 121.76 114.56 1ubk s ALA 107 Ca -0.03 0.54 0.04 0.00 0.00 0.00 0.00 51.96 52.52 1ubk s ALA 107 Cb 0.12 0.09 -0.00 0.00 0.00 0.00 0.00 23.12 23.33 1ubk s ALA 107 CO 0.78 -0.30 -0.19 0.08 0.00 0.00 0.00 175.76 176.13 1ubk s VAL 108 N -1.41 1.60 -0.18 0.00 1.01 -1.26 -1.10 120.40 119.06 1ubk s VAL 108 Ca -0.12 -0.79 -0.00 0.00 0.00 0.00 0.00 61.98 61.07 1ubk s VAL 108 Cb -0.04 -1.39 0.01 0.00 0.00 0.00 0.00 36.38 34.97 1ubk s VAL 108 CO 0.05 0.46 -0.16 -0.63 0.00 0.00 0.00 175.10 174.82 1ubk s ILE 109 N 0.19 2.50 -0.32 2.22 1.01 0.01 -0.92 121.20 125.89 1ubk s ILE 109 Ca -0.09 -0.81 -0.20 0.00 0.00 0.00 0.00 60.65 59.55 1ubk s ILE 109 Cb -0.14 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.26 1ubk s ILE 109 CO 0.04 0.51 0.63 0.00 0.00 0.00 0.00 174.94 176.12 1ubk s ALA 110 N 1.14 3.51 -0.27 9.38 0.00 0.89 -0.93 121.76 135.47 1ubk s ALA 110 Ca 0.01 -0.71 -0.04 0.00 0.00 0.00 0.00 51.96 51.22 1ubk s ALA 110 Cb -0.14 -3.12 0.02 0.00 0.00 0.00 0.00 23.12 19.88 1ubk s ALA 110 CO -0.06 -1.15 0.00 -0.47 0.00 0.00 0.00 175.76 174.08 1ubk s TYR 111 N 2.63 3.10 0.00 0.00 5.04 0.10 -0.78 117.35 127.45 1ubk s TYR 111 Ca 0.25 -1.28 0.00 0.00 -2.44 0.00 0.00 57.07 53.60 1ubk s TYR 111 Cb -0.15 -2.15 0.00 0.00 0.35 0.00 0.00 41.96 40.02 1ubk s TYR 111 CO 0.13 -0.65 0.00 0.41 -1.34 0.00 0.00 175.55 174.09 1ubk n GLY 112 N 4.76 1.95 0.29 8.97 0.00 0.30 -4.34 105.19 117.12 1ubk n GLY 112 Ca -0.16 -1.71 0.12 0.00 0.00 0.00 0.00 46.02 44.27 1ubk n GLY 112 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ubk h THR 113 N 0.00 0.77 -0.17 2.61 2.02 -1.26 0.16 112.91 117.05 1ubk h THR 113 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1ubk h THR 113 Cb 0.00 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1ubk h THR 113 CO 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 175.52 175.89 1ubk h ALA 115 N 0.77 0.94 -0.02 0.00 0.00 -1.27 -0.19 119.26 119.49 1ubk h ALA 115 Ca 0.05 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 1ubk h ALA 115 Cb 0.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ubk h ALA 115 CO 0.01 0.66 -0.23 1.79 0.00 0.00 0.00 179.25 181.48 1ubk h THR 116 N 0.24 1.50 0.00 0.00 1.35 -0.67 0.78 112.91 116.11 1ubk h THR 116 Ca 0.01 -1.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.06 1ubk h THR 116 Cb 0.96 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 69.98 1ubk h THR 116 CO 0.08 0.50 0.00 0.49 -0.25 0.00 0.00 175.52 176.34 1ubk n PHE 117 N -4.53 0.00 0.00 4.73 3.72 0.19 -4.36 117.46 117.21 1ubk n PHE 117 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 1ubk n PHE 117 Cb 0.47 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 1ubk n PHE 117 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ubk n GLY 118 N 0.14 3.11 7.00 1.37 0.00 -0.09 -4.16 105.19 112.56 1ubk n GLY 118 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.95 1ubk n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ubk n GLY 119 N 0.00 0.32 0.25 -0.02 0.00 -1.18 -3.54 105.19 101.03 1ubk n GLY 119 Ca 0.00 -0.89 -0.08 0.00 0.00 0.00 0.00 46.02 45.05 1ubk n GLY 119 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1ubk h VAL 120 N 0.00 1.23 0.00 1.61 3.04 -1.94 0.51 116.25 120.70 1ubk h VAL 120 Ca 0.00 -0.71 0.00 0.00 -1.01 0.00 0.00 66.70 64.98 1ubk h VAL 120 Cb 0.00 0.65 0.00 0.00 -2.01 0.00 0.00 31.29 29.93 1ubk h VAL 120 CO 0.00 0.27 0.00 0.00 -1.01 0.00 0.00 177.57 176.83 1ubk n GLN 121 N -4.49 0.16 0.00 4.17 0.00 -1.26 -1.97 117.38 113.99 1ubk n GLN 121 Ca 0.03 0.34 0.13 0.00 0.00 0.00 0.00 57.00 57.50 1ubk n GLN 121 Cb 0.17 -1.78 0.47 0.00 0.00 0.00 0.00 30.24 29.10 1ubk n GLN 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ubk n ALA 122 N -1.71 2.97 -1.34 2.61 0.00 0.15 -4.46 120.51 118.73 1ubk n ALA 122 Ca 0.03 -0.32 -0.34 0.00 0.00 0.00 0.00 53.44 52.81 1ubk n ALA 122 Cb 0.25 -1.23 0.09 0.00 0.00 0.00 0.00 19.45 18.56 1ubk n ALA 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ubk s ALA 123 N -2.59 2.11 0.30 0.00 0.00 -0.83 -4.36 121.76 116.39 1ubk s ALA 123 Ca 0.24 0.85 -0.29 0.00 0.00 0.00 0.00 51.96 52.75 1ubk s ALA 123 Cb 0.19 -3.46 -0.13 0.00 0.00 0.00 0.00 23.12 19.73 1ubk s ALA 123 CO 0.53 -1.88 1.37 1.63 0.00 0.00 0.00 175.76 177.41 1ubk n LYS 124 N -2.77 2.19 -0.82 0.00 5.02 -1.26 -0.02 118.16 120.50 1ubk n LYS 124 Ca 0.13 0.77 -0.02 0.00 -2.02 0.00 0.00 58.31 57.17 1ubk n LYS 124 Cb 0.50 -2.41 0.27 0.00 -0.02 0.00 0.00 35.03 33.38 1ubk n LYS 124 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1ubk n PRO 125 N 1.22 3.51 -3.74 1.97 -0.04 -1.26 -4.98 135.00 131.68 1ubk n PRO 125 Ca 0.07 -2.53 -0.34 0.00 -0.04 0.00 0.00 63.50 60.67 1ubk n PRO 125 Cb 0.35 -2.07 0.04 0.00 -0.04 0.00 0.00 33.50 31.77 1ubk n PRO 125 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1ubk n ASN 126 N 0.09 -5.18 0.26 3.54 4.05 0.97 -4.85 115.26 114.13 1ubk n ASN 126 Ca 0.31 -1.06 0.10 0.00 0.45 0.00 0.00 54.58 54.38 1ubk n ASN 126 Cb 1.16 -3.11 0.69 0.00 1.23 0.00 0.00 39.78 39.76 1ubk n ASN 126 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1ubk h PRO 127 N -1.98 0.00 -0.58 1.20 0.13 -1.83 -2.11 132.00 126.83 1ubk h PRO 127 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1ubk h PRO 127 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1ubk h PRO 127 CO 0.48 0.06 0.00 0.25 -0.23 0.00 0.00 178.00 178.57 1ubk n THR 128 N -4.18 0.77 -3.63 1.56 -2.24 -1.26 -4.89 114.28 100.41 1ubk n THR 128 Ca -0.03 -0.83 -0.24 0.00 -2.27 0.00 0.00 64.05 60.68 1ubk n THR 128 Cb 0.15 0.58 0.07 0.00 -2.10 0.00 0.00 70.33 69.02 1ubk n THR 128 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ubk n GLY 129 N 1.53 -0.49 3.76 3.38 0.00 -0.79 -1.04 105.19 111.54 1ubk n GLY 129 Ca 0.21 0.21 -0.41 0.00 0.00 0.00 0.00 46.02 46.04 1ubk n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ubk s ALA 130 N -3.35 3.44 0.08 4.61 0.00 -1.26 -0.95 121.76 124.34 1ubk s ALA 130 Ca 0.46 1.01 0.03 0.00 0.00 0.00 0.00 51.96 53.45 1ubk s ALA 130 Cb -0.21 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 1ubk s ALA 130 CO 0.75 -0.32 -0.09 0.15 0.00 0.00 0.00 175.76 176.25 1ubk s LYS 131 N -1.35 0.75 0.95 0.00 1.02 -0.28 -4.65 119.74 116.18 1ubk s LYS 131 Ca 0.47 -1.05 -0.11 0.00 0.02 0.00 0.00 55.97 55.29 1ubk s LYS 131 Cb -0.34 -0.43 0.16 0.00 -0.52 0.00 0.00 37.83 36.69 1ubk s LYS 131 CO 0.44 0.06 1.09 0.20 -0.92 0.00 0.00 175.35 176.22 1ubk s GLY 132 N -2.23 1.62 0.08 -3.33 0.00 -1.26 -0.54 107.32 101.66 1ubk s GLY 132 Ca 0.01 0.05 -0.23 0.00 0.00 0.00 0.00 44.72 44.56 1ubk s GLY 132 CO -0.00 0.57 1.67 -2.08 0.00 0.00 0.00 173.10 173.25 1ubk h VAL 133 N -1.81 1.08 -0.31 1.40 2.07 -1.03 0.58 116.25 118.23 1ubk h VAL 133 Ca -0.51 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 66.73 1ubk h VAL 133 Cb 1.29 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 1ubk h VAL 133 CO 0.51 0.06 -0.12 0.78 0.02 0.00 0.00 177.57 178.83 1ubk h ASN 134 N -0.03 0.51 0.07 0.57 2.35 -1.82 -0.91 115.58 116.33 1ubk h ASN 134 Ca 0.01 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1ubk h ASN 134 Cb 0.08 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.32 1ubk h ASN 134 CO -0.00 0.66 -0.04 -0.78 -1.65 0.00 0.00 177.43 175.62 1ubk h ASP 135 N 0.49 -0.09 -0.49 5.81 3.58 -1.80 -1.35 116.42 122.57 1ubk h ASP 135 Ca 0.09 -0.31 -0.00 0.00 0.42 0.00 0.00 57.03 57.22 1ubk h ASP 135 Cb 0.50 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 1ubk h ASP 135 CO 0.03 0.28 0.30 0.00 -2.88 0.00 0.00 179.24 176.96 1ubk h ALA 136 N 0.43 1.58 -0.15 -0.78 0.00 -0.66 -3.22 119.26 116.46 1ubk h ALA 136 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ubk h ALA 136 Cb 0.39 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ubk h ALA 136 CO 0.02 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.91 1ubk n LEU 137 N -4.43 3.08 -0.28 0.00 4.77 -0.37 -4.70 117.00 115.06 1ubk n LEU 137 Ca 0.04 -2.90 0.10 0.00 -0.03 0.00 0.00 56.01 53.22 1ubk n LEU 137 Cb 0.08 -0.44 0.24 0.00 -2.33 0.00 0.00 43.42 40.97 1ubk n LEU 137 CO 0.36 0.68 0.91 0.50 -1.33 0.00 0.00 177.39 178.51 1ubk h LYS 138 N 0.98 0.18 0.00 3.23 3.64 -1.26 0.25 116.57 123.59 1ubk h LYS 138 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1ubk h LYS 138 Cb 1.15 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1ubk h LYS 138 CO 0.10 0.12 0.00 -2.39 -2.27 0.00 0.00 179.45 175.01 1ubk n HIS 139 N -5.25 0.60 0.67 1.91 1.44 -1.26 -1.10 115.22 112.23 1ubk n HIS 139 Ca 0.18 0.22 0.12 0.00 -2.01 0.00 0.00 57.72 56.23 1ubk n HIS 139 Cb 0.60 -0.85 0.15 0.00 0.12 0.00 0.00 29.99 30.01 1ubk n HIS 139 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1ubk n LEU 140 N -2.03 3.22 0.00 2.39 4.77 0.06 -4.97 117.00 120.43 1ubk n LEU 140 Ca 0.03 -1.24 0.00 0.00 -0.03 0.00 0.00 56.01 54.78 1ubk n LEU 140 Cb 0.27 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1ubk n LEU 140 CO 0.21 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1ubk n GLY 141 N 1.41 0.65 3.72 -0.72 0.00 -0.25 -4.93 105.19 105.07 1ubk n GLY 141 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1ubk n GLY 141 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ubk s VAL 142 N -2.46 3.02 -0.43 1.61 1.01 -1.21 -4.97 120.40 116.96 1ubk s VAL 142 Ca 0.00 0.73 0.02 0.00 0.00 0.00 0.00 61.98 62.73 1ubk s VAL 142 Cb 0.00 -3.47 0.14 0.00 0.00 0.00 0.00 36.38 33.05 1ubk s VAL 142 CO 0.00 0.06 0.26 -0.54 0.00 0.00 0.00 175.10 174.88 1ubk s LYS 143 N 1.07 1.09 0.25 2.72 1.02 -1.26 -4.62 119.74 120.00 1ubk s LYS 143 Ca 0.66 -1.92 -0.30 0.00 0.02 0.00 0.00 55.97 54.44 1ubk s LYS 143 Cb -0.40 -1.97 -0.09 0.00 -0.52 0.00 0.00 37.83 34.85 1ubk s LYS 143 CO 0.31 -1.22 1.09 0.00 -0.92 0.00 0.00 175.35 174.61 1ubk s ALA 144 N 0.39 3.39 0.16 5.17 0.00 -1.26 -4.71 121.76 124.91 1ubk s ALA 144 Ca 0.21 0.85 -0.31 0.00 0.00 0.00 0.00 51.96 52.71 1ubk s ALA 144 Cb -0.18 -3.32 -0.09 0.00 0.00 0.00 0.00 23.12 19.52 1ubk s ALA 144 CO -0.04 -0.14 1.48 0.42 0.00 0.00 0.00 175.76 177.48 1ubk s ILE 145 N -0.91 2.88 -0.29 0.00 1.01 -0.10 -4.76 121.20 119.04 1ubk s ILE 145 Ca 0.46 0.65 -0.10 0.00 0.00 0.00 0.00 60.65 61.65 1ubk s ILE 145 Cb -0.31 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 1ubk s ILE 145 CO 0.39 0.06 0.17 0.20 0.00 0.00 0.00 174.94 175.75 1ubk s ASN 146 N 0.99 5.78 -0.40 3.58 0.01 0.05 -0.08 114.94 124.87 1ubk s ASN 146 Ca 0.66 -0.17 -0.03 0.00 -0.71 0.00 0.00 52.86 52.61 1ubk s ASN 146 Cb -0.41 -2.07 0.10 0.00 0.41 0.00 0.00 41.25 39.29 1ubk s ASN 146 CO 0.33 -0.09 0.18 -0.63 -1.51 0.00 0.00 177.10 175.38 1ubk s ILE 147 N 1.71 3.26 0.51 0.60 1.01 0.04 -3.91 121.20 124.42 1ubk s ILE 147 Ca 0.06 -1.99 -0.03 0.00 0.00 0.00 0.00 60.65 58.70 1ubk s ILE 147 Cb -0.16 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.10 1ubk s ILE 147 CO 0.09 -0.63 0.78 0.00 0.00 0.00 0.00 174.94 175.17 1ubk s ALA 148 N 1.15 3.54 0.00 9.38 0.00 -1.26 -0.54 121.76 134.03 1ubk s ALA 148 Ca 0.07 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1ubk s ALA 148 Cb -0.22 -2.36 0.00 0.00 0.00 0.00 0.00 23.12 20.53 1ubk s ALA 148 CO -0.04 -0.56 0.00 0.41 0.00 0.00 0.00 175.76 175.57 1ubk n GLY 149 N -2.31 3.86 2.32 0.00 0.00 -1.24 -4.29 105.19 103.54 1ubk n GLY 149 Ca 0.03 -1.71 -0.25 0.00 0.00 0.00 0.00 46.02 44.08 1ubk n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ubk s PRO 151 N -1.40 2.52 1.02 0.00 0.04 -1.26 -5.07 135.00 130.85 1ubk s PRO 151 Ca 0.35 -0.49 -0.12 0.00 0.04 0.00 0.00 61.00 60.78 1ubk s PRO 151 Cb 0.13 -2.36 0.20 0.00 0.04 0.00 0.00 34.50 32.51 1ubk s PRO 151 CO -0.10 -0.84 1.08 -2.14 0.04 0.00 0.00 177.00 175.03 1ubk s PRO 152 N -4.93 0.22 -0.00 0.56 0.02 -1.12 -4.97 135.00 124.78 1ubk s PRO 152 Ca 0.57 0.76 -0.30 0.00 0.02 0.00 0.00 61.00 62.05 1ubk s PRO 152 Cb -0.10 -1.69 -0.05 0.00 0.02 0.00 0.00 34.50 32.67 1ubk s PRO 152 CO 0.41 -2.93 1.40 1.21 -0.33 0.00 0.00 177.00 176.76 1ubk s ASN 153 N -3.10 6.85 0.58 2.53 3.84 -1.26 -4.90 114.94 119.48 1ubk s ASN 153 Ca 0.66 2.12 0.35 0.00 0.21 0.00 0.00 52.86 56.20 1ubk s ASN 153 Cb -0.21 -2.56 1.78 0.00 -0.55 0.00 0.00 41.25 39.71 1ubk s ASN 153 CO 0.60 -0.72 2.16 1.55 -2.79 0.00 0.00 177.10 177.89 1ubk h PRO 154 N 7.85 0.00 -0.83 0.43 0.13 -1.93 0.51 132.00 138.16 1ubk h PRO 154 Ca -0.38 0.00 0.16 0.00 -0.87 0.00 0.00 66.00 64.91 1ubk h PRO 154 Cb 1.18 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.25 1ubk h PRO 154 CO 0.90 0.04 0.55 -0.92 -0.23 0.00 0.00 178.00 178.34 1ubk h TYR 155 N 0.00 0.63 -0.01 1.56 3.20 -1.93 -1.56 116.97 118.86 1ubk h TYR 155 Ca -0.00 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.72 1ubk h TYR 155 Cb 0.26 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.32 1ubk h TYR 155 CO 0.00 0.22 -0.78 -0.91 -1.64 0.00 0.00 178.16 175.06 1ubk h ASN 156 N 0.52 0.12 0.02 -2.11 2.35 -1.28 -0.59 115.58 114.61 1ubk h ASN 156 Ca 0.42 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 56.08 1ubk h ASN 156 Cb 0.85 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.18 1ubk h ASN 156 CO -0.16 0.85 -0.01 0.25 -1.65 0.00 0.00 177.43 176.70 1ubk h LEU 157 N 0.06 -0.02 -0.73 1.61 5.85 -1.45 -2.36 115.31 118.27 1ubk h LEU 157 Ca -0.02 -0.52 -0.03 0.00 0.84 0.00 0.00 57.88 58.15 1ubk h LEU 157 Cb 1.36 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.37 1ubk h LEU 157 CO 0.11 0.51 0.34 0.58 -0.34 0.00 0.00 178.44 179.64 1ubk h VAL 158 N -0.56 1.24 -0.22 1.05 2.07 -1.30 -0.91 116.25 117.62 1ubk h VAL 158 Ca -0.00 -0.69 -0.06 0.00 0.82 0.00 0.00 66.70 66.76 1ubk h VAL 158 Cb 0.53 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1ubk h VAL 158 CO 0.00 0.29 -0.14 1.23 0.02 0.00 0.00 177.57 178.97 1ubk h GLY 159 N 1.03 0.40 0.83 2.17 0.00 -1.15 -0.35 103.07 105.99 1ubk h GLY 159 Ca 0.25 -0.26 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 1ubk h GLY 159 CO -0.03 0.24 -0.38 -0.84 0.00 0.00 0.00 176.54 175.53 1ubk h THR 160 N 0.34 1.37 -0.36 4.70 2.02 -0.85 -1.82 112.91 118.31 1ubk h THR 160 Ca 0.07 -1.68 -0.01 0.00 0.77 0.00 0.00 66.41 65.56 1ubk h THR 160 Cb 0.46 2.10 -0.02 0.00 -1.74 0.00 0.00 68.15 68.95 1ubk h THR 160 CO 0.03 0.50 0.19 0.40 0.37 0.00 0.00 175.52 177.01 1ubk h ILE 161 N 0.08 1.14 -0.58 3.11 2.04 -0.95 -0.89 117.51 121.47 1ubk h ILE 161 Ca -0.01 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.51 1ubk h ILE 161 Cb 1.00 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 1ubk h ILE 161 CO 0.08 0.15 0.34 0.58 0.00 0.00 0.00 178.15 179.30 1ubk h VAL 162 N 0.45 1.04 -0.20 1.67 2.07 -1.06 0.54 116.25 120.77 1ubk h VAL 162 Ca 0.13 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1ubk h VAL 162 Cb 0.06 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 1ubk h VAL 162 CO -0.02 0.12 0.13 0.22 0.02 0.00 0.00 177.57 178.04 1ubk h TYR 163 N 0.67 0.25 -0.88 1.57 5.03 -1.07 -1.03 116.97 121.51 1ubk h TYR 163 Ca 0.24 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.53 1ubk h TYR 163 Cb 0.05 -0.08 -0.04 0.00 1.55 0.00 0.00 36.73 38.21 1ubk h TYR 163 CO -0.06 0.16 0.47 -0.92 -1.32 0.00 0.00 178.16 176.49 1ubk h TYR 164 N 0.26 1.22 0.00 -3.82 3.20 -0.56 0.68 116.97 117.95 1ubk h TYR 164 Ca 0.07 -0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.82 1ubk h TYR 164 Cb -0.02 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 37.84 1ubk h TYR 164 CO -0.06 0.85 -0.43 -0.07 -1.64 0.00 0.00 178.16 176.81 1ubk h LEU 165 N 1.23 0.00 0.16 2.82 3.38 -0.57 0.37 115.31 122.70 1ubk h LEU 165 Ca 0.31 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 58.06 1ubk h LEU 165 Cb 0.04 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.81 1ubk h LEU 165 CO -0.05 0.43 -0.96 0.50 0.09 0.00 0.00 178.44 178.45 1ubk h LYS 166 N 0.00 0.34 -0.01 1.13 3.64 -0.73 -3.38 116.57 117.57 1ubk h LYS 166 Ca -0.00 -0.58 0.00 0.00 -1.27 0.00 0.00 60.65 58.80 1ubk h LYS 166 Cb 0.84 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1ubk h LYS 166 CO 0.06 1.28 -0.53 0.09 -2.27 0.00 0.00 179.45 178.07 1ubk n ASN 167 N -4.05 1.27 -2.26 4.20 3.02 0.19 -4.96 115.26 112.68 1ubk n ASN 167 Ca -0.15 -1.13 -0.20 0.00 -0.03 0.00 0.00 54.58 53.07 1ubk n ASN 167 Cb 0.88 0.71 -0.02 0.00 -0.61 0.00 0.00 39.78 40.73 1ubk n ASN 167 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1ubk n LYS 168 N -0.68 -1.69 -3.61 3.52 4.01 0.13 -4.93 118.16 114.92 1ubk n LYS 168 Ca 0.05 1.01 -0.13 0.00 -0.51 0.00 0.00 58.31 58.74 1ubk n LYS 168 Cb 0.31 -5.62 -0.05 0.00 -0.51 0.00 0.00 35.03 29.15 1ubk n LYS 168 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ubk s ALA 169 N -2.95 -1.15 0.64 7.82 0.00 -1.24 -5.07 121.76 119.81 1ubk s ALA 169 Ca 0.00 0.35 -0.16 0.00 0.00 0.00 0.00 51.96 52.15 1ubk s ALA 169 Cb 0.00 0.47 -0.01 0.00 0.00 0.00 0.00 23.12 23.58 1ubk s ALA 169 CO 0.00 -0.54 1.13 0.00 0.00 0.00 0.00 175.76 176.35 1ubk s ALA 170 N -2.84 2.47 1.04 0.00 0.00 -1.26 -4.08 121.76 117.09 1ubk s ALA 170 Ca -0.03 0.66 -0.15 0.00 0.00 0.00 0.00 51.96 52.44 1ubk s ALA 170 Cb -0.00 -3.35 0.21 0.00 0.00 0.00 0.00 23.12 19.98 1ubk s ALA 170 CO -0.05 -1.24 1.14 -1.25 0.00 0.00 0.00 175.76 174.36 1ubk s PRO 171 N -3.88 0.08 0.24 0.00 0.04 -1.26 -4.94 135.00 125.27 1ubk s PRO 171 Ca 0.69 0.12 -0.31 0.00 0.04 0.00 0.00 61.00 61.54 1ubk s PRO 171 Cb -0.23 -1.73 -0.13 0.00 0.04 0.00 0.00 34.50 32.46 1ubk s PRO 171 CO 0.39 -2.88 1.54 -1.91 0.04 0.00 0.00 177.00 174.17 1ubk n GLU 172 N -4.21 2.36 -4.37 4.56 2.13 -1.26 -4.92 120.64 114.93 1ubk n GLU 172 Ca 0.10 0.84 -0.29 0.00 0.66 0.00 0.00 57.16 58.46 1ubk n GLU 172 Cb 0.59 -2.58 -0.12 0.00 0.27 0.00 0.00 31.44 29.59 1ubk n GLU 172 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1ubk s LEU 173 N 0.21 2.54 0.00 4.31 1.02 -1.26 -1.16 118.68 124.34 1ubk s LEU 173 Ca 0.70 -0.62 -0.04 0.00 0.02 0.00 0.00 54.13 54.19 1ubk s LEU 173 Cb -0.59 -1.42 0.08 0.00 0.02 0.00 0.00 46.19 44.28 1ubk s LEU 173 CO 0.45 0.19 0.50 -0.90 0.02 0.00 0.00 176.35 176.61 1ubk n ASP 174 N 0.91 0.32 0.00 2.29 5.68 0.47 -4.83 116.55 121.39 1ubk n ASP 174 Ca -0.17 -1.35 0.10 0.00 -0.50 0.00 0.00 54.79 52.87 1ubk n ASP 174 Cb 0.53 -0.36 0.47 0.00 -1.14 0.00 0.00 41.12 40.62 1ubk n ASP 174 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1ubk n SER 175 N -3.16 0.00 -1.52 -1.12 3.41 -1.26 -0.60 113.62 109.37 1ubk n SER 175 Ca 0.07 0.19 0.09 0.00 -0.26 0.00 0.00 58.87 58.97 1ubk n SER 175 Cb 0.25 -0.37 0.35 0.00 -0.26 0.00 0.00 64.21 64.18 1ubk n SER 175 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ubk n LEU 176 N -1.37 4.69 -1.17 1.04 4.32 -1.26 -4.95 117.00 118.30 1ubk n LEU 176 Ca 0.08 -2.48 -0.14 0.00 -0.02 0.00 0.00 56.01 53.45 1ubk n LEU 176 Cb 0.18 -0.57 -0.05 0.00 -1.62 0.00 0.00 43.42 41.37 1ubk n LEU 176 CO 0.16 0.80 -0.14 -3.20 -1.22 0.00 0.00 177.39 173.79 1ubk n ASN 177 N 0.99 -4.60 -4.87 -1.43 5.15 0.23 -4.67 115.26 106.07 1ubk n ASN 177 Ca 0.25 0.27 -0.36 0.00 -0.60 0.00 0.00 54.58 54.14 1ubk n ASN 177 Cb 0.89 -3.41 -0.06 0.00 -0.53 0.00 0.00 39.78 36.67 1ubk n ASN 177 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1ubk s ARG 178 N -3.48 3.67 0.15 1.20 0.52 -1.25 -0.77 118.95 118.98 1ubk s ARG 178 Ca 0.00 0.08 -0.31 0.00 -0.52 0.00 0.00 55.73 54.98 1ubk s ARG 178 Cb 0.00 -3.12 -0.11 0.00 0.52 0.00 0.00 34.95 32.24 1ubk s ARG 178 CO 0.00 0.67 1.81 -2.30 0.02 0.00 0.00 175.30 175.50 1ubk n PRO 179 N 1.42 2.82 0.29 3.54 -0.02 -1.26 -0.40 135.00 141.40 1ubk n PRO 179 Ca -0.13 1.02 0.18 0.00 -2.02 0.00 0.00 63.50 62.55 1ubk n PRO 179 Cb 0.53 -2.91 0.89 0.00 -0.02 0.00 0.00 33.50 31.99 1ubk n PRO 179 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1ubk h THR 180 N 4.42 0.20 0.00 3.45 1.35 -1.46 -0.76 112.91 120.11 1ubk h THR 180 Ca -0.45 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 1ubk h THR 180 Cb 1.21 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 1ubk h THR 180 CO 0.95 0.04 0.00 0.00 -0.25 0.00 0.00 175.52 176.26 1ubk h MET 181 N 0.00 0.00 0.00 4.72 -0.00 -1.89 -2.08 114.93 115.68 1ubk h MET 181 Ca -0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 59.70 59.63 1ubk h MET 181 Cb 0.27 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.86 1ubk h MET 181 CO 0.01 0.00 -1.31 1.19 -0.00 0.00 0.00 176.91 176.80 1ubk n PHE 182 N -2.52 0.00 -0.75 -0.10 3.72 -0.79 -4.76 117.46 112.25 1ubk n PHE 182 Ca 0.02 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.49 1ubk n PHE 182 Cb 0.26 -0.22 0.17 0.00 -0.94 0.00 0.00 39.48 38.75 1ubk n PHE 182 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1ubk n PHE 183 N -2.11 0.43 1.30 1.38 3.72 -0.36 -3.36 117.46 118.46 1ubk n PHE 183 Ca -0.07 -0.81 0.14 0.00 -0.05 0.00 0.00 57.45 56.67 1ubk n PHE 183 Cb 0.58 -0.18 0.64 0.00 -0.94 0.00 0.00 39.48 39.58 1ubk n PHE 183 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ubk n GLY 184 N -0.66 -1.22 3.33 1.37 0.00 -0.78 -4.59 105.19 102.64 1ubk n GLY 184 Ca 0.15 -0.19 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 1ubk n GLY 184 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ubk s GLN 185 N -2.67 1.32 0.62 1.61 -0.21 -1.26 -5.08 119.66 114.00 1ubk s GLN 185 Ca 0.24 -1.21 -0.17 0.00 0.02 0.00 0.00 55.36 54.24 1ubk s GLN 185 Cb 0.20 -1.66 -0.02 0.00 1.00 0.00 0.00 33.01 32.53 1ubk s GLN 185 CO 0.50 0.40 1.13 0.95 -2.12 0.00 0.00 175.29 176.15 1ubk s THR 186 N -1.05 3.08 0.23 -0.19 -4.23 -1.26 -2.68 115.64 109.53 1ubk s THR 186 Ca 0.10 0.57 -0.06 0.00 -1.18 0.00 0.00 61.69 61.12 1ubk s THR 186 Cb -0.10 -3.13 0.19 0.00 1.34 0.00 0.00 72.50 70.80 1ubk s THR 186 CO 0.05 -0.24 1.81 0.58 -0.54 0.00 0.00 174.62 176.27 1ubk h VAL 187 N 0.46 0.94 -0.76 2.29 2.07 -0.91 -3.02 116.25 117.30 1ubk h VAL 187 Ca -0.48 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 1ubk h VAL 187 Cb 1.26 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 1ubk h VAL 187 CO 0.55 0.14 0.37 -0.74 0.02 0.00 0.00 177.57 177.91 1ubk h HIS 188 N 0.76 1.10 0.00 1.57 -0.00 -1.71 -1.67 115.15 115.20 1ubk h HIS 188 Ca 0.36 -0.05 0.00 0.00 -0.00 0.00 0.00 60.37 60.68 1ubk h HIS 188 Cb 0.28 -0.34 0.00 0.00 -0.00 0.00 0.00 27.41 27.35 1ubk h HIS 188 CO -0.07 0.80 0.00 -0.85 -0.00 0.00 0.00 177.93 177.81 1ubk n GLU 189 N -4.39 0.18 -0.02 5.26 0.28 -1.14 -1.62 120.64 119.19 1ubk n GLU 189 Ca 0.07 0.46 0.12 0.00 -0.16 0.00 0.00 57.16 57.65 1ubk n GLU 189 Cb 0.13 -1.88 0.11 0.00 1.43 0.00 0.00 31.44 31.23 1ubk n GLU 189 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1ubk n GLN 190 N -2.22 2.24 -2.94 3.44 6.02 -0.65 -5.01 117.38 118.26 1ubk n GLN 190 Ca 0.01 -1.92 -0.40 0.00 -0.01 0.00 0.00 57.00 54.69 1ubk n GLN 190 Cb 0.19 -1.45 -0.05 0.00 1.02 0.00 0.00 30.24 29.94 1ubk n GLN 190 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ubk h PRO 192 N 5.04 0.00 -0.02 0.00 0.11 -1.93 -2.36 132.00 132.85 1ubk h PRO 192 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1ubk h PRO 192 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ubk h PRO 192 CO 0.69 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 179.02 1ubk n ARG 193 N -2.90 1.59 -0.34 1.05 1.74 -1.26 -4.34 116.66 112.19 1ubk n ARG 193 Ca -0.02 -0.86 0.15 0.00 -0.77 0.00 0.00 57.85 56.35 1ubk n ARG 193 Cb 0.12 -1.48 0.35 0.00 -1.02 0.00 0.00 32.46 30.44 1ubk n ARG 193 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1ubk h LEU 194 N 2.08 0.73 -1.37 0.55 5.85 -1.72 0.93 115.31 122.36 1ubk h LEU 194 Ca 0.00 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1ubk h LEU 194 Cb 0.44 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1ubk h LEU 194 CO 0.00 0.23 0.15 -0.65 -0.34 0.00 0.00 178.44 177.83 1ubk h PRO 195 N 0.69 0.58 -0.25 5.25 0.11 -1.85 -0.28 132.00 136.25 1ubk h PRO 195 Ca 0.59 -0.08 -0.05 0.00 0.11 0.00 0.00 66.00 66.56 1ubk h PRO 195 Cb 1.01 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 1ubk h PRO 195 CO -0.38 0.49 -0.05 0.45 -0.21 0.00 0.00 178.00 178.29 1ubk h HIS 196 N 0.57 0.54 -0.54 0.65 3.86 -1.15 -2.03 115.15 117.05 1ubk h HIS 196 Ca 0.14 -0.11 0.11 0.00 -1.16 0.00 0.00 60.37 59.35 1ubk h HIS 196 Cb 0.14 -0.13 -0.10 0.00 1.06 0.00 0.00 27.41 28.38 1ubk h HIS 196 CO 0.01 0.69 -0.11 0.35 0.86 0.00 0.00 177.93 179.74 1ubk h PHE 197 N 0.23 -0.23 -0.12 2.45 3.04 -0.89 0.25 116.94 121.67 1ubk h PHE 197 Ca 0.06 0.05 -0.02 0.00 3.98 0.00 0.00 57.97 62.04 1ubk h PHE 197 Cb 0.51 0.19 -0.01 0.00 2.56 0.00 0.00 35.95 39.20 1ubk h PHE 197 CO 0.05 -0.21 -0.03 -0.44 -2.02 0.00 0.00 178.31 175.65 1ubk h ASP 198 N 0.02 0.16 0.02 0.41 3.32 -0.94 -1.71 116.42 117.71 1ubk h ASP 198 Ca 0.27 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1ubk h ASP 198 Cb 0.41 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1ubk h ASP 198 CO -0.54 0.22 -0.03 0.00 -1.72 0.00 0.00 179.24 177.18 1ubk n ALA 199 N -2.51 2.64 -2.22 3.45 0.00 -0.48 -4.91 120.51 116.49 1ubk n ALA 199 Ca -0.01 -0.40 -0.12 0.00 0.00 0.00 0.00 53.44 52.91 1ubk n ALA 199 Cb 0.18 -1.22 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 1ubk n ALA 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ubk n GLY 200 N 1.17 -0.10 3.36 0.00 0.00 -0.47 -4.97 105.19 104.16 1ubk n GLY 200 Ca 0.19 -0.39 -0.46 0.00 0.00 0.00 0.00 46.02 45.36 1ubk n GLY 200 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ubk s GLU 201 N -4.57 3.43 -0.08 1.61 2.02 0.77 -5.01 118.70 116.87 1ubk s GLU 201 Ca 0.00 -2.05 0.01 0.00 0.02 0.00 0.00 54.97 52.95 1ubk s GLU 201 Cb 0.00 -4.48 -0.02 0.00 0.10 0.00 0.00 34.13 29.73 1ubk s GLU 201 CO 0.00 -1.43 -0.11 -0.06 0.02 0.00 0.00 175.26 173.68 1ubk s PHE 202 N 1.22 2.81 0.11 1.61 0.08 -1.26 -1.77 117.98 120.78 1ubk s PHE 202 Ca 0.18 -0.25 -0.31 0.00 0.12 0.00 0.00 56.93 56.67 1ubk s PHE 202 Cb -0.14 -1.73 -0.08 0.00 -0.57 0.00 0.00 43.02 40.50 1ubk s PHE 202 CO -0.05 0.11 1.41 0.00 -0.10 0.00 0.00 175.22 176.58 1ubk s ALA 203 N -0.40 3.60 -0.82 5.36 0.00 -0.03 -4.87 121.76 124.61 1ubk s ALA 203 Ca 0.05 1.12 0.26 0.00 0.00 0.00 0.00 51.96 53.38 1ubk s ALA 203 Cb -0.12 -3.55 0.66 0.00 0.00 0.00 0.00 23.12 20.11 1ubk s ALA 203 CO 0.02 -0.65 1.57 -0.35 0.00 0.00 0.00 175.76 176.35 1ubk n PRO 204 N 4.07 0.16 -3.57 0.00 -0.04 -1.26 -4.42 135.00 129.94 1ubk n PRO 204 Ca 0.12 0.08 -0.08 0.00 -0.04 0.00 0.00 63.50 63.58 1ubk n PRO 204 Cb 0.42 -1.63 -0.02 0.00 -0.04 0.00 0.00 33.50 32.23 1ubk n PRO 204 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1ubk s SER 205 N -3.76 -0.35 0.41 3.54 1.04 -1.26 -4.95 113.70 108.37 1ubk s SER 205 Ca 0.10 -0.14 0.22 0.00 0.48 0.00 0.00 55.95 56.61 1ubk s SER 205 Cb 0.15 0.47 0.60 0.00 0.10 0.00 0.00 66.02 67.34 1ubk s SER 205 CO 0.65 -0.79 1.69 -0.26 0.98 0.00 0.00 173.24 175.50 1ubk h PHE 206 N 2.00 0.00 0.00 5.02 0.04 -1.98 -2.99 116.94 119.03 1ubk h PHE 206 Ca -0.24 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.53 1ubk h PHE 206 Cb 1.25 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.40 1ubk h PHE 206 CO 0.29 0.22 -0.17 -0.85 -0.60 0.00 0.00 178.31 177.21 1ubk n GLU 207 N -3.24 0.04 -1.75 1.51 0.00 -1.26 -4.69 120.64 111.25 1ubk n GLU 207 Ca 0.02 0.02 -0.33 0.00 0.00 0.00 0.00 57.16 56.87 1ubk n GLU 207 Cb 0.52 -1.53 0.05 0.00 0.00 0.00 0.00 31.44 30.48 1ubk n GLU 207 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 1ubk s SER 208 N -3.19 5.09 0.41 -1.84 1.04 -1.13 -4.88 113.70 109.20 1ubk s SER 208 Ca 0.13 2.00 0.12 0.00 0.48 0.00 0.00 55.95 58.67 1ubk s SER 208 Cb 0.18 -2.55 0.85 0.00 0.10 0.00 0.00 66.02 64.60 1ubk s SER 208 CO 0.59 -1.64 1.93 -0.33 0.98 0.00 0.00 173.24 174.77 1ubk h GLU 209 N 0.01 0.13 -0.63 4.02 4.39 -1.92 -1.25 114.58 119.33 1ubk h GLU 209 Ca -0.47 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.17 1ubk h GLU 209 Cb 1.25 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.85 1ubk h GLU 209 CO 0.54 0.31 0.26 0.93 -1.16 0.00 0.00 179.01 179.88 1ubk h GLU 210 N 0.12 0.94 -0.59 2.33 3.07 -1.91 -0.58 114.58 117.96 1ubk h GLU 210 Ca 0.02 -0.17 -0.02 0.00 -0.50 0.00 0.00 59.36 58.69 1ubk h GLU 210 Cb 0.39 -0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 28.12 1ubk h GLU 210 CO 0.03 0.79 0.28 0.00 -1.40 0.00 0.00 179.01 178.71 1ubk h ALA 211 N 1.10 0.76 -0.93 3.43 0.00 -1.61 -1.23 119.26 120.77 1ubk h ALA 211 Ca 0.21 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.07 1ubk h ALA 211 Cb 0.20 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.69 1ubk h ALA 211 CO -0.02 0.32 0.60 -0.09 0.00 0.00 0.00 179.25 180.06 1ubk h ARG 212 N 0.80 0.97 -0.02 0.00 2.43 -0.72 -0.79 114.38 117.05 1ubk h ARG 212 Ca 0.20 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1ubk h ARG 212 Cb 0.12 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1ubk h ARG 212 CO -0.03 0.64 0.00 1.63 -1.51 0.00 0.00 179.97 180.71 1ubk n LYS 213 N -4.52 1.17 -1.25 0.20 5.02 -0.27 -4.91 118.16 113.59 1ubk n LYS 213 Ca 0.15 -0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 1ubk n LYS 213 Cb 0.25 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1ubk n LYS 213 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ubk n GLY 214 N 0.96 0.56 3.66 0.72 0.00 -0.30 -5.05 105.19 105.73 1ubk n GLY 214 Ca 0.19 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 45.08 1ubk n GLY 214 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ubk s TRP 215 N -2.00 1.95 0.49 1.61 0.52 -0.50 -4.85 118.94 116.16 1ubk s TRP 215 Ca 0.00 1.40 -0.23 0.00 0.02 0.00 0.00 56.10 57.29 1ubk s TRP 215 Cb 0.00 -3.18 -0.06 0.00 -1.15 0.00 0.00 33.47 29.07 1ubk s TRP 215 CO 0.00 -2.78 1.26 0.00 0.02 0.00 0.00 176.95 175.45 1ubk n LEU 217 N -0.67 3.61 -0.23 0.00 4.77 -1.26 -0.85 117.00 122.37 1ubk n LEU 217 Ca 0.08 -1.81 -0.03 0.00 -0.03 0.00 0.00 56.01 54.23 1ubk n LEU 217 Cb 0.46 -0.45 0.08 0.00 -2.33 0.00 0.00 43.42 41.18 1ubk n LEU 217 CO 0.51 0.85 1.11 0.22 -1.33 0.00 0.00 177.39 178.75 1ubk h TYR 218 N 3.79 0.73 0.00 -1.77 5.03 -1.91 -0.67 116.97 122.16 1ubk h TYR 218 Ca 0.00 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.33 1ubk h TYR 218 Cb 0.94 -0.23 -0.00 0.00 1.55 0.00 0.00 36.73 38.99 1ubk h TYR 218 CO 0.47 0.39 -0.03 1.49 -1.32 0.00 0.00 178.16 179.16 1ubk h GLU 219 N 0.75 0.00 -0.57 1.82 4.81 -1.82 -0.92 114.58 118.65 1ubk h GLU 219 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1ubk h GLU 219 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1ubk h GLU 219 CO -0.13 0.03 0.00 1.28 -0.73 0.00 0.00 179.01 179.46 1ubk n LEU 220 N -3.18 3.07 0.00 1.64 4.32 -0.31 -4.56 117.00 117.98 1ubk n LEU 220 Ca -0.01 -1.55 0.00 0.00 -0.02 0.00 0.00 56.01 54.44 1ubk n LEU 220 Cb 0.24 -0.43 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 1ubk n LEU 220 CO 0.26 0.57 0.00 0.61 -1.22 0.00 0.00 177.39 177.61 1ubk n GLY 221 N 0.90 0.78 3.69 -0.72 0.00 -0.35 -4.36 105.19 105.13 1ubk n GLY 221 Ca 0.16 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 1ubk n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ubk n LYS 223 N 3.89 2.62 -0.31 0.00 4.76 -0.19 -4.54 118.16 124.40 1ubk n LYS 223 Ca 0.17 -2.45 0.15 0.00 -2.87 0.00 0.00 58.31 53.31 1ubk n LYS 223 Cb 0.31 -1.54 0.33 0.00 -1.84 0.00 0.00 35.03 32.29 1ubk n LYS 223 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1ubk h GLY 224 N 4.51 1.54 2.00 0.72 0.00 -1.89 -0.41 103.07 109.53 1ubk h GLY 224 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1ubk h GLY 224 CO 0.01 -0.37 0.00 -2.55 0.00 0.00 0.00 176.54 173.63 1ubk h PRO 225 N 0.27 0.00 -0.02 4.80 0.11 -1.95 -2.53 132.00 132.69 1ubk h PRO 225 Ca 0.59 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.70 1ubk h PRO 225 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1ubk h PRO 225 CO -0.62 0.00 0.00 1.33 -0.21 0.00 0.00 178.00 178.50 1ubk n VAL 226 N -2.88 1.80 -4.77 3.15 0.24 -0.19 -4.91 118.33 110.76 1ubk n VAL 226 Ca -0.01 -2.07 -0.27 0.00 -2.04 0.00 0.00 64.34 59.95 1ubk n VAL 226 Cb 0.14 -0.14 -0.17 0.00 -1.47 0.00 0.00 33.84 32.20 1ubk n VAL 226 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1ubk s THR 227 N -2.62 1.41 -0.31 3.34 2.01 -1.07 -4.98 115.64 113.42 1ubk s THR 227 Ca 0.29 -0.64 -0.11 0.00 0.31 0.00 0.00 61.69 61.53 1ubk s THR 227 Cb 0.25 -1.26 -0.02 0.00 0.01 0.00 0.00 72.50 71.47 1ubk s THR 227 CO 0.03 0.42 0.20 -0.04 -0.69 0.00 0.00 174.62 174.54 1ubk s MET 228 N 0.57 3.60 0.08 4.92 -1.94 -1.26 -0.62 119.30 124.65 1ubk s MET 228 Ca -0.16 -0.56 -0.27 0.00 -1.71 0.00 0.00 55.69 52.99 1ubk s MET 228 Cb -0.16 -3.70 0.09 0.00 2.01 0.00 0.00 34.83 33.06 1ubk s MET 228 CO 0.05 -0.35 1.09 1.21 -0.01 0.00 0.00 175.02 177.01 1ubk s ASN 229 N 1.71 -0.13 -0.24 3.03 3.04 -1.09 -4.78 114.94 116.48 1ubk s ASN 229 Ca 0.06 -0.30 0.13 0.00 0.04 0.00 0.00 52.86 52.80 1ubk s ASN 229 Cb -0.17 0.36 0.54 0.00 -1.54 0.00 0.00 41.25 40.44 1ubk s ASN 229 CO 0.10 -0.66 1.48 -0.46 -3.04 0.00 0.00 177.10 174.52 1ubk n ASN 230 N -0.48 3.43 -0.17 -4.21 2.04 -1.21 -4.01 115.26 110.65 1ubk n ASN 230 Ca -0.07 -3.32 -0.05 0.00 -0.44 0.00 0.00 54.58 50.70 1ubk n ASN 230 Cb 0.62 -0.60 0.05 0.00 -2.53 0.00 0.00 39.78 37.31 1ubk n ASN 230 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ubk h PRO 232 N 0.52 0.00 0.00 0.00 0.11 -1.88 0.09 132.00 130.84 1ubk h PRO 232 Ca 0.22 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.24 1ubk h PRO 232 Cb 0.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 1ubk h PRO 232 CO -0.14 0.05 -0.68 -0.22 -0.21 0.00 0.00 178.00 176.79 1ubk h LYS 233 N 0.00 0.00 0.07 1.05 3.64 -1.59 -3.40 116.57 116.34 1ubk h LYS 233 Ca -0.00 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.11 1ubk h LYS 233 Cb 0.56 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 1ubk h LYS 233 CO 0.01 0.52 -1.35 0.82 -2.27 0.00 0.00 179.45 177.17 1ubk h ILE 234 N -1.00 1.33 -2.62 2.00 1.08 -1.41 -3.50 117.51 113.39 1ubk h ILE 234 Ca -0.14 -3.01 0.28 0.00 -0.39 0.00 0.00 64.86 61.60 1ubk h ILE 234 Cb 0.82 2.76 -0.07 0.00 -3.07 0.00 0.00 36.82 37.26 1ubk h ILE 234 CO -0.08 0.83 -0.37 0.29 -0.69 0.00 0.00 178.15 178.12 1ubk n LYS 235 N -3.37 -2.09 -5.05 2.37 5.02 0.02 -4.70 118.16 110.36 1ubk n LYS 235 Ca -0.10 1.37 -0.31 0.00 -2.02 0.00 0.00 58.31 57.25 1ubk n LYS 235 Cb 1.01 -2.54 -0.15 0.00 -0.02 0.00 0.00 35.03 33.33 1ubk n LYS 235 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ubk s PHE 236 N -1.69 2.40 -1.84 2.13 0.08 0.67 -4.67 117.98 115.06 1ubk s PHE 236 Ca 0.00 -0.37 0.00 0.00 0.12 0.00 0.00 56.93 56.68 1ubk s PHE 236 Cb 0.00 -1.48 0.00 0.00 -0.57 0.00 0.00 43.02 40.97 1ubk s PHE 236 CO 0.00 0.08 0.00 0.09 -0.10 0.00 0.00 175.22 175.29 1ubk n ASN 237 N 2.11 -5.47 -1.72 1.36 4.13 -1.26 -1.22 115.26 113.19 1ubk n ASN 237 Ca -0.16 0.20 -0.19 0.00 1.68 0.00 0.00 54.58 56.10 1ubk n ASN 237 Cb 0.52 -4.67 -0.05 0.00 -1.54 0.00 0.00 39.78 34.03 1ubk n ASN 237 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ubk n GLN 238 N -2.72 -1.39 0.00 3.52 3.00 -1.26 -4.76 117.38 113.77 1ubk n GLN 238 Ca -0.22 1.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.84 1ubk n GLN 238 Cb 0.67 -5.47 0.00 0.00 0.00 0.00 0.00 30.24 25.44 1ubk n GLN 238 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 1ubk n THR 239 N -3.06 0.00 -3.83 5.09 5.66 -0.36 -5.10 114.28 112.68 1ubk n THR 239 Ca -0.20 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.74 1ubk n THR 239 Cb 0.64 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.40 1ubk n THR 239 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1ubk s ASN 240 N -0.13 -0.24 0.20 1.09 3.84 -0.87 -4.93 114.94 113.88 1ubk s ASN 240 Ca 0.00 -0.55 -0.17 0.00 0.21 0.00 0.00 52.86 52.34 1ubk s ASN 240 Cb 0.00 0.67 0.03 0.00 -0.55 0.00 0.00 41.25 41.40 1ubk s ASN 240 CO 0.00 -1.24 0.52 -1.66 -2.79 0.00 0.00 177.10 171.94 1ubk s TRP 241 N -3.76 -0.11 0.18 0.43 1.48 -1.26 -0.24 118.94 115.66 1ubk s TRP 241 Ca 0.11 -0.24 -0.19 0.00 -1.06 0.00 0.00 56.10 54.73 1ubk s TRP 241 Cb -0.05 0.39 0.12 0.00 -1.16 0.00 0.00 33.47 32.77 1ubk s TRP 241 CO 0.06 -0.92 1.63 -1.35 -4.06 0.00 0.00 176.95 172.30 1ubk h PRO 242 N 2.20 -0.12 -0.30 3.25 0.11 -1.95 -1.58 132.00 133.61 1ubk h PRO 242 Ca -0.29 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.75 1ubk h PRO 242 Cb 1.26 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.38 1ubk h PRO 242 CO 0.37 -0.08 -0.15 0.28 -0.21 0.00 0.00 178.00 178.21 1ubk h VAL 243 N -0.13 1.24 0.00 3.15 2.07 -1.85 -0.77 116.25 119.96 1ubk h VAL 243 Ca 0.21 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 66.65 1ubk h VAL 243 Cb 0.45 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 1ubk h VAL 243 CO -0.52 0.35 0.00 0.44 0.02 0.00 0.00 177.57 177.86 1ubk h ASP 244 N 0.48 0.00 -0.42 0.57 3.32 -1.62 0.38 116.42 119.13 1ubk h ASP 244 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1ubk h ASP 244 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1ubk h ASP 244 CO 0.03 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.55 1ubk n ALA 245 N -1.88 2.44 -0.78 3.45 0.00 -0.39 -4.94 120.51 118.41 1ubk n ALA 245 Ca 0.01 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.72 1ubk n ALA 245 Cb 0.24 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1ubk n ALA 245 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ubk n GLY 246 N 1.16 0.66 3.49 0.00 0.00 0.12 -5.05 105.19 105.57 1ubk n GLY 246 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1ubk n GLY 246 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ubk s HIS 247 N -2.27 2.70 0.67 1.61 5.65 -0.67 -4.98 115.29 118.00 1ubk s HIS 247 Ca 0.00 -0.16 -0.17 0.00 0.25 0.00 0.00 55.06 54.98 1ubk s HIS 247 Cb 0.00 -1.59 0.01 0.00 -1.18 0.00 0.00 32.58 29.82 1ubk s HIS 247 CO 0.00 0.23 1.28 -1.25 -0.65 0.00 0.00 174.74 174.34 1ubk s PRO 248 N -0.98 2.40 0.33 2.88 0.04 -1.26 -2.85 135.00 135.55 1ubk s PRO 248 Ca 0.13 2.00 -0.29 0.00 0.04 0.00 0.00 61.00 62.89 1ubk s PRO 248 Cb -0.11 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.49 1ubk s PRO 248 CO 0.03 -1.70 1.42 0.00 0.04 0.00 0.00 177.00 176.78 1ubk n ILE 250 N 1.05 0.46 -1.53 0.00 -5.35 -1.26 -1.02 119.36 111.71 1ubk n ILE 250 Ca 0.02 -0.73 0.00 0.00 -0.27 0.00 0.00 62.75 61.77 1ubk n ILE 250 Cb 0.40 0.98 0.00 0.00 -1.74 0.00 0.00 39.64 39.28 1ubk n ILE 250 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ubk n GLY 251 N 1.15 0.73 0.00 3.28 0.00 -1.26 -4.85 105.19 104.25 1ubk n GLY 251 Ca 0.15 -0.69 0.12 0.00 0.00 0.00 0.00 46.02 45.59 1ubk n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ubk n SER 253 N -1.33 3.48 -4.77 0.00 3.41 -1.26 -3.50 113.62 109.65 1ubk n SER 253 Ca 0.10 -1.99 -0.31 0.00 -0.26 0.00 0.00 58.87 56.41 1ubk n SER 253 Cb 0.20 -0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 63.67 1ubk n SER 253 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1ubk s GLU 254 N -1.17 2.93 0.48 4.33 0.41 -0.68 -4.54 118.70 120.45 1ubk s GLU 254 Ca 0.43 -0.62 -0.24 0.00 -0.41 0.00 0.00 54.97 54.13 1ubk s GLU 254 Cb 0.23 -2.76 -0.07 0.00 -1.78 0.00 0.00 34.13 29.74 1ubk s GLU 254 CO 0.30 0.60 1.40 -1.25 -0.49 0.00 0.00 175.26 175.81 1ubk s PRO 255 N -2.11 3.55 -1.75 0.39 0.04 -1.26 -2.70 135.00 131.15 1ubk s PRO 255 Ca 0.26 2.34 0.00 0.00 0.04 0.00 0.00 61.00 63.64 1ubk s PRO 255 Cb -0.12 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 31.88 1ubk s PRO 255 CO 0.18 -0.90 0.00 -0.25 0.04 0.00 0.00 177.00 176.08 1ubk n ASP 256 N -0.42 -5.44 0.20 6.66 8.00 -1.26 -4.84 116.55 119.44 1ubk n ASP 256 Ca 0.07 0.13 0.04 0.00 0.71 0.00 0.00 54.79 55.74 1ubk n ASP 256 Cb 0.43 -4.61 0.42 0.00 -0.02 0.00 0.00 41.12 37.34 1ubk n ASP 256 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 1ubk h PHE 257 N 0.00 0.02 -0.78 1.24 -5.15 -1.80 0.60 116.94 111.07 1ubk h PHE 257 Ca -0.44 -0.00 0.15 0.00 -0.20 0.00 0.00 57.97 57.47 1ubk h PHE 257 Cb 1.32 -0.01 -0.05 0.00 0.22 0.00 0.00 35.95 37.43 1ubk h PHE 257 CO 0.58 0.29 0.52 -1.49 -2.00 0.00 0.00 178.31 176.20 1ubk h TRP 258 N 0.02 0.54 0.00 6.09 4.06 -1.88 0.12 115.95 124.90 1ubk h TRP 258 Ca 0.00 0.02 -0.36 0.00 2.06 0.00 0.00 58.89 60.61 1ubk h TRP 258 Cb 0.49 -0.17 -0.07 0.00 -1.00 0.00 0.00 29.16 28.41 1ubk h TRP 258 CO 0.00 0.21 -2.35 -0.25 -3.56 0.00 0.00 178.44 172.49 1ubk n ASP 259 N -4.49 0.77 0.09 -3.49 8.00 -0.70 -4.21 116.55 112.52 1ubk n ASP 259 Ca 0.15 -0.04 -0.06 0.00 0.71 0.00 0.00 54.79 55.55 1ubk n ASP 259 Cb 0.52 0.58 0.01 0.00 -0.02 0.00 0.00 41.12 42.20 1ubk n ASP 259 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ubk h ALA 260 N 0.67 0.60 -0.03 2.24 0.00 -0.72 -3.32 119.26 118.71 1ubk h ALA 260 Ca -0.53 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 53.65 1ubk h ALA 260 Cb 2.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.78 1ubk h ALA 260 CO -0.00 0.96 -0.07 -1.33 0.00 0.00 0.00 179.25 178.81 1ubk n MET 261 N -3.62 2.11 -3.61 0.00 2.81 0.40 -4.93 117.12 110.28 1ubk n MET 261 Ca -0.02 -1.72 -0.28 0.00 -1.81 0.00 0.00 57.70 53.87 1ubk n MET 261 Cb 0.79 -1.46 -0.03 0.00 -0.71 0.00 0.00 33.22 31.80 1ubk n MET 261 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1ubk s THR 262 N -2.08 5.15 0.27 2.03 -4.23 -1.25 -3.61 115.64 111.93 1ubk s THR 262 Ca 0.27 -0.19 -0.30 0.00 -1.18 0.00 0.00 61.69 60.29 1ubk s THR 262 Cb 0.20 -3.71 -0.10 0.00 1.34 0.00 0.00 72.50 70.22 1ubk s THR 262 CO 0.34 -0.17 1.48 -2.84 -0.54 0.00 0.00 174.62 172.89 1ubk s PRO 263 N -3.25 4.23 0.56 3.99 0.02 -1.26 -4.99 135.00 134.29 1ubk s PRO 263 Ca 0.40 2.38 0.28 0.00 0.02 0.00 0.00 61.00 64.08 1ubk s PRO 263 Cb -0.11 -3.08 1.63 0.00 0.02 0.00 0.00 34.50 32.96 1ubk s PRO 263 CO 0.28 -0.47 2.17 0.74 -0.33 0.00 0.00 177.00 179.39 1ubk h PHE 264 N 4.82 0.00 -0.58 6.54 0.04 -1.93 -2.46 116.94 123.37 1ubk h PHE 264 Ca -0.47 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.30 1ubk h PHE 264 Cb 1.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.37 1ubk h PHE 264 CO 0.59 0.06 0.00 0.66 -0.60 0.00 0.00 178.31 179.02 1ubk n TYR 265 N -3.80 1.82 -4.52 -0.55 4.01 -1.26 -4.36 117.16 108.51 1ubk n TYR 265 Ca -0.02 -0.65 -0.25 0.00 -0.16 0.00 0.00 57.90 56.82 1ubk n TYR 265 Cb 0.15 -0.41 -0.14 0.00 -0.31 0.00 0.00 39.34 38.63 1ubk n TYR 265 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1ubk s GLN 266 N -2.40 1.27 0.00 -0.72 -0.21 -0.93 -3.82 119.66 112.85 1ubk s GLN 266 Ca 0.51 -0.99 0.00 0.00 0.02 0.00 0.00 55.36 54.91 1ubk s GLN 266 Cb 0.37 -1.42 0.00 0.00 1.00 0.00 0.00 33.01 32.96 1ubk s GLN 266 CO 0.18 0.35 0.28 0.09 -2.12 0.00 0.00 175.29 174.07