#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u0m s THR 3 N 0.00 1.64 0.05 0.00 2.01 -0.33 -1.21 115.64 117.79 1u0m s THR 3 Ca 0.00 -0.80 -0.31 0.00 0.31 0.00 0.00 61.69 60.90 1u0m s THR 3 Cb 0.00 -1.42 -0.06 0.00 0.01 0.00 0.00 72.50 71.03 1u0m s THR 3 CO 0.00 0.47 1.25 -0.22 -0.69 0.00 0.00 174.62 175.43 1u0m s LEU 4 N 0.29 4.35 0.00 4.42 0.20 -0.24 -2.90 118.68 124.80 1u0m s LEU 4 Ca -0.12 2.05 0.00 0.00 0.69 0.00 0.00 54.13 56.75 1u0m s LEU 4 Cb -0.15 -3.58 0.00 0.00 -0.43 0.00 0.00 46.19 42.03 1u0m s LEU 4 CO 0.05 -0.54 0.00 0.00 -0.29 0.00 0.00 176.35 175.57 1u0m s ARG 6 N 2.01 3.44 0.29 0.00 1.81 -1.26 -4.84 118.95 120.40 1u0m s ARG 6 Ca 0.00 0.17 -0.30 0.00 -1.72 0.00 0.00 55.73 53.89 1u0m s ARG 6 Cb 0.00 -4.05 -0.11 0.00 -0.45 0.00 0.00 34.95 30.34 1u0m s ARG 6 CO 0.00 -1.78 1.47 -1.25 -0.68 0.00 0.00 175.30 173.05 1u0m s PRO 7 N 5.13 4.22 -0.15 3.54 0.04 -1.26 -4.77 135.00 141.75 1u0m s PRO 7 Ca 0.42 2.39 -0.08 0.00 0.04 0.00 0.00 61.00 63.78 1u0m s PRO 7 Cb -0.08 -3.06 -0.04 0.00 0.04 0.00 0.00 34.50 31.36 1u0m s PRO 7 CO 0.23 -0.46 0.12 0.45 0.04 0.00 0.00 177.00 177.39 1u0m s SER 8 N 0.21 6.14 0.01 6.66 0.15 0.18 -4.58 113.70 122.48 1u0m s SER 8 Ca 0.58 0.31 0.02 0.00 0.70 0.00 0.00 55.95 57.56 1u0m s SER 8 Cb -0.44 -2.02 -0.01 0.00 -1.71 0.00 0.00 66.02 61.84 1u0m s SER 8 CO 0.48 0.30 -0.07 -0.69 1.20 0.00 0.00 173.24 174.46 1u0m s VAL 9 N -0.35 0.56 -0.07 4.45 1.01 -1.26 -1.58 120.40 123.16 1u0m s VAL 9 Ca 0.11 -0.49 -0.06 0.00 0.00 0.00 0.00 61.98 61.53 1u0m s VAL 9 Cb -0.12 -0.51 0.02 0.00 0.00 0.00 0.00 36.38 35.78 1u0m s VAL 9 CO 0.01 0.03 0.19 -0.55 0.00 0.00 0.00 175.10 174.78 1u0m s SER 10 N -0.52 -0.19 0.17 3.32 0.15 -0.79 -5.02 113.70 110.82 1u0m s SER 10 Ca -0.00 0.39 0.09 0.00 0.70 0.00 0.00 55.95 57.13 1u0m s SER 10 Cb -0.04 0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 64.59 1u0m s SER 10 CO 0.00 -0.09 -0.20 0.68 1.20 0.00 0.00 173.24 174.83 1u0m s VAL 11 N 0.38 2.00 0.87 4.45 -7.23 -1.26 -1.75 120.40 117.85 1u0m s VAL 11 Ca -0.02 -1.94 -0.10 0.00 -1.81 0.00 0.00 61.98 58.10 1u0m s VAL 11 Cb -0.04 -1.92 0.12 0.00 0.56 0.00 0.00 36.38 35.10 1u0m s VAL 11 CO -0.02 -0.23 1.14 -2.16 -0.31 0.00 0.00 175.10 173.52 1u0m s PRO 12 N -2.71 1.37 0.26 4.82 0.04 -1.26 -4.96 135.00 132.56 1u0m s PRO 12 Ca 0.17 1.47 0.26 0.00 0.04 0.00 0.00 61.00 62.94 1u0m s PRO 12 Cb -0.07 -1.77 0.85 0.00 0.04 0.00 0.00 34.50 33.55 1u0m s PRO 12 CO 0.08 -2.36 1.75 1.05 0.04 0.00 0.00 177.00 177.56 1u0m h GLU 13 N -1.62 0.00 -6.02 4.56 9.09 -1.92 -3.41 114.58 115.27 1u0m h GLU 13 Ca -0.43 0.00 -0.57 0.00 0.05 0.00 0.00 59.36 58.40 1u0m h GLU 13 Cb 1.26 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 28.30 1u0m h GLU 13 CO 0.44 0.00 0.46 -1.01 0.05 0.00 0.00 179.01 178.95 1u0m s HIS 14 N -3.21 3.43 -0.06 2.06 3.76 -1.22 -4.98 115.29 115.08 1u0m s HIS 14 Ca 0.08 1.34 0.03 0.00 -0.15 0.00 0.00 55.06 56.36 1u0m s HIS 14 Cb 0.11 -3.07 -0.03 0.00 1.11 0.00 0.00 32.58 30.70 1u0m s HIS 14 CO 0.54 -0.26 -0.13 0.08 -0.85 0.00 0.00 174.74 174.12 1u0m s VAL 15 N 2.21 3.14 -0.12 -0.90 1.01 -1.26 -1.10 120.40 123.38 1u0m s VAL 15 Ca 0.41 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.71 1u0m s VAL 15 Cb -0.17 -2.24 0.02 0.00 0.00 0.00 0.00 36.38 33.99 1u0m s VAL 15 CO 0.13 0.59 -0.15 -0.51 0.00 0.00 0.00 175.10 175.16 1u0m s ILE 16 N -0.63 1.52 0.64 2.22 2.07 -0.23 -4.97 121.20 121.81 1u0m s ILE 16 Ca 0.09 -0.63 -0.07 0.00 -1.41 0.00 0.00 60.65 58.63 1u0m s ILE 16 Cb -0.11 -1.40 0.03 0.00 0.13 0.00 0.00 42.46 41.10 1u0m s ILE 16 CO 0.01 0.45 0.96 0.42 -1.91 0.00 0.00 174.94 174.86 1u0m s THR 17 N 1.16 3.19 0.12 4.00 -4.23 -1.26 -1.30 115.64 117.33 1u0m s THR 17 Ca -0.03 -0.04 -0.20 0.00 -1.18 0.00 0.00 61.69 60.25 1u0m s THR 17 Cb -0.14 -3.31 -0.05 0.00 1.34 0.00 0.00 72.50 70.34 1u0m s THR 17 CO -0.05 -0.33 1.72 -0.03 -0.54 0.00 0.00 174.62 175.39 1u0m h MET 18 N -0.36 0.03 -0.34 3.99 4.05 -0.85 -1.51 114.93 119.94 1u0m h MET 18 Ca -0.45 -0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.02 1u0m h MET 18 Cb 1.28 -0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 32.02 1u0m h MET 18 CO 0.61 0.02 0.03 1.49 0.23 0.00 0.00 176.91 179.29 1u0m h GLU 19 N 0.03 0.13 -0.62 0.39 4.81 -1.92 -1.76 114.58 115.63 1u0m h GLU 19 Ca 0.08 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1u0m h GLU 19 Cb 0.11 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.43 1u0m h GLU 19 CO -0.16 0.08 0.40 0.93 -0.73 0.00 0.00 179.01 179.53 1u0m h GLU 20 N 0.13 0.77 -0.50 1.92 5.08 -1.88 -1.67 114.58 118.44 1u0m h GLU 20 Ca 0.16 -0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.54 1u0m h GLU 20 Cb 0.21 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 1u0m h GLU 20 CO -0.25 0.51 0.21 1.15 -1.00 0.00 0.00 179.01 179.63 1u0m h THR 21 N 0.79 0.88 -0.67 1.13 2.02 -0.67 -1.30 112.91 115.09 1u0m h THR 21 Ca 0.24 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 1u0m h THR 21 Cb -0.03 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 66.79 1u0m h THR 21 CO -0.08 0.07 0.36 -0.07 0.37 0.00 0.00 175.52 176.18 1u0m h LEU 22 N 0.40 0.85 0.52 2.58 4.07 -0.84 -0.67 115.31 122.22 1u0m h LEU 22 Ca 0.23 -0.10 -0.02 0.00 0.08 0.00 0.00 57.88 58.07 1u0m h LEU 22 Cb 0.21 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.73 1u0m h LEU 22 CO -0.21 0.71 -0.29 -0.33 -1.08 0.00 0.00 178.44 177.24 1u0m h GLU 23 N 0.93 -0.73 0.09 1.13 5.08 -0.65 0.18 114.58 120.62 1u0m h GLU 23 Ca 0.24 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.67 1u0m h GLU 23 Cb 0.05 0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 1u0m h GLU 23 CO -0.04 -0.49 -0.29 -0.07 -1.00 0.00 0.00 179.01 177.12 1u0m h LEU 24 N -0.76 -0.85 -1.06 1.33 3.38 -1.17 0.37 115.31 116.55 1u0m h LEU 24 Ca -0.06 0.10 0.18 0.00 0.09 0.00 0.00 57.88 58.19 1u0m h LEU 24 Cb 0.61 0.33 -0.10 0.00 0.09 0.00 0.00 40.66 41.58 1u0m h LEU 24 CO 0.08 -0.38 0.62 0.00 0.09 0.00 0.00 178.44 178.85 1u0m h ALA 25 N 0.21 1.70 0.33 1.53 0.00 -1.04 0.98 119.26 122.98 1u0m h ALA 25 Ca 0.04 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1u0m h ALA 25 Cb 0.54 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1u0m h ALA 25 CO -0.19 -0.04 -0.16 0.00 0.00 0.00 0.00 179.25 178.86 1u0m h ARG 26 N 0.77 -0.43 -0.79 0.00 3.08 0.23 -1.54 114.38 115.70 1u0m h ARG 26 Ca 0.55 0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.64 1u0m h ARG 26 Cb 0.85 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.96 1u0m h ARG 26 CO -0.34 -0.11 0.52 0.00 -1.07 0.00 0.00 179.97 178.98 1u0m h ARG 27 N -0.89 1.04 -0.00 0.04 3.08 0.45 -0.14 114.38 117.96 1u0m h ARG 27 Ca -0.05 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1u0m h ARG 27 Cb 0.53 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1u0m h ARG 27 CO 0.08 0.69 -0.08 0.54 -1.07 0.00 0.00 179.97 180.12 1u0m n ARG 28 N -4.42 0.86 -1.03 0.04 1.74 0.33 -4.10 116.66 110.08 1u0m n ARG 28 Ca 0.09 -0.29 0.01 0.00 -0.77 0.00 0.00 57.85 56.88 1u0m n ARG 28 Cb 0.03 -1.49 -0.00 0.00 -1.02 0.00 0.00 32.46 29.97 1u0m n ARG 28 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1u0m n HIS 29 N -0.82 0.00 -0.50 -1.55 8.25 -0.58 -4.94 115.22 115.09 1u0m n HIS 29 Ca 0.16 -0.31 0.41 0.00 -0.26 0.00 0.00 57.72 57.72 1u0m n HIS 29 Cb 0.26 0.02 0.70 0.00 1.12 0.00 0.00 29.99 32.10 1u0m n HIS 29 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1u0m h THR 30 N 6.47 0.14 -0.00 1.59 1.03 -1.18 0.45 112.91 121.41 1u0m h THR 30 Ca -0.20 -0.02 0.00 0.00 -0.01 0.00 0.00 66.41 66.18 1u0m h THR 30 Cb 1.59 0.07 0.00 0.00 -1.07 0.00 0.00 68.15 68.73 1u0m h THR 30 CO -0.00 0.01 -0.48 0.47 -0.01 0.00 0.00 175.52 175.51 1u0m n ASP 31 N -4.43 0.58 -4.66 0.00 10.43 -1.26 -4.91 116.55 112.30 1u0m n ASP 31 Ca 0.37 -0.35 -0.43 0.00 2.57 0.00 0.00 54.79 56.96 1u0m n ASP 31 Cb 1.55 0.25 -0.03 0.00 1.84 0.00 0.00 41.12 44.73 1u0m n ASP 31 CO 0.00 0.00 0.00 1.57 -1.07 0.00 0.00 177.20 177.70 1u0m n HIS 32 N -1.39 2.47 0.17 1.24 -0.00 0.16 -4.86 115.22 113.01 1u0m n HIS 32 Ca 0.06 -0.31 0.18 0.00 0.46 0.00 0.00 57.72 58.11 1u0m n HIS 32 Cb 0.34 -2.78 0.80 0.00 -0.12 0.00 0.00 29.99 28.23 1u0m n HIS 32 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1u0m h PRO 33 N 10.48 0.00 -0.30 1.57 0.11 -1.90 -1.11 132.00 140.84 1u0m h PRO 33 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1u0m h PRO 33 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1u0m h PRO 33 CO 0.94 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.77 1u0m n GLN 34 N -3.81 3.12 0.00 1.05 1.13 -1.26 -4.76 117.38 112.85 1u0m n GLN 34 Ca 0.03 -2.81 -0.11 0.00 -1.94 0.00 0.00 57.00 52.17 1u0m n GLN 34 Cb 0.40 -1.84 -0.05 0.00 0.11 0.00 0.00 30.24 28.87 1u0m n GLN 34 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 1u0m h LEU 35 N 2.07 -1.07 -1.04 1.08 5.85 -1.52 -0.84 115.31 119.83 1u0m h LEU 35 Ca 0.00 0.15 0.12 0.00 0.84 0.00 0.00 57.88 58.99 1u0m h LEU 35 Cb 1.43 0.45 -0.08 0.00 0.37 0.00 0.00 40.66 42.83 1u0m h LEU 35 CO 0.23 -0.38 0.63 1.55 -0.34 0.00 0.00 178.44 180.13 1u0m h PRO 36 N -0.42 0.96 -0.61 5.25 0.13 -1.85 -0.20 132.00 135.25 1u0m h PRO 36 Ca 0.09 -0.06 -0.05 0.00 -0.87 0.00 0.00 66.00 65.12 1u0m h PRO 36 Cb 0.57 -0.22 -0.03 0.00 0.13 0.00 0.00 31.00 31.46 1u0m h PRO 36 CO -0.36 0.63 0.20 1.25 -0.23 0.00 0.00 178.00 179.49 1u0m h LEU 37 N 0.98 0.88 0.27 1.56 5.85 -1.78 -2.13 115.31 120.95 1u0m h LEU 37 Ca 0.49 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 1u0m h LEU 37 Cb 0.48 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1u0m h LEU 37 CO -0.25 0.85 -0.13 0.00 -0.34 0.00 0.00 178.44 178.57 1u0m h ALA 38 N 1.07 -0.36 -0.78 1.25 0.00 0.33 -1.98 119.26 118.77 1u0m h ALA 38 Ca 0.20 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1u0m h ALA 38 Cb 0.28 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1u0m h ALA 38 CO -0.01 -0.69 0.48 -0.07 0.00 0.00 0.00 179.25 178.96 1u0m h LEU 39 N -0.39 0.75 -0.10 0.00 4.07 -1.08 -1.55 115.31 117.01 1u0m h LEU 39 Ca -0.04 0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.94 1u0m h LEU 39 Cb 0.30 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 41.90 1u0m h LEU 39 CO 0.06 0.49 0.05 -0.09 -1.08 0.00 0.00 178.44 177.87 1u0m h ARG 40 N 0.88 0.14 -0.32 1.13 2.43 -1.25 -0.41 114.38 116.98 1u0m h ARG 40 Ca 0.34 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.53 1u0m h ARG 40 Cb 0.14 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 1u0m h ARG 40 CO -0.16 0.20 0.06 -0.07 -1.51 0.00 0.00 179.97 178.50 1u0m h LEU 41 N 0.04 0.01 0.24 3.80 4.07 -1.12 0.11 115.31 122.47 1u0m h LEU 41 Ca 0.03 0.05 -0.01 0.00 0.08 0.00 0.00 57.88 58.04 1u0m h LEU 41 Cb 0.11 0.07 -0.00 0.00 1.08 0.00 0.00 40.66 41.92 1u0m h LEU 41 CO -0.00 0.04 -0.13 0.40 -1.08 0.00 0.00 178.44 177.67 1u0m h ILE 42 N 0.18 0.73 -0.99 1.22 2.04 -1.12 -2.74 117.51 116.83 1u0m h ILE 42 Ca 0.15 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.08 1u0m h ILE 42 Cb 0.17 0.73 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 1u0m h ILE 42 CO -0.20 0.00 0.64 -0.08 0.00 0.00 0.00 178.15 178.51 1u0m h GLU 43 N -0.34 1.12 0.00 2.37 4.81 -0.68 -0.80 114.58 121.05 1u0m h GLU 43 Ca -0.03 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1u0m h GLU 43 Cb 0.28 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 1u0m h GLU 43 CO 0.04 0.74 -0.02 -0.91 -0.73 0.00 0.00 179.01 178.13 1u0m h ASN 44 N 1.15 0.00 -0.08 1.04 -0.26 -0.76 -2.60 115.58 114.07 1u0m h ASN 44 Ca 0.43 0.00 0.02 0.00 -0.56 0.00 0.00 56.30 56.19 1u0m h ASN 44 Cb 0.17 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.43 1u0m h ASN 44 CO -0.18 0.02 0.09 0.74 -1.06 0.00 0.00 177.43 177.04 1u0m h THR 45 N 0.00 0.55 -0.05 2.81 2.02 -0.84 -3.46 112.91 113.94 1u0m h THR 45 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1u0m h THR 45 Cb 0.21 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1u0m h THR 45 CO 0.00 0.00 -0.02 0.61 0.37 0.00 0.00 175.52 176.48 1u0m n GLY 46 N -1.38 0.41 3.54 2.16 0.00 -0.98 -4.43 105.19 104.51 1u0m n GLY 46 Ca -0.01 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1u0m n GLY 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u0m s VAL 47 N -1.74 4.05 0.07 1.61 1.01 -1.26 -4.58 120.40 119.56 1u0m s VAL 47 Ca 0.00 0.40 -0.08 0.00 0.00 0.00 0.00 61.98 62.30 1u0m s VAL 47 Cb 0.00 -4.74 -0.30 0.00 0.00 0.00 0.00 36.38 31.34 1u0m s VAL 47 CO 0.00 -1.48 1.11 0.08 0.00 0.00 0.00 175.10 174.82 1u0m h ARG 48 N 9.65 0.38 -3.88 2.72 0.11 -1.64 -3.37 114.38 118.36 1u0m h ARG 48 Ca -0.27 -0.62 -0.14 0.00 0.10 0.00 0.00 59.98 59.05 1u0m h ARG 48 Cb 1.06 0.22 -0.19 0.00 1.11 0.00 0.00 29.97 32.18 1u0m h ARG 48 CO 1.19 1.29 -0.59 0.95 0.10 0.00 0.00 179.97 182.91 1u0m s THR 49 N -2.71 0.13 0.05 0.08 -4.23 -1.14 -0.32 115.64 107.50 1u0m s THR 49 Ca -0.06 -1.09 -0.04 0.00 -1.18 0.00 0.00 61.69 59.32 1u0m s THR 49 Cb 0.06 -0.74 -0.02 0.00 1.34 0.00 0.00 72.50 73.14 1u0m s THR 49 CO 0.90 -0.60 0.05 -0.13 -0.54 0.00 0.00 174.62 174.30 1u0m s ARG 50 N -2.31 0.59 0.03 3.99 0.52 -0.42 -3.22 118.95 118.12 1u0m s ARG 50 Ca -0.08 -0.92 0.08 0.00 -0.52 0.00 0.00 55.73 54.30 1u0m s ARG 50 Cb -0.03 0.22 -0.03 0.00 0.52 0.00 0.00 34.95 35.63 1u0m s ARG 50 CO -0.04 -0.14 -0.24 -1.01 0.02 0.00 0.00 175.30 173.90 1u0m s HIS 51 N -3.07 2.40 0.07 -0.53 3.76 -1.26 -1.07 115.29 115.60 1u0m s HIS 51 Ca -0.01 -0.36 0.04 0.00 -0.15 0.00 0.00 55.06 54.58 1u0m s HIS 51 Cb 0.02 -1.43 -0.03 0.00 1.11 0.00 0.00 32.58 32.24 1u0m s HIS 51 CO -0.07 0.14 -0.12 0.96 -0.85 0.00 0.00 174.74 174.81 1u0m s ILE 52 N -0.81 0.97 0.10 0.60 -4.36 -0.26 -0.49 121.20 116.95 1u0m s ILE 52 Ca 0.12 -1.35 0.21 0.00 -0.26 0.00 0.00 60.65 59.37 1u0m s ILE 52 Cb -0.10 -1.06 0.17 0.00 1.25 0.00 0.00 42.46 42.73 1u0m s ILE 52 CO 0.02 -0.34 1.74 -0.37 0.24 0.00 0.00 174.94 176.24 1u0m h VAL 53 N 4.14 0.71 -2.44 8.37 -1.51 -1.92 -3.23 116.25 120.38 1u0m h VAL 53 Ca -0.39 -1.41 -0.60 0.00 -1.23 0.00 0.00 66.70 63.07 1u0m h VAL 53 Cb 1.19 1.92 -0.13 0.00 -2.13 0.00 0.00 31.29 32.14 1u0m h VAL 53 CO 0.43 0.31 -0.71 -1.10 -1.23 0.00 0.00 177.57 175.27 1u0m s GLN 54 N -3.54 1.98 0.87 5.19 -0.21 -1.26 -4.89 119.66 117.79 1u0m s GLN 54 Ca 0.01 -1.52 -0.13 0.00 0.02 0.00 0.00 55.36 53.74 1u0m s GLN 54 Cb 0.10 -2.00 0.06 0.00 1.00 0.00 0.00 33.01 32.17 1u0m s GLN 54 CO 0.67 0.37 0.82 -2.30 -2.12 0.00 0.00 175.29 172.73 1u0m n PRO 55 N -0.53 -0.09 -0.27 2.91 -0.02 -1.26 -4.63 135.00 131.11 1u0m n PRO 55 Ca -0.07 0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.44 1u0m n PRO 55 Cb 0.58 -2.14 0.21 0.00 -0.02 0.00 0.00 33.50 32.13 1u0m n PRO 55 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1u0m h ILE 56 N -1.25 1.20 0.00 4.25 6.09 -1.96 -1.94 117.51 123.90 1u0m h ILE 56 Ca -0.45 -0.38 -0.04 0.00 -1.37 0.00 0.00 64.86 62.62 1u0m h ILE 56 Cb 1.29 -0.01 -0.01 0.00 0.47 0.00 0.00 36.82 38.57 1u0m h ILE 56 CO 0.40 0.20 -0.20 -0.33 -3.07 0.00 0.00 178.15 175.16 1u0m h GLU 57 N 1.11 0.00 0.14 2.19 3.07 -2.00 -2.01 114.58 117.08 1u0m h GLU 57 Ca 0.31 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 58.86 1u0m h GLU 57 Cb -0.10 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1u0m h GLU 57 CO -0.07 0.20 -1.55 -0.44 -1.40 0.00 0.00 179.01 175.75 1u0m h ASP 58 N 0.00 0.46 0.88 1.42 3.32 -1.74 -3.28 116.42 117.48 1u0m h ASP 58 Ca -0.00 -0.63 -0.03 0.00 0.02 0.00 0.00 57.03 56.39 1u0m h ASP 58 Cb 0.39 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 1u0m h ASP 58 CO 0.03 1.52 -0.15 0.00 -1.72 0.00 0.00 179.24 178.91 1u0m h THR 59 N 0.08 0.40 0.00 0.35 1.03 -1.14 -2.47 112.91 111.16 1u0m h THR 59 Ca -0.25 -0.88 -0.04 0.00 -0.01 0.00 0.00 66.41 65.22 1u0m h THR 59 Cb 2.04 1.64 -0.01 0.00 -1.07 0.00 0.00 68.15 70.75 1u0m h THR 59 CO 0.18 0.15 -0.21 -0.07 -0.01 0.00 0.00 175.52 175.55 1u0m h LEU 60 N 0.00 0.00-10.02 0.00 3.38 -1.46 -3.45 115.31 103.75 1u0m h LEU 60 Ca -0.00 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.48 1u0m h LEU 60 Cb 0.63 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1u0m h LEU 60 CO 0.02 0.21 0.10 -1.61 0.09 0.00 0.00 178.44 177.25 1u0m s GLU 61 N -3.25 3.99 -0.37 1.13 0.41 -0.93 -4.86 118.70 114.83 1u0m s GLU 61 Ca 0.04 0.67 0.03 0.00 -0.41 0.00 0.00 54.97 55.30 1u0m s GLU 61 Cb 0.07 -2.42 0.11 0.00 -1.78 0.00 0.00 34.13 30.10 1u0m s GLU 61 CO 0.68 0.14 0.09 -1.58 -0.49 0.00 0.00 175.26 174.10 1u0m s HIS 62 N -2.01 3.44 -2.00 1.61 2.46 -1.26 -4.94 115.29 112.59 1u0m s HIS 62 Ca 0.54 -2.90 0.08 0.00 0.47 0.00 0.00 55.06 53.25 1u0m s HIS 62 Cb -0.10 -2.77 0.48 0.00 -0.13 0.00 0.00 32.58 30.06 1u0m s HIS 62 CO 0.18 -0.91 1.30 -0.35 -2.47 0.00 0.00 174.74 172.49 1u0m n PRO 63 N 4.11 0.99 0.00 2.88 -0.04 -1.26 -4.98 135.00 136.70 1u0m n PRO 63 Ca 0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1u0m n PRO 63 Cb 0.40 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 1u0m n PRO 63 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1u0m n GLY 64 N 0.62 2.37 0.36 0.55 0.00 -1.26 -4.41 105.19 103.41 1u0m n GLY 64 Ca 0.06 -1.81 -0.01 0.00 0.00 0.00 0.00 46.02 44.26 1u0m n GLY 64 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1u0m h PHE 65 N 0.00 1.08 0.11 1.61 -0.00 -1.77 0.28 116.94 118.25 1u0m h PHE 65 Ca 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 57.98 1u0m h PHE 65 Cb 0.00 -0.36 0.00 0.00 -0.00 0.00 0.00 35.95 35.59 1u0m h PHE 65 CO 0.00 0.69 -0.05 1.49 -0.00 0.00 0.00 178.31 180.44 1u0m h GLU 66 N 1.15 -0.14 -0.56 1.11 4.81 -1.90 0.26 114.58 119.31 1u0m h GLU 66 Ca 0.31 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.44 1u0m h GLU 66 Cb -0.11 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1u0m h GLU 66 CO -0.06 -0.03 -0.07 -0.44 -0.73 0.00 0.00 179.01 177.67 1u0m h ASP 67 N -0.21 1.03 -0.07 1.04 5.19 -1.71 -1.41 116.42 120.29 1u0m h ASP 67 Ca -0.01 -0.32 0.02 0.00 -0.62 0.00 0.00 57.03 56.09 1u0m h ASP 67 Cb 0.17 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.38 1u0m h ASP 67 CO 0.02 1.12 -0.04 -0.09 -3.12 0.00 0.00 179.24 177.13 1u0m h ARG 68 N 0.93 -0.03 0.00 3.56 9.65 -0.77 -0.41 114.38 127.30 1u0m h ARG 68 Ca 0.15 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 59.00 1u0m h ARG 68 Cb 0.63 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.21 1u0m h ARG 68 CO 0.04 -0.02 -0.18 -0.97 2.80 0.00 0.00 179.97 181.64 1u0m h ASN 69 N -0.04 0.00 -0.27 -3.80 -1.24 -0.32 -0.92 115.58 108.99 1u0m h ASN 69 Ca 0.04 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 57.00 1u0m h ASN 69 Cb 0.09 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.14 1u0m h ASN 69 CO -0.09 0.18 -0.01 0.11 -1.29 0.00 0.00 177.43 176.33 1u0m h LYS 70 N 0.00 0.49 -0.89 6.67 6.56 -0.33 -2.27 116.57 126.79 1u0m h LYS 70 Ca -0.00 -0.16 0.04 0.00 -1.06 0.00 0.00 60.65 59.47 1u0m h LYS 70 Cb 0.38 -0.04 -0.05 0.00 -0.57 0.00 0.00 32.23 31.95 1u0m h LYS 70 CO 0.02 0.65 0.58 0.28 -2.06 0.00 0.00 179.45 178.93 1u0m h VAL 71 N 0.27 1.15 0.07 0.50 2.07 0.02 -1.99 116.25 118.34 1u0m h VAL 71 Ca 0.08 -0.38 0.02 0.00 0.82 0.00 0.00 66.70 67.24 1u0m h VAL 71 Cb 0.44 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.12 1u0m h VAL 71 CO 0.02 0.20 -0.20 0.22 0.02 0.00 0.00 177.57 177.83 1u0m h TYR 72 N 1.11 -0.52 -0.22 1.57 5.03 -0.75 -0.80 116.97 122.39 1u0m h TYR 72 Ca 0.35 0.01 -0.13 0.00 2.58 0.00 0.00 58.73 61.54 1u0m h TYR 72 Cb 0.03 0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.52 1u0m h TYR 72 CO -0.00 -0.28 -0.42 1.05 -1.32 0.00 0.00 178.16 177.19 1u0m h GLU 73 N -0.35 0.53 -0.19 1.82 4.11 -1.11 -2.17 114.58 117.20 1u0m h GLU 73 Ca 0.04 -0.27 -0.01 0.00 0.07 0.00 0.00 59.36 59.19 1u0m h GLU 73 Cb 0.39 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1u0m h GLU 73 CO -0.13 0.85 0.09 -0.09 0.07 0.00 0.00 179.01 179.80 1u0m h ARG 74 N 0.43 0.28 0.00 1.06 2.43 -1.20 -1.24 114.38 116.15 1u0m h ARG 74 Ca 0.04 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 1u0m h ARG 74 Cb 0.91 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.40 1u0m h ARG 74 CO 0.08 0.32 -0.31 0.93 -1.51 0.00 0.00 179.97 179.48 1u0m h GLU 75 N 0.18 0.00 0.08 0.20 4.39 -1.10 -2.10 114.58 116.22 1u0m h GLU 75 Ca 0.07 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.52 1u0m h GLU 75 Cb 0.14 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1u0m h GLU 75 CO -0.01 0.31 -1.12 0.00 -1.16 0.00 0.00 179.01 177.03 1u0m h ALA 76 N 1.69 0.22 -0.30 3.43 0.00 -1.21 -2.59 119.26 120.49 1u0m h ALA 76 Ca -0.00 -0.83 -0.17 0.00 0.00 0.00 0.00 54.91 53.91 1u0m h ALA 76 Cb 0.57 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 1u0m h ALA 76 CO 0.04 0.95 -0.49 0.87 0.00 0.00 0.00 179.25 180.62 1u0m h LYS 77 N 0.11 0.82 -0.00 0.00 1.57 -0.98 -0.86 116.57 117.22 1u0m h LYS 77 Ca -0.10 -0.49 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 1u0m h LYS 77 Cb 1.82 0.04 0.00 0.00 0.08 0.00 0.00 32.23 34.17 1u0m h LYS 77 CO 0.18 1.12 -0.09 -1.13 -0.57 0.00 0.00 179.45 178.97 1u0m n SER 78 N -4.01 0.16 -0.01 0.86 3.41 -0.81 -4.39 113.62 108.82 1u0m n SER 78 Ca -0.03 0.02 -0.01 0.00 -0.26 0.00 0.00 58.87 58.58 1u0m n SER 78 Cb 0.59 -0.26 -0.01 0.00 -0.26 0.00 0.00 64.21 64.27 1u0m n SER 78 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1u0m n ARG 79 N -1.34 0.34 -0.04 4.33 1.74 -0.98 -4.84 116.66 115.88 1u0m n ARG 79 Ca 0.10 0.01 -0.08 0.00 -0.77 0.00 0.00 57.85 57.11 1u0m n ARG 79 Cb 0.30 -1.04 -0.02 0.00 -1.02 0.00 0.00 32.46 30.68 1u0m n ARG 79 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1u0m h VAL 80 N 0.00 0.61 -0.99 1.55 2.07 -1.36 -3.24 116.25 114.89 1u0m h VAL 80 Ca -0.05 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.59 1u0m h VAL 80 Cb 1.08 0.61 -0.13 0.00 -1.52 0.00 0.00 31.29 31.32 1u0m h VAL 80 CO -0.01 0.00 -0.51 -2.65 0.02 0.00 0.00 177.57 174.42 1u0m n PRO 81 N -5.29 -0.36 -0.14 1.57 -0.02 -1.26 -1.61 135.00 127.88 1u0m n PRO 81 Ca -0.01 1.51 -0.03 0.00 -2.02 0.00 0.00 63.50 62.95 1u0m n PRO 81 Cb 0.21 -2.23 0.04 0.00 -0.02 0.00 0.00 33.50 31.50 1u0m n PRO 81 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1u0m h ALA 82 N 0.83 0.40 -0.60 3.55 0.00 -1.90 -1.58 119.26 119.96 1u0m h ALA 82 Ca 0.23 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 1u0m h ALA 82 Cb 0.48 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1u0m h ALA 82 CO -0.95 -0.40 0.34 0.28 0.00 0.00 0.00 179.25 178.51 1u0m h VAL 83 N 0.09 1.19 -0.59 0.00 2.07 -1.40 -2.21 116.25 115.38 1u0m h VAL 83 Ca 0.23 -0.45 0.04 0.00 0.82 0.00 0.00 66.70 67.34 1u0m h VAL 83 Cb 0.34 0.40 -0.05 0.00 -1.52 0.00 0.00 31.29 30.47 1u0m h VAL 83 CO -0.40 0.20 0.33 0.40 0.02 0.00 0.00 177.57 178.12 1u0m h ILE 84 N 0.81 1.00 -0.01 4.57 2.04 -0.83 -2.62 117.51 122.46 1u0m h ILE 84 Ca 0.21 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1u0m h ILE 84 Cb 0.02 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1u0m h ILE 84 CO -0.04 0.12 -0.08 -0.61 0.00 0.00 0.00 178.15 177.54 1u0m h GLN 85 N 0.64 -0.09 -0.16 2.37 5.75 -0.70 -0.59 115.11 122.32 1u0m h GLN 85 Ca 0.26 0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.81 1u0m h GLN 85 Cb 0.12 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 1u0m h GLN 85 CO -0.15 -0.06 0.58 0.00 -2.65 0.00 0.00 178.83 176.55 1u0m h ARG 86 N -0.09 0.00 0.00 1.69 3.08 -1.37 0.97 114.38 118.66 1u0m h ARG 86 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 1u0m h ARG 86 Cb 0.10 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 1u0m h ARG 86 CO -0.06 0.00 -0.87 0.00 -1.07 0.00 0.00 179.97 177.97 1u0m h ALA 87 N 1.00 0.61 0.06 0.04 0.00 -0.75 -2.84 119.26 117.36 1u0m h ALA 87 Ca 0.08 -0.69 -0.08 0.00 0.00 0.00 0.00 54.91 54.22 1u0m h ALA 87 Cb 1.23 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.04 1u0m h ALA 87 CO -0.00 0.87 -0.36 -0.07 0.00 0.00 0.00 179.25 179.69 1u0m h LEU 88 N 0.00 0.22 -0.87 0.00 3.38 0.18 -2.93 115.31 115.29 1u0m h LEU 88 Ca -0.05 -0.96 0.14 0.00 0.09 0.00 0.00 57.88 57.10 1u0m h LEU 88 Cb 1.54 -0.07 -0.09 0.00 0.09 0.00 0.00 40.66 42.13 1u0m h LEU 88 CO 0.08 1.16 0.46 0.44 0.09 0.00 0.00 178.44 180.67 1u0m h ASP 89 N -0.69 0.59 -0.16 -0.43 3.32 -1.25 1.01 116.42 118.81 1u0m h ASP 89 Ca -0.06 0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 1u0m h ASP 89 Cb 1.26 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.79 1u0m h ASP 89 CO 0.07 0.26 -0.07 0.44 -1.72 0.00 0.00 179.24 178.22 1u0m h ASP 90 N 0.67 0.34 0.90 6.45 5.19 -1.59 -2.76 116.42 125.63 1u0m h ASP 90 Ca 0.46 -0.40 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 1u0m h ASP 90 Cb 0.63 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.04 1u0m h ASP 90 CO -0.34 0.67 0.00 0.00 -3.12 0.00 0.00 179.24 176.44 1u0m n ALA 91 N -2.37 2.14 -2.79 3.45 0.00 -0.86 -4.84 120.51 115.24 1u0m n ALA 91 Ca -0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 53.44 53.28 1u0m n ALA 91 Cb 0.29 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1u0m n ALA 91 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1u0m n GLU 92 N -1.57 -1.60 -3.76 0.00 1.02 0.34 -5.01 120.64 110.06 1u0m n GLU 92 Ca 0.06 1.64 -0.10 0.00 -0.02 0.00 0.00 57.16 58.74 1u0m n GLU 92 Cb 0.30 -5.23 -0.04 0.00 -0.02 0.00 0.00 31.44 26.45 1u0m n GLU 92 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1u0m s LEU 93 N -3.14 0.14 0.37 -4.62 2.01 -0.75 -5.02 118.68 107.68 1u0m s LEU 93 Ca 0.10 -0.52 0.08 0.00 0.01 0.00 0.00 54.13 53.80 1u0m s LEU 93 Cb -0.03 2.07 -0.04 0.00 0.01 0.00 0.00 46.19 48.21 1u0m s LEU 93 CO 0.67 -1.05 0.24 -1.48 1.01 0.00 0.00 176.35 175.74 1u0m s LEU 94 N -2.88 3.33 0.39 1.79 2.34 -1.26 -4.31 118.68 118.07 1u0m s LEU 94 Ca 0.10 -0.77 0.20 0.00 0.06 0.00 0.00 54.13 53.72 1u0m s LEU 94 Cb -0.01 -1.85 1.15 0.00 -0.56 0.00 0.00 46.19 44.92 1u0m s LEU 94 CO -0.02 -0.44 1.72 0.00 -1.06 0.00 0.00 176.35 176.55 1u0m h ALA 95 N 1.34 2.27 0.00 1.48 0.00 -1.89 -0.01 119.26 122.44 1u0m h ALA 95 Ca -0.43 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1u0m h ALA 95 Cb 1.26 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1u0m h ALA 95 CO 0.62 -0.75 0.00 2.41 0.00 0.00 0.00 179.25 181.53 1u0m n THR 96 N -4.71 0.00 0.67 0.00 -1.04 -1.26 -3.22 114.28 104.71 1u0m n THR 96 Ca 0.29 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.41 1u0m n THR 96 Cb 1.00 -0.45 0.14 0.00 -1.82 0.00 0.00 70.33 69.20 1u0m n THR 96 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1u0m n ASP 97 N -0.84 3.10 -4.70 8.00 8.00 -0.02 -4.84 116.55 125.25 1u0m n ASP 97 Ca 0.13 -1.96 -0.37 0.00 0.71 0.00 0.00 54.79 53.30 1u0m n ASP 97 Cb 0.06 -0.10 -0.08 0.00 -0.02 0.00 0.00 41.12 40.98 1u0m n ASP 97 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1u0m s ILE 98 N -1.70 5.30 -0.14 0.53 -1.09 -1.20 -4.07 121.20 118.83 1u0m s ILE 98 Ca 0.31 0.48 0.20 0.00 -2.23 0.00 0.00 60.65 59.41 1u0m s ILE 98 Cb 0.20 -3.61 -0.16 0.00 -1.58 0.00 0.00 42.46 37.31 1u0m s ILE 98 CO 0.29 0.35 0.72 0.47 -1.23 0.00 0.00 174.94 175.55 1u0m n ASP 99 N 3.93 0.51 -3.74 3.58 9.92 0.76 -4.73 116.55 126.78 1u0m n ASP 99 Ca -0.12 0.21 -0.12 0.00 -0.53 0.00 0.00 54.79 54.23 1u0m n ASP 99 Cb 0.52 0.90 -0.13 0.00 -0.64 0.00 0.00 41.12 41.77 1u0m n ASP 99 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1u0m s VAL 100 N -3.22 -0.03 -0.13 2.53 0.11 -1.24 -1.27 120.40 117.15 1u0m s VAL 100 Ca -0.04 0.11 -0.06 0.00 -2.93 0.00 0.00 61.98 59.05 1u0m s VAL 100 Cb 0.10 -0.40 -0.04 0.00 -1.53 0.00 0.00 36.38 34.52 1u0m s VAL 100 CO 0.84 0.05 0.10 -0.63 -3.33 0.00 0.00 175.10 172.12 1u0m s ILE 101 N 1.03 5.18 -0.34 7.04 1.01 0.93 -1.07 121.20 134.98 1u0m s ILE 101 Ca -0.07 0.09 0.02 0.00 0.00 0.00 0.00 60.65 60.69 1u0m s ILE 101 Cb -0.08 -3.26 0.10 0.00 0.01 0.00 0.00 42.46 39.23 1u0m s ILE 101 CO -0.07 0.58 0.08 -0.63 0.00 0.00 0.00 174.94 174.90 1u0m s ILE 102 N -0.70 1.80 -0.33 2.92 1.01 0.34 -0.66 121.20 125.58 1u0m s ILE 102 Ca 0.13 -2.08 -0.13 0.00 0.00 0.00 0.00 60.65 58.57 1u0m s ILE 102 Cb -0.12 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 40.00 1u0m s ILE 102 CO 0.03 -0.64 0.24 -0.47 0.00 0.00 0.00 174.94 174.09 1u0m s TYR 103 N 1.07 3.23 -0.11 3.97 5.04 -0.99 -1.04 117.35 128.52 1u0m s TYR 103 Ca 0.11 -0.15 0.02 0.00 -2.44 0.00 0.00 57.07 54.61 1u0m s TYR 103 Cb -0.19 -2.47 -0.01 0.00 0.35 0.00 0.00 41.96 39.64 1u0m s TYR 103 CO -0.13 -0.33 -0.18 0.14 -1.34 0.00 0.00 175.55 173.71 1u0m s VAL 104 N 1.75 2.65 -0.28 3.14 -7.23 -0.11 -1.60 120.40 118.72 1u0m s VAL 104 Ca 0.07 -0.82 -0.21 0.00 -1.81 0.00 0.00 61.98 59.21 1u0m s VAL 104 Cb -0.17 -2.07 0.11 0.00 0.56 0.00 0.00 36.38 34.82 1u0m s VAL 104 CO 0.11 0.55 0.92 -0.55 -0.31 0.00 0.00 175.10 175.81 1u0m s SER 105 N 0.20 -0.59 0.00 4.85 0.15 -1.15 -1.85 113.70 115.31 1u0m s SER 105 Ca -0.11 1.04 0.00 0.00 0.70 0.00 0.00 55.95 57.58 1u0m s SER 105 Cb -0.16 1.14 0.00 0.00 -1.71 0.00 0.00 66.02 65.29 1u0m s SER 105 CO 0.06 -0.17 0.77 0.00 1.20 0.00 0.00 173.24 175.10 1u0m n THR 107 N -0.29 0.41 -3.71 0.00 -2.24 -1.26 -4.95 114.28 102.24 1u0m n THR 107 Ca 0.00 -0.60 -0.01 0.00 -2.27 0.00 0.00 64.05 61.17 1u0m n THR 107 Cb 0.25 0.71 -0.01 0.00 -2.10 0.00 0.00 70.33 69.19 1u0m n THR 107 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1u0m s GLY 108 N -1.48 -0.30 -0.03 3.38 0.00 -1.26 -4.74 107.32 102.90 1u0m s GLY 108 Ca 0.36 0.33 -0.00 0.00 0.00 0.00 0.00 44.72 45.41 1u0m s GLY 108 CO 0.29 0.10 0.03 -0.12 0.00 0.00 0.00 173.10 173.39 1u0m s PHE 109 N -2.94 0.14 -0.07 1.90 2.19 -1.26 -5.01 117.98 112.94 1u0m s PHE 109 Ca 0.13 0.11 -0.08 0.00 0.33 0.00 0.00 56.93 57.42 1u0m s PHE 109 Cb 0.01 -0.37 0.02 0.00 -1.31 0.00 0.00 43.02 41.37 1u0m s PHE 109 CO -0.00 -0.14 0.22 0.00 1.83 0.00 0.00 175.22 177.13 1u0m s MET 110 N 1.37 0.32 -0.08 10.12 0.23 -1.26 -5.06 119.30 124.93 1u0m s MET 110 Ca -0.05 0.19 -0.01 0.00 -1.03 0.00 0.00 55.69 54.79 1u0m s MET 110 Cb -0.13 0.15 0.03 0.00 -1.53 0.00 0.00 34.83 33.35 1u0m s MET 110 CO -0.03 -0.05 -0.01 1.41 -2.03 0.00 0.00 175.02 174.31 1u0m s MET 111 N -0.15 0.78 0.97 3.16 0.00 -1.26 -3.22 119.30 119.58 1u0m s MET 111 Ca -0.03 0.03 -0.12 0.00 0.00 0.00 0.00 55.69 55.58 1u0m s MET 111 Cb -0.03 -1.07 0.17 0.00 0.00 0.00 0.00 34.83 33.91 1u0m s MET 111 CO 0.01 -0.28 1.08 -2.14 0.00 0.00 0.00 175.02 173.69 1u0m s PRO 112 N 1.87 0.61 1.11 4.11 0.02 -1.26 -5.14 135.00 136.32 1u0m s PRO 112 Ca 0.04 0.88 -0.19 0.00 0.02 0.00 0.00 61.00 61.76 1u0m s PRO 112 Cb -0.12 -1.73 0.26 0.00 0.02 0.00 0.00 34.50 32.93 1u0m s PRO 112 CO -0.05 -2.70 1.24 -1.54 -0.33 0.00 0.00 177.00 173.61 1u0m s SER 113 N -3.12 1.73 0.57 2.53 1.04 -1.20 -4.91 113.70 110.35 1u0m s SER 113 Ca 0.65 0.34 0.30 0.00 0.48 0.00 0.00 55.95 57.72 1u0m s SER 113 Cb -0.20 -0.39 1.73 0.00 0.10 0.00 0.00 66.02 67.26 1u0m s SER 113 CO 0.59 -3.59 2.19 -0.07 0.98 0.00 0.00 173.24 173.33 1u0m h LEU 114 N -2.23 0.00 -0.77 2.42 3.38 -1.98 -3.20 115.31 112.93 1u0m h LEU 114 Ca -0.43 0.00 0.18 0.00 0.09 0.00 0.00 57.88 57.72 1u0m h LEU 114 Cb 1.25 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.87 1u0m h LEU 114 CO 0.31 0.05 0.08 0.71 0.09 0.00 0.00 178.44 179.67 1u0m h THR 115 N 0.00 0.37 -0.13 0.22 1.35 -1.98 0.16 112.91 112.89 1u0m h THR 115 Ca -0.00 -0.05 0.02 0.00 -0.55 0.00 0.00 66.41 65.83 1u0m h THR 115 Cb 0.15 0.20 -0.02 0.00 -1.73 0.00 0.00 68.15 66.75 1u0m h THR 115 CO 0.01 0.03 0.01 0.00 -0.25 0.00 0.00 175.52 175.32 1u0m h ALA 116 N 1.70 0.12 -0.04 6.62 0.00 -1.92 -0.09 119.26 125.65 1u0m h ALA 116 Ca 0.44 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.31 1u0m h ALA 116 Cb 0.79 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1u0m h ALA 116 CO -0.64 -0.44 -0.28 2.35 0.00 0.00 0.00 179.25 180.25 1u0m h TRP 117 N 0.06 0.08 -0.27 0.00 7.01 -1.44 -2.42 115.95 118.98 1u0m h TRP 117 Ca 0.06 -0.01 -0.14 0.00 2.11 0.00 0.00 58.89 60.91 1u0m h TRP 117 Cb 0.06 -0.02 -0.00 0.00 -2.10 0.00 0.00 29.16 27.10 1u0m h TRP 117 CO -0.13 0.35 -0.38 -0.07 -2.79 0.00 0.00 178.44 175.41 1u0m h LEU 118 N 0.07 0.80 -0.59 0.65 3.38 -0.13 -1.64 115.31 117.85 1u0m h LEU 118 Ca 0.01 -0.51 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 1u0m h LEU 118 Cb 0.53 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1u0m h LEU 118 CO 0.04 1.15 0.28 0.40 0.09 0.00 0.00 178.44 180.39 1u0m h ILE 119 N 0.47 1.21 -0.08 1.22 2.04 -0.80 0.28 117.51 121.85 1u0m h ILE 119 Ca 0.03 -0.61 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 1u0m h ILE 119 Cb 0.97 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1u0m h ILE 119 CO 0.09 0.24 0.04 0.78 0.00 0.00 0.00 178.15 179.31 1u0m h ASN 120 N 0.80 0.10 0.14 1.72 4.21 -1.38 -2.02 115.58 119.14 1u0m h ASN 120 Ca 0.20 -0.07 -0.28 0.00 1.21 0.00 0.00 56.30 57.36 1u0m h ASN 120 Cb 0.13 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 37.31 1u0m h ASN 120 CO -0.02 0.14 -1.38 -0.33 -1.29 0.00 0.00 177.43 174.55 1u0m h GLU 121 N 0.05 0.29 0.00 0.81 3.07 -1.21 -3.33 114.58 114.26 1u0m h GLU 121 Ca 0.03 -0.50 0.00 0.00 -0.50 0.00 0.00 59.36 58.39 1u0m h GLU 121 Cb 0.06 0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1u0m h GLU 121 CO -0.00 1.24 0.00 -0.12 -1.40 0.00 0.00 179.01 178.72 1u0m n MET 122 N -3.89 0.60 -2.27 2.33 1.56 0.98 -4.86 117.12 111.58 1u0m n MET 122 Ca -0.23 0.02 -0.14 0.00 -0.27 0.00 0.00 57.70 57.08 1u0m n MET 122 Cb 0.93 -1.50 -0.01 0.00 2.15 0.00 0.00 33.22 34.79 1u0m n MET 122 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1u0m n GLY 123 N 0.47 -0.22 3.58 -5.12 0.00 -1.07 -4.79 105.19 98.04 1u0m n GLY 123 Ca 0.15 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.60 1u0m n GLY 123 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1u0m s PHE 124 N -2.71 1.45 0.15 1.61 0.08 -0.78 -4.56 117.98 113.21 1u0m s PHE 124 Ca 0.00 0.90 -0.31 0.00 0.12 0.00 0.00 56.93 57.64 1u0m s PHE 124 Cb 0.00 -3.23 -0.11 0.00 -0.57 0.00 0.00 43.02 39.11 1u0m s PHE 124 CO 0.00 -3.50 1.76 -0.51 -0.10 0.00 0.00 175.22 172.87 1u0m s ASP 125 N -3.27 6.44 0.00 1.36 1.11 -1.26 -4.81 116.67 116.24 1u0m s ASP 125 Ca 0.67 2.76 0.05 0.00 0.18 0.00 0.00 52.55 56.21 1u0m s ASP 125 Cb -0.18 -2.58 0.27 0.00 1.07 0.00 0.00 42.92 41.50 1u0m s ASP 125 CO 0.59 -0.97 0.66 -0.24 1.18 0.00 0.00 175.17 176.39 1u0m n SER 126 N 5.00 0.00 -0.13 0.27 2.88 -1.26 -0.76 113.62 119.62 1u0m n SER 126 Ca 0.17 -0.26 0.02 0.00 -1.33 0.00 0.00 58.87 57.47 1u0m n SER 126 Cb 0.37 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.84 1u0m n SER 126 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1u0m n THR 127 N -0.85 0.00 -1.69 2.46 -2.24 -1.26 -5.04 114.28 105.65 1u0m n THR 127 Ca 0.03 -0.49 -0.44 0.00 -2.27 0.00 0.00 64.05 60.89 1u0m n THR 127 Cb 0.02 1.07 -0.03 0.00 -2.10 0.00 0.00 70.33 69.28 1u0m n THR 127 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1u0m n THR 128 N 0.00 0.43 -2.84 4.28 -1.04 0.06 -4.95 114.28 110.23 1u0m n THR 128 Ca 0.02 -0.11 -0.40 0.00 -2.04 0.00 0.00 64.05 61.53 1u0m n THR 128 Cb 0.09 -1.68 -0.06 0.00 -1.82 0.00 0.00 70.33 66.86 1u0m n THR 128 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1u0m s ARG 129 N 0.36 4.74 -0.15 -2.82 1.81 -0.40 -4.89 118.95 117.60 1u0m s ARG 129 Ca 0.73 1.36 -0.06 0.00 -1.72 0.00 0.00 55.73 56.04 1u0m s ARG 129 Cb -0.60 -3.24 -0.04 0.00 -0.45 0.00 0.00 34.95 30.62 1u0m s ARG 129 CO 0.42 0.52 0.05 -0.65 -0.68 0.00 0.00 175.30 174.96 1u0m s GLN 130 N -1.23 3.70 -0.49 3.54 -0.21 -1.26 -0.05 119.66 123.66 1u0m s GLN 130 Ca 0.40 -0.35 0.04 0.00 0.02 0.00 0.00 55.36 55.47 1u0m s GLN 130 Cb -0.24 -3.10 0.16 0.00 1.00 0.00 0.00 33.01 30.83 1u0m s GLN 130 CO 0.29 0.41 0.36 0.42 -2.12 0.00 0.00 175.29 174.65 1u0m s ILE 131 N -0.04 1.14 -0.13 1.08 1.01 0.16 -4.95 121.20 119.48 1u0m s ILE 131 Ca 0.06 -2.99 -0.23 0.00 0.00 0.00 0.00 60.65 57.48 1u0m s ILE 131 Cb -0.12 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 1u0m s ILE 131 CO 0.01 -1.11 0.71 -2.16 0.00 0.00 0.00 174.94 172.39 1u0m s PRO 132 N -0.22 4.34 -0.21 2.79 0.04 -1.26 -2.36 135.00 138.13 1u0m s PRO 132 Ca 0.28 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.16 1u0m s PRO 132 Cb -0.04 -3.51 0.05 0.00 0.04 0.00 0.00 34.50 31.04 1u0m s PRO 132 CO -0.15 -0.11 -0.06 0.42 0.04 0.00 0.00 177.00 177.15 1u0m s ILE 133 N 1.42 1.38 -1.12 0.56 1.01 -0.63 -4.98 121.20 118.84 1u0m s ILE 133 Ca 0.35 -0.99 0.15 0.00 0.00 0.00 0.00 60.65 60.17 1u0m s ILE 133 Cb -0.17 -1.60 -0.06 0.00 0.01 0.00 0.00 42.46 40.63 1u0m s ILE 133 CO 0.15 0.00 0.74 0.00 0.00 0.00 0.00 174.94 175.83 1u0m n ALA 134 N 4.75 3.43 -1.15 9.38 0.00 -1.26 -2.94 120.51 132.73 1u0m n ALA 134 Ca -0.12 -0.48 -0.04 0.00 0.00 0.00 0.00 53.44 52.80 1u0m n ALA 134 Cb 0.46 -0.53 0.26 0.00 0.00 0.00 0.00 19.45 19.63 1u0m n ALA 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1u0m n GLN 135 N -0.61 2.96 -0.01 0.00 6.02 -1.26 -4.25 117.38 120.23 1u0m n GLN 135 Ca 0.05 -3.05 0.00 0.00 -0.01 0.00 0.00 57.00 53.99 1u0m n GLN 135 Cb 0.28 -2.04 0.01 0.00 1.02 0.00 0.00 30.24 29.51 1u0m n GLN 135 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1u0m n LEU 136 N -0.56 1.79 0.00 1.08 4.77 -1.26 -4.92 117.00 117.89 1u0m n LEU 136 Ca 0.37 -1.73 0.00 0.00 -0.03 0.00 0.00 56.01 54.62 1u0m n LEU 136 Cb 1.23 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 42.31 1u0m n LEU 136 CO 0.33 0.44 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 1u0m n GLY 137 N -0.31 1.95 0.17 -0.72 0.00 -1.26 -1.16 105.19 103.86 1u0m n GLY 137 Ca 0.01 0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1u0m n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u0m n ALA 139 N -1.79 3.77 0.20 0.00 0.00 -0.30 -3.91 120.51 118.48 1u0m n ALA 139 Ca -0.01 -0.43 0.11 0.00 0.00 0.00 0.00 53.44 53.11 1u0m n ALA 139 Cb 0.06 -0.98 0.66 0.00 0.00 0.00 0.00 19.45 19.19 1u0m n ALA 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u0m h ALA 140 N 2.81 2.12 0.87 0.00 0.00 -0.68 -1.89 119.26 122.49 1u0m h ALA 140 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1u0m h ALA 140 Cb 0.60 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1u0m h ALA 140 CO 0.00 -0.16 -0.47 0.78 0.00 0.00 0.00 179.25 179.39 1u0m h GLY 141 N 0.00 -1.34 0.84 0.00 0.00 -1.76 0.24 103.07 101.06 1u0m h GLY 141 Ca 0.06 0.53 0.04 0.00 0.00 0.00 0.00 47.33 47.96 1u0m h GLY 141 CO -0.00 -0.47 0.63 -1.33 0.00 0.00 0.00 176.54 175.37 1u0m h GLY 142 N -1.24 1.42 1.44 4.60 0.00 -1.78 -1.89 103.07 105.62 1u0m h GLY 142 Ca -0.12 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 1u0m h GLY 142 CO 0.16 0.39 0.27 0.00 0.00 0.00 0.00 176.54 177.36 1u0m h ALA 143 N 1.41 1.48 -0.35 3.60 0.00 -1.16 -0.29 119.26 123.94 1u0m h ALA 143 Ca 0.39 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 1u0m h ALA 143 Cb 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1u0m h ALA 143 CO -0.13 0.42 0.10 0.00 0.00 0.00 0.00 179.25 179.64 1u0m h ALA 144 N 1.56 0.46 0.67 0.00 0.00 -0.15 -1.37 119.26 120.43 1u0m h ALA 144 Ca 0.19 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1u0m h ALA 144 Cb 0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1u0m h ALA 144 CO -0.03 0.12 -0.49 0.82 0.00 0.00 0.00 179.25 179.67 1u0m h ILE 145 N 0.42 0.04 -0.38 0.00 2.04 -0.97 0.10 117.51 118.76 1u0m h ILE 145 Ca 0.11 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.08 1u0m h ILE 145 Cb 0.28 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.38 1u0m h ILE 145 CO -0.00 0.00 0.51 0.78 0.00 0.00 0.00 178.15 179.43 1u0m h ASN 146 N -1.11 0.00 0.00 1.72 2.35 -0.96 0.32 115.58 117.90 1u0m h ASN 146 Ca -0.09 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.55 1u0m h ASN 146 Cb 0.91 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.27 1u0m h ASN 146 CO 0.04 0.00 -0.60 0.03 -1.65 0.00 0.00 177.43 175.25 1u0m h ARG 147 N 0.00 0.00 -0.65 0.81 2.47 -0.18 -2.24 114.38 114.59 1u0m h ARG 147 Ca 0.18 0.00 0.14 0.00 -1.26 0.00 0.00 59.98 59.04 1u0m h ARG 147 Cb 1.19 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.47 1u0m h ARG 147 CO -0.00 0.98 0.44 0.00 0.56 0.00 0.00 179.97 181.96 1u0m h ALA 148 N -0.25 2.25 0.23 0.04 0.00 0.11 0.12 119.26 121.75 1u0m h ALA 148 Ca -0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1u0m h ALA 148 Cb 1.13 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1u0m h ALA 148 CO -0.10 -0.42 -0.11 1.25 0.00 0.00 0.00 179.25 179.87 1u0m h HIS 149 N 0.26 -0.28 -1.07 0.00 -0.00 -1.06 -1.84 115.15 111.16 1u0m h HIS 149 Ca 0.31 -0.01 0.34 0.00 -0.00 0.00 0.00 60.37 61.01 1u0m h HIS 149 Cb 0.87 0.09 -0.14 0.00 -0.00 0.00 0.00 27.41 28.23 1u0m h HIS 149 CO -0.00 -0.18 0.64 -0.44 -0.00 0.00 0.00 177.93 177.95 1u0m h ASP 150 N -0.44 0.46 0.33 3.26 5.19 -0.83 0.18 116.42 124.57 1u0m h ASP 150 Ca -0.03 0.17 -0.02 0.00 -0.62 0.00 0.00 57.03 56.53 1u0m h ASP 150 Cb 0.23 0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.86 1u0m h ASP 150 CO 0.05 -0.11 -0.16 0.15 -3.12 0.00 0.00 179.24 176.05 1u0m h PHE 151 N 0.29 -0.42 -0.81 4.55 3.57 -0.76 -2.61 116.94 120.75 1u0m h PHE 151 Ca 0.73 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 62.28 1u0m h PHE 151 Cb 1.82 0.14 -0.06 0.00 2.79 0.00 0.00 35.95 40.64 1u0m h PHE 151 CO -0.01 -0.15 0.50 0.00 -2.23 0.00 0.00 178.31 176.42 1u0m h THR 153 N 0.91 1.22 0.00 0.00 1.03 -1.21 0.18 112.91 115.04 1u0m h THR 153 Ca 0.36 -0.43 -0.01 0.00 -0.01 0.00 0.00 66.41 66.31 1u0m h THR 153 Cb 0.17 0.03 -0.00 0.00 -1.07 0.00 0.00 68.15 67.27 1u0m h THR 153 CO -0.17 0.22 -0.06 0.00 -0.01 0.00 0.00 175.52 175.50 1u0m h ALA 154 N 1.46 0.99 -2.12 0.00 0.00 -0.76 -3.34 119.26 115.48 1u0m h ALA 154 Ca 0.30 -0.06 -0.50 0.00 0.00 0.00 0.00 54.91 54.65 1u0m h ALA 154 Cb -0.09 -0.01 -0.34 0.00 0.00 0.00 0.00 17.79 17.35 1u0m h ALA 154 CO -0.06 0.08 -0.87 0.71 0.00 0.00 0.00 179.25 179.11 1u0m s TYR 155 N -3.49 0.52 0.44 0.00 2.02 -0.22 -5.04 117.35 111.58 1u0m s TYR 155 Ca 0.03 -1.89 0.30 0.00 -0.37 0.00 0.00 57.07 55.14 1u0m s TYR 155 Cb 0.08 -0.67 1.43 0.00 -0.40 0.00 0.00 41.96 42.39 1u0m s TYR 155 CO 0.61 -0.91 1.62 -1.35 -1.57 0.00 0.00 175.55 173.94 1u0m h PRO 156 N 5.72 0.08 -0.64 -1.71 0.11 -0.83 0.23 132.00 134.95 1u0m h PRO 156 Ca 0.21 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1u0m h PRO 156 Cb 0.96 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1u0m h PRO 156 CO 0.29 0.05 0.00 0.39 -0.21 0.00 0.00 178.00 178.52 1u0m n GLU 157 N -4.70 3.88 -3.35 1.05 -0.58 -1.26 -3.80 120.64 111.88 1u0m n GLU 157 Ca 0.37 -2.56 -0.38 0.00 -0.42 0.00 0.00 57.16 54.17 1u0m n GLU 157 Cb 1.44 -2.00 -0.06 0.00 -0.57 0.00 0.00 31.44 30.24 1u0m n GLU 157 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1u0m s ALA 158 N -2.19 3.62 -0.17 0.62 0.00 0.82 -4.76 121.76 119.70 1u0m s ALA 158 Ca 0.45 -0.05 -0.01 0.00 0.00 0.00 0.00 51.96 52.34 1u0m s ALA 158 Cb 0.32 -2.55 -0.01 0.00 0.00 0.00 0.00 23.12 20.88 1u0m s ALA 158 CO 0.17 0.42 -0.10 -0.80 0.00 0.00 0.00 175.76 175.44 1u0m s ASN 159 N -1.06 4.05 0.05 0.00 0.02 -1.26 -2.85 114.94 113.89 1u0m s ASN 159 Ca 0.27 -0.38 0.04 0.00 -1.02 0.00 0.00 52.86 51.77 1u0m s ASN 159 Cb -0.18 -1.65 -0.04 0.00 0.02 0.00 0.00 41.25 39.40 1u0m s ASN 159 CO 0.17 0.08 -0.00 0.00 0.02 0.00 0.00 177.10 177.37 1u0m s ALA 160 N 0.86 3.28 -0.24 0.60 0.00 -1.07 -0.17 121.76 125.02 1u0m s ALA 160 Ca -0.03 -1.05 -0.03 0.00 0.00 0.00 0.00 51.96 50.85 1u0m s ALA 160 Cb -0.15 -1.25 0.01 0.00 0.00 0.00 0.00 23.12 21.74 1u0m s ALA 160 CO 0.00 0.68 -0.04 -1.17 0.00 0.00 0.00 175.76 175.23 1u0m s LEU 161 N -2.00 3.13 -0.25 0.00 2.96 -0.23 -1.34 118.68 120.95 1u0m s LEU 161 Ca 0.23 -0.69 -0.12 0.00 -0.22 0.00 0.00 54.13 53.34 1u0m s LEU 161 Cb -0.12 -1.71 -0.05 0.00 0.50 0.00 0.00 46.19 44.82 1u0m s LEU 161 CO 0.15 -0.10 0.21 -0.63 -1.32 0.00 0.00 176.35 174.67 1u0m s ILE 162 N 1.39 5.31 -0.11 6.68 1.01 0.49 -0.50 121.20 135.47 1u0m s ILE 162 Ca 0.03 0.26 0.02 0.00 0.00 0.00 0.00 60.65 60.96 1u0m s ILE 162 Cb -0.16 -3.55 0.01 0.00 0.01 0.00 0.00 42.46 38.78 1u0m s ILE 162 CO -0.04 0.29 -0.16 -0.69 0.00 0.00 0.00 174.94 174.34 1u0m s VAL 163 N 1.38 1.58 -0.17 2.92 1.01 -0.20 -0.19 120.40 126.73 1u0m s VAL 163 Ca 0.09 -0.69 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 1u0m s VAL 163 Cb -0.15 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.80 1u0m s VAL 163 CO 0.07 0.46 -0.14 0.00 0.00 0.00 0.00 175.10 175.49 1u0m s ALA 164 N 0.95 2.52 -0.19 5.51 0.00 0.52 -0.94 121.76 130.14 1u0m s ALA 164 Ca -0.07 -1.10 -0.00 0.00 0.00 0.00 0.00 51.96 50.79 1u0m s ALA 164 Cb -0.15 -1.30 0.05 0.00 0.00 0.00 0.00 23.12 21.72 1u0m s ALA 164 CO -0.02 -0.16 -0.05 0.00 0.00 0.00 0.00 175.76 175.54 1u0m s GLU 166 N 1.57 0.96 -0.76 0.00 0.41 -0.46 -4.40 118.70 116.02 1u0m s GLU 166 Ca -0.01 -0.30 0.03 0.00 -0.41 0.00 0.00 54.97 54.28 1u0m s GLU 166 Cb -0.17 -1.73 0.26 0.00 -1.78 0.00 0.00 34.13 30.72 1u0m s GLU 166 CO -0.07 -0.45 0.93 1.19 -0.49 0.00 0.00 175.26 176.36 1u0m n PHE 167 N 5.01 3.32 0.27 1.61 0.99 -1.26 -0.67 117.46 126.72 1u0m n PHE 167 Ca -0.10 -3.77 0.13 0.00 -0.00 0.00 0.00 57.45 53.71 1u0m n PHE 167 Cb 0.48 -0.76 0.80 0.00 -1.00 0.00 0.00 39.48 39.00 1u0m n PHE 167 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1u0m h SER 169 N 0.00 0.00 -0.02 0.00 4.64 -1.87 -0.73 113.55 115.57 1u0m h SER 169 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1u0m h SER 169 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1u0m h SER 169 CO -0.00 0.02 0.00 0.18 -0.87 0.00 0.00 176.83 176.16 1u0m n LEU 170 N -3.55 0.13 -0.13 5.97 7.99 -0.12 -2.63 117.00 124.67 1u0m n LEU 170 Ca -0.03 -0.06 0.06 0.00 -0.01 0.00 0.00 56.01 55.97 1u0m n LEU 170 Cb 0.10 -0.01 0.09 0.00 -0.11 0.00 0.00 43.42 43.49 1u0m n LEU 170 CO 0.25 0.03 0.55 0.00 -1.51 0.00 0.00 177.39 176.72 1u0m s TYR 172 N -1.99 3.06 -0.39 0.00 5.04 -1.08 -4.80 117.35 117.18 1u0m s TYR 172 Ca 0.19 0.93 0.03 0.00 -2.44 0.00 0.00 57.07 55.78 1u0m s TYR 172 Cb 0.16 -3.64 0.11 0.00 0.35 0.00 0.00 41.96 38.94 1u0m s TYR 172 CO 0.03 -2.27 0.13 -0.65 -1.34 0.00 0.00 175.55 171.45 1u0m s GLN 173 N 1.81 1.49 0.48 4.97 -1.52 -1.26 -4.96 119.66 120.67 1u0m s GLN 173 Ca 0.63 -1.98 0.33 0.00 -1.95 0.00 0.00 55.36 52.40 1u0m s GLN 173 Cb -0.33 -2.98 1.45 0.00 -0.22 0.00 0.00 33.01 30.93 1u0m s GLN 173 CO 0.28 -1.01 1.70 -1.35 -0.25 0.00 0.00 175.29 174.66 1u0m h PRO 174 N 7.30 0.11 -0.00 2.91 0.11 -1.94 0.14 132.00 140.62 1u0m h PRO 174 Ca -0.06 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.97 1u0m h PRO 174 Cb 0.98 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1u0m h PRO 174 CO 0.55 0.07 -0.33 1.79 -0.21 0.00 0.00 178.00 179.88 1u0m h THR 175 N 0.11 1.24 -2.88 -1.15 1.35 -2.00 -3.41 112.91 106.16 1u0m h THR 175 Ca 0.71 -1.13 -0.56 0.00 -0.55 0.00 0.00 66.41 64.88 1u0m h THR 175 Cb 2.45 1.60 -0.04 0.00 -1.73 0.00 0.00 68.15 70.43 1u0m h THR 175 CO -0.19 0.32 1.18 -1.81 -0.25 0.00 0.00 175.52 174.76 1u0m s ASP 176 N -6.95 6.05 0.00 5.36 -0.00 0.49 -4.85 116.67 116.77 1u0m s ASP 176 Ca -0.03 0.89 0.14 0.00 -0.00 0.00 0.00 52.55 53.55 1u0m s ASP 176 Cb 0.15 -2.53 0.23 0.00 -0.00 0.00 0.00 42.92 40.76 1u0m s ASP 176 CO 0.72 -1.65 1.11 0.18 -0.00 0.00 0.00 175.17 175.52 1u0m n LEU 177 N 9.81 2.60 -4.80 1.23 4.77 -1.26 -4.67 117.00 124.67 1u0m n LEU 177 Ca 0.19 -1.44 -0.33 0.00 -0.03 0.00 0.00 56.01 54.40 1u0m n LEU 177 Cb 0.48 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.44 1u0m n LEU 177 CO 0.70 0.57 0.72 -0.83 -1.33 0.00 0.00 177.39 177.22 1u0m s GLY 178 N -1.09 2.30 0.50 -0.72 0.00 -1.26 -4.86 107.32 102.18 1u0m s GLY 178 Ca 0.22 0.50 0.18 0.00 0.00 0.00 0.00 44.72 45.62 1u0m s GLY 178 CO 0.18 0.82 2.05 -0.39 0.00 0.00 0.00 173.10 175.77 1u0m h VAL 179 N 0.90 0.90 -0.35 1.40 -1.51 -1.95 0.04 116.25 115.67 1u0m h VAL 179 Ca -0.48 -0.05 -0.01 0.00 -1.23 0.00 0.00 66.70 64.94 1u0m h VAL 179 Cb 1.22 0.75 -0.02 0.00 -2.13 0.00 0.00 31.29 31.11 1u0m h VAL 179 CO 0.58 0.02 0.20 1.23 -1.23 0.00 0.00 177.57 178.38 1u0m h GLY 180 N 0.14 0.52 0.89 5.19 0.00 -1.92 -0.20 103.07 107.68 1u0m h GLY 180 Ca 0.16 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1u0m h GLY 180 CO -0.02 0.22 -0.12 1.76 0.00 0.00 0.00 176.54 178.39 1u0m h SER 181 N 0.45 -0.30 -0.89 0.19 0.02 -1.36 -1.18 113.55 110.49 1u0m h SER 181 Ca 0.13 0.03 0.17 0.00 -0.84 0.00 0.00 61.79 61.28 1u0m h SER 181 Cb 0.04 0.10 -0.10 0.00 0.14 0.00 0.00 62.40 62.58 1u0m h SER 181 CO -0.02 -0.18 0.46 -0.07 -1.14 0.00 0.00 176.83 175.87 1u0m h LEU 182 N -0.27 0.52 0.81 5.07 4.07 -1.10 0.36 115.31 124.77 1u0m h LEU 182 Ca -0.00 0.11 -0.04 0.00 0.08 0.00 0.00 57.88 58.03 1u0m h LEU 182 Cb 0.25 0.03 -0.00 0.00 1.08 0.00 0.00 40.66 42.02 1u0m h LEU 182 CO -0.01 0.17 -0.49 -0.07 -1.08 0.00 0.00 178.44 176.96 1u0m h LEU 183 N 0.59 -1.24 -1.33 1.67 -0.00 -0.28 -2.75 115.31 111.97 1u0m h LEU 183 Ca 0.51 0.07 0.24 0.00 -0.00 0.00 0.00 57.88 58.70 1u0m h LEU 183 Cb 0.80 0.36 -0.09 0.00 -0.00 0.00 0.00 40.66 41.73 1u0m h LEU 183 CO -0.41 -0.76 0.64 0.00 -0.00 0.00 0.00 178.44 177.91 1u0m h ASN 185 N 0.46 0.00 -0.02 0.00 2.35 -0.67 -2.11 115.58 115.59 1u0m h ASN 185 Ca 0.57 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 1u0m h ASN 185 Cb 1.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.70 1u0m h ASN 185 CO -0.29 0.00 -0.26 0.61 -1.65 0.00 0.00 177.43 175.84 1u0m n GLY 186 N -0.40 0.16 0.29 2.83 0.00 0.11 -4.70 105.19 103.47 1u0m n GLY 186 Ca 0.01 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.33 1u0m n GLY 186 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1u0m n LEU 187 N 0.30 2.01 -4.79 0.99 7.94 -0.82 -4.93 117.00 117.69 1u0m n LEU 187 Ca 0.09 0.09 -0.36 0.00 -1.11 0.00 0.00 56.01 54.72 1u0m n LEU 187 Cb 0.42 -0.57 -0.07 0.00 0.53 0.00 0.00 43.42 43.74 1u0m n LEU 187 CO 0.19 0.55 0.65 -0.36 -1.11 0.00 0.00 177.39 177.32 1u0m s PHE 188 N -2.34 3.61 0.24 1.96 0.40 -1.03 0.12 117.98 120.94 1u0m s PHE 188 Ca -0.25 1.75 0.04 0.00 -0.60 0.00 0.00 56.93 57.87 1u0m s PHE 188 Cb 0.08 -2.91 -0.01 0.00 0.51 0.00 0.00 43.02 40.69 1u0m s PHE 188 CO 0.35 0.14 0.13 0.41 0.70 0.00 0.00 175.22 176.96 1u0m n GLY 189 N 0.31 3.45 3.61 4.36 0.00 0.06 -4.74 105.19 112.24 1u0m n GLY 189 Ca 0.03 -1.94 -0.34 0.00 0.00 0.00 0.00 46.02 43.77 1u0m n GLY 189 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1u0m s ASP 190 N -2.54 4.95 -0.02 1.61 1.01 0.36 -3.48 116.67 118.57 1u0m s ASP 190 Ca 0.18 0.03 -0.28 0.00 0.71 0.00 0.00 52.55 53.20 1u0m s ASP 190 Cb 0.01 -1.42 0.09 0.00 1.01 0.00 0.00 42.92 42.61 1u0m s ASP 190 CO 0.13 0.33 0.80 -0.83 0.21 0.00 0.00 175.17 175.81 1u0m s GLY 191 N -0.61 -0.48 -0.06 0.21 0.00 0.15 -4.43 107.32 102.10 1u0m s GLY 191 Ca 0.10 1.21 0.02 0.00 0.00 0.00 0.00 44.72 46.04 1u0m s GLY 191 CO 0.02 0.61 -0.10 -0.42 0.00 0.00 0.00 173.10 173.22 1u0m s ILE 192 N -2.31 0.94 0.03 0.90 1.01 -0.72 -1.35 121.20 119.70 1u0m s ILE 192 Ca -0.01 -0.36 0.05 0.00 0.00 0.00 0.00 60.65 60.32 1u0m s ILE 192 Cb -0.01 -0.88 -0.02 0.00 0.01 0.00 0.00 42.46 41.57 1u0m s ILE 192 CO -0.03 0.31 -0.13 0.00 0.00 0.00 0.00 174.94 175.09 1u0m s ALA 193 N 0.73 1.11 -0.09 9.38 0.00 0.88 -1.88 121.76 131.89 1u0m s ALA 193 Ca -0.14 -0.78 -0.04 0.00 0.00 0.00 0.00 51.96 51.00 1u0m s ALA 193 Cb -0.15 -0.18 0.05 0.00 0.00 0.00 0.00 23.12 22.84 1u0m s ALA 193 CO 0.03 0.21 0.20 0.00 0.00 0.00 0.00 175.76 176.19 1u0m s ALA 194 N -0.80 -0.38 0.00 0.00 0.00 -0.61 0.20 121.76 120.16 1u0m s ALA 194 Ca 0.01 0.79 -0.01 0.00 0.00 0.00 0.00 51.96 52.76 1u0m s ALA 194 Cb -0.07 -0.69 -0.00 0.00 0.00 0.00 0.00 23.12 22.35 1u0m s ALA 194 CO 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 175.76 175.43 1u0m s ALA 195 N 1.67 0.00 0.04 0.00 0.00 0.73 -0.64 121.76 123.55 1u0m s ALA 195 Ca -0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 51.96 51.76 1u0m s ALA 195 Cb -0.11 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 1u0m s ALA 195 CO -0.07 -0.06 0.18 0.08 0.00 0.00 0.00 175.76 175.89 1u0m s VAL 196 N -0.46 5.28 -0.46 0.00 1.01 -1.26 -0.38 120.40 124.12 1u0m s VAL 196 Ca -0.05 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1u0m s VAL 196 Cb -0.03 -3.53 0.14 0.00 0.00 0.00 0.00 36.38 32.95 1u0m s VAL 196 CO -0.00 0.20 0.27 0.68 0.00 0.00 0.00 175.10 176.24 1u0m s VAL 197 N -1.43 1.52 -0.14 2.92 -7.23 -0.45 -1.65 120.40 113.94 1u0m s VAL 197 Ca 0.32 -2.74 -0.25 0.00 -1.81 0.00 0.00 61.98 57.50 1u0m s VAL 197 Cb -0.13 -2.05 -0.02 0.00 0.56 0.00 0.00 36.38 34.74 1u0m s VAL 197 CO 0.24 -0.92 0.80 0.00 -0.31 0.00 0.00 175.10 174.91 1u0m s ARG 198 N 0.15 4.34 0.24 4.82 1.70 -1.14 -2.58 118.95 126.48 1u0m s ARG 198 Ca 0.19 0.98 0.17 0.00 -0.47 0.00 0.00 55.73 56.61 1u0m s ARG 198 Cb -0.21 -3.54 0.05 0.00 -0.57 0.00 0.00 34.95 30.68 1u0m s ARG 198 CO -0.02 -0.21 1.27 0.78 -1.08 0.00 0.00 175.30 176.04 1u0m h GLY 199 N 7.85 0.00 -0.25 3.88 0.00 -1.75 -0.88 103.07 111.92 1u0m h GLY 199 Ca -0.33 0.00 0.24 0.00 0.00 0.00 0.00 47.33 47.24 1u0m h GLY 199 CO 0.81 0.00 0.46 0.07 0.00 0.00 0.00 176.54 177.88 1u0m h ARG 200 N 0.00 0.41 0.00 4.80 0.11 -1.81 -3.34 114.38 114.56 1u0m h ARG 200 Ca -0.04 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.01 1u0m h ARG 200 Cb 1.33 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 32.32 1u0m h ARG 200 CO 0.04 0.27 0.00 0.41 0.10 0.00 0.00 179.97 180.80 1u0m n GLY 201 N -1.33 0.46 0.00 0.08 0.00 -1.25 -5.05 105.19 98.10 1u0m n GLY 201 Ca 0.25 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1u0m n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u0m n GLY 202 N 0.00 2.05 2.89 -0.02 0.00 -1.25 -5.05 105.19 103.81 1u0m n GLY 202 Ca 0.00 -2.08 -0.29 0.00 0.00 0.00 0.00 46.02 43.65 1u0m n GLY 202 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1u0m s THR 203 N 1.54 1.21 0.00 2.61 -1.32 -1.26 -4.59 115.64 113.82 1u0m s THR 203 Ca 0.00 -0.88 0.00 0.00 -1.21 0.00 0.00 61.69 59.60 1u0m s THR 203 Cb 0.00 -1.48 0.00 0.00 -1.51 0.00 0.00 72.50 69.51 1u0m s THR 203 CO 0.00 -0.02 0.00 0.61 -2.21 0.00 0.00 174.62 173.00 1u0m n GLY 204 N 4.81 -0.55 3.74 6.08 0.00 -0.29 -4.37 105.19 114.61 1u0m n GLY 204 Ca -0.12 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 1u0m n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1u0m s VAL 205 N -2.82 4.35 -0.26 1.61 1.01 -0.85 0.10 120.40 123.53 1u0m s VAL 205 Ca 0.00 2.07 -0.16 0.00 0.00 0.00 0.00 61.98 63.90 1u0m s VAL 205 Cb 0.00 -4.32 -0.03 0.00 0.00 0.00 0.00 36.38 32.02 1u0m s VAL 205 CO 0.00 0.38 0.41 -0.60 0.00 0.00 0.00 175.10 175.29 1u0m s ARG 206 N -0.42 4.04 0.30 2.72 3.52 2.20 -1.08 118.95 130.23 1u0m s ARG 206 Ca 0.45 0.11 -0.27 0.00 -0.13 0.00 0.00 55.73 55.89 1u0m s ARG 206 Cb -0.24 -3.65 -0.14 0.00 -1.56 0.00 0.00 34.95 29.36 1u0m s ARG 206 CO 0.31 -0.28 0.82 1.47 -0.81 0.00 0.00 175.30 176.80 1u0m n LEU 207 N 5.33 0.85 0.00 -0.88 -0.00 -0.35 -1.18 117.00 120.78 1u0m n LEU 207 Ca -0.07 1.11 0.00 0.00 -0.00 0.00 0.00 56.01 57.05 1u0m n LEU 207 Cb 0.51 -1.19 0.00 0.00 -0.00 0.00 0.00 43.42 42.74 1u0m n LEU 207 CO 0.38 -2.02 0.00 -0.62 -0.00 0.00 0.00 177.39 175.13 1u0m n GLU 208 N 0.72 0.00 -4.80 1.47 -0.58 -0.93 -4.73 120.64 111.79 1u0m n GLU 208 Ca 0.12 0.00 -0.26 0.00 -0.42 0.00 0.00 57.16 56.60 1u0m n GLU 208 Cb 0.32 0.00 -0.16 0.00 -0.57 0.00 0.00 31.44 31.03 1u0m n GLU 208 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 1u0m s ARG 209 N 1.18 1.78 0.33 3.49 3.52 -1.11 -4.99 118.95 123.16 1u0m s ARG 209 Ca 0.00 -0.58 0.09 0.00 -0.13 0.00 0.00 55.73 55.11 1u0m s ARG 209 Cb 0.00 -1.53 -0.06 0.00 -1.56 0.00 0.00 34.95 31.80 1u0m s ARG 209 CO 0.00 0.21 -0.08 0.54 -0.81 0.00 0.00 175.30 175.15 1u0m s ASN 210 N 0.14 3.52 -0.09 -2.12 2.20 -1.26 -0.95 114.94 116.37 1u0m s ASN 210 Ca -0.06 -1.21 -0.30 0.00 -0.94 0.00 0.00 52.86 50.35 1u0m s ASN 210 Cb -0.12 -0.31 0.12 0.00 -2.00 0.00 0.00 41.25 38.94 1u0m s ASN 210 CO 0.03 -0.25 0.98 -0.83 -2.94 0.00 0.00 177.10 174.09 1u0m s GLY 211 N -3.58 -0.36 0.38 0.45 0.00 -0.72 -4.99 107.32 98.50 1u0m s GLY 211 Ca 0.32 1.49 0.08 0.00 0.00 0.00 0.00 44.72 46.60 1u0m s GLY 211 CO 0.16 0.63 0.29 -0.45 0.00 0.00 0.00 173.10 173.72 1u0m s SER 212 N -1.92 4.95 -0.29 1.64 0.15 -1.26 -1.68 113.70 115.29 1u0m s SER 212 Ca 0.03 -0.74 -0.14 0.00 0.70 0.00 0.00 55.95 55.80 1u0m s SER 212 Cb -0.01 -0.68 0.12 0.00 -1.71 0.00 0.00 66.02 63.74 1u0m s SER 212 CO -0.04 -0.51 0.76 -0.47 1.20 0.00 0.00 173.24 174.18 1u0m s TYR 213 N -2.45 -1.02 -0.25 3.44 6.14 -1.05 -4.98 117.35 117.18 1u0m s TYR 213 Ca 0.44 1.91 -0.06 0.00 0.64 0.00 0.00 57.07 60.00 1u0m s TYR 213 Cb -0.03 0.61 -0.01 0.00 0.42 0.00 0.00 41.96 42.95 1u0m s TYR 213 CO 0.26 -0.51 0.04 -1.17 0.64 0.00 0.00 175.55 174.81 1u0m s LEU 214 N 2.07 3.37 -0.29 6.97 1.98 -1.26 -2.06 118.68 129.46 1u0m s LEU 214 Ca -0.08 -0.38 -0.29 0.00 -2.89 0.00 0.00 54.13 50.50 1u0m s LEU 214 Cb -0.07 -1.86 -0.02 0.00 0.66 0.00 0.00 46.19 44.91 1u0m s LEU 214 CO -0.19 -0.07 1.64 -0.63 -1.89 0.00 0.00 176.35 175.22 1u0m s ILE 215 N 1.55 3.66 0.32 6.68 1.01 -0.58 -4.93 121.20 128.90 1u0m s ILE 215 Ca 0.05 0.70 -0.26 0.00 0.00 0.00 0.00 60.65 61.15 1u0m s ILE 215 Cb -0.15 -3.77 -0.14 0.00 0.01 0.00 0.00 42.46 38.40 1u0m s ILE 215 CO 0.01 -0.42 0.75 -2.65 0.00 0.00 0.00 174.94 172.64 1u0m n PRO 216 N 8.01 0.80 -3.98 2.79 -0.02 -1.26 -3.34 135.00 138.00 1u0m n PRO 216 Ca 0.20 0.29 -0.41 0.00 -2.02 0.00 0.00 63.50 61.56 1u0m n PRO 216 Cb 0.46 -1.56 0.02 0.00 -0.02 0.00 0.00 33.50 32.40 1u0m n PRO 216 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1u0m n LYS 217 N 0.72 -0.72 -0.42 -0.52 4.76 -1.26 -4.87 118.16 115.85 1u0m n LYS 217 Ca 0.12 0.20 0.00 0.00 -2.87 0.00 0.00 58.31 55.76 1u0m n LYS 217 Cb 0.33 -3.15 0.00 0.00 -1.84 0.00 0.00 35.03 30.38 1u0m n LYS 217 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1u0m n THR 218 N -4.75 0.00 -0.25 -0.18 -2.24 -1.21 -4.93 114.28 100.72 1u0m n THR 218 Ca -0.13 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.70 1u0m n THR 218 Cb 0.59 0.51 0.18 0.00 -2.10 0.00 0.00 70.33 69.50 1u0m n THR 218 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1u0m h GLU 219 N 0.00 0.30 -0.53 -0.78 3.07 -1.70 -0.71 114.58 114.22 1u0m h GLU 219 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1u0m h GLU 219 Cb 1.30 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 1u0m h GLU 219 CO 0.00 0.20 0.00 -0.40 -1.40 0.00 0.00 179.01 177.41 1u0m n ASP 220 N -5.12 2.87 0.09 1.42 5.68 -1.26 -4.35 116.55 115.88 1u0m n ASP 220 Ca 0.14 -2.14 -0.08 0.00 -0.50 0.00 0.00 54.79 52.21 1u0m n ASP 220 Cb 0.44 -0.39 -0.03 0.00 -1.14 0.00 0.00 41.12 40.00 1u0m n ASP 220 CO 0.00 0.00 0.00 -0.50 -1.33 0.00 0.00 177.20 175.37 1u0m h TRP 221 N 2.70 0.19 -2.79 2.11 4.06 -1.46 -3.40 115.95 117.36 1u0m h TRP 221 Ca 0.00 -0.11 -0.57 0.00 2.06 0.00 0.00 58.89 60.27 1u0m h TRP 221 Cb 0.82 -0.02 -0.40 0.00 -1.00 0.00 0.00 29.16 28.57 1u0m h TRP 221 CO 0.40 0.97 -0.80 0.42 -3.56 0.00 0.00 178.44 175.88 1u0m s ILE 222 N -3.05 0.36 0.31 1.49 1.01 -1.25 -0.47 121.20 119.60 1u0m s ILE 222 Ca -0.02 -1.47 -0.02 0.00 0.00 0.00 0.00 60.65 59.14 1u0m s ILE 222 Cb 0.10 -1.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.29 1u0m s ILE 222 CO 0.82 -0.85 0.41 0.00 0.00 0.00 0.00 174.94 175.33 1u0m s MET 223 N 1.39 1.77 -0.09 2.79 0.23 -0.44 -4.07 119.30 120.88 1u0m s MET 223 Ca 0.14 -1.71 -0.00 0.00 -1.03 0.00 0.00 55.69 53.09 1u0m s MET 223 Cb -0.20 0.41 -0.03 0.00 -1.53 0.00 0.00 34.83 33.49 1u0m s MET 223 CO -0.15 -0.71 -0.07 0.71 -2.03 0.00 0.00 175.02 172.77 1u0m s TYR 224 N -3.35 2.95 -0.25 3.16 4.12 -1.26 -0.01 117.35 122.70 1u0m s TYR 224 Ca 0.32 -0.10 -0.11 0.00 0.02 0.00 0.00 57.07 57.20 1u0m s TYR 224 Cb 0.01 -1.77 -0.05 0.00 -1.52 0.00 0.00 41.96 38.62 1u0m s TYR 224 CO 0.19 0.21 0.17 -0.51 0.02 0.00 0.00 175.55 175.63 1u0m s ASP 225 N -0.47 6.09 -0.42 2.29 -0.00 0.12 -4.91 116.67 119.37 1u0m s ASP 225 Ca 0.07 0.07 -0.15 0.00 -0.00 0.00 0.00 52.55 52.55 1u0m s ASP 225 Cb -0.12 -2.11 0.03 0.00 -0.00 0.00 0.00 42.92 40.72 1u0m s ASP 225 CO 0.02 0.03 0.31 -0.69 -0.00 0.00 0.00 175.17 174.84 1u0m s VAL 226 N 1.27 5.20 0.51 -1.27 1.01 -1.26 -0.69 120.40 125.16 1u0m s VAL 226 Ca 0.07 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.31 1u0m s VAL 226 Cb -0.14 -3.93 -0.00 0.00 0.00 0.00 0.00 36.38 32.30 1u0m s VAL 226 CO 0.06 -0.35 0.01 0.29 0.00 0.00 0.00 175.10 175.11 1u0m n LYS 227 N 5.15 0.73 0.29 2.72 5.02 0.02 -4.98 118.16 127.11 1u0m n LYS 227 Ca -0.11 -3.77 0.16 0.00 -2.02 0.00 0.00 58.31 52.57 1u0m n LYS 227 Cb 0.46 1.08 0.89 0.00 -0.02 0.00 0.00 35.03 37.44 1u0m n LYS 227 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1u0m h ALA 228 N 1.30 1.25 -0.00 7.82 0.00 -2.04 0.11 119.26 127.69 1u0m h ALA 228 Ca -0.42 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1u0m h ALA 228 Cb 1.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1u0m h ALA 228 CO 0.70 0.06 -0.19 0.25 0.00 0.00 0.00 179.25 180.07 1u0m n THR 229 N -3.51 0.00 0.00 0.00 -2.24 -1.26 -4.41 114.28 102.86 1u0m n THR 229 Ca -0.02 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1u0m n THR 229 Cb 0.16 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 1u0m n THR 229 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u0m n GLY 230 N 1.35 0.21 3.62 3.38 0.00 0.02 -4.36 105.19 109.42 1u0m n GLY 230 Ca 0.12 -1.91 -0.38 0.00 0.00 0.00 0.00 46.02 43.85 1u0m n GLY 230 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1u0m s PHE 231 N 0.00 3.27 -0.31 1.61 0.08 -1.26 -0.80 117.98 120.56 1u0m s PHE 231 Ca 0.00 0.32 -0.09 0.00 0.12 0.00 0.00 56.93 57.28 1u0m s PHE 231 Cb 0.00 -2.46 0.00 0.00 -0.57 0.00 0.00 43.02 40.00 1u0m s PHE 231 CO 0.00 -0.13 0.13 -1.01 -0.10 0.00 0.00 175.22 174.11 1u0m s HIS 232 N 1.70 3.17 -0.01 0.36 3.76 0.13 -4.83 115.29 119.57 1u0m s HIS 232 Ca 0.12 -0.76 -0.30 0.00 -0.15 0.00 0.00 55.06 53.97 1u0m s HIS 232 Cb -0.15 -2.32 -0.03 0.00 1.11 0.00 0.00 32.58 31.18 1u0m s HIS 232 CO 0.09 -0.52 1.04 0.12 -0.85 0.00 0.00 174.74 174.63 1u0m s PHE 233 N 1.56 3.56 -0.16 1.40 5.36 -1.26 0.16 117.98 128.60 1u0m s PHE 233 Ca 0.04 1.57 0.02 0.00 -0.96 0.00 0.00 56.93 57.59 1u0m s PHE 233 Cb -0.17 -3.21 0.01 0.00 -0.34 0.00 0.00 43.02 39.31 1u0m s PHE 233 CO 0.05 -0.39 -0.21 -0.51 -1.46 0.00 0.00 175.22 172.70 1u0m s LEU 234 N 1.28 2.13 -0.22 6.12 1.02 0.98 -4.87 118.68 125.12 1u0m s LEU 234 Ca 0.53 -0.62 0.00 0.00 0.02 0.00 0.00 54.13 54.06 1u0m s LEU 234 Cb -0.22 -1.47 0.06 0.00 0.02 0.00 0.00 46.19 44.58 1u0m s LEU 234 CO 0.26 0.04 -0.05 -0.22 0.02 0.00 0.00 176.35 176.41 1u0m s LEU 235 N 1.04 2.32 0.29 1.79 2.96 -1.26 -1.33 118.68 124.48 1u0m s LEU 235 Ca -0.01 -1.08 -0.30 0.00 -0.22 0.00 0.00 54.13 52.52 1u0m s LEU 235 Cb -0.14 -1.10 -0.11 0.00 0.50 0.00 0.00 46.19 45.34 1u0m s LEU 235 CO -0.07 -0.23 1.49 -0.62 -1.32 0.00 0.00 176.35 175.60 1u0m s ASP 236 N 1.46 6.53 0.51 3.68 2.15 0.38 -4.88 116.67 126.50 1u0m s ASP 236 Ca -0.04 2.81 0.32 0.00 0.43 0.00 0.00 52.55 56.07 1u0m s ASP 236 Cb -0.18 -2.63 1.45 0.00 -0.30 0.00 0.00 42.92 41.25 1u0m s ASP 236 CO -0.07 -0.78 1.82 0.11 -0.17 0.00 0.00 175.17 176.08 1u0m h LYS 237 N 4.58 0.08 0.00 4.34 6.56 -1.99 -0.40 116.57 129.73 1u0m h LYS 237 Ca -0.47 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.11 1u0m h LYS 237 Cb 1.22 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.86 1u0m h LYS 237 CO 0.76 0.05 0.00 0.54 -2.06 0.00 0.00 179.45 178.74 1u0m n ARG 238 N -4.29 0.98 -0.10 3.15 1.74 -1.26 -4.35 116.66 112.54 1u0m n ARG 238 Ca 0.24 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.26 1u0m n ARG 238 Cb 1.12 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 31.08 1u0m n ARG 238 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1u0m h VAL 239 N 0.00 0.75 -0.33 1.55 2.07 -1.42 -2.90 116.25 115.97 1u0m h VAL 239 Ca 0.00 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.51 1u0m h VAL 239 Cb 0.00 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 1u0m h VAL 239 CO 0.00 0.02 0.14 1.55 0.02 0.00 0.00 177.57 179.30 1u0m h PRO 240 N 0.11 0.30 -0.16 1.57 0.13 -1.84 -1.79 132.00 130.32 1u0m h PRO 240 Ca 0.17 -0.02 0.05 0.00 -0.87 0.00 0.00 66.00 65.33 1u0m h PRO 240 Cb 0.23 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.28 1u0m h PRO 240 CO -0.28 0.20 0.37 0.00 -0.23 0.00 0.00 178.00 178.06 1u0m h ALA 241 N 1.19 1.64 0.00 -0.56 0.00 -1.82 0.48 119.26 120.18 1u0m h ALA 241 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1u0m h ALA 241 Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1u0m h ALA 241 CO -0.12 -0.45 0.00 0.25 0.00 0.00 0.00 179.25 178.93 1u0m n THR 242 N -3.22 0.78 0.14 0.00 -2.24 -0.67 -2.44 114.28 106.62 1u0m n THR 242 Ca 0.02 0.20 0.04 0.00 -2.27 0.00 0.00 64.05 62.03 1u0m n THR 242 Cb 0.47 -1.02 0.44 0.00 -2.10 0.00 0.00 70.33 68.12 1u0m n THR 242 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1u0m h MET 243 N 0.00 0.21 0.40 -0.78 4.05 -1.06 -2.55 114.93 115.21 1u0m h MET 243 Ca 0.00 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.36 1u0m h MET 243 Cb 0.11 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 30.88 1u0m h MET 243 CO 0.00 0.31 -0.19 1.49 0.23 0.00 0.00 176.91 178.74 1u0m h GLU 244 N 0.21 -0.52 0.00 0.39 4.81 -1.72 -1.61 114.58 116.13 1u0m h GLU 244 Ca 0.05 0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1u0m h GLU 244 Cb 0.28 0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 1u0m h GLU 244 CO 0.01 -0.30 -0.06 -1.35 -0.73 0.00 0.00 179.01 176.59 1u0m h PRO 245 N -0.63 0.00 0.06 0.92 0.11 -1.74 -3.09 132.00 127.64 1u0m h PRO 245 Ca -0.06 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.78 1u0m h PRO 245 Cb 0.46 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.55 1u0m h PRO 245 CO 0.09 0.06 -1.39 1.25 -0.21 0.00 0.00 178.00 177.80 1u0m h LEU 246 N 0.00 0.20 -0.61 2.35 5.85 -1.25 -3.38 115.31 118.47 1u0m h LEU 246 Ca -0.00 -0.27 0.12 0.00 0.84 0.00 0.00 57.88 58.57 1u0m h LEU 246 Cb 0.37 -0.07 -0.12 0.00 0.37 0.00 0.00 40.66 41.21 1u0m h LEU 246 CO 0.01 1.22 -0.25 0.00 -0.34 0.00 0.00 178.44 179.09 1u0m h ALA 247 N 0.74 0.20 -0.97 1.25 0.00 -1.20 -0.88 119.26 118.41 1u0m h ALA 247 Ca -0.18 0.21 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1u0m h ALA 247 Cb 1.94 0.63 -0.07 0.00 0.00 0.00 0.00 17.79 20.30 1u0m h ALA 247 CO 0.14 -0.55 0.62 -1.35 0.00 0.00 0.00 179.25 178.11 1u0m h PRO 248 N -0.09 1.10 0.00 0.00 0.11 -1.74 -0.22 132.00 131.16 1u0m h PRO 248 Ca 0.27 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.31 1u0m h PRO 248 Cb 0.52 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.38 1u0m h PRO 248 CO -0.67 0.73 -0.03 0.00 -0.21 0.00 0.00 178.00 177.82 1u0m h ALA 249 N 1.44 1.85 -0.00 -0.75 0.00 -1.36 0.88 119.26 121.32 1u0m h ALA 249 Ca 0.42 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 55.06 1u0m h ALA 249 Cb 0.15 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.95 1u0m h ALA 249 CO -0.17 0.03 -0.98 -0.07 0.00 0.00 0.00 179.25 178.07 1u0m h LEU 250 N 0.00 0.66 -0.01 0.00 3.38 -0.55 -3.13 115.31 115.66 1u0m h LEU 250 Ca -0.00 -0.53 -0.08 0.00 0.09 0.00 0.00 57.88 57.35 1u0m h LEU 250 Cb 0.05 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.60 1u0m h LEU 250 CO 0.00 1.33 -0.32 0.11 0.09 0.00 0.00 178.44 179.65 1u0m h LYS 251 N 0.29 0.24 -0.58 1.13 1.57 -0.33 -1.33 116.57 117.55 1u0m h LYS 251 Ca -0.10 -0.24 0.10 0.00 -1.87 0.00 0.00 60.65 58.54 1u0m h LYS 251 Cb 1.62 0.06 -0.11 0.00 0.08 0.00 0.00 32.23 33.88 1u0m h LYS 251 CO 0.18 0.95 -0.37 0.93 -0.57 0.00 0.00 179.45 180.56 1u0m h GLU 252 N -0.37 -0.18 -0.09 3.15 3.07 0.61 0.30 114.58 121.06 1u0m h GLU 252 Ca -0.04 0.01 -0.17 0.00 -0.50 0.00 0.00 59.36 58.66 1u0m h GLU 252 Cb 1.05 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 29.00 1u0m h GLU 252 CO 0.06 -0.12 -0.68 1.25 -1.40 0.00 0.00 179.01 178.12 1u0m h LEU 253 N -0.19 0.46 -2.18 1.33 7.12 -1.64 -2.70 115.31 117.51 1u0m h LEU 253 Ca 0.21 -0.29 -0.00 0.00 0.13 0.00 0.00 57.88 57.93 1u0m h LEU 253 Cb 0.56 -0.14 -0.00 0.00 -0.53 0.00 0.00 40.66 40.55 1u0m h LEU 253 CO -0.68 1.01 -0.01 0.00 -0.13 0.00 0.00 178.44 178.63 1u0m h ALA 254 N 0.98 1.77 0.00 1.25 0.00 0.10 -2.77 119.26 120.59 1u0m h ALA 254 Ca -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1u0m h ALA 254 Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1u0m h ALA 254 CO 0.12 0.01 -0.00 0.78 0.00 0.00 0.00 179.25 180.16 1u0m h GLY 255 N 0.05 -0.01 -1.27 0.00 0.00 -0.17 0.59 103.07 102.26 1u0m h GLY 255 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1u0m h GLY 255 CO 0.00 -0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.72 1u0m n GLU 256 N -4.67 0.00 0.00 4.80 1.02 -1.04 0.48 120.64 121.23 1u0m n GLU 256 Ca -0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 1u0m n GLU 256 Cb 0.41 -1.12 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 1u0m n GLU 256 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 1u0m n HIS 257 N 0.62 0.00 0.00 -0.32 -0.00 -1.25 -5.04 115.22 109.24 1u0m n HIS 257 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1u0m n HIS 257 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1u0m n HIS 257 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1u0m n GLY 258 N 0.23 2.53 0.37 1.57 0.00 0.18 -4.69 105.19 105.38 1u0m n GLY 258 Ca 0.00 -0.58 0.17 0.00 0.00 0.00 0.00 46.02 45.61 1u0m n GLY 258 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1u0m h TRP 259 N 0.00 0.00 0.00 1.61 -0.00 -1.81 -3.40 115.95 112.35 1u0m h TRP 259 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 1u0m h TRP 259 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.16 1u0m h TRP 259 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 178.44 178.04 1u0m n ASP 260 N -3.23 0.00 -4.75 -3.49 5.75 0.20 -4.67 116.55 106.37 1u0m n ASP 260 Ca 0.04 0.00 -0.33 0.00 -0.01 0.00 0.00 54.79 54.49 1u0m n ASP 260 Cb 0.62 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.78 1u0m n ASP 260 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u0m s ALA 261 N 0.00 2.26 0.39 2.12 0.00 -1.26 -3.68 121.76 121.58 1u0m s ALA 261 Ca 0.00 0.63 0.10 0.00 0.00 0.00 0.00 51.96 52.69 1u0m s ALA 261 Cb 0.00 -3.37 0.78 0.00 0.00 0.00 0.00 23.12 20.53 1u0m s ALA 261 CO 0.00 -1.62 1.90 0.66 0.00 0.00 0.00 175.76 176.70 1u0m h SER 262 N -0.32 0.19 -0.02 0.00 4.64 -1.93 -3.39 113.55 112.72 1u0m h SER 262 Ca -0.46 -0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 60.73 1u0m h SER 262 Cb 1.26 -0.05 0.02 0.00 -0.31 0.00 0.00 62.40 63.33 1u0m h SER 262 CO 0.51 0.38 0.66 -0.67 -0.87 0.00 0.00 176.83 176.84 1u0m n ASP 263 N -4.25 -0.37 -4.68 4.97 4.64 -1.26 -4.76 116.55 110.84 1u0m n ASP 263 Ca -0.01 -1.73 -0.28 0.00 -1.38 0.00 0.00 54.79 51.39 1u0m n ASP 263 Cb 0.29 -0.82 -0.09 0.00 -1.04 0.00 0.00 41.12 39.46 1u0m n ASP 263 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 1u0m s LEU 264 N 5.29 2.85 -0.00 -2.67 1.43 -1.26 -5.03 118.68 119.29 1u0m s LEU 264 Ca 0.35 -1.34 0.08 0.00 -1.03 0.00 0.00 54.13 52.19 1u0m s LEU 264 Cb 0.01 -1.01 -0.10 0.00 0.03 0.00 0.00 46.19 45.12 1u0m s LEU 264 CO 0.11 -0.55 0.34 0.47 0.23 0.00 0.00 176.35 176.95 1u0m n ASP 265 N -1.10 0.65 -4.08 2.29 8.00 -1.26 -4.98 116.55 116.07 1u0m n ASP 265 Ca -0.06 -0.63 -0.29 0.00 0.71 0.00 0.00 54.79 54.52 1u0m n ASP 265 Cb 0.66 1.04 -0.17 0.00 -0.02 0.00 0.00 41.12 42.64 1u0m n ASP 265 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1u0m s PHE 266 N -1.88 2.11 -0.28 1.24 5.36 -1.25 -4.89 117.98 118.39 1u0m s PHE 266 Ca 0.03 -0.99 -0.02 0.00 -0.96 0.00 0.00 56.93 54.99 1u0m s PHE 266 Cb 0.06 -1.49 0.12 0.00 -0.34 0.00 0.00 43.02 41.37 1u0m s PHE 266 CO 0.35 -0.49 0.24 0.71 -1.46 0.00 0.00 175.22 174.57 1u0m s TYR 267 N 0.91 -0.23 -0.62 10.12 1.51 -1.26 -2.56 117.35 125.23 1u0m s TYR 267 Ca -0.08 -0.35 0.05 0.00 -1.01 0.00 0.00 57.07 55.68 1u0m s TYR 267 Cb -0.15 -0.58 0.17 0.00 -0.11 0.00 0.00 41.96 41.28 1u0m s TYR 267 CO -0.01 -0.88 0.43 0.42 -1.11 0.00 0.00 175.55 174.41 1u0m s ILE 268 N 2.28 2.21 0.03 2.71 -1.09 -0.91 -4.52 121.20 121.91 1u0m s ILE 268 Ca 0.09 -3.77 0.06 0.00 -2.23 0.00 0.00 60.65 54.80 1u0m s ILE 268 Cb -0.15 -2.47 -0.03 0.00 -1.58 0.00 0.00 42.46 38.23 1u0m s ILE 268 CO -0.33 -1.04 -0.15 0.68 -1.23 0.00 0.00 174.94 172.87 1u0m s VAL 269 N -0.96 3.04 -0.23 2.92 -7.23 -1.26 -2.58 120.40 114.10 1u0m s VAL 269 Ca 0.26 -1.06 -0.08 0.00 -1.81 0.00 0.00 61.98 59.29 1u0m s VAL 269 Cb -0.05 -2.29 -0.03 0.00 0.56 0.00 0.00 36.38 34.57 1u0m s VAL 269 CO -0.16 0.36 0.08 -2.28 -0.31 0.00 0.00 175.10 172.78 1u0m s HIS 270 N -0.94 3.14 -0.01 2.82 2.46 -0.62 -4.71 115.29 117.43 1u0m s HIS 270 Ca 0.15 -0.23 -0.00 0.00 0.47 0.00 0.00 55.06 55.45 1u0m s HIS 270 Cb -0.11 -2.20 0.01 0.00 -0.13 0.00 0.00 32.58 30.15 1u0m s HIS 270 CO 0.06 -0.19 0.02 0.00 -2.47 0.00 0.00 174.74 172.16 1u0m s ALA 271 N 1.24 -0.01 -0.23 1.58 0.00 -1.26 -3.44 121.76 119.64 1u0m s ALA 271 Ca 0.05 0.11 -0.29 0.00 0.00 0.00 0.00 51.96 51.83 1u0m s ALA 271 Cb -0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 1u0m s ALA 271 CO 0.04 -0.03 1.64 0.20 0.00 0.00 0.00 175.76 177.61 1u0m s GLY 272 N 0.26 1.17 0.23 0.00 0.00 -1.26 -4.70 107.32 103.02 1u0m s GLY 272 Ca -0.02 0.45 0.00 0.00 0.00 0.00 0.00 44.72 45.15 1u0m s GLY 272 CO -0.01 3.04 0.00 0.61 0.00 0.00 0.00 173.10 176.74 1u0m n GLY 273 N 4.76 -3.49 0.31 0.20 0.00 -1.26 -4.10 105.19 101.61 1u0m n GLY 273 Ca 0.19 -1.05 0.20 0.00 0.00 0.00 0.00 46.02 45.36 1u0m n GLY 273 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1u0m h PRO 274 N 0.38 0.00 0.91 1.61 0.13 -1.84 -2.80 132.00 130.38 1u0m h PRO 274 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 1u0m h PRO 274 Cb 0.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.33 1u0m h PRO 274 CO 0.00 0.00 -0.48 0.07 -0.23 0.00 0.00 178.00 177.36 1u0m h ARG 275 N 0.00 -1.23 -0.09 0.86 -0.00 -1.91 0.35 114.38 112.35 1u0m h ARG 275 Ca 0.00 0.08 -0.03 0.00 -0.00 0.00 0.00 59.98 60.03 1u0m h ARG 275 Cb 0.08 0.28 -0.01 0.00 -0.00 0.00 0.00 29.97 30.32 1u0m h ARG 275 CO 0.00 -0.82 -0.08 0.82 -0.00 0.00 0.00 179.97 179.89 1u0m h ILE 276 N -1.28 1.12 -0.05 0.08 2.04 -1.65 -2.02 117.51 115.75 1u0m h ILE 276 Ca -0.12 -0.50 -0.14 0.00 1.00 0.00 0.00 64.86 65.10 1u0m h ILE 276 Cb 1.00 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 1u0m h ILE 276 CO 0.18 0.16 -0.60 0.25 0.00 0.00 0.00 178.15 178.13 1u0m h LEU 277 N 0.14 0.18 -0.30 1.44 5.85 -1.27 -3.07 115.31 118.28 1u0m h LEU 277 Ca 0.03 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 1u0m h LEU 277 Cb 0.23 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1u0m h LEU 277 CO 0.01 0.74 -0.22 0.44 -0.34 0.00 0.00 178.44 179.07 1u0m h ASP 278 N 0.12 0.00 1.51 1.25 3.32 0.43 -2.69 116.42 120.35 1u0m h ASP 278 Ca -0.01 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1u0m h ASP 278 Cb 1.09 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.64 1u0m h ASP 278 CO 0.09 0.22 -0.03 0.44 -1.72 0.00 0.00 179.24 178.23 1u0m h ASP 279 N 0.00 0.00 1.22 6.45 5.19 -1.39 -2.64 116.42 125.25 1u0m h ASP 279 Ca -0.00 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.30 1u0m h ASP 279 Cb 1.06 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.55 1u0m h ASP 279 CO 0.03 0.03 -0.82 0.25 -3.12 0.00 0.00 179.24 175.62 1u0m h LEU 280 N 0.00 0.00 -0.90 1.55 7.12 -1.44 -2.09 115.31 119.54 1u0m h LEU 280 Ca -0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1u0m h LEU 280 Cb 0.80 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.93 1u0m h LEU 280 CO 0.00 0.44 0.00 -1.54 -0.13 0.00 0.00 178.44 177.21 1u0m n SER 281 N -3.05 1.32 0.07 1.25 3.41 -1.00 -3.29 113.62 112.34 1u0m n SER 281 Ca -0.02 -1.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.70 1u0m n SER 281 Cb 0.74 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 1u0m n SER 281 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1u0m n THR 282 N 0.18 0.83 0.00 6.66 -2.24 -1.18 -4.12 114.28 114.41 1u0m n THR 282 Ca 0.11 0.28 0.14 0.00 -2.27 0.00 0.00 64.05 62.31 1u0m n THR 282 Cb 0.23 -1.25 0.59 0.00 -2.10 0.00 0.00 70.33 67.80 1u0m n THR 282 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1u0m h PHE 283 N 0.00 0.20 0.07 4.78 0.04 -1.56 -2.07 116.94 118.41 1u0m h PHE 283 Ca 0.00 0.01 -0.24 0.00 2.80 0.00 0.00 57.97 60.54 1u0m h PHE 283 Cb 0.00 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.07 1u0m h PHE 283 CO 0.00 0.10 -1.24 1.25 -0.60 0.00 0.00 178.31 177.82 1u0m h LEU 284 N 0.19 0.25 -1.09 1.54 5.85 -1.76 -3.47 115.31 116.82 1u0m h LEU 284 Ca 0.22 -0.79 0.00 0.00 0.84 0.00 0.00 57.88 58.15 1u0m h LEU 284 Cb 0.64 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.59 1u0m h LEU 284 CO -0.04 1.53 0.00 -0.62 -0.34 0.00 0.00 178.44 178.97 1u0m n GLU 285 N -4.10 0.00 0.00 1.25 1.02 -0.78 -4.95 120.64 113.08 1u0m n GLU 285 Ca -0.25 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.89 1u0m n GLU 285 Cb 0.81 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.65 1u0m n GLU 285 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1u0m n VAL 286 N -0.88 0.00 -3.55 2.62 0.31 -1.26 -4.91 118.33 110.66 1u0m n VAL 286 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.17 1u0m n VAL 286 Cb 0.31 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.19 1u0m n VAL 286 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 1u0m s ASP 287 N -1.00 -0.60 0.08 4.52 1.47 -1.26 -5.02 116.67 114.87 1u0m s ASP 287 Ca 0.00 0.74 -0.32 0.00 1.18 0.00 0.00 52.55 54.15 1u0m s ASP 287 Cb 0.00 0.61 -0.15 0.00 -0.34 0.00 0.00 42.92 43.04 1u0m s ASP 287 CO 0.00 -0.49 1.51 -0.65 0.68 0.00 0.00 175.17 176.22 1u0m h PRO 288 N 3.19 -0.80 0.00 2.11 0.11 -1.97 -2.28 132.00 132.35 1u0m h PRO 288 Ca -0.25 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1u0m h PRO 288 Cb 1.15 0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1u0m h PRO 288 CO 0.32 -0.53 0.69 1.58 -0.21 0.00 0.00 178.00 179.85 1u0m n HIS 289 N -5.22 0.05 -0.18 0.65 -0.00 -1.26 -1.79 115.22 107.47 1u0m n HIS 289 Ca -0.10 0.03 -0.08 0.00 -0.00 0.00 0.00 57.72 57.57 1u0m n HIS 289 Cb 0.40 -0.08 0.02 0.00 -0.00 0.00 0.00 29.99 30.33 1u0m n HIS 289 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1u0m h ALA 290 N 0.14 0.67 -0.61 1.57 0.00 -1.81 -2.81 119.26 116.42 1u0m h ALA 290 Ca 0.00 -0.11 -0.55 0.00 0.00 0.00 0.00 54.91 54.25 1u0m h ALA 290 Cb 1.38 -0.21 -0.19 0.00 0.00 0.00 0.00 17.79 18.77 1u0m h ALA 290 CO 0.00 0.22 0.53 1.19 0.00 0.00 0.00 179.25 181.20 1u0m n PHE 291 N -4.60 1.83 -0.02 0.00 3.01 -0.74 -4.53 117.46 112.41 1u0m n PHE 291 Ca 0.02 -2.02 -0.09 0.00 1.01 0.00 0.00 57.45 56.37 1u0m n PHE 291 Cb 0.11 -1.36 0.06 0.00 -0.01 0.00 0.00 39.48 38.27 1u0m n PHE 291 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 1u0m h ARG 292 N 3.04 0.62 -0.14 -1.08 2.43 -1.72 -2.40 114.38 115.12 1u0m h ARG 292 Ca 0.43 -0.36 -0.21 0.00 -0.81 0.00 0.00 59.98 59.03 1u0m h ARG 292 Cb 0.60 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.19 1u0m h ARG 292 CO 0.98 0.97 -0.72 0.74 -1.51 0.00 0.00 179.97 180.42 1u0m h PHE 293 N 0.49 1.00 0.33 2.20 0.04 -1.86 -2.00 116.94 117.14 1u0m h PHE 293 Ca 0.02 -0.44 -0.02 0.00 2.80 0.00 0.00 57.97 60.33 1u0m h PHE 293 Cb 1.03 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 39.03 1u0m h PHE 293 CO 0.05 1.27 -0.16 0.77 -0.60 0.00 0.00 178.31 179.63 1u0m h SER 294 N 0.45 -0.38 -0.21 2.17 0.02 -1.84 -2.47 113.55 111.29 1u0m h SER 294 Ca -0.05 -0.10 0.06 0.00 -0.84 0.00 0.00 61.79 60.86 1u0m h SER 294 Cb 1.36 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.99 1u0m h SER 294 CO 0.15 -0.12 0.19 -0.09 -1.14 0.00 0.00 176.83 175.81 1u0m h ARG 295 N -0.63 0.00 -0.30 3.45 2.43 -1.49 -0.73 114.38 117.11 1u0m h ARG 295 Ca -0.05 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 58.96 1u0m h ARG 295 Cb 0.45 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 1u0m h ARG 295 CO 0.08 0.00 -0.46 0.00 -1.51 0.00 0.00 179.97 178.08 1u0m h ALA 296 N 1.82 0.63 -0.38 2.80 0.00 -0.94 -1.33 119.26 121.87 1u0m h ALA 296 Ca 0.10 -0.48 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 1u0m h ALA 296 Cb 0.47 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1u0m h ALA 296 CO -0.00 0.67 -0.02 1.15 0.00 0.00 0.00 179.25 181.06 1u0m h THR 297 N 0.62 1.26 -0.35 0.00 2.02 -0.71 -2.38 112.91 113.37 1u0m h THR 297 Ca 0.04 -1.03 -0.10 0.00 0.77 0.00 0.00 66.41 66.08 1u0m h THR 297 Cb 1.03 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 1u0m h THR 297 CO 0.10 0.34 -0.20 -0.07 0.37 0.00 0.00 175.52 176.06 1u0m h LEU 298 N 0.50 0.66 -0.72 2.58 3.38 -1.39 0.75 115.31 121.06 1u0m h LEU 298 Ca 0.11 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 1u0m h LEU 298 Cb 0.49 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1u0m h LEU 298 CO 0.02 0.86 -0.21 0.74 0.09 0.00 0.00 178.44 179.95 1u0m h THR 299 N 0.58 1.27 0.00 0.22 2.02 -1.14 -0.47 112.91 115.39 1u0m h THR 299 Ca 0.09 -1.31 -0.31 0.00 0.77 0.00 0.00 66.41 65.65 1u0m h THR 299 Cb 0.67 1.20 -0.06 0.00 -1.74 0.00 0.00 68.15 68.22 1u0m h THR 299 CO 0.05 0.44 -2.28 1.21 0.37 0.00 0.00 175.52 175.31 1u0m n GLU 300 N -4.12 0.68 -0.01 6.66 2.13 -0.90 -1.86 120.64 123.22 1u0m n GLU 300 Ca 0.00 -0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1u0m n GLU 300 Cb 0.42 -1.54 -0.03 0.00 0.27 0.00 0.00 31.44 30.56 1u0m n GLU 300 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1u0m n TYR 301 N -2.70 0.00 -1.96 4.31 0.53 0.26 -4.07 117.16 113.53 1u0m n TYR 301 Ca -0.28 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.60 1u0m n TYR 301 Cb 1.06 -0.12 0.00 0.00 -1.03 0.00 0.00 39.34 39.25 1u0m n TYR 301 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1u0m n GLY 302 N 2.50 -1.81 3.53 2.72 0.00 -0.19 -4.14 105.19 107.81 1u0m n GLY 302 Ca -0.03 -1.72 -0.43 0.00 0.00 0.00 0.00 46.02 43.85 1u0m n GLY 302 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1u0m s ASN 303 N -4.00 6.39 -0.56 1.61 3.84 0.12 -3.99 114.94 118.34 1u0m s ASN 303 Ca 0.00 -0.21 0.01 0.00 0.21 0.00 0.00 52.86 52.87 1u0m s ASN 303 Cb 0.00 -2.44 0.48 0.00 -0.55 0.00 0.00 41.25 38.75 1u0m s ASN 303 CO 0.00 -1.16 1.86 2.30 -2.79 0.00 0.00 177.10 177.31 1u0m n ILE 304 N 6.26 3.36 -0.47 -5.21 -5.35 -1.26 -0.76 119.36 115.92 1u0m n ILE 304 Ca 0.03 -3.00 0.00 0.00 -0.27 0.00 0.00 62.75 59.51 1u0m n ILE 304 Cb 0.48 -1.03 0.00 0.00 -1.74 0.00 0.00 39.64 37.35 1u0m n ILE 304 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1u0m n ALA 305 N -0.93 0.00 0.03 -1.28 0.00 -1.26 -1.98 120.51 115.09 1u0m n ALA 305 Ca 0.58 0.00 0.22 0.00 0.00 0.00 0.00 53.44 54.24 1u0m n ALA 305 Cb 0.85 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.94 1u0m n ALA 305 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1u0m h SER 306 N 0.94 0.00 0.98 0.00 4.64 -1.76 -0.55 113.55 117.80 1u0m h SER 306 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u0m h SER 306 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1u0m h SER 306 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1u0m n ALA 307 N -2.25 2.32 0.29 5.18 0.00 -0.84 -3.57 120.51 121.64 1u0m n ALA 307 Ca 0.11 -0.10 -0.16 0.00 0.00 0.00 0.00 53.44 53.29 1u0m n ALA 307 Cb 0.89 -1.47 -0.08 0.00 0.00 0.00 0.00 19.45 18.79 1u0m n ALA 307 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1u0m h VAL 308 N 0.00 0.38 -0.56 0.00 2.07 -1.22 -1.94 116.25 114.98 1u0m h VAL 308 Ca 0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1u0m h VAL 308 Cb 0.49 0.38 -0.11 0.00 -1.52 0.00 0.00 31.29 30.53 1u0m h VAL 308 CO 0.00 0.00 -0.16 -0.37 0.02 0.00 0.00 177.57 177.06 1u0m h VAL 309 N -0.76 0.41 -0.91 2.57 -1.51 -1.81 0.30 116.25 114.53 1u0m h VAL 309 Ca -0.06 0.00 0.05 0.00 -1.23 0.00 0.00 66.70 65.46 1u0m h VAL 309 Cb 0.62 0.41 -0.06 0.00 -2.13 0.00 0.00 31.29 30.12 1u0m h VAL 309 CO 0.06 0.00 0.58 -0.07 -1.23 0.00 0.00 177.57 176.91 1u0m h LEU 310 N -0.03 0.94 -0.61 4.19 4.07 -1.76 -1.37 115.31 120.75 1u0m h LEU 310 Ca 0.27 0.01 -0.15 0.00 0.08 0.00 0.00 57.88 58.08 1u0m h LEU 310 Cb 0.43 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.96 1u0m h LEU 310 CO -0.59 0.62 -0.69 -0.78 -1.08 0.00 0.00 178.44 175.92 1u0m h ASP 311 N 1.08 0.06 -0.19 -0.43 1.82 -0.40 -0.74 116.42 117.62 1u0m h ASP 311 Ca 0.39 -0.04 -0.02 0.00 -0.39 0.00 0.00 57.03 56.97 1u0m h ASP 311 Cb 0.11 -0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.10 1u0m h ASP 311 CO -0.15 0.73 0.05 0.00 -1.61 0.00 0.00 179.24 178.25 1u0m h ALA 312 N 1.27 0.25 0.00 -0.78 0.00 -0.29 -1.15 119.26 118.57 1u0m h ALA 312 Ca -0.01 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1u0m h ALA 312 Cb 1.22 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1u0m h ALA 312 CO 0.09 -0.11 -0.09 -0.07 0.00 0.00 0.00 179.25 179.08 1u0m h LEU 313 N 0.12 -0.24 -1.60 0.00 3.38 -1.15 -0.57 115.31 115.24 1u0m h LEU 313 Ca 0.06 0.04 0.28 0.00 0.09 0.00 0.00 57.88 58.35 1u0m h LEU 313 Cb 0.26 0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.04 1u0m h LEU 313 CO -0.00 -0.13 0.71 -0.09 0.09 0.00 0.00 178.44 179.02 1u0m h ARG 314 N -0.15 0.24 0.00 1.13 1.12 -0.80 0.90 114.38 116.82 1u0m h ARG 314 Ca 0.03 -0.01 -0.05 0.00 -1.11 0.00 0.00 59.98 58.83 1u0m h ARG 314 Cb 0.19 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.09 1u0m h ARG 314 CO -0.08 0.16 -0.30 0.00 -3.11 0.00 0.00 179.97 176.63 1u0m h ARG 315 N 0.25 0.00 0.00 0.20 3.08 0.11 -2.86 114.38 115.17 1u0m h ARG 315 Ca 0.56 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.60 1u0m h ARG 315 Cb 1.71 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.76 1u0m h ARG 315 CO -0.19 0.24 -0.06 1.25 -1.07 0.00 0.00 179.97 180.14 1u0m h LEU 316 N 0.00 0.00 0.09 3.04 6.46 0.21 -2.96 115.31 122.16 1u0m h LEU 316 Ca -0.01 0.00 -0.15 0.00 -0.12 0.00 0.00 57.88 57.60 1u0m h LEU 316 Cb 1.20 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 41.14 1u0m h LEU 316 CO 0.03 0.06 -0.70 -0.26 -0.62 0.00 0.00 178.44 176.95 1u0m h PHE 317 N 0.00 0.36 -0.99 1.25 -1.00 -1.06 -1.13 116.94 114.37 1u0m h PHE 317 Ca -0.00 -0.26 0.04 0.00 2.81 0.00 0.00 57.97 60.55 1u0m h PHE 317 Cb 0.96 -0.01 -0.06 0.00 3.61 0.00 0.00 35.95 40.45 1u0m h PHE 317 CO 0.00 1.27 0.65 -0.44 -1.61 0.00 0.00 178.31 178.18 1u0m h ASP 318 N -0.56 1.09 1.71 2.17 3.32 -1.52 0.53 116.42 123.15 1u0m h ASP 318 Ca -0.14 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 1u0m h ASP 318 Cb 1.47 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 1u0m h ASP 318 CO 0.08 0.74 -0.30 -0.08 -1.72 0.00 0.00 179.24 177.97 1u0m h GLU 319 N 1.26 0.00 -0.23 3.56 4.81 -1.65 -3.48 114.58 118.85 1u0m h GLU 319 Ca 0.39 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.62 1u0m h GLU 319 Cb -0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1u0m h GLU 319 CO -0.12 0.20 0.00 0.41 -0.73 0.00 0.00 179.01 178.77 1u0m n GLY 320 N 1.16 0.00 0.07 1.92 0.00 0.19 -4.85 105.19 103.67 1u0m n GLY 320 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 1u0m n GLY 320 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1u0m h GLY 321 N 0.33 -0.08 0.00 -0.02 0.00 -1.85 -3.49 103.07 97.96 1u0m h GLY 321 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1u0m h GLY 321 CO 0.00 -0.03 0.00 -0.62 0.00 0.00 0.00 176.54 175.89 1u0m n VAL 322 N -4.21 0.00 0.00 4.60 0.31 -1.26 -4.96 118.33 112.80 1u0m n VAL 322 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1u0m n VAL 322 Cb 0.03 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.96 1u0m n VAL 322 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1u0m n GLU 323 N -1.12 0.00 -2.65 5.55 1.02 -1.26 -4.67 120.64 117.51 1u0m n GLU 323 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.12 1u0m n GLU 323 Cb 0.00 -0.87 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 1u0m n GLU 323 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1u0m n GLU 324 N -0.26 -0.27 -0.71 3.49 0.00 -1.26 -3.84 120.64 117.80 1u0m n GLU 324 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 57.16 57.79 1u0m n GLU 324 Cb 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 31.44 30.63 1u0m n GLU 324 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1u0m n GLY 325 N 1.06 0.80 3.80 8.31 0.00 -0.07 -4.91 105.19 114.18 1u0m n GLY 325 Ca -0.00 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.12 1u0m n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u0m s ALA 326 N -2.00 2.72 0.84 4.61 0.00 -1.25 -4.64 121.76 122.05 1u0m s ALA 326 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.36 1u0m s ALA 326 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.88 1u0m s ALA 326 CO 0.00 -0.84 0.00 0.54 0.00 0.00 0.00 175.76 175.46 1u0m n ARG 327 N -2.07 -0.49 -3.65 0.00 5.12 -1.26 -2.52 116.66 111.79 1u0m n ARG 327 Ca 0.09 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 56.00 1u0m n ARG 327 Cb 0.53 0.00 -0.07 0.00 -1.16 0.00 0.00 32.46 31.76 1u0m n ARG 327 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1u0m s GLY 328 N -1.41 0.45 -0.27 -0.13 0.00 -0.69 -3.86 107.32 101.40 1u0m s GLY 328 Ca 0.00 3.62 -0.04 0.00 0.00 0.00 0.00 44.72 48.30 1u0m s GLY 328 CO 0.00 2.31 0.13 -2.27 0.00 0.00 0.00 173.10 173.27 1u0m s LEU 329 N 0.50 0.50 -0.24 0.66 1.98 -1.06 -1.80 118.68 119.23 1u0m s LEU 329 Ca 0.00 -1.19 -0.10 0.00 -2.89 0.00 0.00 54.13 49.96 1u0m s LEU 329 Cb -0.04 -0.33 -0.05 0.00 0.66 0.00 0.00 46.19 46.44 1u0m s LEU 329 CO -0.13 -0.43 0.14 -0.76 -1.89 0.00 0.00 176.35 173.29 1u0m s LEU 330 N 2.11 4.01 0.02 -0.68 1.43 0.16 -2.14 118.68 123.58 1u0m s LEU 330 Ca 0.08 0.07 -0.04 0.00 -1.03 0.00 0.00 54.13 53.21 1u0m s LEU 330 Cb -0.16 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 43.98 1u0m s LEU 330 CO -0.33 0.06 0.06 0.00 0.23 0.00 0.00 176.35 176.38 1u0m s ALA 331 N 1.08 -0.08 0.00 4.21 0.00 -1.06 0.16 121.76 126.06 1u0m s ALA 331 Ca 0.07 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.63 1u0m s ALA 331 Cb -0.14 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 1u0m s ALA 331 CO 0.04 -0.22 -0.10 0.20 0.00 0.00 0.00 175.76 175.68 1u0m s GLY 332 N -1.63 0.50 -0.01 0.00 0.00 0.01 -1.58 107.32 104.60 1u0m s GLY 332 Ca -0.12 -0.47 0.04 0.00 0.00 0.00 0.00 44.72 44.17 1u0m s GLY 332 CO -0.01 -0.41 -0.14 -1.36 0.00 0.00 0.00 173.10 171.17 1u0m s PHE 333 N -0.35 1.28 0.00 1.90 2.99 -1.22 -0.49 117.98 122.08 1u0m s PHE 333 Ca 0.03 -0.24 0.00 0.00 0.00 0.00 0.00 56.93 56.71 1u0m s PHE 333 Cb -0.04 -0.82 0.00 0.00 0.00 0.00 0.00 43.02 42.15 1u0m s PHE 333 CO -0.00 -0.02 0.00 0.41 -0.00 0.00 0.00 175.22 175.61 1u0m n GLY 334 N 2.72 1.65 3.58 4.36 0.00 -0.63 -2.92 105.19 113.96 1u0m n GLY 334 Ca -0.14 -0.29 -0.58 0.00 0.00 0.00 0.00 46.02 45.00 1u0m n GLY 334 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1u0m n PRO 335 N 0.00 0.45 0.00 1.61 -0.02 -1.26 -1.18 135.00 134.61 1u0m n PRO 335 Ca 0.00 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1u0m n PRO 335 Cb 0.00 -1.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1u0m n PRO 335 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1u0m n GLY 336 N 2.44 0.15 3.70 -1.23 0.00 -1.26 -2.42 105.19 106.57 1u0m n GLY 336 Ca 0.22 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.97 1u0m n GLY 336 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u0m s ILE 337 N 0.00 3.80 0.12 -0.61 1.01 -1.19 -2.13 121.20 122.20 1u0m s ILE 337 Ca 0.00 1.23 0.04 0.00 0.00 0.00 0.00 60.65 61.92 1u0m s ILE 337 Cb 0.00 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 1u0m s ILE 337 CO 0.00 0.04 0.09 -0.89 0.00 0.00 0.00 174.94 174.17 1u0m s THR 338 N 1.83 4.42 -0.15 2.92 2.01 -0.32 -1.53 115.64 124.82 1u0m s THR 338 Ca 0.61 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.65 1u0m s THR 338 Cb -0.31 -3.18 0.05 0.00 0.01 0.00 0.00 72.50 69.08 1u0m s THR 338 CO 0.27 0.03 0.05 0.00 -0.69 0.00 0.00 174.62 174.28 1u0m s ALA 339 N -1.52 0.69 -0.53 7.40 0.00 -0.87 -1.61 121.76 125.32 1u0m s ALA 339 Ca 0.29 -0.37 -0.15 0.00 0.00 0.00 0.00 51.96 51.74 1u0m s ALA 339 Cb -0.11 -0.99 0.13 0.00 0.00 0.00 0.00 23.12 22.15 1u0m s ALA 339 CO 0.22 -0.95 0.47 -1.21 0.00 0.00 0.00 175.76 174.29 1u0m s GLU 340 N 2.00 2.91 0.12 0.00 0.41 0.35 -2.53 118.70 121.96 1u0m s GLU 340 Ca 0.02 -1.71 -0.04 0.00 -0.41 0.00 0.00 54.97 52.83 1u0m s GLU 340 Cb -0.15 -4.24 -0.05 0.00 -1.78 0.00 0.00 34.13 27.91 1u0m s GLU 340 CO -0.07 -1.30 0.34 -1.64 -0.49 0.00 0.00 175.26 172.09 1u0m s MET 341 N 1.56 3.58 -0.15 1.61 -1.94 -0.67 -0.81 119.30 122.48 1u0m s MET 341 Ca 0.03 -0.16 -0.06 0.00 -1.71 0.00 0.00 55.69 53.79 1u0m s MET 341 Cb -0.29 -2.90 0.07 0.00 2.01 0.00 0.00 34.83 33.71 1u0m s MET 341 CO 0.03 0.51 0.32 0.45 -0.01 0.00 0.00 175.02 176.32 1u0m s SER 342 N -2.41 -0.06 -0.15 3.03 0.15 0.41 -1.75 113.70 112.93 1u0m s SER 342 Ca 0.39 0.73 -0.06 0.00 0.70 0.00 0.00 55.95 57.71 1u0m s SER 342 Cb -0.12 0.82 -0.04 0.00 -1.71 0.00 0.00 66.02 64.97 1u0m s SER 342 CO 0.25 -0.22 0.07 -0.76 1.20 0.00 0.00 173.24 173.79 1u0m s LEU 343 N 2.08 3.94 -0.08 3.45 1.43 -0.13 0.36 118.68 129.73 1u0m s LEU 343 Ca -0.03 0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 52.98 1u0m s LEU 343 Cb -0.11 -1.97 0.10 0.00 0.03 0.00 0.00 46.19 44.24 1u0m s LEU 343 CO -0.10 0.28 0.86 -0.83 0.23 0.00 0.00 176.35 176.79 1u0m s GLY 344 N -0.29 -0.41 0.16 -3.19 0.00 -0.75 -2.19 107.32 100.65 1u0m s GLY 344 Ca 0.09 1.54 -0.03 0.00 0.00 0.00 0.00 44.72 46.31 1u0m s GLY 344 CO 0.01 0.82 0.37 0.00 0.00 0.00 0.00 173.10 174.31 1u0m s TRP 346 N -1.72 3.77 -0.07 0.00 -0.11 -1.05 0.55 118.94 120.31 1u0m s TRP 346 Ca 0.40 1.77 0.02 0.00 1.22 0.00 0.00 56.10 59.51 1u0m s TRP 346 Cb -0.12 -3.13 0.01 0.00 -1.50 0.00 0.00 33.47 28.73 1u0m s TRP 346 CO 0.26 -0.06 -0.14 -1.14 -4.62 0.00 0.00 176.95 171.25 1u0m s GLN 347 N -0.74 1.90 0.04 5.86 0.74 0.29 -0.89 119.66 126.85 1u0m s GLN 347 Ca 0.45 -0.48 0.02 0.00 0.05 0.00 0.00 55.36 55.41 1u0m s GLN 347 Cb -0.27 -1.55 -0.04 0.00 1.10 0.00 0.00 33.01 32.25 1u0m s GLN 347 CO 0.34 0.03 0.05 0.99 -0.55 0.00 0.00 175.29 176.15 1u0m s THR 348 N 0.67 4.44 0.00 -0.34 2.01 -1.26 -1.13 115.64 120.03 1u0m s THR 348 Ca -0.14 -0.67 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1u0m s THR 348 Cb -0.16 -3.08 0.00 0.00 0.01 0.00 0.00 72.50 69.27 1u0m s THR 348 CO 0.04 0.23 0.00 0.00 -0.69 0.00 0.00 174.62 174.20