#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xvi s GLN 5 N 0.00 2.19 0.11 0.38 -2.07 -1.26 -4.93 119.66 114.08 1xvi s GLN 5 Ca 0.00 0.99 -0.34 0.00 -1.82 0.00 0.00 55.36 54.19 1xvi s GLN 5 Cb 0.00 -1.90 -0.13 0.00 -1.09 0.00 0.00 33.01 29.89 1xvi s GLN 5 CO 0.00 -1.64 1.67 0.94 -1.32 0.00 0.00 175.29 174.94 1xvi n GLN 6 N -3.50 2.23 -2.29 9.60 7.27 -1.26 -4.90 117.38 124.54 1xvi n GLN 6 Ca 0.08 0.81 -0.42 0.00 0.07 0.00 0.00 57.00 57.54 1xvi n GLN 6 Cb 0.54 -2.61 -0.03 0.00 2.41 0.00 0.00 30.24 30.55 1xvi n GLN 6 CO 0.00 0.00 0.00 -2.14 0.07 0.00 0.00 177.06 174.99 1xvi s PRO 7 N 1.71 4.39 -0.32 3.69 0.02 -1.26 -4.98 135.00 138.26 1xvi s PRO 7 Ca 0.82 1.94 0.02 0.00 0.02 0.00 0.00 61.00 63.80 1xvi s PRO 7 Cb -0.66 -3.27 0.08 0.00 0.02 0.00 0.00 34.50 30.67 1xvi s PRO 7 CO 0.40 -0.29 0.01 -0.51 -0.33 0.00 0.00 177.00 176.28 1xvi s LEU 8 N 0.69 4.32 -0.09 -5.54 1.43 -1.26 -1.35 118.68 116.88 1xvi s LEU 8 Ca 0.60 -1.82 0.02 0.00 -1.03 0.00 0.00 54.13 51.90 1xvi s LEU 8 Cb -0.34 -1.64 -0.02 0.00 0.03 0.00 0.00 46.19 44.23 1xvi s LEU 8 CO 0.32 -0.33 -0.16 -0.76 0.23 0.00 0.00 176.35 175.65 1xvi s LEU 9 N 1.03 2.58 -0.21 1.79 1.43 -0.33 -3.79 118.68 121.18 1xvi s LEU 9 Ca 0.03 -0.33 -0.05 0.00 -1.03 0.00 0.00 54.13 52.74 1xvi s LEU 9 Cb -0.20 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.46 1xvi s LEU 9 CO -0.06 0.23 -0.00 -0.69 0.23 0.00 0.00 176.35 176.06 1xvi s VAL 10 N -0.05 3.89 -0.35 -1.59 1.01 -0.52 -0.85 120.40 121.94 1xvi s VAL 10 Ca -0.04 -0.33 -0.12 0.00 0.00 0.00 0.00 61.98 61.49 1xvi s VAL 10 Cb -0.14 -2.77 0.00 0.00 0.00 0.00 0.00 36.38 33.47 1xvi s VAL 10 CO 0.04 0.42 0.22 -0.36 0.00 0.00 0.00 175.10 175.41 1xvi s PHE 11 N 1.14 3.22 -0.31 5.22 0.40 0.99 0.10 117.98 128.74 1xvi s PHE 11 Ca 0.03 -0.55 -0.04 0.00 -0.60 0.00 0.00 56.93 55.77 1xvi s PHE 11 Cb -0.14 -2.45 0.04 0.00 0.51 0.00 0.00 43.02 40.97 1xvi s PHE 11 CO 0.01 -0.49 0.04 0.45 0.70 0.00 0.00 175.22 175.94 1xvi s SER 12 N 1.65 5.02 -0.85 1.36 0.15 -0.32 -0.83 113.70 119.87 1xvi s SER 12 Ca 0.05 -1.12 0.01 0.00 0.70 0.00 0.00 55.95 55.59 1xvi s SER 12 Cb -0.18 -1.79 0.28 0.00 -1.71 0.00 0.00 66.02 62.63 1xvi s SER 12 CO 0.08 -0.26 1.13 -0.67 1.20 0.00 0.00 173.24 174.72 1xvi n ASP 13 N 4.73 5.13 -2.38 5.45 -0.08 0.65 -1.30 116.55 128.76 1xvi n ASP 13 Ca -0.13 -3.45 -0.08 0.00 -1.51 0.00 0.00 54.79 49.61 1xvi n ASP 13 Cb 0.45 -0.96 0.04 0.00 2.34 0.00 0.00 41.12 42.99 1xvi n ASP 13 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1xvi n LEU 14 N 0.99 2.82 -4.69 -2.67 4.77 -1.26 -3.86 117.00 113.11 1xvi n LEU 14 Ca 0.29 -3.63 -0.42 0.00 -0.03 0.00 0.00 56.01 52.21 1xvi n LEU 14 Cb 0.37 0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1xvi n LEU 14 CO 0.56 1.41 1.33 -1.81 -1.33 0.00 0.00 177.39 177.55 1xvi s ASP 15 N -3.61 6.62 0.00 -1.43 1.01 -1.26 -1.31 116.67 116.69 1xvi s ASP 15 Ca 0.37 2.45 0.00 0.00 0.71 0.00 0.00 52.55 56.08 1xvi s ASP 15 Cb 0.36 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.73 1xvi s ASP 15 CO -0.02 -0.89 0.00 0.61 0.21 0.00 0.00 175.17 175.08 1xvi n GLY 16 N 4.00 0.38 0.58 0.21 0.00 -1.26 -4.84 105.19 104.25 1xvi n GLY 16 Ca 0.16 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.16 1xvi n GLY 16 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xvi n THR 17 N -1.70 0.12 -0.04 2.61 -1.04 -0.83 -4.85 114.28 108.55 1xvi n THR 17 Ca 0.00 -0.04 -0.16 0.00 -2.04 0.00 0.00 64.05 61.82 1xvi n THR 17 Cb 0.00 -1.16 -0.05 0.00 -1.82 0.00 0.00 70.33 67.30 1xvi n THR 17 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1xvi h LEU 18 N -0.05 0.93 -9.71 -4.42 3.38 -1.53 -3.46 115.31 100.46 1xvi h LEU 18 Ca -0.05 -0.56 -0.54 0.00 0.09 0.00 0.00 57.88 56.82 1xvi h LEU 18 Cb 1.06 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 1xvi h LEU 18 CO -0.02 1.35 0.14 -0.76 0.09 0.00 0.00 178.44 179.24 1xvi s LEU 19 N -8.51 4.57 -0.06 1.67 1.43 -1.26 -4.59 118.68 111.93 1xvi s LEU 19 Ca -0.10 1.56 -0.30 0.00 -1.03 0.00 0.00 54.13 54.27 1xvi s LEU 19 Cb 0.09 -3.22 -0.06 0.00 0.03 0.00 0.00 46.19 43.03 1xvi s LEU 19 CO 0.89 0.20 1.77 -0.62 0.23 0.00 0.00 176.35 178.83 1xvi s ASP 20 N -1.04 6.49 0.27 2.29 -1.08 -1.26 -4.68 116.67 117.66 1xvi s ASP 20 Ca 0.35 2.25 0.00 0.00 -0.52 0.00 0.00 52.55 54.63 1xvi s ASP 20 Cb -0.22 -2.53 0.63 0.00 -1.46 0.00 0.00 42.92 39.34 1xvi s ASP 20 CO 0.25 -1.07 1.68 0.77 0.52 0.00 0.00 175.17 177.31 1xvi h SER 21 N 10.35 0.14 0.00 -0.34 4.64 -1.97 -3.00 113.55 123.37 1xvi h SER 21 Ca -0.41 0.16 -0.35 0.00 -0.47 0.00 0.00 61.79 60.72 1xvi h SER 21 Cb 1.19 0.19 -0.06 0.00 -0.31 0.00 0.00 62.40 63.41 1xvi h SER 21 CO 0.96 -0.05 -2.33 0.00 -0.87 0.00 0.00 176.83 174.53 1xvi n HIS 22 N -5.13 0.00 -1.08 4.77 1.44 -1.26 -5.09 115.22 108.87 1xvi n HIS 22 Ca 0.19 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.60 1xvi n HIS 22 Cb 0.60 -0.91 0.25 0.00 0.12 0.00 0.00 29.99 30.05 1xvi n HIS 22 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1xvi s SER 23 N -6.15 0.59 0.00 4.39 0.15 -1.14 -5.07 113.70 106.47 1xvi s SER 23 Ca -0.29 0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.87 1xvi s SER 23 Cb 0.08 -0.65 0.00 0.00 -1.71 0.00 0.00 66.02 63.74 1xvi s SER 23 CO 0.57 -4.31 0.00 0.00 1.20 0.00 0.00 173.24 170.70 1xvi n TYR 24 N -4.87 0.00 1.85 3.44 4.19 -1.26 -4.84 117.16 115.68 1xvi n TYR 24 Ca 0.15 0.00 0.10 0.00 3.31 0.00 0.00 57.90 61.46 1xvi n TYR 24 Cb 0.60 0.00 0.62 0.00 0.49 0.00 0.00 39.34 41.05 1xvi n TYR 24 CO 0.00 0.00 0.00 -0.25 0.91 0.00 0.00 176.86 177.52 1xvi n ASP 25 N 0.00 0.00 -4.05 2.98 8.00 -1.26 -4.65 116.55 117.57 1xvi n ASP 25 Ca 0.00 -1.20 -0.34 0.00 0.71 0.00 0.00 54.79 53.96 1xvi n ASP 25 Cb 0.00 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 40.98 1xvi n ASP 25 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1xvi s TRP 26 N -2.00 3.40 -0.22 1.24 0.52 -1.26 -4.87 118.94 115.74 1xvi s TRP 26 Ca 0.31 -2.83 -0.13 0.00 0.02 0.00 0.00 56.10 53.48 1xvi s TRP 26 Cb 0.14 -3.07 -0.05 0.00 -1.15 0.00 0.00 33.47 29.34 1xvi s TRP 26 CO 0.24 -0.84 0.25 -0.65 0.02 0.00 0.00 176.95 175.97 1xvi s GLN 27 N 0.12 4.12 0.43 4.98 -1.52 -1.26 -4.89 119.66 121.64 1xvi s GLN 27 Ca 0.15 -0.08 0.20 0.00 -1.95 0.00 0.00 55.36 53.68 1xvi s GLN 27 Cb -0.22 -3.53 1.15 0.00 -0.22 0.00 0.00 33.01 30.18 1xvi s GLN 27 CO -0.03 0.03 1.85 -1.35 -0.25 0.00 0.00 175.29 175.54 1xvi h PRO 28 N 7.43 0.33 0.00 2.91 0.11 -1.95 -1.98 132.00 138.85 1xvi h PRO 28 Ca -0.37 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1xvi h PRO 28 Cb 1.17 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1xvi h PRO 28 CO 0.68 0.22 0.00 0.00 -0.21 0.00 0.00 178.00 178.69 1xvi h ALA 29 N 1.60 1.00 -0.10 -0.75 0.00 -1.94 -3.39 119.26 115.68 1xvi h ALA 29 Ca 0.49 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.44 1xvi h ALA 29 Cb 1.31 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.05 1xvi h ALA 29 CO -0.17 0.00 -0.26 0.00 0.00 0.00 0.00 179.25 178.82 1xvi h ALA 30 N 2.14 -0.27 -0.93 0.00 0.00 -1.53 -1.48 119.26 117.18 1xvi h ALA 30 Ca 0.00 0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1xvi h ALA 30 Cb 0.65 0.48 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 1xvi h ALA 30 CO 0.00 -0.73 0.61 -1.00 0.00 0.00 0.00 179.25 178.13 1xvi h PRO 31 N -0.34 1.08 0.55 0.00 0.13 -1.80 0.35 132.00 131.96 1xvi h PRO 31 Ca 0.09 -0.06 -0.03 0.00 -0.87 0.00 0.00 66.00 65.13 1xvi h PRO 31 Cb 0.48 -0.24 0.01 0.00 0.13 0.00 0.00 31.00 31.37 1xvi h PRO 31 CO -0.29 0.71 -0.26 -1.49 -0.23 0.00 0.00 178.00 176.43 1xvi h TRP 32 N 1.11 -0.69 -0.14 1.56 4.06 -1.75 -2.81 115.95 117.28 1xvi h TRP 32 Ca 0.39 -0.02 -0.06 0.00 2.06 0.00 0.00 58.89 61.26 1xvi h TRP 32 Cb 0.13 0.23 -0.01 0.00 -1.00 0.00 0.00 29.16 28.50 1xvi h TRP 32 CO -0.00 -0.41 -0.19 -0.07 -3.56 0.00 0.00 178.44 174.22 1xvi h LEU 33 N -0.79 0.23 -0.14 -4.49 3.38 -1.06 -1.80 115.31 110.64 1xvi h LEU 33 Ca -0.08 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.84 1xvi h LEU 33 Cb 0.59 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1xvi h LEU 33 CO 0.12 0.44 0.07 0.74 0.09 0.00 0.00 178.44 179.90 1xvi h THR 34 N 0.22 1.00 -1.00 0.22 2.02 -0.95 -1.16 112.91 113.26 1xvi h THR 34 Ca 0.04 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 67.18 1xvi h THR 34 Cb 0.47 0.84 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 1xvi h THR 34 CO 0.03 0.03 0.66 0.03 0.37 0.00 0.00 175.52 176.64 1xvi h ARG 35 N 0.15 1.32 -0.86 6.66 3.08 -1.14 -1.94 114.38 121.65 1xvi h ARG 35 Ca 0.05 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1xvi h ARG 35 Cb 0.01 -0.30 -0.04 0.00 0.08 0.00 0.00 29.97 29.72 1xvi h ARG 35 CO -0.03 0.87 0.46 -0.07 -1.07 0.00 0.00 179.97 180.13 1xvi h LEU 36 N 1.36 1.09 -0.92 3.04 4.07 -1.12 -1.63 115.31 121.19 1xvi h LEU 36 Ca 0.37 -0.11 -0.02 0.00 0.08 0.00 0.00 57.88 58.20 1xvi h LEU 36 Cb -0.15 -0.28 -0.04 0.00 1.08 0.00 0.00 40.66 41.27 1xvi h LEU 36 CO -0.08 0.88 0.50 -0.09 -1.08 0.00 0.00 178.44 178.57 1xvi h ARG 37 N 1.21 1.26 0.00 1.13 2.43 -0.89 0.49 114.38 120.01 1xvi h ARG 37 Ca 0.30 -0.15 -0.09 0.00 -0.81 0.00 0.00 59.98 59.24 1xvi h ARG 37 Cb 0.05 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 1xvi h ARG 37 CO -0.05 0.92 -0.42 0.93 -1.51 0.00 0.00 179.97 179.84 1xvi h GLU 38 N 1.27 0.00 -0.02 0.20 5.08 -0.95 -2.55 114.58 117.61 1xvi h GLU 38 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1xvi h GLU 38 Cb 0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1xvi h GLU 38 CO -0.05 0.42 0.00 0.00 -1.00 0.00 0.00 179.01 178.38 1xvi n ALA 39 N -2.42 2.63 -3.53 3.43 0.00 -0.65 -4.93 120.51 115.04 1xvi n ALA 39 Ca -0.01 -0.24 -0.19 0.00 0.00 0.00 0.00 53.44 52.99 1xvi n ALA 39 Cb 0.47 -1.36 0.07 0.00 0.00 0.00 0.00 19.45 18.63 1xvi n ALA 39 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xvi n ASN 40 N -0.62 -2.60 -3.92 0.00 5.15 -0.96 -5.00 115.26 107.31 1xvi n ASN 40 Ca 0.19 -0.66 -0.29 0.00 -0.60 0.00 0.00 54.58 53.23 1xvi n ASN 40 Cb 0.16 -4.85 -0.11 0.00 -0.53 0.00 0.00 39.78 34.45 1xvi n ASN 40 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1xvi n VAL 41 N -4.31 1.87 -1.86 3.44 0.31 0.14 -4.60 118.33 113.31 1xvi n VAL 41 Ca -0.24 -4.92 -0.42 0.00 -0.01 0.00 0.00 64.34 58.75 1xvi n VAL 41 Cb 0.65 -2.21 -0.03 0.00 -0.91 0.00 0.00 33.84 31.34 1xvi n VAL 41 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1xvi s PRO 42 N -1.51 4.18 -0.37 5.55 0.04 -1.25 -4.20 135.00 137.44 1xvi s PRO 42 Ca 0.26 2.46 -0.14 0.00 0.04 0.00 0.00 61.00 63.62 1xvi s PRO 42 Cb -0.04 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1xvi s PRO 42 CO -0.16 -0.63 0.29 0.08 0.04 0.00 0.00 177.00 176.63 1xvi s VAL 43 N 0.77 5.25 -0.48 -0.36 1.01 -1.26 -1.44 120.40 123.89 1xvi s VAL 43 Ca 0.69 -0.37 -0.19 0.00 0.00 0.00 0.00 61.98 62.10 1xvi s VAL 43 Cb -0.46 -3.83 0.04 0.00 0.00 0.00 0.00 36.38 32.13 1xvi s VAL 43 CO 0.36 -0.17 0.60 -0.63 0.00 0.00 0.00 175.10 175.26 1xvi s ILE 44 N 1.77 4.90 0.26 2.22 1.09 0.29 -4.90 121.20 126.82 1xvi s ILE 44 Ca 0.07 -0.34 -0.29 0.00 -1.10 0.00 0.00 60.65 58.98 1xvi s ILE 44 Cb -0.18 -4.24 -0.09 0.00 -1.06 0.00 0.00 42.46 36.89 1xvi s ILE 44 CO 0.11 -0.70 1.21 -0.76 -0.10 0.00 0.00 174.94 174.70 1xvi s LEU 45 N 2.59 4.47 -0.07 2.97 1.43 -1.26 -1.17 118.68 127.64 1xvi s LEU 45 Ca 0.16 2.39 0.02 0.00 -1.03 0.00 0.00 54.13 55.67 1xvi s LEU 45 Cb -0.18 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.43 1xvi s LEU 45 CO 0.14 -0.36 -0.10 0.00 0.23 0.00 0.00 176.35 176.25 1xvi s SER 47 N 0.86 -0.31 0.31 0.00 0.15 -0.23 -4.24 113.70 110.24 1xvi s SER 47 Ca -0.11 -0.27 0.25 0.00 0.70 0.00 0.00 55.95 56.52 1xvi s SER 47 Cb -0.15 0.52 0.65 0.00 -1.71 0.00 0.00 66.02 65.33 1xvi s SER 47 CO 0.01 -0.91 1.72 0.77 1.20 0.00 0.00 173.24 176.03 1xvi h SER 48 N 2.26 0.00 -4.23 5.45 4.64 -1.91 -1.81 113.55 117.95 1xvi h SER 48 Ca -0.33 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.47 1xvi h SER 48 Cb 1.27 0.00 0.18 0.00 -0.31 0.00 0.00 62.40 63.54 1xvi h SER 48 CO 0.44 0.00 0.24 -0.54 -0.87 0.00 0.00 176.83 176.09 1xvi s LYS 49 N -3.17 1.25 0.77 4.77 1.02 -1.26 -3.62 119.74 119.50 1xvi s LYS 49 Ca 0.09 1.40 -0.11 0.00 0.02 0.00 0.00 55.97 57.36 1xvi s LYS 49 Cb 0.09 -1.77 0.05 0.00 -0.52 0.00 0.00 37.83 35.69 1xvi s LYS 49 CO 0.61 -2.42 1.08 0.95 -0.92 0.00 0.00 175.35 174.66 1xvi s THR 50 N -2.72 3.40 0.21 2.17 -4.23 -1.26 -0.57 115.64 112.65 1xvi s THR 50 Ca 0.65 0.46 -0.09 0.00 -1.18 0.00 0.00 61.69 61.53 1xvi s THR 50 Cb -0.21 -3.12 0.17 0.00 1.34 0.00 0.00 72.50 70.67 1xvi s THR 50 CO 0.58 -0.60 1.83 -1.28 -0.54 0.00 0.00 174.62 174.61 1xvi h SER 51 N -1.02 1.01 -0.29 3.99 0.87 -1.90 -0.83 113.55 115.38 1xvi h SER 51 Ca -0.46 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 59.99 1xvi h SER 51 Cb 1.24 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 1xvi h SER 51 CO 0.56 0.83 0.15 0.00 -0.53 0.00 0.00 176.83 177.85 1xvi h ALA 52 N 1.23 0.38 0.52 6.23 0.00 -1.82 -0.05 119.26 125.74 1xvi h ALA 52 Ca 0.28 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1xvi h ALA 52 Cb 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1xvi h ALA 52 CO -0.04 -0.09 -0.35 1.49 0.00 0.00 0.00 179.25 180.26 1xvi h GLU 53 N 0.35 -0.81 -0.56 0.00 4.81 -1.65 -2.37 114.58 114.35 1xvi h GLU 53 Ca 0.10 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 1xvi h GLU 53 Cb 0.08 0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1xvi h GLU 53 CO -0.02 -0.54 0.35 0.52 -0.73 0.00 0.00 179.01 178.59 1xvi h MET 54 N -0.84 0.74 -0.29 1.92 2.86 -1.11 0.05 114.93 118.26 1xvi h MET 54 Ca -0.06 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.40 1xvi h MET 54 Cb 0.70 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.19 1xvi h MET 54 CO 0.04 0.51 -0.36 -0.07 1.06 0.00 0.00 176.91 178.09 1xvi h LEU 55 N 0.76 0.68 0.18 1.22 3.38 -0.94 0.80 115.31 121.39 1xvi h LEU 55 Ca 0.20 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1xvi h LEU 55 Cb -0.05 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1xvi h LEU 55 CO -0.04 0.98 -0.09 0.22 0.09 0.00 0.00 178.44 179.60 1xvi h TYR 56 N 0.54 -0.23 -0.33 1.13 3.20 -0.76 -2.47 116.97 118.07 1xvi h TYR 56 Ca 0.05 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1xvi h TYR 56 Cb 0.87 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 39.20 1xvi h TYR 56 CO 0.04 -0.08 0.17 -0.07 -1.64 0.00 0.00 178.16 176.58 1xvi h LEU 57 N -0.32 0.42 -0.78 2.82 3.38 -0.88 -2.24 115.31 117.71 1xvi h LEU 57 Ca -0.02 -0.10 0.17 0.00 0.09 0.00 0.00 57.88 58.01 1xvi h LEU 57 Cb 0.24 -0.11 -0.11 0.00 0.09 0.00 0.00 40.66 40.78 1xvi h LEU 57 CO 0.04 0.40 0.27 -0.61 0.09 0.00 0.00 178.44 178.63 1xvi h GLN 58 N 0.40 0.35 -0.42 1.13 4.15 -0.86 -0.96 115.11 118.89 1xvi h GLN 58 Ca 0.11 -0.02 -0.10 0.00 0.77 0.00 0.00 58.65 59.42 1xvi h GLN 58 Cb 0.09 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 1xvi h GLN 58 CO -0.02 0.23 -0.12 -0.22 -1.93 0.00 0.00 178.83 176.77 1xvi h LYS 59 N 0.36 0.82 0.00 1.69 3.64 -1.03 0.81 116.57 122.86 1xvi h LYS 59 Ca 0.45 -0.32 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 1xvi h LYS 59 Cb 0.77 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1xvi h LYS 59 CO -0.48 0.95 -0.10 1.79 -2.27 0.00 0.00 179.45 179.33 1xvi h THR 60 N 0.64 0.32 -0.00 1.00 1.35 -0.78 -2.72 112.91 112.71 1xvi h THR 60 Ca 0.10 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 1xvi h THR 60 Cb 0.66 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 1xvi h THR 60 CO 0.05 0.10 -0.29 0.18 -0.25 0.00 0.00 175.52 175.31 1xvi n LEU 61 N -3.32 0.78 0.00 3.87 4.77 -0.44 -4.45 117.00 118.21 1xvi n LEU 61 Ca -0.00 -0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1xvi n LEU 61 Cb 0.31 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1xvi n LEU 61 CO 0.29 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1xvi n GLY 62 N 1.38 0.81 0.67 -0.72 0.00 -1.03 -4.25 105.19 102.05 1xvi n GLY 62 Ca 0.11 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 46.13 1xvi n GLY 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xvi n LEU 63 N 0.00 2.88 -4.71 0.99 4.77 0.25 -4.62 117.00 116.56 1xvi n LEU 63 Ca 0.00 -1.87 -0.43 0.00 -0.03 0.00 0.00 56.01 53.68 1xvi n LEU 63 Cb 0.00 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 1xvi n LEU 63 CO 0.00 0.70 1.09 1.67 -1.33 0.00 0.00 177.39 179.53 1xvi n GLN 64 N 0.61 2.34 -0.07 3.23 7.27 -1.20 -2.20 117.38 127.37 1xvi n GLN 64 Ca 0.12 0.83 0.00 0.00 0.07 0.00 0.00 57.00 58.02 1xvi n GLN 64 Cb 0.42 -2.53 0.00 0.00 2.41 0.00 0.00 30.24 30.54 1xvi n GLN 64 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1xvi n GLY 65 N 1.88 0.58 3.93 1.69 0.00 -1.26 -5.03 105.19 106.98 1xvi n GLY 65 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1xvi n GLY 65 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xvi s LEU 66 N 0.00 4.16 0.81 0.99 1.43 -0.93 -0.75 118.68 124.40 1xvi s LEU 66 Ca 0.00 0.46 -0.13 0.00 -1.03 0.00 0.00 54.13 53.44 1xvi s LEU 66 Cb 0.00 -3.25 0.09 0.00 0.03 0.00 0.00 46.19 43.05 1xvi s LEU 66 CO 0.00 -0.11 1.18 -2.84 0.23 0.00 0.00 176.35 174.80 1xvi s PRO 67 N -3.54 1.65 0.10 1.29 0.02 -1.26 -4.61 135.00 128.65 1xvi s PRO 67 Ca 0.40 1.64 -0.15 0.00 0.02 0.00 0.00 61.00 62.91 1xvi s PRO 67 Cb -0.11 -1.79 0.03 0.00 0.02 0.00 0.00 34.50 32.65 1xvi s PRO 67 CO 0.30 -2.18 0.35 -0.48 -0.33 0.00 0.00 177.00 174.66 1xvi s LEU 68 N -5.84 0.66 -0.24 -5.54 0.05 -1.02 -4.12 118.68 102.63 1xvi s LEU 68 Ca 0.70 -0.34 -0.02 0.00 0.05 0.00 0.00 54.13 54.52 1xvi s LEU 68 Cb -0.26 1.62 0.01 0.00 -2.05 0.00 0.00 46.19 45.51 1xvi s LEU 68 CO 0.52 -0.78 -0.06 -0.63 -0.55 0.00 0.00 176.35 174.84 1xvi s ILE 69 N -3.56 3.02 0.28 1.48 1.01 0.46 -1.50 121.20 122.39 1xvi s ILE 69 Ca 0.02 -0.83 0.10 0.00 0.00 0.00 0.00 60.65 59.93 1xvi s ILE 69 Cb 0.02 -2.46 -0.05 0.00 0.01 0.00 0.00 42.46 39.98 1xvi s ILE 69 CO -0.10 0.29 -0.06 0.00 0.00 0.00 0.00 174.94 175.07 1xvi s ALA 70 N 1.38 3.04 -1.40 9.38 0.00 -0.42 -1.07 121.76 132.67 1xvi s ALA 70 Ca 0.03 -1.75 -0.05 0.00 0.00 0.00 0.00 51.96 50.18 1xvi s ALA 70 Cb -0.16 -0.58 0.03 0.00 0.00 0.00 0.00 23.12 22.42 1xvi s ALA 70 CO -0.04 0.25 0.74 0.39 0.00 0.00 0.00 175.76 177.10 1xvi n GLU 71 N -0.82 -4.78 -2.41 0.00 1.02 0.27 -0.90 120.64 113.02 1xvi n GLU 71 Ca -0.06 0.57 -0.18 0.00 -0.02 0.00 0.00 57.16 57.48 1xvi n GLU 71 Cb 0.60 -5.16 -0.01 0.00 -0.02 0.00 0.00 31.44 26.84 1xvi n GLU 71 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1xvi n ASN 72 N -2.97 -5.13 0.00 1.62 3.02 -0.71 -1.73 115.26 109.36 1xvi n ASN 72 Ca -0.19 0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.43 1xvi n ASN 72 Cb 0.63 -4.30 0.00 0.00 -0.61 0.00 0.00 39.78 35.50 1xvi n ASN 72 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xvi n GLY 73 N -0.93 0.54 0.06 7.41 0.00 -0.08 -2.84 105.19 109.36 1xvi n GLY 73 Ca -0.21 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.92 1xvi n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xvi n ALA 74 N -1.58 1.82 -3.41 4.61 0.00 -0.71 -4.46 120.51 116.79 1xvi n ALA 74 Ca 0.00 -0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1xvi n ALA 74 Cb 0.00 -1.35 -0.16 0.00 0.00 0.00 0.00 19.45 17.94 1xvi n ALA 74 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xvi s VAL 75 N -3.14 0.45 -0.20 0.00 1.01 -0.97 -1.30 120.40 116.25 1xvi s VAL 75 Ca 0.07 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.94 1xvi s VAL 75 Cb 0.11 -0.46 0.05 0.00 0.00 0.00 0.00 36.38 36.08 1xvi s VAL 75 CO 0.39 0.18 -0.09 -0.63 0.00 0.00 0.00 175.10 174.95 1xvi s ILE 76 N 0.63 1.58 0.03 2.22 1.01 0.56 -1.31 121.20 125.92 1xvi s ILE 76 Ca -0.08 -1.02 -0.29 0.00 0.00 0.00 0.00 60.65 59.26 1xvi s ILE 76 Cb -0.11 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 1xvi s ILE 76 CO -0.00 0.11 0.95 -1.58 0.00 0.00 0.00 174.94 174.42 1xvi s GLN 77 N 1.41 4.59 0.43 2.79 2.00 -0.56 -1.06 119.66 129.27 1xvi s GLN 77 Ca -0.02 1.38 -0.05 0.00 -2.00 0.00 0.00 55.36 54.67 1xvi s GLN 77 Cb -0.17 -3.43 -0.04 0.00 0.80 0.00 0.00 33.01 30.17 1xvi s GLN 77 CO -0.08 0.04 0.73 -0.51 -0.50 0.00 0.00 175.29 174.98 1xvi s LEU 78 N 0.67 3.75 0.46 3.68 1.02 -0.45 -2.43 118.68 125.40 1xvi s LEU 78 Ca 0.49 0.89 -0.25 0.00 0.02 0.00 0.00 54.13 55.28 1xvi s LEU 78 Cb -0.21 -3.80 -0.08 0.00 0.02 0.00 0.00 46.19 42.11 1xvi s LEU 78 CO 0.28 -0.47 1.43 0.00 0.02 0.00 0.00 176.35 177.61 1xvi s ALA 79 N -2.56 3.20 0.19 4.21 0.00 -1.26 -4.35 121.76 121.19 1xvi s ALA 79 Ca 0.47 1.48 -0.02 0.00 0.00 0.00 0.00 51.96 53.88 1xvi s ALA 79 Cb -0.10 -3.60 0.39 0.00 0.00 0.00 0.00 23.12 19.81 1xvi s ALA 79 CO 0.40 -1.25 1.03 -1.91 0.00 0.00 0.00 175.76 174.03 1xvi n GLU 80 N -0.31 -0.06 -0.17 0.00 2.13 0.07 -1.67 120.64 120.64 1xvi n GLU 80 Ca 0.06 1.01 0.06 0.00 0.66 0.00 0.00 57.16 58.94 1xvi n GLU 80 Cb 0.42 -1.55 0.16 0.00 0.27 0.00 0.00 31.44 30.73 1xvi n GLU 80 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1xvi n GLN 81 N -4.99 1.79 -1.31 5.31 1.13 -1.26 -4.28 117.38 113.78 1xvi n GLN 81 Ca 0.13 -1.22 -0.29 0.00 -1.94 0.00 0.00 57.00 53.67 1xvi n GLN 81 Cb 0.41 -1.27 0.12 0.00 0.11 0.00 0.00 30.24 29.61 1xvi n GLN 81 CO 0.00 0.00 0.00 0.91 -1.44 0.00 0.00 177.06 176.53 1xvi n TRP 82 N 0.49 3.03 0.30 1.08 8.01 -0.67 -4.68 117.44 125.01 1xvi n TRP 82 Ca 0.12 -2.51 0.16 0.00 -1.31 0.00 0.00 57.50 53.96 1xvi n TRP 82 Cb 0.29 -1.16 0.95 0.00 -2.01 0.00 0.00 31.31 29.38 1xvi n TRP 82 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.69 178.64 1xvi h GLN 83 N 1.61 0.00 -0.01 -0.99 7.50 -1.80 -1.70 115.11 119.72 1xvi h GLN 83 Ca 0.58 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.73 1xvi h GLN 83 Cb 1.60 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.13 1xvi h GLN 83 CO 1.31 0.00 -0.06 0.39 -1.50 0.00 0.00 178.83 178.98 1xvi n GLU 84 N -3.74 1.43 -3.04 1.46 -0.58 -1.26 -4.82 120.64 110.08 1xvi n GLU 84 Ca -0.03 -0.81 -0.40 0.00 -0.42 0.00 0.00 57.16 55.50 1xvi n GLU 84 Cb 0.09 -1.48 -0.05 0.00 -0.57 0.00 0.00 31.44 29.42 1xvi n GLU 84 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1xvi s ILE 85 N -2.13 4.98 -0.02 -3.67 -1.09 -0.64 -4.99 121.20 113.64 1xvi s ILE 85 Ca 0.35 1.34 -0.35 0.00 -2.23 0.00 0.00 60.65 59.76 1xvi s ILE 85 Cb 0.21 -4.01 -0.13 0.00 -1.58 0.00 0.00 42.46 36.94 1xvi s ILE 85 CO 0.38 0.09 1.71 0.47 -1.23 0.00 0.00 174.94 176.37 1xvi n ASP 86 N 5.05 3.03 0.00 3.58 8.00 -1.26 -1.50 116.55 133.45 1xvi n ASP 86 Ca 0.01 1.03 0.00 0.00 0.71 0.00 0.00 54.79 56.54 1xvi n ASP 86 Cb 0.49 -1.34 0.00 0.00 -0.02 0.00 0.00 41.12 40.25 1xvi n ASP 86 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xvi n GLY 87 N 3.88 1.54 3.65 0.44 0.00 -1.26 -5.05 105.19 108.39 1xvi n GLY 87 Ca 0.21 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.79 1xvi n GLY 87 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1xvi n PHE 88 N -0.92 1.89 0.92 1.61 7.35 -0.56 -1.88 117.46 125.87 1xvi n PHE 88 Ca 0.00 0.60 0.13 0.00 -0.76 0.00 0.00 57.45 57.41 1xvi n PHE 88 Cb 0.00 -2.36 0.33 0.00 0.35 0.00 0.00 39.48 37.80 1xvi n PHE 88 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1xvi n PRO 89 N 0.79 0.06 -3.71 -7.13 -0.04 -1.26 -5.02 135.00 118.69 1xvi n PRO 89 Ca 0.07 0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.44 1xvi n PRO 89 Cb 0.34 -1.54 -0.11 0.00 -0.04 0.00 0.00 33.50 32.15 1xvi n PRO 89 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1xvi s ARG 90 N -3.03 0.36 -0.26 0.54 3.52 -0.79 -1.34 118.95 117.97 1xvi s ARG 90 Ca 0.11 0.71 -0.07 0.00 -0.13 0.00 0.00 55.73 56.35 1xvi s ARG 90 Cb 0.17 -0.01 -0.02 0.00 -1.56 0.00 0.00 34.95 33.53 1xvi s ARG 90 CO 0.66 -0.14 0.06 0.42 -0.81 0.00 0.00 175.30 175.48 1xvi s ILE 91 N 1.21 4.09 0.05 4.11 1.01 -0.22 -4.94 121.20 126.51 1xvi s ILE 91 Ca -0.08 -0.34 0.08 0.00 0.00 0.00 0.00 60.65 60.30 1xvi s ILE 91 Cb -0.08 -2.95 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 1xvi s ILE 91 CO -0.10 0.29 -0.19 -0.63 0.00 0.00 0.00 174.94 174.30 1xvi s ILE 92 N 1.57 2.69 0.33 2.92 1.01 -1.26 -0.32 121.20 128.13 1xvi s ILE 92 Ca 0.05 -1.27 -0.29 0.00 0.00 0.00 0.00 60.65 59.15 1xvi s ILE 92 Cb -0.15 -2.14 -0.12 0.00 0.01 0.00 0.00 42.46 40.06 1xvi s ILE 92 CO 0.02 0.30 1.35 -1.20 0.00 0.00 0.00 174.94 175.41 1xvi n SER 93 N 1.46 2.95 0.21 3.58 7.64 -0.42 -4.88 113.62 124.15 1xvi n SER 93 Ca -0.16 1.20 0.14 0.00 1.01 0.00 0.00 58.87 61.06 1xvi n SER 93 Cb 0.52 -1.50 0.73 0.00 -1.01 0.00 0.00 64.21 62.96 1xvi n SER 93 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1xvi h GLY 94 N 2.98 0.00 -7.15 0.23 0.00 -1.99 -3.35 103.07 93.79 1xvi h GLY 94 Ca -0.46 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 46.24 1xvi h GLY 94 CO 0.66 0.00 0.43 -0.42 0.00 0.00 0.00 176.54 177.21 1xvi s ILE 95 N -3.67 4.50 0.74 2.60 1.01 -1.26 -5.06 121.20 120.07 1xvi s ILE 95 Ca -0.02 0.03 -0.07 0.00 0.00 0.00 0.00 60.65 60.58 1xvi s ILE 95 Cb 0.08 -4.49 0.09 0.00 0.01 0.00 0.00 42.46 38.15 1xvi s ILE 95 CO 0.29 -1.07 1.06 -0.94 0.00 0.00 0.00 174.94 174.27 1xvi s SER 96 N 2.89 4.53 0.29 3.58 1.04 -1.26 -4.70 113.70 120.07 1xvi s SER 96 Ca 0.26 0.35 -0.03 0.00 0.48 0.00 0.00 55.95 57.01 1xvi s SER 96 Cb -0.15 -0.88 0.41 0.00 0.10 0.00 0.00 66.02 65.50 1xvi s SER 96 CO 0.16 -1.78 1.95 -0.74 0.98 0.00 0.00 173.24 173.81 1xvi h HIS 97 N -0.74 1.11 -0.63 5.02 2.76 -1.30 -2.26 115.15 119.12 1xvi h HIS 97 Ca -0.44 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 57.75 1xvi h HIS 97 Cb 1.30 -0.37 -0.03 0.00 1.55 0.00 0.00 27.41 29.86 1xvi h HIS 97 CO 0.08 0.67 0.34 0.78 -1.30 0.00 0.00 177.93 178.51 1xvi h GLY 98 N 1.17 0.94 1.05 5.26 0.00 -1.90 -0.24 103.07 109.35 1xvi h GLY 98 Ca 0.34 -0.42 -0.15 0.00 0.00 0.00 0.00 47.33 47.10 1xvi h GLY 98 CO -0.09 0.41 -0.38 -2.09 0.00 0.00 0.00 176.54 174.39 1xvi h GLU 99 N 0.85 0.81 -0.28 4.80 4.81 -1.90 -1.90 114.58 121.78 1xvi h GLU 99 Ca 0.22 -0.45 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1xvi h GLU 99 Cb 0.04 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1xvi h GLU 99 CO -0.04 1.09 0.16 0.82 -0.73 0.00 0.00 179.01 180.31 1xvi h ILE 100 N 0.58 1.11 -0.87 2.32 2.04 -1.31 -1.59 117.51 119.80 1xvi h ILE 100 Ca 0.04 -0.28 0.11 0.00 1.00 0.00 0.00 64.86 65.74 1xvi h ILE 100 Cb 0.97 0.78 -0.08 0.00 -0.74 0.00 0.00 36.82 37.75 1xvi h ILE 100 CO 0.09 0.11 0.50 0.28 0.00 0.00 0.00 178.15 179.13 1xvi h SER 101 N 0.35 0.71 -0.26 1.72 0.02 -0.95 0.16 113.55 115.31 1xvi h SER 101 Ca 0.10 0.06 0.01 0.00 -0.84 0.00 0.00 61.79 61.12 1xvi h SER 101 Cb 0.03 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1xvi h SER 101 CO -0.02 0.38 0.15 -0.07 -1.14 0.00 0.00 176.83 176.13 1xvi h LEU 102 N 0.81 0.23 -0.47 5.07 3.38 -0.95 -0.79 115.31 122.60 1xvi h LEU 102 Ca 0.43 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.38 1xvi h LEU 102 Cb 0.44 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1xvi h LEU 102 CO -0.27 0.17 0.21 0.58 0.09 0.00 0.00 178.44 179.22 1xvi h VAL 103 N 0.30 1.20 -0.70 1.22 2.07 -0.63 -1.34 116.25 118.37 1xvi h VAL 103 Ca 0.10 -0.58 -0.07 0.00 0.82 0.00 0.00 66.70 66.97 1xvi h VAL 103 Cb 0.00 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 1xvi h VAL 103 CO -0.05 0.22 0.15 -0.07 0.02 0.00 0.00 177.57 177.84 1xvi h LEU 104 N 0.62 1.08 -0.66 2.57 3.38 -0.53 -1.90 115.31 119.87 1xvi h LEU 104 Ca 0.16 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 1xvi h LEU 104 Cb 0.15 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1xvi h LEU 104 CO -0.02 1.04 -0.63 0.78 0.09 0.00 0.00 178.44 179.70 1xvi h ASN 105 N 1.06 0.17 -0.31 -0.43 2.35 -1.05 -2.23 115.58 115.15 1xvi h ASN 105 Ca 0.22 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1xvi h ASN 105 Cb 0.40 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 1xvi h ASN 105 CO 0.01 0.76 0.12 0.74 -1.65 0.00 0.00 177.43 177.41 1xvi h THR 106 N 0.11 1.18 -0.78 2.81 2.02 -0.88 -1.18 112.91 116.19 1xvi h THR 106 Ca -0.01 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.61 1xvi h THR 106 Cb 1.14 0.97 -0.04 0.00 -1.74 0.00 0.00 68.15 68.48 1xvi h THR 106 CO 0.09 0.19 0.45 -0.07 0.37 0.00 0.00 175.52 176.55 1xvi h LEU 107 N 0.35 0.96 -0.32 2.58 3.38 -1.27 -0.61 115.31 120.37 1xvi h LEU 107 Ca 0.10 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1xvi h LEU 107 Cb 0.18 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1xvi h LEU 107 CO -0.01 0.76 -0.16 -0.09 0.09 0.00 0.00 178.44 179.03 1xvi h ARG 108 N 1.07 0.67 -0.14 1.13 2.43 -1.33 0.92 114.38 119.13 1xvi h ARG 108 Ca 0.28 -0.30 -0.20 0.00 -0.81 0.00 0.00 59.98 58.95 1xvi h ARG 108 Cb 0.00 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1xvi h ARG 108 CO -0.05 0.89 -0.69 0.93 -1.51 0.00 0.00 179.97 179.54 1xvi h GLU 109 N 0.43 0.72 0.05 0.20 4.39 -1.11 -1.61 114.58 117.64 1xvi h GLU 109 Ca 0.07 -0.58 -0.29 0.00 0.34 0.00 0.00 59.36 58.89 1xvi h GLU 109 Cb 0.70 0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.43 1xvi h GLU 109 CO 0.05 1.20 -1.61 0.87 -1.16 0.00 0.00 179.01 178.35 1xvi h LYS 110 N 0.42 0.10 -0.00 2.33 1.57 -1.18 -3.39 116.57 116.42 1xvi h LYS 110 Ca -0.05 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1xvi h LYS 110 Cb 1.33 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.70 1xvi h LYS 110 CO 0.14 0.82 -0.13 0.39 -0.57 0.00 0.00 179.45 180.11 1xvi n GLU 111 N -3.25 3.29 -3.21 3.15 1.02 0.29 -5.02 120.64 116.90 1xvi n GLU 111 Ca -0.17 -0.31 -0.23 0.00 -0.02 0.00 0.00 57.16 56.44 1xvi n GLU 111 Cb 1.03 -0.86 0.05 0.00 -0.02 0.00 0.00 31.44 31.65 1xvi n GLU 111 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1xvi n HIS 112 N -0.57 -2.28 -2.01 -0.32 8.25 -0.61 -4.97 115.22 112.71 1xvi n HIS 112 Ca 0.02 0.69 -0.41 0.00 -0.26 0.00 0.00 57.72 57.76 1xvi n HIS 112 Cb 0.09 -4.70 -0.02 0.00 1.12 0.00 0.00 29.99 26.48 1xvi n HIS 112 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1xvi s PHE 113 N -3.23 2.92 -0.41 4.41 0.08 -1.25 -4.99 117.98 115.51 1xvi s PHE 113 Ca 0.40 1.27 -0.16 0.00 0.12 0.00 0.00 56.93 58.56 1xvi s PHE 113 Cb -0.18 -3.80 0.02 0.00 -0.57 0.00 0.00 43.02 38.49 1xvi s PHE 113 CO 0.49 -2.33 0.36 0.15 -0.10 0.00 0.00 175.22 173.79 1xvi s LYS 114 N -1.57 3.05 -0.02 0.44 1.02 -1.26 -4.69 119.74 116.71 1xvi s LYS 114 Ca 0.52 -0.89 -0.29 0.00 0.02 0.00 0.00 55.97 55.33 1xvi s LYS 114 Cb -0.42 -3.97 0.11 0.00 -0.52 0.00 0.00 37.83 33.03 1xvi s LYS 114 CO 0.53 -0.78 0.91 -0.59 -0.92 0.00 0.00 175.35 174.51 1xvi s PHE 115 N 1.88 -0.33 -0.11 3.18 -0.12 -1.26 -0.16 117.98 121.05 1xvi s PHE 115 Ca 0.08 0.23 0.00 0.00 -0.05 0.00 0.00 56.93 57.19 1xvi s PHE 115 Cb -0.18 0.53 0.02 0.00 -0.63 0.00 0.00 43.02 42.76 1xvi s PHE 115 CO 0.12 -0.51 -0.10 0.99 -0.05 0.00 0.00 175.22 175.67 1xvi s THR 116 N -2.98 1.15 0.53 -4.49 2.01 -0.57 -4.94 115.64 106.35 1xvi s THR 116 Ca 0.05 -0.38 -0.02 0.00 0.31 0.00 0.00 61.69 61.65 1xvi s THR 116 Cb -0.01 -1.13 0.01 0.00 0.01 0.00 0.00 72.50 71.38 1xvi s THR 116 CO -0.08 0.38 0.79 0.42 -0.69 0.00 0.00 174.62 175.44 1xvi s THR 117 N 1.52 3.54 0.31 -0.82 -4.23 -1.26 -0.29 115.64 114.41 1xvi s THR 117 Ca 0.02 -0.34 0.38 0.00 -1.18 0.00 0.00 61.69 60.57 1xvi s THR 117 Cb -0.13 -3.36 0.41 0.00 1.34 0.00 0.00 72.50 70.76 1xvi s THR 117 CO -0.07 -0.30 2.13 -0.26 -0.54 0.00 0.00 174.62 175.58 1xvi h PHE 118 N 0.09 0.00 0.00 3.99 -1.00 -1.38 -2.14 116.94 116.50 1xvi h PHE 118 Ca -0.45 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.27 1xvi h PHE 118 Cb 1.27 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.82 1xvi h PHE 118 CO 0.44 0.00 -0.29 -0.44 -1.61 0.00 0.00 178.31 176.40 1xvi h ASP 119 N 0.00 0.00 0.54 2.17 3.32 -1.89 -3.32 116.42 117.24 1xvi h ASP 119 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xvi h ASP 119 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1xvi h ASP 119 CO 0.00 0.29 -0.05 0.47 -1.72 0.00 0.00 179.24 178.23 1xvi n ASP 120 N -3.42 0.15 -4.39 6.45 8.00 -0.80 -4.91 116.55 117.63 1xvi n ASP 120 Ca 0.00 -0.21 -0.19 0.00 0.71 0.00 0.00 54.79 55.10 1xvi n ASP 120 Cb 0.48 -0.23 -0.10 0.00 -0.02 0.00 0.00 41.12 41.25 1xvi n ASP 120 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1xvi s VAL 121 N -2.59 0.96 0.69 2.53 -7.23 -1.25 -5.01 120.40 108.50 1xvi s VAL 121 Ca 0.27 -2.01 -0.06 0.00 -1.81 0.00 0.00 61.98 58.38 1xvi s VAL 121 Cb 0.20 -2.68 0.06 0.00 0.56 0.00 0.00 36.38 34.52 1xvi s VAL 121 CO 0.48 -0.04 0.99 1.51 -0.31 0.00 0.00 175.10 177.72 1xvi s ASP 122 N -3.40 4.84 0.21 4.85 1.47 -1.26 -4.95 116.67 118.42 1xvi s ASP 122 Ca 0.36 0.38 -0.09 0.00 1.18 0.00 0.00 52.55 54.39 1xvi s ASP 122 Cb 0.08 -1.05 0.31 0.00 -0.34 0.00 0.00 42.92 41.92 1xvi s ASP 122 CO 0.14 -1.56 1.73 0.44 0.68 0.00 0.00 175.17 176.60 1xvi h ASP 123 N -0.53 0.18 -0.79 2.11 3.45 -1.93 -2.32 116.42 116.59 1xvi h ASP 123 Ca -0.44 0.09 0.11 0.00 0.43 0.00 0.00 57.03 57.22 1xvi h ASP 123 Cb 1.31 0.08 -0.05 0.00 -0.56 0.00 0.00 39.33 40.11 1xvi h ASP 123 CO 0.59 0.10 0.51 0.00 -1.57 0.00 0.00 179.24 178.87 1xvi h ALA 124 N 1.45 1.84 -0.02 3.45 0.00 -1.95 0.10 119.26 124.13 1xvi h ALA 124 Ca 0.32 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 55.05 1xvi h ALA 124 Cb 0.43 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1xvi h ALA 124 CO -0.34 -0.01 -0.78 1.15 0.00 0.00 0.00 179.25 179.26 1xvi h THR 125 N 0.66 1.47 -0.05 0.00 2.02 -1.81 -2.06 112.91 113.13 1xvi h THR 125 Ca 0.37 -2.42 -0.03 0.00 0.77 0.00 0.00 66.41 65.10 1xvi h THR 125 Cb 0.54 2.32 -0.00 0.00 -1.74 0.00 0.00 68.15 69.27 1xvi h THR 125 CO -0.14 0.71 -0.08 0.40 0.37 0.00 0.00 175.52 176.77 1xvi h ILE 126 N 0.12 1.41 -0.89 3.11 2.04 -0.90 -1.63 117.51 120.78 1xvi h ILE 126 Ca -0.03 -1.35 0.23 0.00 1.00 0.00 0.00 64.86 64.71 1xvi h ILE 126 Cb 1.37 2.19 -0.13 0.00 -0.74 0.00 0.00 36.82 39.51 1xvi h ILE 126 CO 0.12 0.37 0.32 0.00 0.00 0.00 0.00 178.15 178.95 1xvi h ALA 127 N 0.49 1.37 -0.20 1.87 0.00 -0.88 0.22 119.26 122.13 1xvi h ALA 127 Ca 0.00 0.20 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1xvi h ALA 127 Cb 0.64 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1xvi h ALA 127 CO 0.02 -0.42 -0.33 1.49 0.00 0.00 0.00 179.25 180.01 1xvi h GLU 128 N 0.29 0.41 0.02 0.00 4.81 -1.25 0.14 114.58 119.00 1xvi h GLU 128 Ca 0.56 -0.17 -0.22 0.00 -0.13 0.00 0.00 59.36 59.40 1xvi h GLU 128 Cb 1.12 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 1xvi h GLU 128 CO -0.60 0.69 -1.03 -1.49 -0.73 0.00 0.00 179.01 175.86 1xvi h TRP 129 N 0.36 0.09 -0.00 0.92 6.55 0.03 -3.37 115.95 120.53 1xvi h TRP 129 Ca 0.04 -0.06 0.00 0.00 0.95 0.00 0.00 58.89 59.82 1xvi h TRP 129 Cb 0.75 -0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.05 1xvi h TRP 129 CO 0.02 1.03 -0.51 0.25 -1.05 0.00 0.00 178.44 178.19 1xvi n THR 130 N -3.40 0.00 -0.21 1.49 -2.24 0.56 -4.98 114.28 105.50 1xvi n THR 130 Ca -0.01 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1xvi n THR 130 Cb 0.94 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 70.22 1xvi n THR 130 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xvi n GLY 131 N 1.22 1.52 3.74 3.38 0.00 0.49 -4.99 105.19 110.54 1xvi n GLY 131 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1xvi n GLY 131 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xvi s LEU 132 N 0.00 2.33 0.88 0.99 1.43 -1.19 -4.97 118.68 118.15 1xvi s LEU 132 Ca 0.00 1.44 -0.11 0.00 -1.03 0.00 0.00 54.13 54.42 1xvi s LEU 132 Cb 0.00 -3.90 0.12 0.00 0.03 0.00 0.00 46.19 42.44 1xvi s LEU 132 CO 0.00 -2.49 1.09 -0.94 0.23 0.00 0.00 176.35 174.24 1xvi s SER 133 N -3.54 3.59 0.33 2.29 1.04 -1.26 -4.52 113.70 111.63 1xvi s SER 133 Ca 0.63 1.48 0.01 0.00 0.48 0.00 0.00 55.95 58.54 1xvi s SER 133 Cb -0.17 -2.16 0.57 0.00 0.10 0.00 0.00 66.02 64.36 1xvi s SER 133 CO 0.56 -2.56 1.99 -0.09 0.98 0.00 0.00 173.24 174.12 1xvi h ARG 134 N -1.50 0.92 -0.26 4.02 2.43 -1.94 -0.97 114.38 117.07 1xvi h ARG 134 Ca -0.49 -0.06 -0.13 0.00 -0.81 0.00 0.00 59.98 58.49 1xvi h ARG 134 Cb 1.28 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1xvi h ARG 134 CO 0.55 0.61 -0.38 1.03 -1.51 0.00 0.00 179.97 180.26 1xvi h SER 135 N 0.95 0.64 0.17 -3.80 0.87 -1.95 -1.62 113.55 108.81 1xvi h SER 135 Ca 0.26 -0.28 -0.31 0.00 -1.23 0.00 0.00 61.79 60.24 1xvi h SER 135 Cb -0.10 -0.18 0.03 0.00 -0.44 0.00 0.00 62.40 61.71 1xvi h SER 135 CO -0.06 0.96 -1.29 1.56 -0.53 0.00 0.00 176.83 177.47 1xvi h GLN 136 N 0.50 0.60 -0.96 2.24 1.08 -1.86 -3.21 115.11 113.51 1xvi h GLN 136 Ca 0.05 -0.84 0.16 0.00 -1.45 0.00 0.00 58.65 56.57 1xvi h GLN 136 Cb 0.89 0.28 -0.08 0.00 -0.05 0.00 0.00 27.48 28.52 1xvi h GLN 136 CO 0.08 1.39 0.60 0.00 -0.95 0.00 0.00 178.83 179.95 1xvi h ALA 137 N 0.28 1.75 -1.00 3.87 0.00 -1.07 -0.48 119.26 122.61 1xvi h ALA 137 Ca -0.20 0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1xvi h ALA 137 Cb 1.96 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 19.56 1xvi h ALA 137 CO 0.24 -0.04 0.65 0.00 0.00 0.00 0.00 179.25 180.10 1xvi h ALA 138 N 1.60 1.38 -0.12 0.00 0.00 -1.29 -1.03 119.26 119.78 1xvi h ALA 138 Ca 0.50 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 55.23 1xvi h ALA 138 Cb 0.77 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1xvi h ALA 138 CO -0.27 0.47 -0.59 -0.07 0.00 0.00 0.00 179.25 178.79 1xvi h LEU 139 N 1.20 0.47 -2.32 0.00 3.38 -1.18 -2.58 115.31 114.28 1xvi h LEU 139 Ca 0.42 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1xvi h LEU 139 Cb 0.13 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1xvi h LEU 139 CO -0.16 0.95 -0.03 0.74 0.09 0.00 0.00 178.44 180.03 1xvi h THR 140 N 0.31 0.23 0.01 0.22 2.02 -0.65 -2.95 112.91 112.09 1xvi h THR 140 Ca -0.00 -0.25 -0.29 0.00 0.77 0.00 0.00 66.41 66.63 1xvi h THR 140 Cb 1.12 1.20 -0.05 0.00 -1.74 0.00 0.00 68.15 68.69 1xvi h THR 140 CO 0.10 0.03 -1.68 -0.61 0.37 0.00 0.00 175.52 173.74 1xvi h GLN 141 N 0.00 0.02 -6.31 6.66 4.15 -0.82 -3.45 115.11 115.36 1xvi h GLN 141 Ca -0.00 -0.03 -0.57 0.00 0.77 0.00 0.00 58.65 58.82 1xvi h GLN 141 Cb 0.20 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 1xvi h GLN 141 CO 0.00 0.56 1.18 -0.51 -1.93 0.00 0.00 178.83 178.14 1xvi s LEU 142 N -6.18 3.69 -0.04 -2.39 1.43 -1.05 -4.86 118.68 109.29 1xvi s LEU 142 Ca -0.05 1.39 0.05 0.00 -1.03 0.00 0.00 54.13 54.49 1xvi s LEU 142 Cb 0.08 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 1xvi s LEU 142 CO 0.82 -1.47 -0.19 -1.00 0.23 0.00 0.00 176.35 174.74 1xvi s HIS 143 N 5.93 2.55 -0.16 0.29 3.76 -1.26 -4.55 115.29 121.86 1xvi s HIS 143 Ca 0.74 -0.28 -0.09 0.00 -0.15 0.00 0.00 55.06 55.28 1xvi s HIS 143 Cb -0.23 -1.58 -0.23 0.00 1.11 0.00 0.00 32.58 31.65 1xvi s HIS 143 CO 0.32 0.09 0.25 0.39 -0.85 0.00 0.00 174.74 174.93 1xvi n GLU 144 N 2.38 0.71 -2.43 1.40 1.02 -1.26 -4.68 120.64 117.78 1xvi n GLU 144 Ca -0.17 0.31 -0.01 0.00 -0.02 0.00 0.00 57.16 57.27 1xvi n GLU 144 Cb 0.52 -1.69 0.06 0.00 -0.02 0.00 0.00 31.44 30.31 1xvi n GLU 144 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xvi n ALA 145 N -3.15 2.74 -3.80 0.62 0.00 -1.26 -0.94 120.51 114.72 1xvi n ALA 145 Ca -0.34 -2.03 -0.05 0.00 0.00 0.00 0.00 53.44 51.02 1xvi n ALA 145 Cb 0.97 -0.80 -0.01 0.00 0.00 0.00 0.00 19.45 19.62 1xvi n ALA 145 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1xvi s SER 146 N -2.56 -0.18 -0.05 0.00 1.04 -1.26 -4.52 113.70 106.18 1xvi s SER 146 Ca 0.21 -0.54 0.01 0.00 0.48 0.00 0.00 55.95 56.10 1xvi s SER 146 Cb 0.34 0.59 0.02 0.00 0.10 0.00 0.00 66.02 67.07 1xvi s SER 146 CO -0.08 -1.11 -0.05 -0.69 0.98 0.00 0.00 173.24 172.29 1xvi s VAL 147 N -3.33 0.60 -0.11 5.02 1.01 -0.21 -4.64 120.40 118.74 1xvi s VAL 147 Ca 0.13 -0.15 -0.12 0.00 0.00 0.00 0.00 61.98 61.84 1xvi s VAL 147 Cb -0.03 -0.62 -0.05 0.00 0.00 0.00 0.00 36.38 35.68 1xvi s VAL 147 CO 0.05 0.24 0.27 -0.89 0.00 0.00 0.00 175.10 174.77 1xvi s THR 148 N 0.93 5.30 0.07 3.92 2.01 -1.26 -0.60 115.64 126.00 1xvi s THR 148 Ca -0.11 0.51 -0.06 0.00 0.31 0.00 0.00 61.69 62.34 1xvi s THR 148 Cb -0.14 -3.58 -0.01 0.00 0.01 0.00 0.00 72.50 68.78 1xvi s THR 148 CO 0.00 0.51 0.12 -1.48 -0.69 0.00 0.00 174.62 173.09 1xvi s LEU 149 N -0.38 1.72 -0.21 4.42 0.05 -0.57 -0.85 118.68 122.86 1xvi s LEU 149 Ca 0.17 -0.68 -0.08 0.00 0.05 0.00 0.00 54.13 53.59 1xvi s LEU 149 Cb -0.14 0.77 -0.04 0.00 -2.05 0.00 0.00 46.19 44.73 1xvi s LEU 149 CO 0.06 -0.65 0.09 -0.63 -0.55 0.00 0.00 176.35 174.68 1xvi s ILE 150 N -3.54 4.87 0.12 1.48 1.01 0.61 -1.88 121.20 123.87 1xvi s ILE 150 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 60.65 60.38 1xvi s ILE 150 Cb 0.04 -3.24 -0.06 0.00 0.01 0.00 0.00 42.46 39.21 1xvi s ILE 150 CO -0.09 0.40 0.97 0.86 0.00 0.00 0.00 174.94 177.07 1xvi s TRP 151 N 0.86 3.82 -0.08 3.97 -0.11 -1.26 -1.52 118.94 124.62 1xvi s TRP 151 Ca 0.05 1.80 0.12 0.00 1.22 0.00 0.00 56.10 59.29 1xvi s TRP 151 Cb -0.13 -3.06 0.22 0.00 -1.50 0.00 0.00 33.47 28.99 1xvi s TRP 151 CO 0.03 0.19 1.11 0.54 -4.62 0.00 0.00 176.95 174.19 1xvi n ARG 152 N 2.67 0.70 -2.47 5.86 5.12 0.77 -4.94 116.66 124.38 1xvi n ARG 152 Ca 0.02 -2.03 -0.06 0.00 -1.93 0.00 0.00 57.85 53.86 1xvi n ARG 152 Cb 0.49 -0.98 -0.01 0.00 -1.16 0.00 0.00 32.46 30.80 1xvi n ARG 152 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1xvi n ASP 153 N -0.65 1.98 -4.92 0.55 -0.08 -0.97 -4.76 116.55 107.70 1xvi n ASP 153 Ca 0.09 -1.40 -0.26 0.00 -1.51 0.00 0.00 54.79 51.71 1xvi n ASP 153 Cb 0.73 0.09 0.01 0.00 2.34 0.00 0.00 41.12 44.29 1xvi n ASP 153 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 1xvi s SER 154 N -1.49 6.03 0.30 1.67 1.04 -1.26 -4.91 113.70 115.09 1xvi s SER 154 Ca 0.01 0.75 -0.01 0.00 0.48 0.00 0.00 55.95 57.19 1xvi s SER 154 Cb 0.00 -2.00 0.49 0.00 0.10 0.00 0.00 66.02 64.62 1xvi s SER 154 CO 0.01 -0.70 1.95 0.44 0.98 0.00 0.00 173.24 175.91 1xvi h ASP 155 N 0.18 0.91 -0.49 7.02 5.19 -2.01 0.46 116.42 127.69 1xvi h ASP 155 Ca -0.47 -0.01 -0.07 0.00 -0.62 0.00 0.00 57.03 55.86 1xvi h ASP 155 Cb 1.23 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 40.50 1xvi h ASP 155 CO 0.61 0.64 0.07 -0.08 -3.12 0.00 0.00 179.24 177.35 1xvi h GLU 156 N 1.07 0.88 -0.23 3.56 4.57 -2.00 -1.49 114.58 120.94 1xvi h GLU 156 Ca 0.33 -0.22 -0.15 0.00 -1.18 0.00 0.00 59.36 58.15 1xvi h GLU 156 Cb -0.01 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1xvi h GLU 156 CO -0.09 0.83 -0.46 0.00 -1.18 0.00 0.00 179.01 178.11 1xvi h ARG 157 N 0.83 0.59 -0.91 1.92 2.47 -1.74 -2.81 114.38 114.74 1xvi h ARG 157 Ca 0.17 -0.33 0.03 0.00 -1.26 0.00 0.00 59.98 58.59 1xvi h ARG 157 Cb 0.40 0.02 -0.05 0.00 -1.65 0.00 0.00 29.97 28.68 1xvi h ARG 157 CO 0.01 0.93 0.59 1.98 0.56 0.00 0.00 179.97 184.04 1xvi h MET 158 N 0.48 1.11 -0.49 0.04 4.05 -0.58 -1.61 114.93 117.92 1xvi h MET 158 Ca 0.03 -0.07 -0.05 0.00 -0.28 0.00 0.00 59.70 59.33 1xvi h MET 158 Cb 0.98 -0.25 -0.02 0.00 -0.80 0.00 0.00 31.60 31.51 1xvi h MET 158 CO 0.09 0.74 0.10 0.00 0.23 0.00 0.00 176.91 178.07 1xvi h ALA 159 N 1.37 0.64 0.00 0.39 0.00 -1.12 -0.90 119.26 119.65 1xvi h ALA 159 Ca 0.36 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1xvi h ALA 159 Cb -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1xvi h ALA 159 CO -0.12 0.35 -0.22 -0.56 0.00 0.00 0.00 179.25 178.71 1xvi h GLN 160 N 0.67 0.00 0.04 0.00 3.07 -1.36 -2.91 115.11 114.63 1xvi h GLN 160 Ca 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.89 1xvi h GLN 160 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.92 1xvi h GLN 160 CO 0.01 0.22 -0.02 0.35 0.09 0.00 0.00 178.83 179.48 1xvi h PHE 161 N 0.00 -0.05 -0.95 0.06 3.57 -0.88 -2.48 116.94 116.21 1xvi h PHE 161 Ca -0.00 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.58 1xvi h PHE 161 Cb 0.59 0.02 -0.07 0.00 2.79 0.00 0.00 35.95 39.28 1xvi h PHE 161 CO 0.00 0.35 0.60 0.00 -2.23 0.00 0.00 178.31 177.02 1xvi h THR 162 N -0.46 1.01 -0.07 4.41 1.03 -1.11 -1.05 112.91 116.67 1xvi h THR 162 Ca -0.01 -0.35 -0.01 0.00 -0.01 0.00 0.00 66.41 66.03 1xvi h THR 162 Cb 0.42 -0.12 -0.00 0.00 -1.07 0.00 0.00 68.15 67.38 1xvi h THR 162 CO 0.01 0.19 0.01 0.00 -0.01 0.00 0.00 175.52 175.71 1xvi h ALA 163 N 1.47 0.09 -0.51 0.00 0.00 -1.56 0.18 119.26 118.93 1xvi h ALA 163 Ca 0.44 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.25 1xvi h ALA 163 Cb 0.29 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1xvi h ALA 163 CO -0.21 -0.24 0.19 0.00 0.00 0.00 0.00 179.25 178.98 1xvi h ARG 164 N -0.15 0.36 -0.18 0.00 2.47 -1.22 -0.10 114.38 115.56 1xvi h ARG 164 Ca 0.02 -0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1xvi h ARG 164 Cb 0.31 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 1xvi h ARG 164 CO 0.00 0.24 0.10 -0.07 0.56 0.00 0.00 179.97 180.80 1xvi h LEU 165 N 0.37 0.22 -0.63 3.04 3.38 -0.99 -2.42 115.31 118.29 1xvi h LEU 165 Ca 0.24 -0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.21 1xvi h LEU 165 Cb 0.25 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 1xvi h LEU 165 CO -0.24 0.23 0.32 0.78 0.09 0.00 0.00 178.44 179.62 1xvi h ASN 166 N 0.20 0.44 -0.12 -0.43 2.35 -0.26 -0.00 115.58 117.75 1xvi h ASN 166 Ca 0.06 0.04 0.03 0.00 -0.55 0.00 0.00 56.30 55.89 1xvi h ASN 166 Cb 0.06 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 1xvi h ASN 166 CO -0.01 0.28 0.09 -0.33 -1.65 0.00 0.00 177.43 175.80 1xvi h GLU 167 N 0.58 0.01 -0.52 0.81 5.08 -0.85 -2.54 114.58 117.15 1xvi h GLU 167 Ca 0.29 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1xvi h GLU 167 Cb 0.24 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1xvi h GLU 167 CO -0.21 0.01 0.00 1.28 -1.00 0.00 0.00 179.01 179.09 1xvi n LEU 168 N -4.51 2.82 0.00 1.33 4.77 -0.18 -4.92 117.00 116.32 1xvi n LEU 168 Ca -0.00 -1.42 0.00 0.00 -0.03 0.00 0.00 56.01 54.56 1xvi n LEU 168 Cb 0.20 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 1xvi n LEU 168 CO 0.35 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 1xvi n GLY 169 N 1.13 0.54 3.36 -0.72 0.00 -0.96 -5.04 105.19 103.50 1xvi n GLY 169 Ca 0.16 -0.64 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 1xvi n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xvi s LEU 170 N 0.00 2.27 0.19 0.99 1.43 -0.24 -0.99 118.68 122.35 1xvi s LEU 170 Ca 0.00 -0.69 0.08 0.00 -1.03 0.00 0.00 54.13 52.49 1xvi s LEU 170 Cb 0.00 -1.17 -0.04 0.00 0.03 0.00 0.00 46.19 45.00 1xvi s LEU 170 CO 0.00 0.18 -0.04 0.00 0.23 0.00 0.00 176.35 176.73 1xvi s GLN 171 N -1.79 2.26 -0.33 1.70 -2.07 0.39 -2.35 119.66 117.46 1xvi s GLN 171 Ca 0.12 -1.23 0.02 0.00 -1.82 0.00 0.00 55.36 52.45 1xvi s GLN 171 Cb -0.10 -2.25 0.09 0.00 -1.09 0.00 0.00 33.01 29.66 1xvi s GLN 171 CO 0.05 0.43 0.03 0.12 -1.32 0.00 0.00 175.29 174.59 1xvi s PHE 172 N -1.84 3.56 -0.22 9.60 5.36 -1.26 -2.80 117.98 130.39 1xvi s PHE 172 Ca 0.27 -2.63 -0.03 0.00 -0.96 0.00 0.00 56.93 53.58 1xvi s PHE 172 Cb -0.09 -2.64 -0.00 0.00 -0.34 0.00 0.00 43.02 39.95 1xvi s PHE 172 CO 0.18 -0.92 -0.06 1.41 -1.46 0.00 0.00 175.22 174.37 1xvi s MET 173 N 1.02 3.29 0.17 10.12 -2.45 0.55 -4.92 119.30 127.08 1xvi s MET 173 Ca 0.04 -0.68 -0.30 0.00 -1.25 0.00 0.00 55.69 53.50 1xvi s MET 173 Cb -0.20 -2.97 -0.07 0.00 1.25 0.00 0.00 34.83 32.84 1xvi s MET 173 CO -0.06 -0.22 1.08 -1.14 1.05 0.00 0.00 175.02 175.73 1xvi s GLN 174 N 1.45 4.62 0.04 4.11 0.74 -1.26 -0.30 119.66 129.05 1xvi s GLN 174 Ca 0.05 1.67 0.00 0.00 0.05 0.00 0.00 55.36 57.14 1xvi s GLN 174 Cb -0.14 -3.29 0.00 0.00 1.10 0.00 0.00 33.01 30.68 1xvi s GLN 174 CO -0.04 0.11 0.01 0.41 -0.55 0.00 0.00 175.29 175.22 1xvi n GLY 175 N 2.07 3.65 0.30 2.59 0.00 0.23 -4.95 105.19 109.09 1xvi n GLY 175 Ca 0.03 -2.20 -0.09 0.00 0.00 0.00 0.00 46.02 43.75 1xvi n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xvi h ALA 176 N 0.89 -0.22 0.00 4.61 0.00 -2.03 -3.38 119.26 119.14 1xvi h ALA 176 Ca -0.03 0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1xvi h ALA 176 Cb 0.09 0.56 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1xvi h ALA 176 CO 0.04 -0.72 -1.59 0.54 0.00 0.00 0.00 179.25 177.52 1xvi n ARG 177 N -5.39 0.25 -4.21 0.00 3.00 -1.26 -5.09 116.66 103.96 1xvi n ARG 177 Ca -0.02 0.08 -0.24 0.00 -0.01 0.00 0.00 57.85 57.67 1xvi n ARG 177 Cb 0.31 -1.07 -0.07 0.00 0.00 0.00 0.00 32.46 31.62 1xvi n ARG 177 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 1xvi s PHE 178 N -2.20 2.65 0.16 -1.55 0.08 -1.26 -5.02 117.98 110.84 1xvi s PHE 178 Ca -0.14 -0.38 -0.04 0.00 0.12 0.00 0.00 56.93 56.48 1xvi s PHE 178 Cb 0.05 -1.53 -0.05 0.00 -0.57 0.00 0.00 43.02 40.91 1xvi s PHE 178 CO 0.22 0.42 0.39 -1.58 -0.10 0.00 0.00 175.22 174.57 1xvi s TRP 179 N -2.44 3.47 0.01 0.36 0.52 -0.79 -0.60 118.94 119.48 1xvi s TRP 179 Ca 0.36 0.53 0.05 0.00 0.02 0.00 0.00 56.10 57.06 1xvi s TRP 179 Cb -0.02 -1.99 -0.02 0.00 -1.15 0.00 0.00 33.47 30.29 1xvi s TRP 179 CO 0.21 0.41 -0.15 -1.01 0.02 0.00 0.00 176.95 176.43 1xvi s HIS 180 N -1.72 1.29 -0.11 -1.98 3.76 0.59 -1.51 115.29 115.61 1xvi s HIS 180 Ca 0.41 -0.29 0.03 0.00 -0.15 0.00 0.00 55.06 55.06 1xvi s HIS 180 Cb -0.12 -0.80 -0.00 0.00 1.11 0.00 0.00 32.58 32.77 1xvi s HIS 180 CO 0.26 0.01 -0.21 0.08 -0.85 0.00 0.00 174.74 174.02 1xvi s VAL 181 N -0.55 2.26 0.19 -0.90 1.01 0.23 -0.33 120.40 122.30 1xvi s VAL 181 Ca 0.04 -0.94 -0.23 0.00 0.00 0.00 0.00 61.98 60.85 1xvi s VAL 181 Cb -0.07 -1.89 0.06 0.00 0.00 0.00 0.00 36.38 34.48 1xvi s VAL 181 CO 0.00 0.55 0.68 -1.48 0.00 0.00 0.00 175.10 174.85 1xvi s LEU 182 N 0.42 -0.43 -0.13 3.92 2.34 -1.12 -1.04 118.68 122.63 1xvi s LEU 182 Ca -0.16 -0.22 -0.42 0.00 0.06 0.00 0.00 54.13 53.39 1xvi s LEU 182 Cb -0.17 2.58 -0.20 0.00 -0.56 0.00 0.00 46.19 47.84 1xvi s LEU 182 CO 0.07 -1.07 1.25 -0.67 -1.06 0.00 0.00 176.35 174.86 1xvi n ASP 183 N -0.40 0.49 0.28 1.48 -0.08 -1.26 -0.46 116.55 116.59 1xvi n ASP 183 Ca -0.12 1.16 0.18 0.00 -1.51 0.00 0.00 54.79 54.50 1xvi n ASP 183 Cb 0.63 -0.93 0.76 0.00 2.34 0.00 0.00 41.12 43.91 1xvi n ASP 183 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xvi h ALA 184 N 3.75 1.02 -0.11 -1.67 0.00 -1.33 -2.52 119.26 118.40 1xvi h ALA 184 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1xvi h ALA 184 Cb 1.40 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1xvi h ALA 184 CO 0.75 0.03 0.00 -1.13 0.00 0.00 0.00 179.25 178.90 1xvi n SER 185 N -3.14 1.71 -4.94 0.00 3.41 -1.26 -4.88 113.62 104.52 1xvi n SER 185 Ca -0.00 -1.64 -0.25 0.00 -0.26 0.00 0.00 58.87 56.72 1xvi n SER 185 Cb 0.27 -0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 64.13 1xvi n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xvi s ALA 186 N -1.87 3.87 -0.17 7.33 0.00 -0.95 -4.99 121.76 124.98 1xvi s ALA 186 Ca 0.35 -0.99 -0.31 0.00 0.00 0.00 0.00 51.96 51.00 1xvi s ALA 186 Cb 0.19 -1.89 0.14 0.00 0.00 0.00 0.00 23.12 21.56 1xvi s ALA 186 CO 0.30 0.35 1.12 0.20 0.00 0.00 0.00 175.76 177.73 1xvi s GLY 187 N -3.50 -0.24 0.25 0.00 0.00 -1.22 -4.95 107.32 97.67 1xvi s GLY 187 Ca 0.37 1.90 -0.05 0.00 0.00 0.00 0.00 44.72 46.94 1xvi s GLY 187 CO 0.30 0.78 1.89 0.50 0.00 0.00 0.00 173.10 176.57 1xvi h LYS 188 N 2.20 1.15 -0.35 2.90 1.57 -1.87 -0.32 116.57 121.85 1xvi h LYS 188 Ca -0.14 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 1xvi h LYS 188 Cb 1.18 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 33.22 1xvi h LYS 188 CO 0.27 0.76 0.15 0.38 -0.57 0.00 0.00 179.45 180.44 1xvi h ASP 189 N 1.18 0.47 -0.09 0.86 2.03 -1.89 0.77 116.42 119.75 1xvi h ASP 189 Ca 0.39 -0.15 -0.01 0.00 -0.73 0.00 0.00 57.03 56.54 1xvi h ASP 189 Cb 0.06 -0.12 -0.00 0.00 -0.83 0.00 0.00 39.33 38.43 1xvi h ASP 189 CO -0.14 0.48 0.03 1.56 -1.03 0.00 0.00 179.24 180.15 1xvi h GLN 190 N 0.42 0.13 -0.72 4.15 1.08 -1.82 -0.44 115.11 117.91 1xvi h GLN 190 Ca 0.12 -0.02 0.01 0.00 -1.45 0.00 0.00 58.65 57.30 1xvi h GLN 190 Cb 0.15 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 27.52 1xvi h GLN 190 CO -0.01 0.26 0.48 0.00 -0.95 0.00 0.00 178.83 178.61 1xvi h ALA 191 N 0.86 0.92 -0.36 3.87 0.00 -1.08 -2.38 119.26 121.08 1xvi h ALA 191 Ca 0.03 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1xvi h ALA 191 Cb 0.18 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1xvi h ALA 191 CO -0.00 0.33 0.21 0.00 0.00 0.00 0.00 179.25 179.79 1xvi h ALA 192 N 1.27 0.45 -0.79 0.00 0.00 -0.60 -1.82 119.26 117.78 1xvi h ALA 192 Ca 0.27 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 55.28 1xvi h ALA 192 Cb -0.11 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 17.50 1xvi h ALA 192 CO -0.06 -0.14 0.40 -0.91 0.00 0.00 0.00 179.25 178.55 1xvi h ASN 193 N 0.43 0.52 -0.36 0.00 2.35 -0.91 0.20 115.58 117.81 1xvi h ASN 193 Ca 0.14 0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.90 1xvi h ASN 193 Cb 0.01 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1xvi h ASN 193 CO -0.07 0.27 -0.04 -0.25 -1.65 0.00 0.00 177.43 175.69 1xvi h TRP 194 N 0.64 0.73 0.00 1.19 7.01 -0.95 -0.11 115.95 124.47 1xvi h TRP 194 Ca 0.40 -0.14 -0.00 0.00 2.11 0.00 0.00 58.89 61.26 1xvi h TRP 194 Cb 0.48 -0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.35 1xvi h TRP 194 CO -0.10 0.79 -0.00 0.82 -2.79 0.00 0.00 178.44 177.16 1xvi h ILE 195 N 0.47 1.08 -0.33 2.65 2.04 -1.01 -1.10 117.51 121.31 1xvi h ILE 195 Ca 0.10 -0.24 0.07 0.00 1.00 0.00 0.00 64.86 65.79 1xvi h ILE 195 Cb 0.52 1.24 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 1xvi h ILE 195 CO 0.03 0.06 -0.09 0.40 0.00 0.00 0.00 178.15 178.55 1xvi h ILE 196 N -0.11 0.65 -0.47 -0.67 2.04 -0.88 -1.13 117.51 116.94 1xvi h ILE 196 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1xvi h ILE 196 Cb 0.11 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1xvi h ILE 196 CO 0.00 0.00 0.29 0.00 0.00 0.00 0.00 178.15 178.45 1xvi h ALA 197 N 1.32 1.64 -0.08 1.87 0.00 -0.93 -1.74 119.26 121.34 1xvi h ALA 197 Ca 0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1xvi h ALA 197 Cb 0.26 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1xvi h ALA 197 CO -0.35 0.33 -0.07 1.15 0.00 0.00 0.00 179.25 180.31 1xvi h THR 198 N 0.64 1.36 -0.98 0.00 2.02 -0.48 -0.80 112.91 114.66 1xvi h THR 198 Ca 0.17 -1.19 0.12 0.00 0.77 0.00 0.00 66.41 66.28 1xvi h THR 198 Cb -0.05 1.98 -0.08 0.00 -1.74 0.00 0.00 68.15 68.27 1xvi h THR 198 CO -0.03 0.33 0.62 1.88 0.37 0.00 0.00 175.52 178.69 1xvi h TYR 199 N -0.24 1.09 -0.34 3.16 0.05 -1.00 -1.46 116.97 118.24 1xvi h TYR 199 Ca 0.01 0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.73 1xvi h TYR 199 Cb 0.56 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 37.95 1xvi h TYR 199 CO 0.09 0.44 -0.17 0.37 -1.05 0.00 0.00 178.16 177.83 1xvi h GLN 200 N 0.95 0.71 -0.31 4.88 4.15 -1.19 -1.03 115.11 123.27 1xvi h GLN 200 Ca 0.48 -0.31 -0.01 0.00 0.77 0.00 0.00 58.65 59.58 1xvi h GLN 200 Cb 0.51 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.16 1xvi h GLN 200 CO -0.25 0.91 0.13 0.37 -1.93 0.00 0.00 178.83 178.07 1xvi h GLN 201 N 0.48 0.45 -0.12 1.69 4.15 -0.79 -0.04 115.11 120.93 1xvi h GLN 201 Ca 0.07 -0.08 -0.13 0.00 0.77 0.00 0.00 58.65 59.29 1xvi h GLN 201 Cb 0.71 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.31 1xvi h GLN 201 CO 0.05 0.45 -0.48 -0.07 -1.93 0.00 0.00 178.83 176.85 1xvi h LEU 202 N 0.35 0.33 0.00 -2.39 3.38 -1.25 -3.25 115.31 112.48 1xvi h LEU 202 Ca 0.10 -0.16 -0.19 0.00 0.09 0.00 0.00 57.88 57.73 1xvi h LEU 202 Cb 0.16 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1xvi h LEU 202 CO -0.01 0.76 -1.23 0.77 0.09 0.00 0.00 178.44 178.82 1xvi h SER 203 N 0.24 0.00 0.00 -0.43 4.64 -1.16 -3.48 113.55 113.36 1xvi h SER 203 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1xvi h SER 203 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 1xvi h SER 203 CO 0.08 0.73 0.00 0.61 -0.87 0.00 0.00 176.83 177.37 1xvi n GLY 204 N 1.39 0.39 3.17 -0.77 0.00 -0.03 -4.78 105.19 104.55 1xvi n GLY 204 Ca -0.07 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 1xvi n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xvi s LYS 205 N -0.55 0.99 -0.04 1.61 1.02 -1.22 -5.05 119.74 116.49 1xvi s LYS 205 Ca 0.00 -0.83 -0.30 0.00 0.02 0.00 0.00 55.97 54.86 1xvi s LYS 205 Cb 0.00 -1.02 -0.05 0.00 -0.52 0.00 0.00 37.83 36.23 1xvi s LYS 205 CO 0.00 0.25 1.53 0.50 -0.92 0.00 0.00 175.35 176.71 1xvi s ARG 206 N -1.26 4.22 0.58 1.68 3.52 -1.26 -4.33 118.95 122.09 1xvi s ARG 206 Ca 0.02 2.07 -0.18 0.00 -0.13 0.00 0.00 55.73 57.52 1xvi s ARG 206 Cb -0.08 -3.78 -0.04 0.00 -1.56 0.00 0.00 34.95 29.48 1xvi s ARG 206 CO 0.02 -0.73 1.11 -2.14 -0.81 0.00 0.00 175.30 172.74 1xvi s PRO 207 N 3.30 3.22 -0.12 5.12 0.02 -1.26 -4.57 135.00 140.71 1xvi s PRO 207 Ca 0.68 1.48 -0.03 0.00 0.02 0.00 0.00 61.00 63.14 1xvi s PRO 207 Cb -0.32 -2.00 -0.03 0.00 0.02 0.00 0.00 34.50 32.17 1xvi s PRO 207 CO 0.27 -0.93 0.01 0.99 -0.33 0.00 0.00 177.00 177.01 1xvi s THR 208 N -2.04 4.39 -0.00 0.99 2.01 -0.45 -5.01 115.64 115.53 1xvi s THR 208 Ca 0.69 -0.20 0.06 0.00 0.31 0.00 0.00 61.69 62.55 1xvi s THR 208 Cb -0.21 -2.89 -0.02 0.00 0.01 0.00 0.00 72.50 69.39 1xvi s THR 208 CO 0.32 0.56 -0.18 0.42 -0.69 0.00 0.00 174.62 175.05 1xvi s THR 209 N -0.44 1.45 -0.08 -0.82 -4.23 -1.26 -1.18 115.64 109.07 1xvi s THR 209 Ca 0.08 -0.85 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 1xvi s THR 209 Cb -0.12 -1.22 0.01 0.00 1.34 0.00 0.00 72.50 72.51 1xvi s THR 209 CO 0.02 0.35 -0.16 -0.22 -0.54 0.00 0.00 174.62 174.07 1xvi s LEU 210 N -0.58 1.77 -0.12 4.79 2.96 -0.03 -1.38 118.68 126.08 1xvi s LEU 210 Ca 0.07 -0.39 -0.04 0.00 -0.22 0.00 0.00 54.13 53.55 1xvi s LEU 210 Cb -0.07 -1.03 -0.03 0.00 0.50 0.00 0.00 46.19 45.56 1xvi s LEU 210 CO -0.00 0.06 0.02 -0.83 -1.32 0.00 0.00 176.35 174.28 1xvi s GLY 211 N 0.65 1.87 -0.18 7.98 0.00 0.93 -0.01 107.32 118.55 1xvi s GLY 211 Ca -0.14 -0.78 0.00 0.00 0.00 0.00 0.00 44.72 43.80 1xvi s GLY 211 CO 0.04 -0.32 -0.18 1.08 0.00 0.00 0.00 173.10 173.72 1xvi s LEU 212 N -0.39 2.22 0.19 0.66 1.43 -0.01 -1.37 118.68 121.41 1xvi s LEU 212 Ca 0.08 -0.61 0.03 0.00 -1.03 0.00 0.00 54.13 52.59 1xvi s LEU 212 Cb -0.12 -1.51 -0.05 0.00 0.03 0.00 0.00 46.19 44.54 1xvi s LEU 212 CO 0.02 0.00 -0.03 -0.83 0.23 0.00 0.00 176.35 175.75 1xvi s GLY 213 N 1.28 1.29 -0.17 -3.19 0.00 -0.84 -0.25 107.32 105.45 1xvi s GLY 213 Ca 0.04 -1.62 0.14 0.00 0.00 0.00 0.00 44.72 43.28 1xvi s GLY 213 CO -0.11 -1.59 1.21 2.09 0.00 0.00 0.00 173.10 174.69 1xvi n ASP 214 N -0.29 1.67 -3.61 1.64 5.68 -1.25 -1.42 116.55 118.98 1xvi n ASP 214 Ca -0.07 -3.45 -0.00 0.00 -0.50 0.00 0.00 54.79 50.77 1xvi n ASP 214 Cb 0.63 -0.47 0.01 0.00 -1.14 0.00 0.00 41.12 40.15 1xvi n ASP 214 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1xvi s GLY 215 N -2.98 -0.03 0.38 6.12 0.00 -1.26 -4.92 107.32 104.62 1xvi s GLY 215 Ca 0.37 -0.10 0.28 0.00 0.00 0.00 0.00 44.72 45.27 1xvi s GLY 215 CO -0.09 3.90 1.82 -0.56 0.00 0.00 0.00 173.10 178.16 1xvi h PRO 216 N 2.00 0.00 0.00 2.90 0.13 -2.04 -2.96 132.00 132.03 1xvi h PRO 216 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1xvi h PRO 216 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1xvi h PRO 216 CO 0.33 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.19 1xvi n ASN 217 N -2.64 0.41 -0.85 1.44 4.13 -1.26 -2.97 115.26 113.53 1xvi n ASN 217 Ca 0.02 0.61 0.04 0.00 1.68 0.00 0.00 54.58 56.93 1xvi n ASN 217 Cb 0.30 -0.69 0.16 0.00 -1.54 0.00 0.00 39.78 38.02 1xvi n ASN 217 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1xvi n ASP 218 N -1.96 2.39 -0.05 6.41 8.00 -1.12 -4.54 116.55 125.68 1xvi n ASP 218 Ca 0.02 -2.19 -0.08 0.00 0.71 0.00 0.00 54.79 53.26 1xvi n ASP 218 Cb 0.19 -0.39 -0.01 0.00 -0.02 0.00 0.00 41.12 40.89 1xvi n ASP 218 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xvi h ALA 219 N 3.29 0.06 -0.22 2.24 0.00 -1.78 -2.21 119.26 120.65 1xvi h ALA 219 Ca 0.00 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1xvi h ALA 219 Cb 0.77 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1xvi h ALA 219 CO 0.10 -0.54 0.14 -1.35 0.00 0.00 0.00 179.25 177.59 1xvi h PRO 220 N -0.11 0.27 -0.24 0.00 0.11 -1.90 -0.86 132.00 129.28 1xvi h PRO 220 Ca 0.13 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 1xvi h PRO 220 Cb 0.30 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 1xvi h PRO 220 CO -0.31 0.18 0.15 1.25 -0.21 0.00 0.00 178.00 179.05 1xvi h LEU 221 N 0.28 0.29 -1.67 2.35 5.85 -1.88 -3.03 115.31 117.49 1xvi h LEU 221 Ca 0.08 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 1xvi h LEU 221 Cb -0.02 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 1xvi h LEU 221 CO -0.03 0.25 -0.14 -0.07 -0.34 0.00 0.00 178.44 178.11 1xvi h LEU 222 N 0.30 0.00 -1.17 2.25 3.38 -1.06 -2.99 115.31 116.02 1xvi h LEU 222 Ca 0.09 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.97 1xvi h LEU 222 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1xvi h LEU 222 CO -0.02 0.14 -0.41 -0.33 0.09 0.00 0.00 178.44 177.91 1xvi h GLU 223 N 0.00 0.00 -0.02 1.13 4.39 -1.04 -2.87 114.58 116.18 1xvi h GLU 223 Ca -0.00 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1xvi h GLU 223 Cb 0.47 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1xvi h GLU 223 CO 0.02 0.42 -0.05 1.33 -1.16 0.00 0.00 179.01 179.56 1xvi n VAL 224 N -4.05 0.00 -2.88 3.13 0.24 -1.13 -4.90 118.33 108.74 1xvi n VAL 224 Ca -0.02 -0.26 -0.36 0.00 -2.04 0.00 0.00 64.34 61.66 1xvi n VAL 224 Cb 0.44 0.61 -0.06 0.00 -1.47 0.00 0.00 33.84 33.36 1xvi n VAL 224 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 1xvi s MET 225 N -2.10 4.44 0.24 7.34 -1.94 -1.08 -4.98 119.30 121.21 1xvi s MET 225 Ca 0.34 1.16 -0.06 0.00 -1.71 0.00 0.00 55.69 55.42 1xvi s MET 225 Cb 0.21 -2.72 0.23 0.00 2.01 0.00 0.00 34.83 34.55 1xvi s MET 225 CO 0.37 0.26 1.85 -0.44 -0.01 0.00 0.00 175.02 177.05 1xvi h ASP 226 N 3.03 1.10 -3.74 3.03 3.32 -1.85 -3.43 116.42 117.89 1xvi h ASP 226 Ca -0.47 -0.11 -0.41 0.00 0.02 0.00 0.00 57.03 56.06 1xvi h ASP 226 Cb 1.19 -0.28 -0.31 0.00 0.22 0.00 0.00 39.33 40.15 1xvi h ASP 226 CO 0.65 0.90 -0.78 -0.31 -1.72 0.00 0.00 179.24 177.98 1xvi s TYR 227 N -5.76 0.83 -0.02 4.55 2.02 -0.48 -5.02 117.35 113.46 1xvi s TYR 227 Ca -0.12 -0.21 -0.01 0.00 -0.37 0.00 0.00 57.07 56.36 1xvi s TYR 227 Cb 0.17 -0.62 0.02 0.00 -0.40 0.00 0.00 41.96 41.12 1xvi s TYR 227 CO 0.83 -0.11 0.06 0.00 -1.57 0.00 0.00 175.55 174.75 1xvi s ALA 228 N 0.32 -0.08 0.06 3.71 0.00 -1.26 -0.05 121.76 124.46 1xvi s ALA 228 Ca -0.05 0.25 0.04 0.00 0.00 0.00 0.00 51.96 52.20 1xvi s ALA 228 Cb -0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 1xvi s ALA 228 CO 0.00 -0.06 -0.11 0.14 0.00 0.00 0.00 175.76 175.73 1xvi s VAL 229 N 0.45 0.84 -0.15 0.00 -7.23 -0.47 -4.95 120.40 108.88 1xvi s VAL 229 Ca -0.04 -1.19 -0.15 0.00 -1.81 0.00 0.00 61.98 58.79 1xvi s VAL 229 Cb -0.05 -0.85 -0.04 0.00 0.56 0.00 0.00 36.38 36.00 1xvi s VAL 229 CO -0.02 -0.29 0.37 -0.63 -0.31 0.00 0.00 175.10 174.22 1xvi s ILE 230 N -1.31 5.25 -0.09 -0.62 -1.09 -1.26 -1.98 121.20 120.10 1xvi s ILE 230 Ca -0.06 0.70 0.01 0.00 -2.23 0.00 0.00 60.65 59.07 1xvi s ILE 230 Cb -0.10 -3.70 -0.02 0.00 -1.58 0.00 0.00 42.46 37.05 1xvi s ILE 230 CO 0.01 0.35 -0.12 0.68 -1.23 0.00 0.00 174.94 174.63 1xvi s VAL 231 N 0.65 3.20 -0.11 2.92 -7.23 -0.51 -4.97 120.40 114.35 1xvi s VAL 231 Ca 0.20 -0.64 0.02 0.00 -1.81 0.00 0.00 61.98 59.75 1xvi s VAL 231 Cb -0.14 -2.31 0.01 0.00 0.56 0.00 0.00 36.38 34.50 1xvi s VAL 231 CO 0.06 0.56 -0.19 -0.75 -0.31 0.00 0.00 175.10 174.47 1xvi s LYS 232 N -0.19 2.58 0.19 4.82 2.20 -1.26 -4.49 119.74 123.58 1xvi s LYS 232 Ca 0.01 -0.70 -0.32 0.00 -0.36 0.00 0.00 55.97 54.59 1xvi s LYS 232 Cb -0.13 -2.09 -0.15 0.00 -1.51 0.00 0.00 37.83 33.95 1xvi s LYS 232 CO 0.03 0.01 1.22 0.41 -0.36 0.00 0.00 175.35 176.66 1xvi n GLY 233 N 3.98 0.21 3.80 5.54 0.00 -1.26 -4.95 105.19 112.52 1xvi n GLY 233 Ca -0.20 0.52 -0.34 0.00 0.00 0.00 0.00 46.02 46.01 1xvi n GLY 233 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xvi s LEU 234 N 0.53 3.71 0.00 0.99 2.96 -1.26 -5.24 118.68 120.38 1xvi s LEU 234 Ca 0.72 1.90 0.00 0.00 -0.22 0.00 0.00 54.13 56.52 1xvi s LEU 234 Cb -0.80 -4.55 0.00 0.00 0.50 0.00 0.00 46.19 41.34 1xvi s LEU 234 CO 0.52 -0.94 0.00 -0.46 -1.32 0.00 0.00 176.35 174.15