#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n8p s LEU 2 N 0.00 -1.37 0.91 -4.42 0.20 -1.26 -5.07 118.68 107.66 1n8p s LEU 2 Ca 0.00 -0.05 -0.12 0.00 0.69 0.00 0.00 54.13 54.65 1n8p s LEU 2 Cb 0.00 1.75 0.07 0.00 -0.43 0.00 0.00 46.19 47.58 1n8p s LEU 2 CO 0.00 -0.31 0.72 0.00 -0.29 0.00 0.00 176.35 176.48 1n8p n GLN 3 N 5.33 -0.25 -2.74 1.98 6.02 -1.26 -4.98 117.38 121.49 1n8p n GLN 3 Ca 0.04 -0.02 -0.09 0.00 -0.01 0.00 0.00 57.00 56.93 1n8p n GLN 3 Cb 0.53 -2.07 0.09 0.00 1.02 0.00 0.00 30.24 29.81 1n8p n GLN 3 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1n8p n GLU 4 N -2.56 1.05 -2.88 -1.09 1.02 -1.26 -4.96 120.64 109.96 1n8p n GLU 4 Ca 0.09 -1.97 -0.10 0.00 -0.02 0.00 0.00 57.16 55.16 1n8p n GLU 4 Cb 0.52 -0.87 0.06 0.00 -0.02 0.00 0.00 31.44 31.13 1n8p n GLU 4 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1n8p n SER 5 N 0.17 -2.04 -2.00 1.62 7.64 -1.26 -5.04 113.62 112.70 1n8p n SER 5 Ca 0.05 -0.38 0.00 0.00 1.01 0.00 0.00 58.87 59.55 1n8p n SER 5 Cb 0.73 -3.35 0.00 0.00 -1.01 0.00 0.00 64.21 60.58 1n8p n SER 5 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1n8p n ASP 6 N -2.30 0.00 -4.74 6.43 8.00 -1.26 -5.09 116.55 117.59 1n8p n ASP 6 Ca -0.18 -0.80 -0.27 0.00 0.71 0.00 0.00 54.79 54.25 1n8p n ASP 6 Cb 0.60 0.00 0.10 0.00 -0.02 0.00 0.00 41.12 41.81 1n8p n ASP 6 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1n8p s LYS 7 N -1.95 1.78 0.13 -1.24 -0.14 -1.26 -4.88 119.74 112.18 1n8p s LYS 7 Ca 0.00 -0.26 -0.19 0.00 -1.36 0.00 0.00 55.97 54.16 1n8p s LYS 7 Cb 0.00 -2.06 -0.01 0.00 -1.68 0.00 0.00 37.83 34.07 1n8p s LYS 7 CO 0.00 -1.59 1.74 0.35 -0.76 0.00 0.00 175.35 175.09 1n8p h PHE 8 N -0.92 0.08 -0.13 3.18 3.57 -1.99 -1.03 116.94 119.71 1n8p h PHE 8 Ca -0.44 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.09 1n8p h PHE 8 Cb 1.30 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.02 1n8p h PHE 8 CO -0.02 0.03 0.00 0.00 -2.23 0.00 0.00 178.31 176.09 1n8p h ALA 9 N 1.17 0.11 -0.96 2.41 0.00 -2.00 0.16 119.26 120.15 1n8p h ALA 9 Ca 0.11 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.16 1n8p h ALA 9 Cb 0.10 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 1n8p h ALA 9 CO -0.14 -0.45 0.59 1.15 0.00 0.00 0.00 179.25 180.40 1n8p h THR 10 N 0.04 0.93 -0.44 0.00 2.02 -1.87 -2.14 112.91 111.45 1n8p h THR 10 Ca 0.06 -0.33 -0.13 0.00 0.77 0.00 0.00 66.41 66.78 1n8p h THR 10 Cb 0.07 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.36 1n8p h THR 10 CO -0.10 0.17 -0.24 0.11 0.37 0.00 0.00 175.52 175.83 1n8p h LYS 11 N 0.95 0.91 0.01 6.66 1.57 -0.29 -2.80 116.57 123.58 1n8p h LYS 11 Ca 0.47 -0.40 0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1n8p h LYS 11 Cb 0.43 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1n8p h LYS 11 CO -0.26 1.05 -0.04 0.00 -0.57 0.00 0.00 179.45 179.64 1n8p h ALA 12 N 0.93 -0.05 0.00 3.86 0.00 -0.46 0.44 119.26 123.99 1n8p h ALA 12 Ca 0.10 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1n8p h ALA 12 Cb 0.80 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1n8p h ALA 12 CO 0.07 -0.54 -0.02 0.82 0.00 0.00 0.00 179.25 179.58 1n8p h ILE 13 N -0.07 0.13 0.00 0.00 1.08 -1.31 -3.36 117.51 113.97 1n8p h ILE 13 Ca 0.01 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 64.29 1n8p h ILE 13 Cb 0.09 1.16 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 1n8p h ILE 13 CO -0.03 0.02 -0.03 1.41 -0.69 0.00 0.00 178.15 178.83 1n8p n HIS 14 N -3.23 0.00 -1.97 1.37 8.25 -1.07 -5.01 115.22 113.56 1n8p n HIS 14 Ca -0.02 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.05 1n8p n HIS 14 Cb 0.15 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.27 1n8p n HIS 14 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1n8p s ALA 15 N -0.27 3.08 -0.90 -1.41 0.00 0.15 -2.40 121.76 120.01 1n8p s ALA 15 Ca 0.00 1.24 -0.00 0.00 0.00 0.00 0.00 51.96 53.20 1n8p s ALA 15 Cb 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1n8p s ALA 15 CO 0.00 -1.01 0.01 0.41 0.00 0.00 0.00 175.76 175.17 1n8p n GLY 16 N 0.63 -0.06 3.45 0.00 0.00 -1.26 -4.54 105.19 103.40 1n8p n GLY 16 Ca 0.06 -0.44 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 1n8p n GLY 16 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1n8p n GLU 17 N -2.03 -1.98 -4.62 1.61 2.13 -1.01 -4.79 120.64 109.95 1n8p n GLU 17 Ca -0.12 -0.54 -0.28 0.00 0.66 0.00 0.00 57.16 56.87 1n8p n GLU 17 Cb 0.59 -2.08 -0.11 0.00 0.27 0.00 0.00 31.44 30.11 1n8p n GLU 17 CO 0.00 0.00 0.00 -3.38 -0.41 0.00 0.00 177.13 173.34 1n8p s HIS 18 N -2.40 2.46 -0.34 4.31 -3.43 -1.26 -4.96 115.29 109.68 1n8p s HIS 18 Ca 0.65 -0.70 -0.07 0.00 -0.80 0.00 0.00 55.06 54.14 1n8p s HIS 18 Cb -0.22 -1.75 0.03 0.00 -1.43 0.00 0.00 32.58 29.21 1n8p s HIS 18 CO 0.65 0.42 0.11 0.08 -2.00 0.00 0.00 174.74 174.00 1n8p s VAL 19 N -2.74 3.92 -0.05 -5.38 1.01 -1.26 -5.08 120.40 110.82 1n8p s VAL 19 Ca 0.33 -1.02 -0.00 0.00 0.00 0.00 0.00 61.98 61.29 1n8p s VAL 19 Cb 0.09 -3.18 0.03 0.00 0.00 0.00 0.00 36.38 33.32 1n8p s VAL 19 CO 0.17 -0.14 -0.00 -0.62 0.00 0.00 0.00 175.10 174.51 1n8p s ASP 20 N 1.44 1.01 0.15 3.32 3.68 -1.26 -5.03 116.67 119.97 1n8p s ASP 20 Ca -0.00 -0.05 -0.14 0.00 2.13 0.00 0.00 52.55 54.48 1n8p s ASP 20 Cb -0.19 -0.33 0.03 0.00 -1.45 0.00 0.00 42.92 40.98 1n8p s ASP 20 CO 0.03 -0.14 1.71 0.58 0.13 0.00 0.00 175.17 177.48 1n8p h VAL 21 N 6.27 1.20 -0.94 1.11 2.07 -1.99 -2.54 116.25 121.43 1n8p h VAL 21 Ca -0.30 -0.61 0.12 0.00 0.82 0.00 0.00 66.70 66.73 1n8p h VAL 21 Cb 1.13 0.72 -0.08 0.00 -1.52 0.00 0.00 31.29 31.55 1n8p h VAL 21 CO 0.36 0.23 0.60 0.45 0.02 0.00 0.00 177.57 179.24 1n8p h HIS 22 N 0.63 1.00 0.00 1.57 3.86 -2.04 -3.46 115.15 116.71 1n8p h HIS 22 Ca 0.16 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 1n8p h HIS 22 Cb 0.17 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.32 1n8p h HIS 22 CO 0.00 0.40 0.00 0.41 0.86 0.00 0.00 177.93 179.60 1n8p n GLY 23 N -1.39 1.56 3.54 2.45 0.00 -0.96 -5.05 105.19 105.35 1n8p n GLY 23 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1n8p n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n8p n SER 24 N 0.00 2.49 0.18 1.61 3.41 -1.26 -4.82 113.62 115.24 1n8p n SER 24 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.77 1n8p n SER 24 Cb 0.00 -1.46 0.76 0.00 -0.26 0.00 0.00 64.21 63.25 1n8p n SER 24 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1n8p h VAL 25 N 7.39 0.67 -3.32 -3.33 2.07 -1.98 -3.39 116.25 114.36 1n8p h VAL 25 Ca -0.30 0.00 -0.67 0.00 0.82 0.00 0.00 66.70 66.56 1n8p h VAL 25 Cb 1.27 0.87 -0.16 0.00 -1.52 0.00 0.00 31.29 31.75 1n8p h VAL 25 CO 1.07 0.00 -0.62 -0.63 0.02 0.00 0.00 177.57 177.40 1n8p s ILE 26 N -4.83 4.28 0.22 4.57 -1.09 -1.26 -5.01 121.20 118.08 1n8p s ILE 26 Ca -0.05 -0.25 -0.30 0.00 -2.23 0.00 0.00 60.65 57.83 1n8p s ILE 26 Cb 0.17 -2.83 -0.09 0.00 -1.58 0.00 0.00 42.46 38.13 1n8p s ILE 26 CO 0.62 0.57 1.28 -0.70 -1.23 0.00 0.00 174.94 175.48 1n8p s GLU 27 N -0.55 4.42 0.80 2.79 2.12 -1.26 -5.03 118.70 121.99 1n8p s GLU 27 Ca 0.09 2.04 -0.10 0.00 0.36 0.00 0.00 54.97 57.36 1n8p s GLU 27 Cb -0.12 -3.18 0.11 0.00 0.26 0.00 0.00 34.13 31.20 1n8p s GLU 27 CO 0.02 -0.19 1.14 -1.25 -0.54 0.00 0.00 175.26 174.44 1n8p s PRO 28 N -0.48 1.64 -0.43 4.30 0.04 -1.26 -5.03 135.00 133.78 1n8p s PRO 28 Ca 0.54 -0.32 -0.11 0.00 0.04 0.00 0.00 61.00 61.15 1n8p s PRO 28 Cb -0.36 -2.05 0.08 0.00 0.04 0.00 0.00 34.50 32.21 1n8p s PRO 28 CO 0.40 -1.68 0.29 0.42 0.04 0.00 0.00 177.00 176.48 1n8p s ILE 29 N -3.49 4.48 -0.32 0.56 1.01 -1.26 -4.90 121.20 117.28 1n8p s ILE 29 Ca 0.65 -1.30 -0.16 0.00 0.00 0.00 0.00 60.65 59.84 1n8p s ILE 29 Cb -0.08 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.65 1n8p s ILE 29 CO 0.48 -0.52 0.44 -0.44 0.00 0.00 0.00 174.94 174.90 1n8p s SER 30 N 2.22 6.27 0.00 3.58 0.01 -1.26 -4.85 113.70 119.66 1n8p s SER 30 Ca 0.03 0.01 0.07 0.00 1.31 0.00 0.00 55.95 57.37 1n8p s SER 30 Cb -0.23 -2.23 0.01 0.00 0.21 0.00 0.00 66.02 63.78 1n8p s SER 30 CO 0.03 -0.36 0.57 0.18 0.41 0.00 0.00 173.24 174.08 1n8p n LEU 31 N 5.53 1.16 -4.60 2.44 4.77 -1.26 -4.77 117.00 120.26 1n8p n LEU 31 Ca -0.07 -0.83 -0.51 0.00 -0.03 0.00 0.00 56.01 54.57 1n8p n LEU 31 Cb 0.49 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.53 1n8p n LEU 31 CO 0.42 0.24 0.95 -1.54 -1.33 0.00 0.00 177.39 176.12 1n8p n SER 32 N -0.12 1.89 0.13 -1.43 3.41 -1.26 -4.90 113.62 111.33 1n8p n SER 32 Ca 0.03 1.11 -0.11 0.00 -0.26 0.00 0.00 58.87 59.65 1n8p n SER 32 Cb 0.15 -1.23 -0.07 0.00 -0.26 0.00 0.00 64.21 62.80 1n8p n SER 32 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1n8p h THR 33 N 3.36 0.54 -1.74 6.66 2.02 -1.97 -3.39 112.91 118.39 1n8p h THR 33 Ca -0.47 -0.83 -0.61 0.00 0.77 0.00 0.00 66.41 65.26 1n8p h THR 33 Cb 1.32 0.87 -0.12 0.00 -1.74 0.00 0.00 68.15 68.48 1n8p h THR 33 CO 0.79 0.13 -0.60 0.42 0.37 0.00 0.00 175.52 176.63 1n8p s THR 34 N -3.71 2.16 0.03 3.16 -4.23 -1.26 0.62 115.64 112.41 1n8p s THR 34 Ca -0.12 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.43 1n8p s THR 34 Cb 0.01 -2.90 -0.02 0.00 1.34 0.00 0.00 72.50 70.93 1n8p s THR 34 CO 0.42 -0.06 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.97 1n8p s PHE 35 N -2.65 0.93 0.83 3.99 0.40 -1.16 -4.98 117.98 115.35 1n8p s PHE 35 Ca 0.35 -0.32 -0.11 0.00 -0.60 0.00 0.00 56.93 56.26 1n8p s PHE 35 Cb 0.06 -0.56 0.09 0.00 0.51 0.00 0.00 43.02 43.13 1n8p s PHE 35 CO 0.18 -0.01 1.10 0.15 0.70 0.00 0.00 175.22 177.35 1n8p s LYS 36 N -0.96 1.73 0.05 0.44 1.02 -1.26 -4.87 119.74 115.90 1n8p s LYS 36 Ca -0.01 1.20 0.03 0.00 0.02 0.00 0.00 55.97 57.21 1n8p s LYS 36 Cb -0.07 -1.83 -0.03 0.00 -0.52 0.00 0.00 37.83 35.38 1n8p s LYS 36 CO 0.01 -2.02 -0.09 -0.65 -0.92 0.00 0.00 175.35 171.68 1n8p s GLN 37 N -4.84 0.59 0.05 1.68 -0.21 -1.26 -1.55 119.66 114.12 1n8p s GLN 37 Ca 0.63 -0.83 -0.28 0.00 0.02 0.00 0.00 55.36 54.90 1n8p s GLN 37 Cb -0.19 -0.37 -0.17 0.00 1.00 0.00 0.00 33.01 33.28 1n8p s GLN 37 CO 0.57 0.07 1.47 0.66 -2.12 0.00 0.00 175.29 175.94 1n8p h SER 38 N 4.36 -0.47 -4.21 5.90 4.64 -1.42 -3.43 113.55 118.92 1n8p h SER 38 Ca -0.37 -0.06 -0.43 0.00 -0.47 0.00 0.00 61.79 60.47 1n8p h SER 38 Cb 1.20 0.12 -0.27 0.00 -0.31 0.00 0.00 62.40 63.14 1n8p h SER 38 CO 0.42 -0.22 -0.79 -0.55 -0.87 0.00 0.00 176.83 174.82 1n8p s SER 39 N -4.81 1.40 0.16 4.97 0.15 -1.15 -5.03 113.70 109.39 1n8p s SER 39 Ca -0.15 -0.30 -0.06 0.00 0.70 0.00 0.00 55.95 56.14 1n8p s SER 39 Cb 0.03 -0.12 0.25 0.00 -1.71 0.00 0.00 66.02 64.47 1n8p s SER 39 CO 0.59 0.09 0.92 -2.65 1.20 0.00 0.00 173.24 173.39 1n8p n PRO 40 N 2.45 -0.07 0.02 5.44 -0.02 -1.26 0.14 135.00 141.70 1n8p n PRO 40 Ca -0.16 0.92 -0.11 0.00 -2.02 0.00 0.00 63.50 62.13 1n8p n PRO 40 Cb 0.56 -1.37 -0.05 0.00 -0.02 0.00 0.00 33.50 32.61 1n8p n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n8p h ALA 41 N 1.12 -0.46 -3.55 3.55 0.00 -1.98 -3.44 119.26 114.51 1n8p h ALA 41 Ca 0.27 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.85 1n8p h ALA 41 Cb 0.42 0.64 -0.33 0.00 0.00 0.00 0.00 17.79 18.52 1n8p h ALA 41 CO -0.61 -0.84 -0.75 -0.80 0.00 0.00 0.00 179.25 176.26 1n8p s ASN 42 N -4.88 0.39 0.51 0.00 0.01 0.12 -5.11 114.94 105.98 1n8p s ASN 42 Ca -0.15 -0.03 -0.12 0.00 -0.71 0.00 0.00 52.86 51.85 1n8p s ASN 42 Cb 0.10 -0.19 -0.08 0.00 0.41 0.00 0.00 41.25 41.48 1n8p s ASN 42 CO 0.65 -0.08 -0.66 -2.65 -1.51 0.00 0.00 177.10 172.85 1n8p n PRO 43 N 3.95 0.00 -0.84 -0.60 -0.02 -1.26 -2.93 135.00 133.30 1n8p n PRO 43 Ca -0.25 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.20 1n8p n PRO 43 Cb 0.52 -0.60 0.25 0.00 -0.02 0.00 0.00 33.50 33.65 1n8p n PRO 43 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1n8p n ILE 44 N -2.02 2.70 0.00 4.25 -0.00 -0.59 -2.97 119.36 120.73 1n8p n ILE 44 Ca -0.01 -2.03 0.00 0.00 -0.00 0.00 0.00 62.75 60.71 1n8p n ILE 44 Cb 0.32 -0.33 0.00 0.00 -0.00 0.00 0.00 39.64 39.63 1n8p n ILE 44 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1n8p n GLY 45 N -0.61 3.15 0.03 3.28 0.00 -1.26 -4.95 105.19 104.84 1n8p n GLY 45 Ca 0.36 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1n8p n GLY 45 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1n8p n THR 46 N -0.52 0.00 -3.94 2.61 -1.04 -1.26 -4.43 114.28 105.70 1n8p n THR 46 Ca 0.00 0.31 -0.35 0.00 -2.04 0.00 0.00 64.05 61.97 1n8p n THR 46 Cb 0.00 -0.83 -0.11 0.00 -1.82 0.00 0.00 70.33 67.58 1n8p n THR 46 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1n8p s TYR 47 N -1.32 3.19 -0.17 -1.42 1.51 -1.26 -4.98 117.35 112.90 1n8p s TYR 47 Ca 0.00 -0.06 -0.08 0.00 -1.01 0.00 0.00 57.07 55.92 1n8p s TYR 47 Cb 0.00 -2.13 -0.07 0.00 -0.11 0.00 0.00 41.96 39.64 1n8p s TYR 47 CO 0.00 -0.00 -0.22 -0.85 -1.11 0.00 0.00 175.55 173.37 1n8p n GLU 48 N 3.98 0.36 -3.76 -0.62 0.28 -1.26 -4.52 120.64 115.11 1n8p n GLU 48 Ca -0.16 0.16 -0.14 0.00 -0.16 0.00 0.00 57.16 56.86 1n8p n GLU 48 Cb 0.52 -1.11 -0.15 0.00 1.43 0.00 0.00 31.44 32.13 1n8p n GLU 48 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 1n8p s TYR 49 N -2.31 -0.12 0.00 -1.84 5.04 -1.26 -2.97 117.35 113.89 1n8p s TYR 49 Ca -0.24 0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.78 1n8p s TYR 49 Cb 0.09 -0.11 0.00 0.00 0.35 0.00 0.00 41.96 42.29 1n8p s TYR 49 CO 0.30 -0.14 0.63 0.45 -1.34 0.00 0.00 175.55 175.45 1n8p n SER 50 N 4.09 0.00 -0.30 4.32 2.88 0.20 -1.48 113.62 123.34 1n8p n SER 50 Ca -0.26 0.63 0.13 0.00 -1.33 0.00 0.00 58.87 58.05 1n8p n SER 50 Cb 0.52 -0.23 0.30 0.00 -0.75 0.00 0.00 64.21 64.04 1n8p n SER 50 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1n8p h ARG 51 N 0.00 0.19 -0.20 -1.46 2.43 -1.93 1.42 114.38 114.83 1n8p h ARG 51 Ca 0.00 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.21 1n8p h ARG 51 Cb 0.00 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.50 1n8p h ARG 51 CO 0.00 0.13 0.14 1.03 -1.51 0.00 0.00 179.97 179.76 1n8p h SER 52 N 0.20 0.01 0.00 -3.80 0.87 -1.61 -3.45 113.55 105.77 1n8p h SER 52 Ca 0.56 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.12 1n8p h SER 52 Cb 1.14 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1n8p h SER 52 CO -0.67 0.01 0.00 1.67 -0.53 0.00 0.00 176.83 177.31 1n8p n GLN 53 N -4.48 0.00 -4.07 2.24 -0.06 0.48 -4.99 117.38 106.50 1n8p n GLN 53 Ca 0.02 0.00 -0.10 0.00 -2.00 0.00 0.00 57.00 54.92 1n8p n GLN 53 Cb 0.27 0.00 -0.11 0.00 -4.06 0.00 0.00 30.24 26.35 1n8p n GLN 53 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1n8p s ASN 54 N 0.00 0.65 0.28 1.69 4.22 -1.10 -3.96 114.94 116.73 1n8p s ASN 54 Ca 0.00 -0.73 0.02 0.00 -2.14 0.00 0.00 52.86 50.01 1n8p s ASN 54 Cb 0.00 0.10 0.62 0.00 1.28 0.00 0.00 41.25 43.26 1n8p s ASN 54 CO 0.00 -0.38 1.78 1.55 -2.04 0.00 0.00 177.10 178.01 1n8p h PRO 55 N 3.91 0.73 -0.23 3.55 0.13 -1.94 -2.00 132.00 136.17 1n8p h PRO 55 Ca -0.34 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 64.70 1n8p h PRO 55 Cb 1.18 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 1n8p h PRO 55 CO 0.52 0.49 -0.01 -0.91 -0.23 0.00 0.00 178.00 177.85 1n8p h ASN 56 N 0.76 0.40 0.25 1.44 4.21 -1.89 -0.06 115.58 120.69 1n8p h ASN 56 Ca 0.52 -0.33 -0.01 0.00 1.21 0.00 0.00 56.30 57.69 1n8p h ASN 56 Cb 0.73 -0.11 0.00 0.00 -1.12 0.00 0.00 38.32 37.82 1n8p h ASN 56 CO -0.35 0.63 -0.12 -0.09 -1.29 0.00 0.00 177.43 176.21 1n8p h ARG 57 N 0.16 -0.33 -0.77 0.81 2.43 -1.83 -1.50 114.38 113.36 1n8p h ARG 57 Ca 0.06 0.02 0.15 0.00 -0.81 0.00 0.00 59.98 59.40 1n8p h ARG 57 Cb 0.43 0.07 -0.14 0.00 -0.42 0.00 0.00 29.97 29.92 1n8p h ARG 57 CO 0.01 -0.22 -0.20 -1.91 -1.51 0.00 0.00 179.97 176.14 1n8p n GLU 58 N -3.05 -0.08 -0.10 0.20 2.13 -0.76 0.80 120.64 119.77 1n8p n GLU 58 Ca -0.04 1.20 -0.06 0.00 0.66 0.00 0.00 57.16 58.91 1n8p n GLU 58 Cb 0.13 -1.78 0.12 0.00 0.27 0.00 0.00 31.44 30.18 1n8p n GLU 58 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1n8p h ASN 59 N 0.00 0.79 0.06 4.31 2.35 -0.97 0.46 115.58 122.57 1n8p h ASN 59 Ca 0.36 -0.24 -0.12 0.00 -0.55 0.00 0.00 56.30 55.76 1n8p h ASN 59 Cb 0.55 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1n8p h ASN 59 CO -0.79 0.92 -0.38 0.25 -1.65 0.00 0.00 177.43 175.78 1n8p h LEU 60 N 0.72 0.45 0.06 1.61 5.85 0.15 -1.71 115.31 122.43 1n8p h LEU 60 Ca 0.12 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1n8p h LEU 60 Cb 0.59 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.50 1n8p h LEU 60 CO 0.04 0.79 -0.03 -0.33 -0.34 0.00 0.00 178.44 178.57 1n8p h GLU 61 N 0.36 -0.07 -0.86 1.25 5.08 -0.42 -1.56 114.58 118.37 1n8p h GLU 61 Ca 0.04 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 1n8p h GLU 61 Cb 0.83 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.04 1n8p h GLU 61 CO 0.07 0.21 0.56 0.00 -1.00 0.00 0.00 179.01 178.85 1n8p h ARG 62 N -0.36 0.96 -0.32 2.33 3.08 -0.77 -1.81 114.38 117.49 1n8p h ARG 62 Ca -0.01 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 1n8p h ARG 62 Cb 0.32 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1n8p h ARG 62 CO 0.01 0.64 0.02 0.00 -1.07 0.00 0.00 179.97 179.57 1n8p h ALA 63 N 1.52 0.43 -0.20 0.04 0.00 -1.16 -2.75 119.26 117.14 1n8p h ALA 63 Ca 0.36 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1n8p h ALA 63 Cb 0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1n8p h ALA 63 CO -0.12 0.17 -0.28 0.28 0.00 0.00 0.00 179.25 179.30 1n8p h VAL 64 N 0.37 1.27 0.91 0.00 2.07 -0.78 -1.20 116.25 118.88 1n8p h VAL 64 Ca 0.09 -1.28 -0.04 0.00 0.82 0.00 0.00 66.70 66.29 1n8p h VAL 64 Cb 0.41 1.42 0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1n8p h VAL 64 CO 0.01 0.40 -0.44 0.00 0.02 0.00 0.00 177.57 177.56 1n8p h ALA 65 N 1.36 -1.22 -0.15 1.67 0.00 -1.35 -0.38 119.26 119.20 1n8p h ALA 65 Ca 0.05 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.72 1n8p h ALA 65 Cb 0.68 0.47 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 1n8p h ALA 65 CO 0.05 -1.14 -0.52 0.00 0.00 0.00 0.00 179.25 177.64 1n8p h ALA 66 N -1.30 -0.82 -0.69 0.00 0.00 -1.39 0.24 119.26 115.30 1n8p h ALA 66 Ca -0.12 -0.04 0.20 0.00 0.00 0.00 0.00 54.91 54.94 1n8p h ALA 66 Cb 0.94 0.97 -0.03 0.00 0.00 0.00 0.00 17.79 19.67 1n8p h ALA 66 CO 0.21 -1.06 0.52 -0.07 0.00 0.00 0.00 179.25 178.85 1n8p h LEU 67 N -0.56 0.00 -1.69 0.00 3.38 -1.19 1.21 115.31 116.46 1n8p h LEU 67 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1n8p h LEU 67 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1n8p h LEU 67 CO -0.44 0.00 0.00 1.21 0.09 0.00 0.00 178.44 179.30 1n8p n GLU 68 N -4.21 2.08 -3.80 1.13 4.07 0.55 -4.76 120.64 115.69 1n8p n GLU 68 Ca 0.14 -1.66 -0.23 0.00 -0.06 0.00 0.00 57.16 55.35 1n8p n GLU 68 Cb 0.78 -1.39 0.01 0.00 -0.06 0.00 0.00 31.44 30.78 1n8p n GLU 68 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1n8p n ASN 69 N 0.85 -0.80 -4.16 4.31 5.15 0.42 -4.77 115.26 116.25 1n8p n ASN 69 Ca 0.16 -0.90 -0.17 0.00 -0.60 0.00 0.00 54.58 53.07 1n8p n ASN 69 Cb 0.41 -3.64 -0.12 0.00 -0.53 0.00 0.00 39.78 35.90 1n8p n ASN 69 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1n8p s ALA 70 N -3.79 1.10 0.04 5.20 0.00 0.12 -4.90 121.76 119.53 1n8p s ALA 70 Ca 0.00 -1.00 0.13 0.00 0.00 0.00 0.00 51.96 51.10 1n8p s ALA 70 Cb -0.00 -0.07 0.18 0.00 0.00 0.00 0.00 23.12 23.23 1n8p s ALA 70 CO 0.84 0.12 1.49 1.96 0.00 0.00 0.00 175.76 180.18 1n8p h GLN 71 N 4.23 0.00 -5.19 0.00 1.08 -1.85 -3.29 115.11 110.09 1n8p h GLN 71 Ca -0.40 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 56.44 1n8p h GLN 71 Cb 1.19 0.00 -0.17 0.00 -0.05 0.00 0.00 27.48 28.45 1n8p h GLN 71 CO 0.42 0.61 -0.74 0.71 -0.95 0.00 0.00 178.83 178.88 1n8p s TYR 72 N -3.12 1.26 -0.03 2.96 1.51 -0.64 -4.97 117.35 114.32 1n8p s TYR 72 Ca 0.02 -0.63 -0.22 0.00 -1.01 0.00 0.00 57.07 55.22 1n8p s TYR 72 Cb 0.10 -0.66 0.04 0.00 -0.11 0.00 0.00 41.96 41.33 1n8p s TYR 72 CO 0.75 0.09 0.48 0.20 -1.11 0.00 0.00 175.55 175.96 1n8p s GLY 73 N -2.64 -0.35 -0.08 0.71 0.00 -1.26 -1.33 107.32 102.38 1n8p s GLY 73 Ca 0.10 0.77 -0.03 0.00 0.00 0.00 0.00 44.72 45.56 1n8p s GLY 73 CO 0.02 0.50 0.16 1.08 0.00 0.00 0.00 173.10 174.86 1n8p s LEU 74 N -1.28 0.38 -0.00 0.66 1.43 -0.56 -4.82 118.68 114.48 1n8p s LEU 74 Ca -0.12 0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 53.27 1n8p s LEU 74 Cb -0.03 0.38 -0.04 0.00 0.03 0.00 0.00 46.19 46.53 1n8p s LEU 74 CO 0.07 -0.19 0.23 0.00 0.23 0.00 0.00 176.35 176.69 1n8p s ALA 75 N 1.62 3.90 0.38 4.21 0.00 -1.26 -1.57 121.76 129.04 1n8p s ALA 75 Ca -0.05 -0.66 0.05 0.00 0.00 0.00 0.00 51.96 51.30 1n8p s ALA 75 Cb -0.12 -1.98 -0.03 0.00 0.00 0.00 0.00 23.12 21.00 1n8p s ALA 75 CO -0.06 0.69 0.18 -0.06 0.00 0.00 0.00 175.76 176.51 1n8p s PHE 76 N -1.31 1.76 0.35 0.00 0.40 0.12 -4.40 117.98 114.89 1n8p s PHE 76 Ca 0.27 -1.43 0.09 0.00 -0.60 0.00 0.00 56.93 55.27 1n8p s PHE 76 Cb -0.13 -0.99 0.82 0.00 0.51 0.00 0.00 43.02 43.23 1n8p s PHE 76 CO 0.17 -0.51 1.84 0.77 0.70 0.00 0.00 175.22 178.19 1n8p h SER 77 N 1.91 0.67 -1.01 1.36 0.02 -0.52 -2.72 113.55 113.27 1n8p h SER 77 Ca -0.32 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.69 1n8p h SER 77 Cb 1.26 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1n8p h SER 77 CO 0.49 0.31 0.00 -1.54 -1.14 0.00 0.00 176.83 174.95 1n8p n SER 78 N -4.60 0.00 0.10 3.07 3.41 -1.26 -4.03 113.62 110.31 1n8p n SER 78 Ca 0.19 -0.98 -0.17 0.00 -0.26 0.00 0.00 58.87 57.65 1n8p n SER 78 Cb 0.52 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.36 1n8p n SER 78 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1n8p h GLY 79 N 0.00 0.44 0.99 5.00 0.00 -1.81 -3.06 103.07 104.63 1n8p h GLY 79 Ca 0.00 -0.98 -0.03 0.00 0.00 0.00 0.00 47.33 46.33 1n8p h GLY 79 CO 0.00 0.86 0.28 1.76 0.00 0.00 0.00 176.54 179.44 1n8p h SER 80 N 0.15 0.81 0.74 0.19 0.02 -1.94 -1.05 113.55 112.47 1n8p h SER 80 Ca -0.14 -0.14 -0.04 0.00 -0.84 0.00 0.00 61.79 60.63 1n8p h SER 80 Cb 1.88 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 64.21 1n8p h SER 80 CO 0.21 0.72 -0.19 0.00 -1.14 0.00 0.00 176.83 176.43 1n8p h ALA 81 N 1.12 1.10 -0.10 3.77 0.00 -1.94 -1.29 119.26 121.92 1n8p h ALA 81 Ca 0.21 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1n8p h ALA 81 Cb 0.14 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1n8p h ALA 81 CO -0.02 0.24 -0.49 1.15 0.00 0.00 0.00 179.25 180.13 1n8p h THR 82 N 0.00 1.37 -0.70 0.00 2.02 -1.23 -1.01 112.91 113.36 1n8p h THR 82 Ca -0.00 -1.82 -0.05 0.00 0.77 0.00 0.00 66.41 65.31 1n8p h THR 82 Cb 0.61 2.20 -0.03 0.00 -1.74 0.00 0.00 68.15 69.20 1n8p h THR 82 CO 0.03 0.54 0.25 0.74 0.37 0.00 0.00 175.52 177.45 1n8p h THR 83 N 0.10 1.25 0.00 3.16 2.02 -1.15 -2.83 112.91 115.46 1n8p h THR 83 Ca -0.03 -0.83 -0.07 0.00 0.77 0.00 0.00 66.41 66.25 1n8p h THR 83 Cb 1.13 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 1n8p h THR 83 CO 0.10 0.33 -0.33 0.00 0.37 0.00 0.00 175.52 175.98 1n8p h ALA 84 N 1.11 1.19 0.02 6.16 0.00 -1.17 -0.51 119.26 126.06 1n8p h ALA 84 Ca 0.23 -0.30 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 1n8p h ALA 84 Cb 0.26 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1n8p h ALA 84 CO -0.01 0.42 -0.95 1.15 0.00 0.00 0.00 179.25 179.86 1n8p h THR 85 N 0.00 1.47 0.49 0.00 2.02 -1.02 -2.66 112.91 113.21 1n8p h THR 85 Ca -0.00 -2.63 -0.02 0.00 0.77 0.00 0.00 66.41 64.52 1n8p h THR 85 Cb 0.71 2.51 0.00 0.00 -1.74 0.00 0.00 68.15 69.64 1n8p h THR 85 CO 0.04 0.77 -0.23 0.40 0.37 0.00 0.00 175.52 176.87 1n8p h ILE 86 N 0.15 0.50 -0.41 3.11 2.04 -1.21 -2.31 117.51 119.38 1n8p h ILE 86 Ca -0.07 -0.19 0.02 0.00 1.00 0.00 0.00 64.86 65.63 1n8p h ILE 86 Cb 1.59 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.24 1n8p h ILE 86 CO 0.15 0.03 0.27 -0.07 0.00 0.00 0.00 178.15 178.54 1n8p h LEU 87 N -0.77 0.40 -0.58 1.44 3.38 -1.11 -0.52 115.31 117.55 1n8p h LEU 87 Ca -0.07 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1n8p h LEU 87 Cb 0.56 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1n8p h LEU 87 CO 0.11 0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.92 1n8p n GLN 88 N -4.48 1.39 0.01 1.13 10.64 -1.00 -2.63 117.38 122.43 1n8p n GLN 88 Ca 0.04 -0.58 0.11 0.00 -1.83 0.00 0.00 57.00 54.75 1n8p n GLN 88 Cb 0.13 -1.40 0.09 0.00 -0.86 0.00 0.00 30.24 28.19 1n8p n GLN 88 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 1n8p n SER 89 N -0.25 0.67 -4.77 2.61 3.41 -0.21 -4.91 113.62 110.17 1n8p n SER 89 Ca 0.18 -0.43 -0.38 0.00 -0.26 0.00 0.00 58.87 57.98 1n8p n SER 89 Cb 0.22 0.60 -0.03 0.00 -0.26 0.00 0.00 64.21 64.74 1n8p n SER 89 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1n8p s LEU 90 N -3.28 4.20 0.51 1.04 1.43 -1.08 -4.98 118.68 116.52 1n8p s LEU 90 Ca 0.08 2.21 -0.23 0.00 -1.03 0.00 0.00 54.13 55.17 1n8p s LEU 90 Cb 0.16 -4.06 -0.06 0.00 0.03 0.00 0.00 46.19 42.26 1n8p s LEU 90 CO 0.77 -0.56 1.34 -0.81 0.23 0.00 0.00 176.35 177.32 1n8p n PRO 91 N 0.10 1.80 -1.57 1.29 -0.04 -1.26 -4.84 135.00 130.48 1n8p n PRO 91 Ca 0.04 0.65 -0.47 0.00 -0.04 0.00 0.00 63.50 63.69 1n8p n PRO 91 Cb 0.48 -2.54 -0.03 0.00 -0.04 0.00 0.00 33.50 31.37 1n8p n PRO 91 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1n8p n GLN 92 N -0.70 1.14 -3.15 0.54 -0.06 -1.26 -3.37 117.38 110.52 1n8p n GLN 92 Ca 0.09 0.40 -0.06 0.00 -2.00 0.00 0.00 57.00 55.43 1n8p n GLN 92 Cb 0.43 -1.79 0.00 0.00 -4.06 0.00 0.00 30.24 24.83 1n8p n GLN 92 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1n8p n GLY 93 N 1.63 -1.22 3.71 1.69 0.00 -1.24 -5.05 105.19 104.71 1n8p n GLY 93 Ca 0.13 0.64 -0.33 0.00 0.00 0.00 0.00 46.02 46.46 1n8p n GLY 93 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1n8p n SER 94 N -1.62 3.14 -4.09 1.61 7.64 -1.20 -4.95 113.62 114.14 1n8p n SER 94 Ca -0.03 -3.29 -0.17 0.00 1.01 0.00 0.00 58.87 56.39 1n8p n SER 94 Cb 0.53 0.47 -0.13 0.00 -1.01 0.00 0.00 64.21 64.07 1n8p n SER 94 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1n8p s HIS 95 N -2.92 0.93 0.03 1.43 2.46 0.53 0.14 115.29 117.89 1n8p s HIS 95 Ca 0.03 -0.37 0.01 0.00 0.47 0.00 0.00 55.06 55.19 1n8p s HIS 95 Cb 0.00 -0.55 -0.02 0.00 -0.13 0.00 0.00 32.58 31.88 1n8p s HIS 95 CO 0.02 -0.01 -0.05 0.00 -2.47 0.00 0.00 174.74 172.24 1n8p s ALA 96 N -0.97 0.35 -0.01 1.58 0.00 -1.17 0.18 121.76 121.73 1n8p s ALA 96 Ca -0.03 -0.75 0.07 0.00 0.00 0.00 0.00 51.96 51.26 1n8p s ALA 96 Cb -0.08 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.14 1n8p s ALA 96 CO 0.01 -0.14 -0.23 0.08 0.00 0.00 0.00 175.76 175.48 1n8p s VAL 97 N -1.79 2.30 0.02 0.00 1.01 0.61 -2.37 120.40 120.18 1n8p s VAL 97 Ca -0.10 -1.09 -0.13 0.00 0.00 0.00 0.00 61.98 60.65 1n8p s VAL 97 Cb -0.07 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.48 1n8p s VAL 97 CO -0.02 0.53 0.29 -0.94 0.00 0.00 0.00 175.10 174.96 1n8p s SER 98 N -0.80 -0.13 0.67 3.32 1.04 -1.25 0.72 113.70 117.28 1n8p s SER 98 Ca 0.11 -0.09 -0.17 0.00 0.48 0.00 0.00 55.95 56.27 1n8p s SER 98 Cb -0.10 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1n8p s SER 98 CO 0.00 -0.52 1.23 -0.38 0.98 0.00 0.00 173.24 174.54 1n8p n ILE 99 N 0.93 4.28 0.30 -1.02 5.41 -0.96 -0.80 119.36 127.49 1n8p n ILE 99 Ca -0.20 -0.45 -0.12 0.00 1.00 0.00 0.00 62.75 62.98 1n8p n ILE 99 Cb 0.58 -1.39 -0.06 0.00 -0.71 0.00 0.00 39.64 38.06 1n8p n ILE 99 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1n8p h GLY 100 N 0.25 -0.84 -6.92 7.39 0.00 -1.47 -3.37 103.07 98.10 1n8p h GLY 100 Ca -0.50 0.31 -0.33 0.00 0.00 0.00 0.00 47.33 46.82 1n8p h GLY 100 CO 0.51 -0.30 1.00 1.22 0.00 0.00 0.00 176.54 178.96 1n8p n ASP 101 N -5.17 0.23 -4.38 0.19 8.00 -1.26 -4.79 116.55 109.38 1n8p n ASP 101 Ca -0.10 -1.72 -0.20 0.00 0.71 0.00 0.00 54.79 53.48 1n8p n ASP 101 Cb 0.32 -0.32 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 1n8p n ASP 101 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1n8p s VAL 102 N 5.27 1.93 0.77 2.53 1.01 -1.26 -3.67 120.40 126.98 1n8p s VAL 102 Ca 0.38 -2.26 -0.13 0.00 0.00 0.00 0.00 61.98 59.97 1n8p s VAL 102 Cb 0.08 -2.11 0.06 0.00 0.00 0.00 0.00 36.38 34.42 1n8p s VAL 102 CO 0.19 -0.55 1.16 -0.47 0.00 0.00 0.00 175.10 175.43 1n8p s TYR 103 N -2.85 2.13 -1.36 5.22 5.04 -1.26 -4.83 117.35 119.45 1n8p s TYR 103 Ca 0.24 1.63 0.06 0.00 -2.44 0.00 0.00 57.07 56.56 1n8p s TYR 103 Cb -0.02 -3.32 0.29 0.00 0.35 0.00 0.00 41.96 39.26 1n8p s TYR 103 CO 0.09 -2.36 1.06 0.41 -1.34 0.00 0.00 175.55 173.41 1n8p n GLY 104 N -0.08 -0.52 0.45 8.97 0.00 -1.26 -3.25 105.19 109.50 1n8p n GLY 104 Ca 0.12 -0.03 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 1n8p n GLY 104 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1n8p h GLY 105 N 0.98 -0.94 0.34 -0.02 0.00 -1.98 0.67 103.07 102.11 1n8p h GLY 105 Ca 0.00 0.65 0.02 0.00 0.00 0.00 0.00 47.33 48.00 1n8p h GLY 105 CO 0.00 -0.18 -0.35 -0.91 0.00 0.00 0.00 176.54 175.10 1n8p h THR 106 N -0.49 0.27 -0.30 4.70 1.35 -1.93 0.47 112.91 116.98 1n8p h THR 106 Ca 0.06 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 65.95 1n8p h THR 106 Cb 0.64 0.27 -0.04 0.00 -1.73 0.00 0.00 68.15 67.29 1n8p h THR 106 CO -0.49 0.00 -0.18 1.57 -0.25 0.00 0.00 175.52 176.17 1n8p n HIS 107 N -5.43 -0.13 0.00 4.73 -0.00 -0.62 0.09 115.22 113.86 1n8p n HIS 107 Ca -0.06 0.37 0.00 0.00 -0.00 0.00 0.00 57.72 58.03 1n8p n HIS 107 Cb 0.34 -0.47 0.00 0.00 -0.00 0.00 0.00 29.99 29.86 1n8p n HIS 107 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1n8p n ARG 108 N -3.63 0.00 -0.08 1.57 1.74 0.22 -2.65 116.66 113.84 1n8p n ARG 108 Ca 0.01 0.08 -0.02 0.00 -0.77 0.00 0.00 57.85 57.15 1n8p n ARG 108 Cb 0.08 -0.77 -0.02 0.00 -1.02 0.00 0.00 32.46 30.73 1n8p n ARG 108 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1n8p n TYR 109 N -0.35 -0.08 -0.26 -1.55 0.53 0.16 -0.53 117.16 115.07 1n8p n TYR 109 Ca 0.00 0.22 0.18 0.00 -1.02 0.00 0.00 57.90 57.28 1n8p n TYR 109 Cb 0.00 -0.46 0.34 0.00 -1.03 0.00 0.00 39.34 38.19 1n8p n TYR 109 CO 0.00 0.00 0.00 1.19 -1.02 0.00 0.00 176.86 177.03 1n8p n PHE 110 N -3.32 0.69 -0.06 -0.72 3.01 0.11 -0.51 117.46 116.66 1n8p n PHE 110 Ca 0.00 0.94 -0.13 0.00 1.01 0.00 0.00 57.45 59.28 1n8p n PHE 110 Cb 0.05 -1.21 -0.12 0.00 -0.01 0.00 0.00 39.48 38.19 1n8p n PHE 110 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1n8p h THR 111 N 0.00 1.61 0.08 4.37 2.02 -0.66 -3.16 112.91 117.16 1n8p h THR 111 Ca 0.56 -2.08 0.00 0.00 0.77 0.00 0.00 66.41 65.67 1n8p h THR 111 Cb 1.34 2.98 -0.01 0.00 -1.74 0.00 0.00 68.15 70.71 1n8p h THR 111 CO -0.68 0.52 -0.16 0.11 0.37 0.00 0.00 175.52 175.68 1n8p h LYS 112 N -0.93 -0.24 0.00 6.66 6.56 0.18 0.57 116.57 129.36 1n8p h LYS 112 Ca -0.00 0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1n8p h LYS 112 Cb 0.86 0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.58 1n8p h LYS 112 CO 0.00 -0.16 0.12 0.28 -2.06 0.00 0.00 179.45 177.63 1n8p n VAL 113 N -3.31 1.18 -1.32 0.50 0.31 -0.73 0.18 118.33 115.14 1n8p n VAL 113 Ca -0.03 0.64 -0.27 0.00 -0.01 0.00 0.00 64.34 64.67 1n8p n VAL 113 Cb 0.13 -1.64 0.02 0.00 -0.91 0.00 0.00 33.84 31.44 1n8p n VAL 113 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1n8p n ALA 114 N -1.56 6.00 -0.72 3.52 0.00 0.18 -4.47 120.51 123.46 1n8p n ALA 114 Ca -0.01 -2.83 -0.31 0.00 0.00 0.00 0.00 53.44 50.29 1n8p n ALA 114 Cb 0.13 -1.79 -0.05 0.00 0.00 0.00 0.00 19.45 17.74 1n8p n ALA 114 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1n8p n ASN 115 N 0.12 0.47 0.00 0.00 5.03 0.46 -0.45 115.26 120.90 1n8p n ASN 115 Ca 0.46 0.45 0.00 0.00 0.87 0.00 0.00 54.58 56.36 1n8p n ASN 115 Cb 0.54 -0.42 0.00 0.00 -1.02 0.00 0.00 39.78 38.87 1n8p n ASN 115 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1n8p n ALA 116 N 2.71 0.00 -1.74 5.41 0.00 -1.26 -2.29 120.51 123.34 1n8p n ALA 116 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1n8p n ALA 116 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.43 1n8p n ALA 116 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1n8p n HIS 117 N 0.00 0.00 0.00 0.00 -0.00 0.03 -5.09 115.22 110.16 1n8p n HIS 117 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1n8p n HIS 117 Cb 0.00 0.11 0.00 0.00 -0.12 0.00 0.00 29.99 29.98 1n8p n HIS 117 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1n8p n GLY 118 N 0.00 -2.56 3.45 1.57 0.00 0.41 -4.30 105.19 103.76 1n8p n GLY 118 Ca 0.00 0.52 -0.44 0.00 0.00 0.00 0.00 46.02 46.11 1n8p n GLY 118 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n8p s VAL 119 N -1.85 4.91 1.04 1.61 1.01 -1.26 -3.28 120.40 122.57 1n8p s VAL 119 Ca 0.00 -0.48 -0.16 0.00 0.00 0.00 0.00 61.98 61.34 1n8p s VAL 119 Cb 0.00 -4.27 0.07 0.00 0.00 0.00 0.00 36.38 32.18 1n8p s VAL 119 CO 0.00 -0.76 0.20 -0.62 0.00 0.00 0.00 175.10 173.92 1n8p n GLU 120 N 6.08 -0.95 -3.65 2.72 1.02 0.38 -4.69 120.64 121.55 1n8p n GLU 120 Ca -0.07 -0.25 -0.04 0.00 -0.02 0.00 0.00 57.16 56.79 1n8p n GLU 120 Cb 0.46 -1.77 -0.05 0.00 -0.02 0.00 0.00 31.44 30.05 1n8p n GLU 120 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1n8p s THR 121 N -2.31 -0.62 -0.38 2.62 2.01 -1.26 -3.06 115.64 112.63 1n8p s THR 121 Ca 0.56 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.60 1n8p s THR 121 Cb -0.16 -0.98 0.11 0.00 0.01 0.00 0.00 72.50 71.48 1n8p s THR 121 CO 0.67 0.00 0.13 -0.94 -0.69 0.00 0.00 174.62 173.79 1n8p s SER 122 N 2.42 4.38 0.40 3.53 1.04 -1.00 -4.99 113.70 119.48 1n8p s SER 122 Ca -0.07 -2.28 -0.26 0.00 0.48 0.00 0.00 55.95 53.81 1n8p s SER 122 Cb -0.09 -1.40 -0.09 0.00 0.10 0.00 0.00 66.02 64.54 1n8p s SER 122 CO -0.19 -0.34 1.30 -0.36 0.98 0.00 0.00 173.24 174.63 1n8p s PHE 123 N 0.74 2.84 -0.17 5.02 0.40 -1.26 -3.75 117.98 121.80 1n8p s PHE 123 Ca 0.13 1.41 -0.08 0.00 -0.60 0.00 0.00 56.93 57.78 1n8p s PHE 123 Cb -0.21 -3.67 0.07 0.00 0.51 0.00 0.00 43.02 39.71 1n8p s PHE 123 CO -0.09 -2.07 0.40 0.99 0.70 0.00 0.00 175.22 175.16 1n8p s THR 124 N -1.25 -0.18 0.60 0.64 2.01 0.02 -4.91 115.64 112.58 1n8p s THR 124 Ca 0.56 0.12 -0.04 0.00 0.31 0.00 0.00 61.69 62.64 1n8p s THR 124 Cb -0.38 -0.61 0.03 0.00 0.01 0.00 0.00 72.50 71.54 1n8p s THR 124 CO 0.49 0.05 0.88 0.21 -0.69 0.00 0.00 174.62 175.56 1n8p s ASN 125 N 1.70 5.33 -0.34 3.53 3.84 -1.26 -1.16 114.94 126.57 1n8p s ASN 125 Ca -0.07 0.43 -0.22 0.00 0.21 0.00 0.00 52.86 53.20 1n8p s ASN 125 Cb -0.09 -1.33 0.03 0.00 -0.55 0.00 0.00 41.25 39.31 1n8p s ASN 125 CO -0.13 -1.19 0.45 -0.67 -2.79 0.00 0.00 177.10 172.77 1n8p n ASP 126 N -2.56 -6.61 -0.10 -4.21 2.03 -1.26 -4.80 116.55 99.03 1n8p n ASP 126 Ca 0.06 0.31 -0.10 0.00 0.52 0.00 0.00 54.79 55.57 1n8p n ASP 126 Cb 0.59 -3.00 -0.03 0.00 -0.72 0.00 0.00 41.12 37.97 1n8p n ASP 126 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1n8p h LEU 127 N 2.47 0.47 -1.13 -2.67 5.85 -1.98 -3.27 115.31 115.05 1n8p h LEU 127 Ca -0.25 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1n8p h LEU 127 Cb 1.07 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.98 1n8p h LEU 127 CO 0.16 0.56 0.00 0.18 -0.34 0.00 0.00 178.44 179.01 1n8p n LEU 128 N -4.67 0.63 -0.05 2.25 4.77 -1.26 -2.35 117.00 116.33 1n8p n LEU 128 Ca -0.02 0.73 -0.01 0.00 -0.03 0.00 0.00 56.01 56.68 1n8p n LEU 128 Cb 0.18 -0.72 -0.14 0.00 -2.33 0.00 0.00 43.42 40.41 1n8p n LEU 128 CO 0.37 -0.79 -0.91 0.59 -1.33 0.00 0.00 177.39 175.33 1n8p n ASN 129 N -2.28 0.87 -0.13 -1.43 3.02 -1.23 -4.60 115.26 109.48 1n8p n ASN 129 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 1n8p n ASN 129 Cb 0.13 1.29 -0.04 0.00 -0.61 0.00 0.00 39.78 40.55 1n8p n ASN 129 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1n8p n ASP 130 N -2.42 0.93 -0.34 6.41 8.00 -1.22 -4.61 116.55 123.30 1n8p n ASP 130 Ca -0.17 -0.96 0.01 0.00 0.71 0.00 0.00 54.79 54.37 1n8p n ASP 130 Cb 0.81 0.75 0.17 0.00 -0.02 0.00 0.00 41.12 42.83 1n8p n ASP 130 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1n8p h LEU 131 N 0.64 1.04 -0.12 0.64 5.85 -1.72 -0.67 115.31 120.97 1n8p h LEU 131 Ca 0.00 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 1n8p h LEU 131 Cb 0.34 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 1n8p h LEU 131 CO 0.00 0.71 0.02 1.55 -0.34 0.00 0.00 178.44 180.38 1n8p h PRO 132 N 1.21 0.21 0.00 5.25 0.13 -1.86 2.57 132.00 139.50 1n8p h PRO 132 Ca 0.38 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 65.43 1n8p h PRO 132 Cb 0.01 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.11 1n8p h PRO 132 CO -0.12 0.41 -0.12 1.96 -0.23 0.00 0.00 178.00 179.90 1n8p h GLN 133 N -0.02 0.00 0.00 0.86 4.20 -1.80 -3.16 115.11 115.19 1n8p h GLN 133 Ca 0.04 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.43 1n8p h GLN 133 Cb 0.30 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.02 1n8p h GLN 133 CO 0.00 0.12 -2.22 1.28 -0.67 0.00 0.00 178.83 177.35 1n8p n LEU 134 N -3.81 0.00 0.18 1.46 4.77 -0.28 -4.67 117.00 114.66 1n8p n LEU 134 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1n8p n LEU 134 Cb 0.22 0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1n8p n LEU 134 CO 0.31 0.42 0.66 -0.38 -1.33 0.00 0.00 177.39 177.07 1n8p n ILE 135 N -2.64 0.00 -4.47 -0.08 5.41 0.86 -4.30 119.36 114.13 1n8p n ILE 135 Ca -0.28 0.66 -0.23 0.00 1.00 0.00 0.00 62.75 63.90 1n8p n ILE 135 Cb 1.06 -1.41 -0.10 0.00 -0.71 0.00 0.00 39.64 38.48 1n8p n ILE 135 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1n8p s LYS 136 N -2.80 1.74 0.00 0.38 2.47 -1.26 -4.36 119.74 115.91 1n8p s LYS 136 Ca 0.00 -2.01 0.00 0.00 -1.56 0.00 0.00 55.97 52.40 1n8p s LYS 136 Cb 0.00 -0.76 0.00 0.00 -1.46 0.00 0.00 37.83 35.61 1n8p s LYS 136 CO 0.00 -0.30 0.00 -1.91 0.16 0.00 0.00 175.35 173.30 1n8p n GLU 137 N -0.76 0.00 0.00 4.03 2.13 -1.26 -4.67 120.64 120.10 1n8p n GLU 137 Ca -0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.78 1n8p n GLU 137 Cb 0.66 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.37 1n8p n GLU 137 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1n8p n ASN 138 N 0.00 0.00 -4.62 4.31 5.15 -1.26 -4.67 115.26 114.17 1n8p n ASN 138 Ca 0.00 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.56 1n8p n ASN 138 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1n8p n ASN 138 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1n8p n THR 139 N -1.29 2.28 -0.84 -0.44 -2.24 -1.23 -0.35 114.28 110.18 1n8p n THR 139 Ca 0.00 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 1n8p n THR 139 Cb 0.00 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 1n8p n THR 139 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1n8p n LYS 140 N 0.33 0.00 -4.25 -0.78 4.76 0.48 -4.72 118.16 113.99 1n8p n LYS 140 Ca 0.09 0.00 -0.17 0.00 -2.87 0.00 0.00 58.31 55.36 1n8p n LYS 140 Cb 0.37 -0.11 -0.15 0.00 -1.84 0.00 0.00 35.03 33.30 1n8p n LYS 140 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1n8p s LEU 141 N 0.00 2.00 -0.19 -0.35 2.96 -1.14 -2.56 118.68 119.39 1n8p s LEU 141 Ca 0.00 -0.12 -0.00 0.00 -0.22 0.00 0.00 54.13 53.78 1n8p s LEU 141 Cb 0.00 -0.35 0.05 0.00 0.50 0.00 0.00 46.19 46.39 1n8p s LEU 141 CO 0.00 0.08 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.38 1n8p s VAL 142 N -0.14 1.15 -0.35 1.68 1.01 -0.47 -0.29 120.40 123.00 1n8p s VAL 142 Ca 0.02 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.11 1n8p s VAL 142 Cb -0.03 -1.41 0.03 0.00 0.00 0.00 0.00 36.38 34.97 1n8p s VAL 142 CO -0.00 -0.00 0.15 0.86 0.00 0.00 0.00 175.10 176.11 1n8p s TRP 143 N 1.59 3.24 -0.11 5.22 -0.11 0.22 -0.56 118.94 128.43 1n8p s TRP 143 Ca -0.02 -1.14 0.00 0.00 1.22 0.00 0.00 56.10 56.17 1n8p s TRP 143 Cb -0.17 -2.36 -0.02 0.00 -1.50 0.00 0.00 33.47 29.43 1n8p s TRP 143 CO -0.07 -0.67 -0.12 0.42 -4.62 0.00 0.00 176.95 171.88 1n8p s ILE 144 N 1.49 3.13 -0.84 5.86 1.01 -0.02 -2.27 121.20 129.56 1n8p s ILE 144 Ca 0.01 -0.65 0.01 0.00 0.00 0.00 0.00 60.65 60.01 1n8p s ILE 144 Cb -0.19 -2.30 0.21 0.00 0.01 0.00 0.00 42.46 40.19 1n8p s ILE 144 CO 0.05 0.54 0.71 1.21 0.00 0.00 0.00 174.94 177.45 1n8p n GLU 145 N 3.23 2.43 0.00 2.79 2.13 -1.26 -0.40 120.64 129.56 1n8p n GLU 145 Ca -0.18 -4.49 0.00 0.00 0.66 0.00 0.00 57.16 53.15 1n8p n GLU 145 Cb 0.53 -2.37 0.00 0.00 0.27 0.00 0.00 31.44 29.86 1n8p n GLU 145 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1n8p n THR 146 N 2.13 0.00 -2.98 6.31 -2.24 -1.24 -2.89 114.28 113.37 1n8p n THR 146 Ca 0.22 0.40 -0.42 0.00 -2.27 0.00 0.00 64.05 61.98 1n8p n THR 146 Cb 0.36 -0.61 -0.05 0.00 -2.10 0.00 0.00 70.33 67.93 1n8p n THR 146 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 1n8p s PRO 147 N -0.91 3.95 0.68 -0.78 0.02 -1.26 -3.99 135.00 132.71 1n8p s PRO 147 Ca 0.00 0.52 -0.16 0.00 0.02 0.00 0.00 61.00 61.38 1n8p s PRO 147 Cb 0.00 -3.73 0.01 0.00 0.02 0.00 0.00 34.50 30.80 1n8p s PRO 147 CO 0.00 -0.66 1.22 0.95 -0.33 0.00 0.00 177.00 178.18 1n8p s THR 148 N 2.89 2.36 -0.20 0.99 -4.23 -1.14 -4.83 115.64 111.48 1n8p s THR 148 Ca 0.31 0.20 -0.03 0.00 -1.18 0.00 0.00 61.69 60.99 1n8p s THR 148 Cb -0.14 -2.88 -0.01 0.00 1.34 0.00 0.00 72.50 70.81 1n8p s THR 148 CO 0.12 -0.08 -0.08 0.21 -0.54 0.00 0.00 174.62 174.26 1n8p s ASN 149 N -1.85 4.10 0.00 3.99 2.47 -1.24 -0.83 114.94 121.58 1n8p s ASN 149 Ca 0.76 -0.41 0.22 0.00 0.42 0.00 0.00 52.86 53.85 1n8p s ASN 149 Cb -0.31 -1.68 -0.12 0.00 -1.45 0.00 0.00 41.25 37.69 1n8p s ASN 149 CO 0.42 0.02 0.95 -0.81 -3.72 0.00 0.00 177.10 173.95 1n8p n PRO 150 N 4.53 0.06 -0.31 0.43 -0.04 -1.26 -4.60 135.00 133.80 1n8p n PRO 150 Ca -0.19 -0.01 0.17 0.00 -0.04 0.00 0.00 63.50 63.43 1n8p n PRO 150 Cb 0.51 -1.51 0.36 0.00 -0.04 0.00 0.00 33.50 32.82 1n8p n PRO 150 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1n8p h THR 151 N 0.00 0.31 -0.74 0.52 2.02 -1.91 -3.42 112.91 109.70 1n8p h THR 151 Ca 0.00 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 1n8p h THR 151 Cb 0.55 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1n8p h THR 151 CO 0.00 0.05 -0.00 0.18 0.37 0.00 0.00 175.52 176.12 1n8p n LEU 152 N -5.16 -1.74 -4.59 2.58 4.77 -0.01 -4.77 117.00 108.09 1n8p n LEU 152 Ca 0.25 -0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.81 1n8p n LEU 152 Cb 0.79 -0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 41.36 1n8p n LEU 152 CO 0.07 0.00 1.09 -0.75 -1.33 0.00 0.00 177.39 176.48 1n8p s LYS 153 N -4.74 3.55 0.43 3.23 2.20 -1.26 -4.64 119.74 118.51 1n8p s LYS 153 Ca 0.00 0.38 -0.23 0.00 -0.36 0.00 0.00 55.97 55.75 1n8p s LYS 153 Cb -0.00 -4.00 -0.08 0.00 -1.51 0.00 0.00 37.83 32.24 1n8p s LYS 153 CO 0.00 -1.63 1.09 0.08 -0.36 0.00 0.00 175.35 174.53 1n8p s VAL 154 N 4.96 3.50 0.07 4.02 1.01 -1.26 -3.25 120.40 129.45 1n8p s VAL 154 Ca 0.46 1.13 0.08 0.00 0.00 0.00 0.00 61.98 63.64 1n8p s VAL 154 Cb -0.08 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1n8p s VAL 154 CO 0.27 -0.02 -0.22 -0.89 0.00 0.00 0.00 175.10 174.25 1n8p s THR 155 N -1.64 1.75 -0.67 3.92 2.01 -1.26 -4.84 115.64 114.92 1n8p s THR 155 Ca 0.60 -1.36 -0.25 0.00 0.31 0.00 0.00 61.69 60.99 1n8p s THR 155 Cb -0.24 -1.55 0.05 0.00 0.01 0.00 0.00 72.50 70.77 1n8p s THR 155 CO 0.30 0.12 1.11 -0.62 -0.69 0.00 0.00 174.62 174.84 1n8p s ASP 156 N -1.47 6.22 0.44 3.53 -1.08 -1.26 -4.88 116.67 118.16 1n8p s ASP 156 Ca 0.08 -0.58 0.14 0.00 -0.52 0.00 0.00 52.55 51.66 1n8p s ASP 156 Cb -0.09 -2.49 1.03 0.00 -1.46 0.00 0.00 42.92 39.91 1n8p s ASP 156 CO 0.03 -1.58 1.98 0.40 0.52 0.00 0.00 175.17 176.53 1n8p h ILE 157 N 6.02 0.90 -0.04 4.11 2.04 -1.95 -2.31 117.51 126.28 1n8p h ILE 157 Ca -0.28 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.38 1n8p h ILE 157 Cb 1.06 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1n8p h ILE 157 CO 1.21 0.07 -0.22 -0.61 0.00 0.00 0.00 178.15 178.61 1n8p h GLN 158 N 0.40 0.23 -0.56 2.37 5.75 -1.84 -0.87 115.11 120.59 1n8p h GLN 158 Ca 0.27 -0.18 0.04 0.00 -0.15 0.00 0.00 58.65 58.62 1n8p h GLN 158 Cb 0.52 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.08 1n8p h GLN 158 CO -0.07 0.83 0.37 0.87 -2.65 0.00 0.00 178.83 178.18 1n8p h LYS 159 N -0.33 0.60 0.04 1.69 1.57 -1.85 -0.01 116.57 118.29 1n8p h LYS 159 Ca -0.01 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1n8p h LYS 159 Cb 0.87 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1n8p h LYS 159 CO 0.04 0.39 -0.02 0.28 -0.57 0.00 0.00 179.45 179.58 1n8p h VAL 160 N 0.61 1.33 -0.83 0.50 2.07 -1.41 -0.88 116.25 117.64 1n8p h VAL 160 Ca 0.23 -1.44 0.16 0.00 0.82 0.00 0.00 66.70 66.47 1n8p h VAL 160 Cb 0.14 2.26 -0.10 0.00 -1.52 0.00 0.00 31.29 32.06 1n8p h VAL 160 CO -0.06 0.35 0.38 0.00 0.02 0.00 0.00 177.57 178.26 1n8p h ALA 161 N 0.15 1.24 0.57 1.67 0.00 -0.64 -1.59 119.26 120.66 1n8p h ALA 161 Ca -0.01 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1n8p h ALA 161 Cb 0.62 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.48 1n8p h ALA 161 CO 0.01 -0.19 -0.27 -0.44 0.00 0.00 0.00 179.25 178.36 1n8p h ASP 162 N 0.51 -0.65 -0.56 0.00 3.32 -1.02 -2.83 116.42 115.19 1n8p h ASP 162 Ca 0.47 0.02 0.16 0.00 0.02 0.00 0.00 57.03 57.70 1n8p h ASP 162 Cb 0.75 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.44 1n8p h ASP 162 CO -0.42 -0.24 0.99 0.25 -1.72 0.00 0.00 179.24 178.10 1n8p h LEU 163 N -1.20 0.00 0.00 1.55 5.85 -0.76 0.26 115.31 121.01 1n8p h LEU 163 Ca -0.08 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1n8p h LEU 163 Cb 0.59 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 1n8p h LEU 163 CO 0.13 0.00 -0.06 0.40 -0.34 0.00 0.00 178.44 178.57 1n8p h ILE 164 N 0.00 0.03 -1.48 4.05 2.04 -1.18 -2.25 117.51 118.71 1n8p h ILE 164 Ca 0.26 -1.02 0.44 0.00 1.00 0.00 0.00 64.86 65.54 1n8p h ILE 164 Cb 2.25 0.05 -0.08 0.00 -0.74 0.00 0.00 36.82 38.30 1n8p h ILE 164 CO -0.00 0.01 1.05 0.11 0.00 0.00 0.00 178.15 179.31 1n8p h LYS 165 N -1.00 0.04 0.04 2.37 1.57 -0.29 0.21 116.57 119.51 1n8p h LYS 165 Ca -0.00 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1n8p h LYS 165 Cb 0.07 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1n8p h LYS 165 CO -0.00 0.03 -0.02 -0.22 -0.57 0.00 0.00 179.45 178.67 1n8p h LYS 166 N 0.04 -0.06 -0.07 3.15 3.64 -1.30 -2.68 116.57 119.29 1n8p h LYS 166 Ca 0.74 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.13 1n8p h LYS 166 Cb 2.81 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 34.64 1n8p h LYS 166 CO -0.10 -0.04 0.00 0.72 -2.27 0.00 0.00 179.45 177.77 1n8p n HIS 167 N -2.94 0.00 -2.03 1.91 8.25 -0.81 -3.91 115.22 115.70 1n8p n HIS 167 Ca -0.01 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.42 1n8p n HIS 167 Cb 0.02 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.12 1n8p n HIS 167 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1n8p n ALA 168 N -0.45 1.42 -1.60 -1.41 0.00 -0.00 -4.84 120.51 113.63 1n8p n ALA 168 Ca 0.00 -0.46 -0.36 0.00 0.00 0.00 0.00 53.44 52.61 1n8p n ALA 168 Cb 0.02 -0.41 0.08 0.00 0.00 0.00 0.00 19.45 19.14 1n8p n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n8p n ALA 169 N -0.26 0.79 -0.23 0.00 0.00 -1.01 -3.12 120.51 116.67 1n8p n ALA 169 Ca -0.15 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1n8p n ALA 169 Cb 0.58 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1n8p n ALA 169 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n8p n GLY 170 N 0.92 2.05 1.02 0.00 0.00 -1.26 -4.91 105.19 103.01 1n8p n GLY 170 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.15 1n8p n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n8p n GLN 171 N -2.00 1.84 -4.10 1.61 10.64 -1.18 -5.00 117.38 119.17 1n8p n GLN 171 Ca 0.00 -3.29 -0.34 0.00 -1.83 0.00 0.00 57.00 51.54 1n8p n GLN 171 Cb 0.00 -1.78 -0.04 0.00 -0.86 0.00 0.00 30.24 27.57 1n8p n GLN 171 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1n8p n ASP 172 N -1.10 -2.83 -4.55 2.61 8.00 -1.26 -4.88 116.55 112.53 1n8p n ASP 172 Ca 0.29 -0.91 -0.40 0.00 0.71 0.00 0.00 54.79 54.49 1n8p n ASP 172 Cb 0.91 -2.36 -0.03 0.00 -0.02 0.00 0.00 41.12 39.62 1n8p n ASP 172 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1n8p s VAL 173 N -3.14 3.52 0.29 2.53 1.01 -1.26 -4.90 120.40 118.44 1n8p s VAL 173 Ca 0.69 0.32 -0.27 0.00 0.00 0.00 0.00 61.98 62.72 1n8p s VAL 173 Cb -0.38 -4.31 -0.09 0.00 0.00 0.00 0.00 36.38 31.59 1n8p s VAL 173 CO 0.84 -1.24 0.93 0.27 0.00 0.00 0.00 175.10 175.90 1n8p s ILE 174 N 7.62 4.19 -0.19 2.22 -4.36 -1.06 -4.89 121.20 124.72 1n8p s ILE 174 Ca 0.55 1.89 -0.07 0.00 -0.26 0.00 0.00 60.65 62.76 1n8p s ILE 174 Cb -0.11 -4.11 -0.04 0.00 1.25 0.00 0.00 42.46 39.45 1n8p s ILE 174 CO 0.19 0.27 0.05 -0.22 0.24 0.00 0.00 174.94 175.48 1n8p s LEU 175 N -1.73 3.71 -0.10 0.37 2.96 -1.26 -1.36 118.68 121.26 1n8p s LEU 175 Ca 0.46 0.02 0.04 0.00 -0.22 0.00 0.00 54.13 54.43 1n8p s LEU 175 Cb -0.21 -1.94 -0.00 0.00 0.50 0.00 0.00 46.19 44.54 1n8p s LEU 175 CO 0.26 0.14 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.52 1n8p s VAL 176 N 0.55 2.17 -0.11 1.68 1.01 0.27 -0.04 120.40 125.92 1n8p s VAL 176 Ca 0.03 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.05 1n8p s VAL 176 Cb -0.13 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.41 1n8p s VAL 176 CO 0.01 0.56 -0.20 -0.69 0.00 0.00 0.00 175.10 174.78 1n8p s VAL 177 N 0.32 2.37 -0.42 2.92 1.01 0.25 -0.84 120.40 126.02 1n8p s VAL 177 Ca -0.18 -0.90 -0.24 0.00 0.00 0.00 0.00 61.98 60.66 1n8p s VAL 177 Cb -0.18 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 34.28 1n8p s VAL 177 CO 0.08 0.55 0.83 -0.62 0.00 0.00 0.00 175.10 175.94 1n8p s ASP 178 N 0.38 6.50 -0.25 3.32 -1.08 0.47 -1.12 116.67 124.89 1n8p s ASP 178 Ca -0.16 0.16 0.12 0.00 -0.52 0.00 0.00 52.55 52.16 1n8p s ASP 178 Cb -0.17 -2.41 0.55 0.00 -1.46 0.00 0.00 42.92 39.43 1n8p s ASP 178 CO 0.07 -0.88 1.50 -3.20 0.52 0.00 0.00 175.17 173.19 1n8p n ASN 179 N 6.72 3.46 -0.07 -0.34 5.15 -0.09 -3.65 115.26 126.44 1n8p n ASN 179 Ca 0.04 -3.35 -0.09 0.00 -0.60 0.00 0.00 54.58 50.58 1n8p n ASN 179 Cb 0.48 -0.61 -0.02 0.00 -0.53 0.00 0.00 39.78 39.10 1n8p n ASN 179 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 1n8p h THR 180 N 1.55 1.04 -0.00 -0.44 2.02 -1.91 -1.16 112.91 114.00 1n8p h THR 180 Ca 0.14 -0.11 -0.09 0.00 0.77 0.00 0.00 66.41 67.12 1n8p h THR 180 Cb 1.69 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.77 1n8p h THR 180 CO 0.38 0.06 -0.41 -0.26 0.37 0.00 0.00 175.52 175.67 1n8p h PHE 181 N 0.33 0.00 0.00 3.16 -1.00 -1.93 -3.31 116.94 114.19 1n8p h PHE 181 Ca 0.10 -0.00 -0.27 0.00 2.81 0.00 0.00 57.97 60.62 1n8p h PHE 181 Cb -0.01 -0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.51 1n8p h PHE 181 CO -0.07 0.41 -1.58 1.28 -1.61 0.00 0.00 178.31 176.73 1n8p n LEU 182 N -4.05 1.89 0.00 1.54 4.77 -1.23 -4.51 117.00 115.41 1n8p n LEU 182 Ca -0.02 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1n8p n LEU 182 Cb 0.44 -0.89 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 1n8p n LEU 182 CO 0.39 0.25 0.00 -1.54 -1.33 0.00 0.00 177.39 175.16 1n8p n SER 183 N -4.40 0.00 -0.39 -1.43 3.41 -0.44 -4.29 113.62 106.08 1n8p n SER 183 Ca -0.35 0.00 0.34 0.00 -0.26 0.00 0.00 58.87 58.59 1n8p n SER 183 Cb 0.69 0.17 0.61 0.00 -0.26 0.00 0.00 64.21 65.42 1n8p n SER 183 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1n8p h PRO 184 N 0.00 0.08 0.59 4.33 0.11 -1.79 -1.85 132.00 133.47 1n8p h PRO 184 Ca 0.00 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.08 1n8p h PRO 184 Cb 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.09 1n8p h PRO 184 CO 0.00 0.05 -0.31 -0.92 -0.21 0.00 0.00 178.00 176.61 1n8p h TYR 185 N 0.08 -0.81 -0.47 0.65 3.20 -1.86 -3.19 116.97 114.57 1n8p h TYR 185 Ca 0.83 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 62.57 1n8p h TYR 185 Cb 2.36 0.28 -0.02 0.00 1.54 0.00 0.00 36.73 40.89 1n8p h TYR 185 CO -0.01 -0.49 -0.14 0.82 -1.64 0.00 0.00 178.16 176.70 1n8p h ILE 186 N -0.83 1.27 -3.57 1.81 2.04 -1.53 -3.43 117.51 113.26 1n8p h ILE 186 Ca -0.08 -1.26 -0.06 0.00 1.00 0.00 0.00 64.86 64.46 1n8p h ILE 186 Cb 0.65 1.05 -0.13 0.00 -0.74 0.00 0.00 36.82 37.66 1n8p h ILE 186 CO 0.11 0.43 -0.17 -0.55 0.00 0.00 0.00 178.15 177.97 1n8p s SER 187 N -6.69 -0.10 -0.33 1.72 0.15 -1.02 0.18 113.70 107.61 1n8p s SER 187 Ca -0.10 -0.53 -0.01 0.00 0.70 0.00 0.00 55.95 56.00 1n8p s SER 187 Cb 0.13 0.45 0.12 0.00 -1.71 0.00 0.00 66.02 65.02 1n8p s SER 187 CO 0.84 -0.87 0.17 0.20 1.20 0.00 0.00 173.24 174.79 1n8p s ASN 188 N -2.86 3.30 0.47 5.45 0.02 -1.26 -4.13 114.94 115.92 1n8p s ASN 188 Ca 0.07 -1.84 0.19 0.00 -1.02 0.00 0.00 52.86 50.26 1n8p s ASN 188 Cb 0.02 -0.45 1.18 0.00 0.02 0.00 0.00 41.25 42.02 1n8p s ASN 188 CO -0.08 -0.36 1.97 -0.65 0.02 0.00 0.00 177.10 178.00 1n8p h PRO 189 N 7.60 0.25 -0.34 -0.60 0.11 -1.93 -1.66 132.00 135.42 1n8p h PRO 189 Ca -0.06 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.07 1n8p h PRO 189 Cb 0.99 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 1n8p h PRO 189 CO 0.36 0.16 0.23 -0.07 -0.21 0.00 0.00 178.00 178.47 1n8p h LEU 190 N 0.25 0.28 -1.05 2.35 3.38 -1.86 -0.63 115.31 118.04 1n8p h LEU 190 Ca 0.30 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1n8p h LEU 190 Cb 0.81 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1n8p h LEU 190 CO -0.06 0.19 0.00 0.59 0.09 0.00 0.00 178.44 179.25 1n8p n ASN 191 N -4.49 0.78 -1.56 -0.43 3.02 -0.63 -2.63 115.26 109.33 1n8p n ASN 191 Ca 0.03 -1.43 -0.01 0.00 -0.03 0.00 0.00 54.58 53.15 1n8p n ASN 191 Cb 0.17 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 1n8p n ASN 191 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1n8p n PHE 192 N 0.17 -0.03 -2.81 3.10 3.01 -0.24 -5.03 117.46 115.62 1n8p n PHE 192 Ca 0.00 -0.77 -0.05 0.00 1.01 0.00 0.00 57.45 57.64 1n8p n PHE 192 Cb 0.19 0.20 0.01 0.00 -0.01 0.00 0.00 39.48 39.86 1n8p n PHE 192 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1n8p n GLY 193 N 0.05 -2.49 3.07 1.37 0.00 -1.08 -3.46 105.19 102.65 1n8p n GLY 193 Ca -0.08 0.93 -0.13 0.00 0.00 0.00 0.00 46.02 46.75 1n8p n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n8p s ALA 194 N -2.18 -0.48 -0.07 4.61 0.00 -1.24 -4.50 121.76 117.89 1n8p s ALA 194 Ca 0.15 0.56 -0.03 0.00 0.00 0.00 0.00 51.96 52.63 1n8p s ALA 194 Cb -0.04 -0.32 -0.27 0.00 0.00 0.00 0.00 23.12 22.49 1n8p s ALA 194 CO 0.77 -0.09 0.55 -0.44 0.00 0.00 0.00 175.76 176.54 1n8p h ASP 195 N 5.87 0.37 -3.66 0.00 3.32 -0.81 -3.42 116.42 118.09 1n8p h ASP 195 Ca -0.26 -0.72 -0.26 0.00 0.02 0.00 0.00 57.03 55.81 1n8p h ASP 195 Cb 1.20 -0.12 -0.30 0.00 0.22 0.00 0.00 39.33 40.32 1n8p h ASP 195 CO 0.39 1.63 -0.72 -0.63 -1.72 0.00 0.00 179.24 178.18 1n8p s ILE 196 N -2.58 -0.00 -0.20 0.35 1.01 -0.67 -4.33 121.20 114.77 1n8p s ILE 196 Ca -0.16 0.07 -0.05 0.00 0.00 0.00 0.00 60.65 60.51 1n8p s ILE 196 Cb 0.07 -0.05 -0.03 0.00 0.01 0.00 0.00 42.46 42.46 1n8p s ILE 196 CO 0.81 0.04 0.01 -0.69 0.00 0.00 0.00 174.94 175.10 1n8p s VAL 197 N 0.38 4.02 -0.00 2.92 1.01 -0.79 -0.58 120.40 127.37 1n8p s VAL 197 Ca -0.03 -0.29 0.08 0.00 0.00 0.00 0.00 61.98 61.74 1n8p s VAL 197 Cb -0.05 -2.82 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 1n8p s VAL 197 CO -0.01 0.43 -0.25 -0.69 0.00 0.00 0.00 175.10 174.57 1n8p s VAL 198 N 0.99 1.99 0.07 2.92 1.01 -0.27 -0.93 120.40 126.17 1n8p s VAL 198 Ca 0.02 -1.14 0.03 0.00 0.00 0.00 0.00 61.98 60.89 1n8p s VAL 198 Cb -0.14 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 1n8p s VAL 198 CO 0.02 0.50 -0.09 -1.00 0.00 0.00 0.00 175.10 174.52 1n8p s HIS 199 N -0.64 0.90 -0.61 5.22 3.76 -0.32 -0.91 115.29 122.69 1n8p s HIS 199 Ca 0.10 -0.58 -0.13 0.00 -0.15 0.00 0.00 55.06 54.30 1n8p s HIS 199 Cb -0.10 -0.52 0.15 0.00 1.11 0.00 0.00 32.58 33.23 1n8p s HIS 199 CO -0.00 -0.04 0.54 0.45 -0.85 0.00 0.00 174.74 174.84 1n8p s SER 200 N -2.00 6.20 0.57 1.40 0.15 -1.26 -2.38 113.70 116.38 1n8p s SER 200 Ca -0.02 -2.13 0.36 0.00 0.70 0.00 0.00 55.95 54.86 1n8p s SER 200 Cb -0.06 -2.15 1.94 0.00 -1.71 0.00 0.00 66.02 64.03 1n8p s SER 200 CO 0.00 -0.72 2.09 0.00 1.20 0.00 0.00 173.24 175.81 1n8p h ALA 201 N 8.39 1.07 -0.94 5.45 0.00 0.23 -2.68 119.26 130.77 1n8p h ALA 201 Ca -0.15 0.00 0.15 0.00 0.00 0.00 0.00 54.91 54.90 1n8p h ALA 201 Cb 1.07 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.78 1n8p h ALA 201 CO 0.91 -0.07 0.60 1.15 0.00 0.00 0.00 179.25 181.84 1n8p h THR 202 N 0.00 0.83 0.00 0.00 2.02 -1.56 -2.77 112.91 111.43 1n8p h THR 202 Ca 0.00 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1n8p h THR 202 Cb 0.15 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.55 1n8p h THR 202 CO 0.00 0.14 0.00 0.29 0.37 0.00 0.00 175.52 176.32 1n8p n LYS 203 N -4.60 0.00 0.34 6.66 4.01 -1.01 -4.29 118.16 119.28 1n8p n LYS 203 Ca 0.19 0.00 -0.15 0.00 -0.51 0.00 0.00 58.31 57.83 1n8p n LYS 203 Cb 0.46 0.00 -0.08 0.00 -0.51 0.00 0.00 35.03 34.91 1n8p n LYS 203 CO 0.00 0.00 0.00 1.88 -1.11 0.00 0.00 177.40 178.17 1n8p h TYR 204 N 0.00 -0.83 -0.14 2.13 -1.99 -1.76 -0.53 116.97 113.85 1n8p h TYR 204 Ca 0.00 -0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.72 1n8p h TYR 204 Cb 0.00 0.27 -0.02 0.00 2.00 0.00 0.00 36.73 38.99 1n8p h TYR 204 CO 0.00 -0.49 -0.08 -0.89 -0.00 0.00 0.00 178.16 176.70 1n8p n ILE 205 N -5.39 -0.10 -0.06 -2.88 5.41 -1.26 -0.05 119.36 115.04 1n8p n ILE 205 Ca -0.12 1.56 -0.11 0.00 1.00 0.00 0.00 62.75 65.08 1n8p n ILE 205 Cb 0.37 -2.05 -0.05 0.00 -0.71 0.00 0.00 39.64 37.21 1n8p n ILE 205 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 176.55 175.42 1n8p h ASN 206 N 0.00 0.28 0.00 4.38 -0.73 -1.66 -2.77 115.58 115.07 1n8p h ASN 206 Ca 0.02 -0.18 0.00 0.00 1.87 0.00 0.00 56.30 58.01 1n8p h ASN 206 Cb 0.06 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 38.58 1n8p h ASN 206 CO -0.13 0.39 0.00 0.61 -0.37 0.00 0.00 177.43 177.92 1n8p n GLY 207 N -0.66 0.20 0.00 1.57 0.00 0.93 -4.22 105.19 103.01 1n8p n GLY 207 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1n8p n GLY 207 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1n8p n HIS 208 N -2.31 0.00 -1.81 1.61 8.25 -1.26 -2.58 115.22 117.11 1n8p n HIS 208 Ca 0.00 -0.44 -0.21 0.00 -0.26 0.00 0.00 57.72 56.82 1n8p n HIS 208 Cb 0.29 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.28 1n8p n HIS 208 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1n8p n SER 209 N -0.44 -5.57 -0.09 0.41 7.64 -1.26 -4.84 113.62 109.47 1n8p n SER 209 Ca 0.00 0.38 0.06 0.00 1.01 0.00 0.00 58.87 60.32 1n8p n SER 209 Cb 0.22 -4.84 0.10 0.00 -1.01 0.00 0.00 64.21 58.67 1n8p n SER 209 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1n8p n ASP 210 N -1.53 2.30 -3.71 6.43 3.85 -1.26 -4.99 116.55 117.64 1n8p n ASP 210 Ca -0.22 -2.69 -0.11 0.00 -0.71 0.00 0.00 54.79 51.06 1n8p n ASP 210 Cb 0.68 -0.28 -0.12 0.00 -1.35 0.00 0.00 41.12 40.05 1n8p n ASP 210 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1n8p s VAL 211 N -2.19 -0.04 -0.45 2.12 1.01 -1.26 -5.04 120.40 114.55 1n8p s VAL 211 Ca 0.21 0.12 -0.12 0.00 0.00 0.00 0.00 61.98 62.19 1n8p s VAL 211 Cb 0.18 -0.51 0.09 0.00 0.00 0.00 0.00 36.38 36.14 1n8p s VAL 211 CO 0.02 0.05 0.33 -0.69 0.00 0.00 0.00 175.10 174.81 1n8p s VAL 212 N 1.35 4.60 0.01 2.92 1.01 -1.26 -3.92 120.40 125.10 1n8p s VAL 212 Ca -0.09 -1.35 -0.09 0.00 0.00 0.00 0.00 61.98 60.44 1n8p s VAL 212 Cb -0.09 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.46 1n8p s VAL 212 CO -0.11 -0.59 0.17 -0.22 0.00 0.00 0.00 175.10 174.35 1n8p s LEU 213 N 1.50 1.43 0.11 3.92 0.20 -1.26 -4.56 118.68 120.01 1n8p s LEU 213 Ca 0.04 -0.19 0.06 0.00 0.69 0.00 0.00 54.13 54.73 1n8p s LEU 213 Cb -0.24 0.80 -0.04 0.00 -0.43 0.00 0.00 46.19 46.28 1n8p s LEU 213 CO 0.03 -0.41 -0.16 -0.83 -0.29 0.00 0.00 176.35 174.69 1n8p s GLY 214 N -1.49 1.09 0.00 7.98 0.00 -1.02 0.92 107.32 114.80 1n8p s GLY 214 Ca -0.13 -1.22 -0.14 0.00 0.00 0.00 0.00 44.72 43.23 1n8p s GLY 214 CO 0.01 -1.26 0.29 -1.34 0.00 0.00 0.00 173.10 170.81 1n8p s VAL 215 N -1.68 0.07 0.12 1.40 -7.23 -1.00 -0.71 120.40 111.37 1n8p s VAL 215 Ca 0.06 -0.55 0.06 0.00 -1.81 0.00 0.00 61.98 59.74 1n8p s VAL 215 Cb -0.07 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 36.14 1n8p s VAL 215 CO 0.03 -0.30 -0.14 -1.48 -0.31 0.00 0.00 175.10 172.90 1n8p s LEU 216 N -1.52 2.40 -0.01 1.32 2.34 -0.61 -1.17 118.68 121.43 1n8p s LEU 216 Ca -0.12 -0.80 0.02 0.00 0.06 0.00 0.00 54.13 53.29 1n8p s LEU 216 Cb -0.04 -0.54 0.00 0.00 -0.56 0.00 0.00 46.19 45.05 1n8p s LEU 216 CO 0.02 -0.15 -0.06 0.00 -1.06 0.00 0.00 176.35 175.11 1n8p s ALA 217 N -2.11 0.52 -0.11 1.48 0.00 -0.11 -1.50 121.76 119.93 1n8p s ALA 217 Ca 0.08 -0.21 -0.13 0.00 0.00 0.00 0.00 51.96 51.70 1n8p s ALA 217 Cb -0.05 -0.18 0.03 0.00 0.00 0.00 0.00 23.12 22.92 1n8p s ALA 217 CO 0.03 0.10 0.35 0.95 0.00 0.00 0.00 175.76 177.19 1n8p s THR 218 N 0.06 0.01 -0.88 0.00 -4.23 -0.44 -1.88 115.64 108.28 1n8p s THR 218 Ca -0.00 -0.11 0.25 0.00 -1.18 0.00 0.00 61.69 60.65 1n8p s THR 218 Cb -0.05 -0.53 0.04 0.00 1.34 0.00 0.00 72.50 73.30 1n8p s THR 218 CO -0.00 -0.06 1.43 0.59 -0.54 0.00 0.00 174.62 176.04 1n8p n ASN 219 N 2.50 0.52 -4.49 3.99 5.03 -1.26 -1.62 115.26 119.92 1n8p n ASN 219 Ca -0.15 -0.06 -0.43 0.00 0.87 0.00 0.00 54.58 54.81 1n8p n ASN 219 Cb 0.57 0.16 -0.03 0.00 -1.02 0.00 0.00 39.78 39.46 1n8p n ASN 219 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1n8p s ASN 220 N -3.39 6.36 0.25 6.41 3.04 -1.26 -4.85 114.94 121.50 1n8p s ASN 220 Ca 0.10 -1.28 -0.04 0.00 0.04 0.00 0.00 52.86 51.67 1n8p s ASN 220 Cb 0.16 -2.46 0.50 0.00 -1.54 0.00 0.00 41.25 37.91 1n8p s ASN 220 CO 0.69 -1.41 1.67 0.50 -3.04 0.00 0.00 177.10 175.50 1n8p h LYS 221 N 9.48 0.21 -0.18 0.43 3.64 -1.99 -1.39 116.57 126.78 1n8p h LYS 221 Ca -0.07 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.25 1n8p h LYS 221 Cb 1.04 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.81 1n8p h LYS 221 CO 1.22 0.14 -0.07 -1.35 -2.27 0.00 0.00 179.45 177.12 1n8p h PRO 222 N 0.22 0.36 -0.00 1.90 0.11 -2.00 -2.13 132.00 130.45 1n8p h PRO 222 Ca 0.44 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 66.40 1n8p h PRO 222 Cb 0.78 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.88 1n8p h PRO 222 CO -0.57 0.65 0.03 1.25 -0.21 0.00 0.00 178.00 179.14 1n8p h LEU 223 N 0.05 0.00 0.00 2.35 5.85 -1.85 0.50 115.31 122.21 1n8p h LEU 223 Ca 0.04 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.59 1n8p h LEU 223 Cb 0.53 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 1n8p h LEU 223 CO 0.02 0.00 -1.20 0.22 -0.34 0.00 0.00 178.44 177.14 1n8p h TYR 224 N 0.00 0.00 0.11 1.25 3.20 -0.92 -3.13 116.97 117.47 1n8p h TYR 224 Ca 0.00 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 61.60 1n8p h TYR 224 Cb 0.06 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.33 1n8p h TYR 224 CO 0.00 0.63 -1.29 0.93 -1.64 0.00 0.00 178.16 176.79 1n8p h GLU 225 N 0.00 0.23 0.33 1.82 5.08 -0.27 -2.59 114.58 119.18 1n8p h GLU 225 Ca -0.13 -0.40 -0.02 0.00 -1.00 0.00 0.00 59.36 57.82 1n8p h GLU 225 Cb 1.59 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.99 1n8p h GLU 225 CO 0.06 1.16 -0.16 0.00 -1.00 0.00 0.00 179.01 179.07 1n8p h ARG 226 N 0.06 -0.42 -1.30 2.33 3.08 -1.49 -1.58 114.38 115.07 1n8p h ARG 226 Ca -0.15 0.03 0.38 0.00 0.07 0.00 0.00 59.98 60.31 1n8p h ARG 226 Cb 1.96 0.10 -0.08 0.00 0.08 0.00 0.00 29.97 32.03 1n8p h ARG 226 CO 0.18 -0.28 0.90 -0.07 -1.07 0.00 0.00 179.97 179.63 1n8p h LEU 227 N -0.49 0.15 -0.18 3.04 4.07 -1.67 0.71 115.31 120.93 1n8p h LEU 227 Ca -0.04 0.04 -0.20 0.00 0.08 0.00 0.00 57.88 57.76 1n8p h LEU 227 Cb 0.34 0.03 -0.02 0.00 1.08 0.00 0.00 40.66 42.08 1n8p h LEU 227 CO 0.07 -0.01 -0.93 -0.61 -1.08 0.00 0.00 178.44 175.88 1n8p h GLN 228 N 0.11 0.06 0.64 1.13 4.15 -1.37 -2.74 115.11 117.08 1n8p h GLN 228 Ca 0.67 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.99 1n8p h GLN 228 Cb 2.37 0.02 0.01 0.00 0.21 0.00 0.00 27.48 30.09 1n8p h GLN 228 CO -0.15 0.94 -0.31 0.35 -1.93 0.00 0.00 178.83 177.73 1n8p h PHE 229 N 0.02 -0.80 -1.01 3.99 3.57 0.15 0.46 116.94 123.33 1n8p h PHE 229 Ca -0.02 -0.02 0.23 0.00 3.53 0.00 0.00 57.97 61.68 1n8p h PHE 229 Cb 1.61 0.26 -0.11 0.00 2.79 0.00 0.00 35.95 40.51 1n8p h PHE 229 CO 0.01 -0.47 0.62 -0.07 -2.23 0.00 0.00 178.31 176.17 1n8p h LEU 230 N -0.95 0.65 0.68 0.59 3.38 -1.48 0.16 115.31 118.33 1n8p h LEU 230 Ca -0.09 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1n8p h LEU 230 Cb 0.69 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.44 1n8p h LEU 230 CO 0.14 0.17 -0.33 -0.61 0.09 0.00 0.00 178.44 177.91 1n8p h GLN 231 N 0.60 -0.88 -0.26 1.13 4.15 -1.11 0.37 115.11 119.11 1n8p h GLN 231 Ca 0.59 0.06 0.01 0.00 0.77 0.00 0.00 58.65 60.09 1n8p h GLN 231 Cb 1.16 0.20 -0.01 0.00 0.21 0.00 0.00 27.48 29.04 1n8p h GLN 231 CO -0.37 -0.57 0.17 -0.97 -1.93 0.00 0.00 178.83 175.15 1n8p h ASN 232 N -0.96 0.27 0.08 -0.69 -1.24 0.66 -2.01 115.58 111.68 1n8p h ASN 232 Ca -0.09 -0.01 -0.24 0.00 0.71 0.00 0.00 56.30 56.67 1n8p h ASN 232 Cb 0.71 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.69 1n8p h ASN 232 CO 0.15 0.19 -1.23 0.00 -1.29 0.00 0.00 177.43 175.26 1n8p h ALA 233 N 1.84 0.18 -0.00 1.57 0.00 -0.44 -3.36 119.26 119.05 1n8p h ALA 233 Ca 0.10 -1.05 0.00 0.00 0.00 0.00 0.00 54.91 53.96 1n8p h ALA 233 Cb 0.02 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1n8p h ALA 233 CO -0.02 0.71 -0.11 0.44 0.00 0.00 0.00 179.25 180.27 1n8p n ILE 234 N -4.10 0.00 -2.43 0.00 -5.35 0.13 -4.98 119.36 102.63 1n8p n ILE 234 Ca -0.25 -0.00 -0.17 0.00 -0.27 0.00 0.00 62.75 62.06 1n8p n ILE 234 Cb 0.81 -0.33 -0.01 0.00 -1.74 0.00 0.00 39.64 38.37 1n8p n ILE 234 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1n8p n GLY 235 N 1.49 -0.50 2.36 3.28 0.00 -0.76 -4.89 105.19 106.18 1n8p n GLY 235 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1n8p n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n8p n ALA 236 N -2.13 6.65 -2.19 4.61 0.00 -1.26 -4.93 120.51 121.26 1n8p n ALA 236 Ca -0.20 -3.08 -0.23 0.00 0.00 0.00 0.00 53.44 49.93 1n8p n ALA 236 Cb 0.65 -2.47 0.02 0.00 0.00 0.00 0.00 19.45 17.65 1n8p n ALA 236 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1n8p s ILE 237 N -0.78 3.59 0.48 0.00 -4.36 -1.26 -0.02 121.20 118.85 1n8p s ILE 237 Ca 0.61 -0.42 -0.05 0.00 -0.26 0.00 0.00 60.65 60.53 1n8p s ILE 237 Cb 0.30 -3.36 -0.03 0.00 1.25 0.00 0.00 42.46 40.62 1n8p s ILE 237 CO -0.13 -0.28 0.78 -2.16 0.24 0.00 0.00 174.94 173.39 1n8p s PRO 238 N -4.71 3.51 0.02 0.37 0.04 -1.26 -3.74 135.00 129.22 1n8p s PRO 238 Ca 0.52 0.16 -0.27 0.00 0.04 0.00 0.00 61.00 61.45 1n8p s PRO 238 Cb -0.10 -2.39 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 1n8p s PRO 238 CO 0.40 -0.21 0.83 0.45 0.04 0.00 0.00 177.00 178.51 1n8p s SER 239 N -4.11 7.24 0.46 6.66 0.15 -1.26 -4.93 113.70 117.91 1n8p s SER 239 Ca 0.47 1.49 0.32 0.00 0.70 0.00 0.00 55.95 58.93 1n8p s SER 239 Cb -0.10 -2.50 1.44 0.00 -1.71 0.00 0.00 66.02 63.16 1n8p s SER 239 CO 0.44 -0.10 1.65 -0.65 1.20 0.00 0.00 173.24 175.79 1n8p h PRO 240 N 6.20 0.10 0.23 5.44 0.11 -1.97 0.15 132.00 142.24 1n8p h PRO 240 Ca -0.42 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 1n8p h PRO 240 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1n8p h PRO 240 CO 0.73 0.07 -0.11 0.35 -0.21 0.00 0.00 178.00 178.83 1n8p h PHE 241 N 0.10 -0.28 -0.59 0.65 3.57 -1.91 -0.93 116.94 117.55 1n8p h PHE 241 Ca 0.78 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 62.30 1n8p h PHE 241 Cb 2.59 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 41.39 1n8p h PHE 241 CO -0.00 0.10 0.39 -0.44 -2.23 0.00 0.00 178.31 176.13 1n8p h ASP 242 N -0.78 0.63 0.40 0.41 3.45 -1.15 -0.35 116.42 119.03 1n8p h ASP 242 Ca -0.03 -0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.40 1n8p h ASP 242 Cb 0.51 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.13 1n8p h ASP 242 CO 0.05 0.45 -0.19 0.00 -1.57 0.00 0.00 179.24 177.97 1n8p h ALA 243 N 1.64 -0.54 -0.79 3.45 0.00 -1.19 0.38 119.26 122.21 1n8p h ALA 243 Ca 0.23 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 55.08 1n8p h ALA 243 Cb 0.01 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 17.93 1n8p h ALA 243 CO -0.06 -0.69 0.41 2.35 0.00 0.00 0.00 179.25 181.26 1n8p h TRP 244 N -0.78 0.72 -0.25 0.00 7.01 -0.85 0.74 115.95 122.54 1n8p h TRP 244 Ca -0.06 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.96 1n8p h TRP 244 Cb 0.53 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.37 1n8p h TRP 244 CO 0.00 0.22 0.10 1.25 -2.79 0.00 0.00 178.44 177.23 1n8p h LEU 245 N 0.64 0.35 -0.29 0.65 5.85 -0.93 -1.65 115.31 119.92 1n8p h LEU 245 Ca 0.41 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 1n8p h LEU 245 Cb 0.50 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1n8p h LEU 245 CO -0.31 0.42 0.16 0.74 -0.34 0.00 0.00 178.44 179.11 1n8p h THR 246 N 0.26 1.13 -0.91 1.05 2.02 0.45 -1.97 112.91 114.94 1n8p h THR 246 Ca 0.08 -0.36 0.16 0.00 0.77 0.00 0.00 66.41 67.06 1n8p h THR 246 Cb 0.18 0.84 -0.10 0.00 -1.74 0.00 0.00 68.15 67.33 1n8p h THR 246 CO -0.01 0.14 0.50 -0.74 0.37 0.00 0.00 175.52 175.78 1n8p h HIS 247 N 0.35 0.88 -0.61 3.16 -0.00 0.62 -1.30 115.15 118.27 1n8p h HIS 247 Ca 0.10 0.03 -0.08 0.00 -0.00 0.00 0.00 60.37 60.43 1n8p h HIS 247 Cb 0.08 -0.25 -0.02 0.00 -0.00 0.00 0.00 27.41 27.21 1n8p h HIS 247 CO -0.03 0.21 0.07 -0.09 -0.00 0.00 0.00 177.93 178.08 1n8p h ARG 248 N 0.68 1.01 0.00 5.26 2.43 -0.68 -3.13 114.38 119.95 1n8p h ARG 248 Ca 0.51 -0.27 -0.06 0.00 -0.81 0.00 0.00 59.98 59.34 1n8p h ARG 248 Cb 0.74 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 1n8p h ARG 248 CO -0.37 0.95 -0.28 0.78 -1.51 0.00 0.00 179.97 179.54 1n8p h GLY 249 N 1.02 0.00 2.00 2.80 0.00 -0.63 -3.22 103.07 105.04 1n8p h GLY 249 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1n8p h GLY 249 CO 0.02 0.00 0.00 -2.00 0.00 0.00 0.00 176.54 174.56 1n8p h LEU 250 N 0.00 0.00 0.00 3.11 6.46 -0.97 -3.02 115.31 120.90 1n8p h LEU 250 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1n8p h LEU 250 Cb 1.22 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.15 1n8p h LEU 250 CO 0.04 0.00 0.00 0.29 -0.62 0.00 0.00 178.44 178.15 1n8p n LYS 251 N -2.56 0.48 -0.02 1.25 5.02 -1.21 -1.88 118.16 119.24 1n8p n LYS 251 Ca 0.02 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1n8p n LYS 251 Cb 0.27 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.79 1n8p n LYS 251 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1n8p n THR 252 N -1.11 0.58 0.01 -0.18 -2.24 -1.14 -4.73 114.28 105.46 1n8p n THR 252 Ca 0.12 -0.60 -0.10 0.00 -2.27 0.00 0.00 64.05 61.21 1n8p n THR 252 Cb 0.10 0.68 -0.04 0.00 -2.10 0.00 0.00 70.33 68.97 1n8p n THR 252 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1n8p h LEU 253 N 0.00 -0.25 -1.06 3.22 5.85 -1.45 0.46 115.31 122.07 1n8p h LEU 253 Ca 0.00 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.85 1n8p h LEU 253 Cb 0.76 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.85 1n8p h LEU 253 CO 0.00 -0.11 0.63 1.12 -0.34 0.00 0.00 178.44 179.74 1n8p h HIS 254 N -0.09 1.13 -0.07 1.25 2.07 -1.87 0.15 115.15 117.71 1n8p h HIS 254 Ca 0.07 0.03 -0.04 0.00 -2.85 0.00 0.00 60.37 57.57 1n8p h HIS 254 Cb 0.19 -0.37 -0.00 0.00 2.57 0.00 0.00 27.41 29.80 1n8p h HIS 254 CO -0.19 0.56 -0.12 -0.07 -3.07 0.00 0.00 177.93 175.04 1n8p h LEU 255 N 1.08 0.23 -1.16 6.12 3.38 -1.72 -2.83 115.31 120.41 1n8p h LEU 255 Ca 0.43 -0.54 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 1n8p h LEU 255 Cb 0.26 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1n8p h LEU 255 CO -0.18 0.72 -0.40 0.03 0.09 0.00 0.00 178.44 178.70 1n8p h ARG 256 N -0.25 0.03 0.19 1.13 3.08 0.34 -2.49 114.38 116.41 1n8p h ARG 256 Ca 0.01 -0.01 -0.32 0.00 0.07 0.00 0.00 59.98 59.72 1n8p h ARG 256 Cb 0.67 -0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.74 1n8p h ARG 256 CO 0.03 0.43 -1.50 0.28 -1.07 0.00 0.00 179.97 178.13 1n8p h VAL 257 N 0.03 1.23 0.14 2.04 2.07 -0.81 -1.96 116.25 118.99 1n8p h VAL 257 Ca -0.00 -2.75 -0.00 0.00 0.82 0.00 0.00 66.70 64.77 1n8p h VAL 257 Cb 0.73 2.92 -0.01 0.00 -1.52 0.00 0.00 31.29 33.41 1n8p h VAL 257 CO 0.05 0.84 -0.11 -0.09 0.02 0.00 0.00 177.57 178.28 1n8p h ARG 258 N 0.11 -0.25 0.27 1.57 9.65 -1.47 0.17 114.38 124.43 1n8p h ARG 258 Ca -0.25 0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.63 1n8p h ARG 258 Cb 2.09 0.06 0.00 0.00 -1.39 0.00 0.00 29.97 30.73 1n8p h ARG 258 CO 0.22 -0.16 -0.13 0.37 2.80 0.00 0.00 179.97 183.07 1n8p h GLN 259 N -0.26 -0.35 -0.97 0.20 5.75 -1.56 -1.97 115.11 115.96 1n8p h GLN 259 Ca -0.00 0.02 0.22 0.00 -0.15 0.00 0.00 58.65 58.74 1n8p h GLN 259 Cb 0.23 0.08 -0.08 0.00 1.07 0.00 0.00 27.48 28.78 1n8p h GLN 259 CO -0.01 -0.09 0.63 0.00 -2.65 0.00 0.00 178.83 176.71 1n8p h ALA 260 N 0.07 2.16 0.17 3.38 0.00 -1.19 -1.80 119.26 122.04 1n8p h ALA 260 Ca -0.04 0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.60 1n8p h ALA 260 Cb 0.43 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.23 1n8p h ALA 260 CO 0.06 -0.49 -1.32 0.00 0.00 0.00 0.00 179.25 177.49 1n8p h ALA 261 N 1.61 -0.04 -0.21 0.00 0.00 -0.48 -2.53 119.26 117.60 1n8p h ALA 261 Ca 0.52 -0.81 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1n8p h ALA 261 Cb 1.25 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1n8p h ALA 261 CO -0.24 0.72 0.10 -0.07 0.00 0.00 0.00 179.25 179.76 1n8p h LEU 262 N 0.22 0.16 -0.60 0.00 3.38 -0.67 -1.06 115.31 116.73 1n8p h LEU 262 Ca -0.21 0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.81 1n8p h LEU 262 Cb 2.00 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 42.69 1n8p h LEU 262 CO 0.25 0.12 0.35 0.28 0.09 0.00 0.00 178.44 179.53 1n8p h SER 263 N 0.22 0.56 -0.36 -0.43 0.02 -1.42 -0.53 113.55 111.60 1n8p h SER 263 Ca 0.08 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 1n8p h SER 263 Cb 0.02 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 1n8p h SER 263 CO -0.06 0.39 0.21 0.00 -1.14 0.00 0.00 176.83 176.23 1n8p h ALA 264 N 1.28 0.46 -0.81 3.77 0.00 -0.97 -0.96 119.26 122.03 1n8p h ALA 264 Ca 0.25 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1n8p h ALA 264 Cb 0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1n8p h ALA 264 CO -0.12 -0.13 0.41 -0.97 0.00 0.00 0.00 179.25 178.44 1n8p h ASN 265 N 0.44 1.03 0.63 0.00 -0.73 -0.76 0.28 115.58 116.47 1n8p h ASN 265 Ca 0.14 -0.12 0.00 0.00 1.87 0.00 0.00 56.30 58.20 1n8p h ASN 265 Cb 0.00 -0.26 0.00 0.00 0.27 0.00 0.00 38.32 38.33 1n8p h ASN 265 CO -0.07 0.86 0.00 0.29 -0.37 0.00 0.00 177.43 178.14 1n8p n LYS 266 N -4.38 0.15 -0.10 6.67 5.02 -0.25 -1.24 118.16 124.04 1n8p n LYS 266 Ca 0.08 0.41 -0.14 0.00 -2.02 0.00 0.00 58.31 56.63 1n8p n LYS 266 Cb 0.12 -1.81 -0.14 0.00 -0.02 0.00 0.00 35.03 33.18 1n8p n LYS 266 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1n8p n ILE 267 N -2.10 1.47 0.22 -0.18 5.41 -0.43 -3.74 119.36 120.02 1n8p n ILE 267 Ca 0.02 -0.72 -0.13 0.00 1.00 0.00 0.00 62.75 62.92 1n8p n ILE 267 Cb 0.20 -1.00 -0.07 0.00 -0.71 0.00 0.00 39.64 38.06 1n8p n ILE 267 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1n8p h ALA 268 N 0.50 -0.60 -0.87 -1.39 0.00 -0.22 -1.75 119.26 114.93 1n8p h ALA 268 Ca -0.54 -0.19 0.23 0.00 0.00 0.00 0.00 54.91 54.41 1n8p h ALA 268 Cb 2.07 0.23 -0.15 0.00 0.00 0.00 0.00 17.79 19.94 1n8p h ALA 268 CO -0.02 -0.66 0.16 0.93 0.00 0.00 0.00 179.25 179.66 1n8p h GLU 269 N -0.94 0.15 -0.35 0.00 5.08 -1.38 0.54 114.58 117.68 1n8p h GLU 269 Ca -0.06 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1n8p h GLU 269 Cb 0.57 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1n8p h GLU 269 CO 0.10 0.10 0.23 0.35 -1.00 0.00 0.00 179.01 178.79 1n8p h PHE 270 N 0.15 0.44 0.00 4.33 3.57 -1.62 -1.62 116.94 122.20 1n8p h PHE 270 Ca 0.53 0.01 0.00 0.00 3.53 0.00 0.00 57.97 62.04 1n8p h PHE 270 Cb 1.05 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.64 1n8p h PHE 270 CO -0.33 0.28 0.00 1.28 -2.23 0.00 0.00 178.31 177.31 1n8p n LEU 271 N -4.84 0.02 -1.20 0.59 4.77 0.14 -2.75 117.00 113.72 1n8p n LEU 271 Ca -0.00 0.50 0.08 0.00 -0.03 0.00 0.00 56.01 56.56 1n8p n LEU 271 Cb 0.02 -0.50 0.29 0.00 -2.33 0.00 0.00 43.42 40.90 1n8p n LEU 271 CO 0.34 -0.13 0.75 0.00 -1.33 0.00 0.00 177.39 177.03 1n8p n ALA 272 N -1.51 2.87 0.00 -1.18 0.00 0.14 -4.09 120.51 116.75 1n8p n ALA 272 Ca 0.05 -1.68 0.00 0.00 0.00 0.00 0.00 53.44 51.82 1n8p n ALA 272 Cb 0.26 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1n8p n ALA 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n8p n ALA 273 N 0.57 1.63 -2.42 0.00 0.00 -0.93 -4.85 120.51 114.51 1n8p n ALA 273 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.23 1n8p n ALA 273 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.24 1n8p n ALA 273 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1n8p n ASP 274 N -1.08 5.05 -0.15 0.00 -0.08 -1.17 -4.76 116.55 114.35 1n8p n ASP 274 Ca 0.00 -3.07 0.27 0.00 -1.51 0.00 0.00 54.79 50.48 1n8p n ASP 274 Cb 0.00 -1.51 0.72 0.00 2.34 0.00 0.00 41.12 42.67 1n8p n ASP 274 CO 0.00 0.00 0.00 0.07 0.12 0.00 0.00 177.20 177.39 1n8p h LYS 275 N 6.05 0.00 0.00 -0.67 5.09 -1.88 -2.80 116.57 122.36 1n8p h LYS 275 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 60.65 61.13 1n8p h LYS 275 Cb 0.68 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.01 1n8p h LYS 275 CO 1.57 0.00 0.00 0.39 -2.09 0.00 0.00 179.45 179.32 1n8p n GLU 276 N -4.24 0.00 0.00 0.07 -0.58 -1.26 -4.18 120.64 110.45 1n8p n GLU 276 Ca 0.17 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.95 1n8p n GLU 276 Cb 0.91 0.00 0.24 0.00 -0.57 0.00 0.00 31.44 32.02 1n8p n GLU 276 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1n8p n ASN 277 N 0.00 0.00 -4.15 1.62 5.03 -1.25 -4.60 115.26 111.90 1n8p n ASN 277 Ca 0.00 -0.18 -0.34 0.00 0.87 0.00 0.00 54.58 54.94 1n8p n ASN 277 Cb 0.00 -0.06 -0.15 0.00 -1.02 0.00 0.00 39.78 38.56 1n8p n ASN 277 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1n8p s VAL 278 N -2.11 2.60 0.00 2.41 1.01 -1.06 0.54 120.40 123.79 1n8p s VAL 278 Ca 0.12 -1.23 0.00 0.00 0.00 0.00 0.00 61.98 60.87 1n8p s VAL 278 Cb 0.06 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 34.06 1n8p s VAL 278 CO 0.10 0.14 0.00 0.52 0.00 0.00 0.00 175.10 175.86 1n8p n VAL 279 N 4.59 0.00 -3.40 2.92 0.31 0.46 -4.64 118.33 118.58 1n8p n VAL 279 Ca -0.16 0.03 -0.19 0.00 -0.01 0.00 0.00 64.34 64.01 1n8p n VAL 279 Cb 0.46 -0.61 -0.01 0.00 -0.91 0.00 0.00 33.84 32.77 1n8p n VAL 279 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1n8p s ALA 280 N -2.84 4.26 -0.06 3.52 0.00 -1.17 -4.94 121.76 120.52 1n8p s ALA 280 Ca 0.00 -1.56 -0.06 0.00 0.00 0.00 0.00 51.96 50.34 1n8p s ALA 280 Cb 0.00 -1.56 0.02 0.00 0.00 0.00 0.00 23.12 21.58 1n8p s ALA 280 CO 0.00 -0.10 0.17 0.08 0.00 0.00 0.00 175.76 175.91 1n8p s VAL 281 N -2.25 -0.00 -0.19 0.00 1.01 -1.26 -1.89 120.40 115.81 1n8p s VAL 281 Ca 0.47 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.48 1n8p s VAL 281 Cb -0.09 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 36.08 1n8p s VAL 281 CO 0.31 0.01 -0.18 0.20 0.00 0.00 0.00 175.10 175.44 1n8p s ASN 282 N 0.19 3.34 -0.30 3.32 0.01 0.74 -4.95 114.94 117.30 1n8p s ASN 282 Ca -0.01 -0.78 -0.01 0.00 -0.71 0.00 0.00 52.86 51.35 1n8p s ASN 282 Cb -0.02 -1.47 0.19 0.00 0.41 0.00 0.00 41.25 40.36 1n8p s ASN 282 CO -0.00 -0.04 0.71 -0.47 -1.51 0.00 0.00 177.10 175.79 1n8p s TYR 283 N 1.27 -1.43 -0.28 2.20 5.04 -1.26 -1.07 117.35 121.82 1n8p s TYR 283 Ca 0.02 1.12 0.00 0.00 -2.44 0.00 0.00 57.07 55.78 1n8p s TYR 283 Cb -0.14 0.35 0.03 0.00 0.35 0.00 0.00 41.96 42.55 1n8p s TYR 283 CO -0.11 -0.81 0.69 -2.30 -1.34 0.00 0.00 175.55 171.67 1n8p n PRO 284 N 5.39 0.00 0.11 4.97 -0.02 -1.26 0.39 135.00 144.58 1n8p n PRO 284 Ca 0.02 0.18 0.02 0.00 -2.02 0.00 0.00 63.50 61.71 1n8p n PRO 284 Cb 0.54 -1.86 -0.01 0.00 -0.02 0.00 0.00 33.50 32.15 1n8p n PRO 284 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1n8p h GLY 285 N 0.00 0.00 -4.50 -1.23 0.00 -1.85 -3.44 103.07 92.05 1n8p h GLY 285 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1n8p h GLY 285 CO 0.00 0.00 0.56 1.08 0.00 0.00 0.00 176.54 178.18 1n8p s LEU 286 N -6.22 4.36 0.64 3.11 1.43 0.16 -4.85 118.68 117.32 1n8p s LEU 286 Ca 0.02 1.98 0.33 0.00 -1.03 0.00 0.00 54.13 55.43 1n8p s LEU 286 Cb 0.08 -3.58 1.81 0.00 0.03 0.00 0.00 46.19 44.53 1n8p s LEU 286 CO 0.77 -0.47 2.07 0.11 0.23 0.00 0.00 176.35 179.06 1n8p h LYS 287 N 6.86 0.00 -0.00 1.70 1.57 -1.88 0.52 116.57 125.33 1n8p h LYS 287 Ca -0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1n8p h LYS 287 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1n8p h LYS 287 CO 0.81 0.00 -0.02 0.25 -0.57 0.00 0.00 179.45 179.92 1n8p n THR 288 N -3.23 0.00 -1.86 -0.16 -2.24 -1.26 -4.77 114.28 100.75 1n8p n THR 288 Ca -0.00 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.28 1n8p n THR 288 Cb 0.32 -0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.34 1n8p n THR 288 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1n8p s HIS 289 N -2.13 2.98 0.37 4.78 5.04 0.18 -4.86 115.29 121.65 1n8p s HIS 289 Ca 0.41 0.58 0.23 0.00 -1.54 0.00 0.00 55.06 54.74 1n8p s HIS 289 Cb 0.21 -4.00 1.33 0.00 0.04 0.00 0.00 32.58 30.16 1n8p s HIS 289 CO 0.39 -3.67 1.51 -2.30 -2.34 0.00 0.00 174.74 168.33 1n8p n PRO 290 N 3.66 -0.05 -2.14 2.88 -0.02 -1.26 -0.40 135.00 137.67 1n8p n PRO 290 Ca 0.13 1.29 -0.23 0.00 -2.02 0.00 0.00 63.50 62.67 1n8p n PRO 290 Cb 0.37 -2.38 0.02 0.00 -0.02 0.00 0.00 33.50 31.50 1n8p n PRO 290 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1n8p n ASN 291 N -5.03 4.73 0.30 2.55 3.02 -1.26 -4.78 115.26 114.79 1n8p n ASN 291 Ca 0.37 -3.67 0.17 0.00 -0.03 0.00 0.00 54.58 51.42 1n8p n ASN 291 Cb 1.31 -0.37 0.99 0.00 -0.61 0.00 0.00 39.78 41.10 1n8p n ASN 291 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1n8p h TYR 292 N 2.27 0.00 -0.04 3.10 3.20 -1.03 0.49 116.97 124.97 1n8p h TYR 292 Ca 0.33 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.15 1n8p h TYR 292 Cb 1.42 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.68 1n8p h TYR 292 CO 0.83 0.00 -0.25 0.38 -1.64 0.00 0.00 178.16 177.48 1n8p h ASP 293 N 0.00 0.06 0.24 -2.11 2.03 -1.86 -1.93 116.42 112.85 1n8p h ASP 293 Ca 0.01 -0.01 -0.32 0.00 -0.73 0.00 0.00 57.03 55.97 1n8p h ASP 293 Cb 0.05 -0.02 0.04 0.00 -0.83 0.00 0.00 39.33 38.57 1n8p h ASP 293 CO -0.00 0.31 -1.43 0.58 -1.03 0.00 0.00 179.24 177.68 1n8p h VAL 294 N 0.06 1.29 -0.10 4.15 2.07 -1.32 -3.24 116.25 119.16 1n8p h VAL 294 Ca 0.01 -2.67 0.04 0.00 0.82 0.00 0.00 66.70 64.89 1n8p h VAL 294 Cb 0.48 3.05 -0.06 0.00 -1.52 0.00 0.00 31.29 33.24 1n8p h VAL 294 CO 0.03 0.80 -0.42 0.58 0.02 0.00 0.00 177.57 178.59 1n8p h VAL 295 N 0.09 0.15 0.00 2.57 2.07 -1.00 0.68 116.25 120.81 1n8p h VAL 295 Ca -0.25 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1n8p h VAL 295 Cb 2.12 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1n8p h VAL 295 CO 0.26 0.00 0.08 0.18 0.02 0.00 0.00 177.57 178.11 1n8p n LEU 296 N -5.44 0.50 -0.10 2.57 4.77 -0.76 -0.07 117.00 118.47 1n8p n LEU 296 Ca -0.04 0.71 0.04 0.00 -0.03 0.00 0.00 56.01 56.69 1n8p n LEU 296 Cb 0.36 -0.75 -0.03 0.00 -2.33 0.00 0.00 43.42 40.68 1n8p n LEU 296 CO 0.13 -0.88 0.09 2.29 -1.33 0.00 0.00 177.39 177.69 1n8p n LYS 297 N -2.20 3.17 0.00 3.23 2.85 0.03 -4.74 118.16 120.51 1n8p n LYS 297 Ca -0.01 -0.27 0.00 0.00 -1.05 0.00 0.00 58.31 56.97 1n8p n LYS 297 Cb 0.11 -0.98 0.00 0.00 -0.65 0.00 0.00 35.03 33.50 1n8p n LYS 297 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 1n8p n GLN 298 N -0.76 2.40 -3.44 -1.58 6.02 -0.04 -5.04 117.38 114.94 1n8p n GLN 298 Ca 0.03 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.64 1n8p n GLN 298 Cb 0.16 -0.80 -0.08 0.00 1.02 0.00 0.00 30.24 30.54 1n8p n GLN 298 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1n8p s HIS 299 N -1.37 3.35 0.13 1.08 3.76 0.90 -4.36 115.29 118.79 1n8p s HIS 299 Ca 0.00 0.52 -0.33 0.00 -0.15 0.00 0.00 55.06 55.10 1n8p s HIS 299 Cb 0.00 -2.48 -0.12 0.00 1.11 0.00 0.00 32.58 31.08 1n8p s HIS 299 CO 0.00 -0.02 1.71 -2.13 -0.85 0.00 0.00 174.74 173.45 1n8p n ARG 300 N 4.54 2.44 -0.80 1.40 0.63 0.47 -1.28 116.66 124.06 1n8p n ARG 300 Ca -0.10 0.88 -0.01 0.00 -0.92 0.00 0.00 57.85 57.71 1n8p n ARG 300 Cb 0.51 -2.71 -0.00 0.00 0.45 0.00 0.00 32.46 30.71 1n8p n ARG 300 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1n8p n ASP 301 N 4.45 -4.63 -1.41 6.15 8.00 -1.26 -1.86 116.55 125.99 1n8p n ASP 301 Ca 0.18 0.01 -0.11 0.00 0.71 0.00 0.00 54.79 55.58 1n8p n ASP 301 Cb 0.32 -2.86 0.00 0.00 -0.02 0.00 0.00 41.12 38.57 1n8p n ASP 301 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1n8p n ALA 302 N 0.78 -0.39 -1.89 2.24 0.00 -0.41 -4.98 120.51 115.86 1n8p n ALA 302 Ca -0.01 0.11 -0.41 0.00 0.00 0.00 0.00 53.44 53.14 1n8p n ALA 302 Cb 0.39 -1.71 -0.03 0.00 0.00 0.00 0.00 19.45 18.11 1n8p n ALA 302 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1n8p s LEU 303 N -3.38 4.43 0.41 0.00 1.43 -0.77 -4.73 118.68 116.06 1n8p s LEU 303 Ca 0.05 2.52 0.22 0.00 -1.03 0.00 0.00 54.13 55.89 1n8p s LEU 303 Cb -0.02 -3.63 0.33 0.00 0.03 0.00 0.00 46.19 42.90 1n8p s LEU 303 CO 0.07 -0.52 1.59 1.23 0.23 0.00 0.00 176.35 178.95 1n8p h GLY 304 N 4.55 0.00 0.00 -3.19 0.00 -1.84 -3.44 103.07 99.14 1n8p h GLY 304 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1n8p h GLY 304 CO 0.73 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.88 1n8p n GLY 305 N 1.06 -1.07 0.00 4.60 0.00 -1.26 -4.49 105.19 104.04 1n8p n GLY 305 Ca 0.03 -2.13 0.09 0.00 0.00 0.00 0.00 46.02 44.01 1n8p n GLY 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n8p n GLY 306 N 0.00 -0.77 3.78 -0.02 0.00 -1.26 -4.01 105.19 102.91 1n8p n GLY 306 Ca 0.00 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.12 1n8p n GLY 306 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1n8p s MET 307 N -2.87 4.30 0.01 1.61 -1.94 -1.26 -1.39 119.30 117.75 1n8p s MET 307 Ca 0.04 0.78 0.02 0.00 -1.71 0.00 0.00 55.69 54.82 1n8p s MET 307 Cb 0.14 -3.29 -0.01 0.00 2.01 0.00 0.00 34.83 33.67 1n8p s MET 307 CO 0.77 0.49 -0.06 0.42 -0.01 0.00 0.00 175.02 176.63 1n8p s ILE 308 N -0.64 0.45 0.02 2.53 1.01 -0.45 -4.81 121.20 119.31 1n8p s ILE 308 Ca 0.31 -0.40 0.05 0.00 0.00 0.00 0.00 60.65 60.61 1n8p s ILE 308 Cb -0.19 -0.41 -0.02 0.00 0.01 0.00 0.00 42.46 41.85 1n8p s ILE 308 CO 0.19 0.02 -0.16 -0.55 0.00 0.00 0.00 174.94 174.44 1n8p s SER 309 N -0.42 1.90 -0.12 3.58 0.15 -0.23 -0.77 113.70 117.79 1n8p s SER 309 Ca -0.00 -0.42 -0.30 0.00 0.70 0.00 0.00 55.95 55.93 1n8p s SER 309 Cb -0.04 -0.16 0.11 0.00 -1.71 0.00 0.00 66.02 64.22 1n8p s SER 309 CO -0.00 0.11 0.90 0.72 1.20 0.00 0.00 173.24 176.17 1n8p s PHE 310 N -0.68 -0.45 -0.09 3.44 -0.12 -0.96 0.26 117.98 119.38 1n8p s PHE 310 Ca 0.04 0.75 0.02 0.00 -0.05 0.00 0.00 56.93 57.70 1n8p s PHE 310 Cb -0.07 0.44 -0.02 0.00 -0.63 0.00 0.00 43.02 42.74 1n8p s PHE 310 CO 0.01 -0.43 -0.16 -0.98 -0.05 0.00 0.00 175.22 173.61 1n8p s ARG 311 N -1.26 2.92 0.47 1.99 1.70 -0.79 0.08 118.95 124.05 1n8p s ARG 311 Ca -0.04 -0.73 -0.04 0.00 -0.47 0.00 0.00 55.73 54.45 1n8p s ARG 311 Cb -0.00 -2.45 -0.03 0.00 -0.57 0.00 0.00 34.95 31.89 1n8p s ARG 311 CO 0.03 0.39 0.75 0.96 -1.08 0.00 0.00 175.30 176.35 1n8p s ILE 312 N -0.12 4.78 0.00 4.99 -4.36 -1.25 -0.40 121.20 124.84 1n8p s ILE 312 Ca -0.02 0.03 -0.01 0.00 -0.26 0.00 0.00 60.65 60.39 1n8p s ILE 312 Cb -0.14 -3.81 -0.05 0.00 1.25 0.00 0.00 42.46 39.71 1n8p s ILE 312 CO 0.04 -0.74 1.23 2.29 0.24 0.00 0.00 174.94 178.00 1n8p n LYS 313 N -2.20 0.57 0.00 0.37 2.85 0.19 -4.42 118.16 115.52 1n8p n LYS 313 Ca 0.00 -0.19 0.00 0.00 -1.05 0.00 0.00 58.31 57.07 1n8p n LYS 313 Cb 0.56 -1.51 0.00 0.00 -0.65 0.00 0.00 35.03 33.43 1n8p n LYS 313 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1n8p n GLY 314 N 2.33 3.81 3.27 2.58 0.00 -1.26 -4.98 105.19 110.94 1n8p n GLY 314 Ca 0.08 -0.71 -0.16 0.00 0.00 0.00 0.00 46.02 45.24 1n8p n GLY 314 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n8p s GLY 315 N 0.00 1.85 0.00 -0.02 0.00 -1.26 -4.94 107.32 102.95 1n8p s GLY 315 Ca 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 44.72 42.91 1n8p s GLY 315 CO 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 173.10 171.60 1n8p n ALA 316 N -0.46 0.00 -0.42 3.20 0.00 -1.26 0.09 120.51 121.66 1n8p n ALA 316 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1n8p n ALA 316 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 1n8p n ALA 316 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1n8p n GLU 317 N -2.11 0.00 -0.21 0.00 -0.58 -1.26 -0.50 120.64 115.98 1n8p n GLU 317 Ca 0.00 0.29 0.15 0.00 -0.42 0.00 0.00 57.16 57.19 1n8p n GLU 317 Cb 0.00 -1.22 0.29 0.00 -0.57 0.00 0.00 31.44 29.94 1n8p n GLU 317 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n8p n ALA 318 N -1.38 0.50 0.14 0.62 0.00 0.11 0.16 120.51 120.67 1n8p n ALA 318 Ca 0.00 0.65 -0.11 0.00 0.00 0.00 0.00 53.44 53.98 1n8p n ALA 318 Cb 0.00 -0.57 -0.07 0.00 0.00 0.00 0.00 19.45 18.81 1n8p n ALA 318 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n8p h ALA 319 N 1.24 -0.42 -0.61 0.00 0.00 -1.51 0.70 119.26 118.66 1n8p h ALA 319 Ca 0.46 -0.18 0.17 0.00 0.00 0.00 0.00 54.91 55.36 1n8p h ALA 319 Cb 1.13 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 1n8p h ALA 319 CO -0.52 -0.47 0.44 1.03 0.00 0.00 0.00 179.25 179.72 1n8p h SER 320 N -0.95 0.03 0.40 0.00 0.87 0.27 0.15 113.55 114.33 1n8p h SER 320 Ca -0.04 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 1n8p h SER 320 Cb 0.51 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1n8p h SER 320 CO 0.07 0.01 -0.19 0.50 -0.53 0.00 0.00 176.83 176.69 1n8p h LYS 321 N 0.03 -0.52 -0.93 2.24 1.63 0.18 -3.22 116.57 115.98 1n8p h LYS 321 Ca 0.29 0.04 0.25 0.00 -0.85 0.00 0.00 60.65 60.37 1n8p h LYS 321 Cb 1.12 0.12 -0.13 0.00 -0.60 0.00 0.00 32.23 32.74 1n8p h LYS 321 CO -0.01 -0.35 0.42 0.35 -3.45 0.00 0.00 179.45 176.40 1n8p h PHE 322 N -0.78 0.68 0.00 1.91 3.57 0.16 0.64 116.94 123.12 1n8p h PHE 322 Ca -0.06 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1n8p h PHE 322 Cb 0.42 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.00 1n8p h PHE 322 CO 0.05 -0.10 0.16 0.00 -2.23 0.00 0.00 178.31 176.19 1n8p h ALA 323 N 1.76 1.15 0.00 2.41 0.00 -0.77 -3.03 119.26 120.78 1n8p h ALA 323 Ca 0.60 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.40 1n8p h ALA 323 Cb 1.21 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1n8p h ALA 323 CO -0.57 -0.15 -1.39 0.43 0.00 0.00 0.00 179.25 177.58 1n8p n SER 324 N -2.81 2.04 0.02 0.00 7.64 0.20 -4.31 113.62 116.40 1n8p n SER 324 Ca -0.02 0.02 0.22 0.00 1.01 0.00 0.00 58.87 60.10 1n8p n SER 324 Cb 0.21 -0.16 0.68 0.00 -1.01 0.00 0.00 64.21 63.93 1n8p n SER 324 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1n8p h SER 325 N -0.12 0.00 -3.41 6.43 0.02 -0.93 -3.41 113.55 112.12 1n8p h SER 325 Ca -0.16 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.22 1n8p h SER 325 Cb 1.20 0.00 0.13 0.00 0.14 0.00 0.00 62.40 63.86 1n8p h SER 325 CO -0.07 0.00 0.39 0.35 -1.14 0.00 0.00 176.83 176.37 1n8p n THR 326 N -3.57 2.61 -0.07 -2.27 -2.24 -1.15 -4.91 114.28 102.68 1n8p n THR 326 Ca 0.11 -0.50 -0.14 0.00 -2.27 0.00 0.00 64.05 61.25 1n8p n THR 326 Cb 0.83 -1.44 -0.05 0.00 -2.10 0.00 0.00 70.33 67.58 1n8p n THR 326 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1n8p n ARG 327 N 0.01 0.29 -0.00 -0.78 0.63 -1.26 -4.80 116.66 110.74 1n8p n ARG 327 Ca 0.08 0.12 -0.17 0.00 -0.92 0.00 0.00 57.85 56.96 1n8p n ARG 327 Cb 0.40 -1.01 -0.13 0.00 0.45 0.00 0.00 32.46 32.17 1n8p n ARG 327 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1n8p h LEU 328 N -0.44 0.30 -9.64 6.15 3.38 -1.95 -3.44 115.31 109.66 1n8p h LEU 328 Ca -0.34 -0.89 -0.52 0.00 0.09 0.00 0.00 57.88 56.22 1n8p h LEU 328 Cb 1.31 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.98 1n8p h LEU 328 CO -0.19 1.16 0.51 -0.36 0.09 0.00 0.00 178.44 179.64 1n8p s PHE 329 N -2.69 3.52 -0.26 1.13 0.40 -1.26 -4.64 117.98 114.19 1n8p s PHE 329 Ca -0.15 1.52 -0.09 0.00 -0.60 0.00 0.00 56.93 57.61 1n8p s PHE 329 Cb 0.00 -3.34 -0.04 0.00 0.51 0.00 0.00 43.02 40.16 1n8p s PHE 329 CO 0.77 -0.86 0.12 0.99 0.70 0.00 0.00 175.22 176.95 1n8p s THR 330 N -0.07 4.78 0.28 0.64 2.01 -0.39 -4.82 115.64 118.07 1n8p s THR 330 Ca 0.51 -0.01 -0.30 0.00 0.31 0.00 0.00 61.69 62.20 1n8p s THR 330 Cb -0.30 -3.25 -0.11 0.00 0.01 0.00 0.00 72.50 68.85 1n8p s THR 330 CO 0.35 0.31 1.47 -0.22 -0.69 0.00 0.00 174.62 175.84 1n8p s LEU 331 N 1.56 4.37 0.00 4.42 2.96 -1.26 -2.24 118.68 128.49 1n8p s LEU 331 Ca 0.06 2.79 0.00 0.00 -0.22 0.00 0.00 54.13 56.76 1n8p s LEU 331 Cb -0.15 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.90 1n8p s LEU 331 CO 0.06 -0.76 0.00 0.00 -1.32 0.00 0.00 176.35 174.34 1n8p n ALA 332 N 1.91 0.00 -4.51 5.97 0.00 -1.19 -4.90 120.51 117.78 1n8p n ALA 332 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.23 1n8p n ALA 332 Cb 0.40 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.80 1n8p n ALA 332 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1n8p n GLU 333 N 0.00 0.96 -0.41 0.00 -0.58 -1.26 -4.45 120.64 114.90 1n8p n GLU 333 Ca 0.00 -3.04 0.06 0.00 -0.42 0.00 0.00 57.16 53.76 1n8p n GLU 333 Cb 0.00 0.75 -0.01 0.00 -0.57 0.00 0.00 31.44 31.60 1n8p n GLU 333 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1n8p n SER 334 N -1.34 -3.61 -0.97 1.62 2.88 -1.26 -5.00 113.62 105.94 1n8p n SER 334 Ca -0.15 0.44 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 1n8p n SER 334 Cb 0.53 -1.23 0.00 0.00 -0.75 0.00 0.00 64.21 62.77 1n8p n SER 334 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n8p n LEU 335 N 0.00 0.00 -1.05 2.46 -0.00 -1.26 -4.93 117.00 112.22 1n8p n LEU 335 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.88 1n8p n LEU 335 Cb 0.18 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.55 1n8p n LEU 335 CO 0.00 0.00 -0.13 0.61 -0.00 0.00 0.00 177.39 177.87 1n8p n GLY 336 N 0.00 1.32 3.92 1.47 0.00 -1.26 -4.54 105.19 106.10 1n8p n GLY 336 Ca 0.00 -0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.71 1n8p n GLY 336 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n8p s GLY 337 N -2.53 1.67 0.32 -0.02 0.00 -1.26 -3.23 107.32 102.27 1n8p s GLY 337 Ca 0.00 -0.92 0.16 0.00 0.00 0.00 0.00 44.72 43.96 1n8p s GLY 337 CO 0.00 -0.36 1.61 1.19 0.00 0.00 0.00 173.10 175.54 1n8p h ILE 338 N -1.11 1.00 -3.31 0.90 2.10 -1.84 -3.43 117.51 111.82 1n8p h ILE 338 Ca -0.45 -1.92 -0.67 0.00 1.08 0.00 0.00 64.86 62.90 1n8p h ILE 338 Cb 1.30 2.16 -0.13 0.00 -1.09 0.00 0.00 36.82 39.05 1n8p h ILE 338 CO 0.55 0.47 -0.63 -1.83 -1.08 0.00 0.00 178.15 175.64 1n8p s GLU 339 N -3.36 2.90 0.47 2.19 1.03 -1.26 -1.89 118.70 118.77 1n8p s GLU 339 Ca 0.01 -0.52 -0.25 0.00 0.03 0.00 0.00 54.97 54.24 1n8p s GLU 339 Cb 0.10 -2.74 -0.08 0.00 -0.80 0.00 0.00 34.13 30.61 1n8p s GLU 339 CO 0.72 0.65 1.40 -1.12 -1.33 0.00 0.00 175.26 175.59 1n8p s SER 340 N -1.36 5.79 0.10 0.83 0.01 -1.26 -4.56 113.70 113.24 1n8p s SER 340 Ca 0.18 2.87 -0.09 0.00 1.31 0.00 0.00 55.95 60.22 1n8p s SER 340 Cb -0.12 -2.65 -0.00 0.00 0.21 0.00 0.00 66.02 63.46 1n8p s SER 340 CO 0.08 -1.23 0.19 -0.76 0.41 0.00 0.00 173.24 171.94 1n8p s LEU 341 N -2.86 1.40 -0.13 2.44 1.43 -0.65 -1.26 118.68 119.04 1n8p s LEU 341 Ca 0.63 -0.68 -0.10 0.00 -1.03 0.00 0.00 54.13 52.95 1n8p s LEU 341 Cb -0.43 1.03 0.04 0.00 0.03 0.00 0.00 46.19 46.87 1n8p s LEU 341 CO 0.54 -0.74 0.33 -1.48 0.23 0.00 0.00 176.35 175.22 1n8p s LEU 342 N -2.87 0.52 0.03 1.79 2.34 -0.95 -0.62 118.68 118.91 1n8p s LEU 342 Ca 0.06 0.67 0.00 0.00 0.06 0.00 0.00 54.13 54.93 1n8p s LEU 342 Cb 0.05 1.08 -0.02 0.00 -0.56 0.00 0.00 46.19 46.74 1n8p s LEU 342 CO -0.10 -0.14 -0.03 -0.70 -1.06 0.00 0.00 176.35 174.32 1n8p s GLU 343 N 0.64 0.36 -0.77 1.48 -6.30 0.63 -3.18 118.70 111.57 1n8p s GLU 343 Ca -0.04 -0.69 -0.12 0.00 -2.50 0.00 0.00 54.97 51.63 1n8p s GLU 343 Cb -0.05 0.08 0.20 0.00 0.00 0.00 0.00 34.13 34.37 1n8p s GLU 343 CO -0.04 -0.05 0.68 0.08 0.02 0.00 0.00 175.26 175.96 1n8p s VAL 344 N -1.71 5.19 0.18 3.70 1.01 -1.26 -0.55 120.40 126.96 1n8p s VAL 344 Ca -0.13 -2.53 -0.12 0.00 0.00 0.00 0.00 61.98 59.20 1n8p s VAL 344 Cb -0.08 -4.24 0.22 0.00 0.00 0.00 0.00 36.38 32.27 1n8p s VAL 344 CO -0.02 -0.99 1.18 -0.81 0.00 0.00 0.00 175.10 174.46 1n8p n PRO 345 N 3.93 -0.16 0.00 2.72 -0.04 -1.26 -2.35 135.00 137.84 1n8p n PRO 345 Ca 0.11 1.17 0.00 0.00 -0.04 0.00 0.00 63.50 64.74 1n8p n PRO 345 Cb 0.45 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 1n8p n PRO 345 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n8p n ALA 346 N -3.62 0.00 -0.79 0.55 0.00 -1.26 -0.59 120.51 114.79 1n8p n ALA 346 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1n8p n ALA 346 Cb 0.32 0.37 0.00 0.00 0.00 0.00 0.00 19.45 20.14 1n8p n ALA 346 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1n8p n VAL 347 N -2.64 0.00 0.00 0.00 0.24 -0.99 -3.72 118.33 111.21 1n8p n VAL 347 Ca 0.00 0.48 0.00 0.00 -2.04 0.00 0.00 64.34 62.78 1n8p n VAL 347 Cb 0.00 -0.99 0.00 0.00 -1.47 0.00 0.00 33.84 31.38 1n8p n VAL 347 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 1n8p n MET 348 N -0.82 0.00 0.00 7.34 2.00 -1.09 -3.77 117.12 120.78 1n8p n MET 348 Ca 0.00 0.88 0.00 0.00 0.00 0.00 0.00 57.70 58.58 1n8p n MET 348 Cb 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 33.22 31.90 1n8p n MET 348 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 1n8p n THR 349 N -2.86 0.00 -0.58 2.03 -1.04 -0.48 -4.53 114.28 106.82 1n8p n THR 349 Ca 0.00 0.03 -0.04 0.00 -2.04 0.00 0.00 64.05 61.99 1n8p n THR 349 Cb 0.00 -0.21 -0.01 0.00 -1.82 0.00 0.00 70.33 68.28 1n8p n THR 349 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1n8p n HIS 350 N 0.00 0.00 0.00 -1.42 8.25 0.24 -4.65 115.22 117.64 1n8p n HIS 350 Ca 0.00 -0.12 0.00 0.00 -0.26 0.00 0.00 57.72 57.34 1n8p n HIS 350 Cb 0.00 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 30.71 1n8p n HIS 350 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1n8p n GLY 351 N 3.27 1.25 2.37 -1.41 0.00 -1.24 -4.29 105.19 105.15 1n8p n GLY 351 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1n8p n GLY 351 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n8p n GLY 352 N 2.36 0.64 2.67 -0.02 0.00 -1.26 -4.45 105.19 105.12 1n8p n GLY 352 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1n8p n GLY 352 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n8p s ILE 353 N 2.00 -0.27 0.11 -0.61 1.01 -1.26 -5.13 121.20 117.05 1n8p s ILE 353 Ca 0.00 -0.58 -0.24 0.00 0.00 0.00 0.00 60.65 59.84 1n8p s ILE 353 Cb 0.00 -0.97 -0.13 0.00 0.01 0.00 0.00 42.46 41.37 1n8p s ILE 353 CO 0.00 -0.56 0.50 -2.65 0.00 0.00 0.00 174.94 172.24 1n8p n PRO 354 N 5.29 0.00 0.24 2.79 -0.02 -1.26 -4.59 135.00 137.45 1n8p n PRO 354 Ca -0.04 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.50 1n8p n PRO 354 Cb 0.45 -0.85 0.32 0.00 -0.02 0.00 0.00 33.50 33.39 1n8p n PRO 354 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1n8p h LYS 355 N 1.16 0.00 -0.35 -0.52 3.64 -1.93 0.69 116.57 119.26 1n8p h LYS 355 Ca -0.26 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.18 1n8p h LYS 355 Cb 1.08 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.82 1n8p h LYS 355 CO 0.45 0.00 -0.50 0.93 -2.27 0.00 0.00 179.45 178.05 1n8p h GLU 356 N 0.00 -0.39 0.00 1.90 5.08 -2.02 -2.16 114.58 116.99 1n8p h GLU 356 Ca 0.00 0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.21 1n8p h GLU 356 Cb 1.12 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 1n8p h GLU 356 CO 0.00 -0.26 -0.86 0.00 -1.00 0.00 0.00 179.01 176.89 1n8p h ALA 357 N 0.11 0.51 0.00 3.43 0.00 -1.15 -3.35 119.26 118.81 1n8p h ALA 357 Ca 0.09 -0.76 -0.04 0.00 0.00 0.00 0.00 54.91 54.20 1n8p h ALA 357 Cb 0.61 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1n8p h ALA 357 CO -0.56 1.01 -0.03 0.54 0.00 0.00 0.00 179.25 180.21 1n8p n ARG 358 N -3.26 0.89 0.00 0.00 1.74 -0.81 -1.20 116.66 114.02 1n8p n ARG 358 Ca -0.01 -0.21 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 1n8p n ARG 358 Cb 0.86 -1.37 0.00 0.00 -1.02 0.00 0.00 32.46 30.93 1n8p n ARG 358 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1n8p n GLU 359 N 1.98 0.06 -0.02 5.56 -0.58 -1.23 -3.89 120.64 122.51 1n8p n GLU 359 Ca 0.09 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1n8p n GLU 359 Cb 0.43 -0.03 -0.00 0.00 -0.57 0.00 0.00 31.44 31.27 1n8p n GLU 359 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n8p h ALA 360 N 0.00 0.00 0.00 0.62 0.00 -1.28 -3.36 119.26 115.23 1n8p h ALA 360 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1n8p h ALA 360 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1n8p h ALA 360 CO 0.00 0.04 0.00 1.03 0.00 0.00 0.00 179.25 180.32 1n8p h SER 361 N -0.45 0.00 0.00 0.00 0.87 -1.79 -3.45 113.55 108.72 1n8p h SER 361 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1n8p h SER 361 Cb 0.04 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 1n8p h SER 361 CO 0.00 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.91 1n8p n GLY 362 N -1.23 0.92 3.43 5.77 0.00 -1.26 -4.82 105.19 108.00 1n8p n GLY 362 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1n8p n GLY 362 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1n8p n VAL 363 N 0.00 0.00 -1.79 1.61 0.31 -1.26 -4.84 118.33 112.36 1n8p n VAL 363 Ca 0.00 -0.06 -0.42 0.00 -0.01 0.00 0.00 64.34 63.85 1n8p n VAL 363 Cb 0.00 -1.74 -0.03 0.00 -0.91 0.00 0.00 33.84 31.16 1n8p n VAL 363 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1n8p s PHE 364 N 6.45 2.66 0.60 3.52 2.99 -1.26 -4.03 117.98 128.90 1n8p s PHE 364 Ca 0.59 0.29 0.28 0.00 0.00 0.00 0.00 56.93 58.09 1n8p s PHE 364 Cb 0.13 -4.09 1.37 0.00 0.00 0.00 0.00 43.02 40.43 1n8p s PHE 364 CO 0.30 -4.25 1.78 0.22 -0.00 0.00 0.00 175.22 173.27 1n8p h ASP 365 N 7.50 0.00 -0.58 1.36 1.82 -1.90 0.30 116.42 124.92 1n8p h ASP 365 Ca -0.44 0.00 -0.29 0.00 -0.39 0.00 0.00 57.03 55.92 1n8p h ASP 365 Cb 1.21 0.00 -0.17 0.00 0.68 0.00 0.00 39.33 41.05 1n8p h ASP 365 CO 0.94 0.00 0.18 -0.90 -1.61 0.00 0.00 179.24 177.85 1n8p n ASP 366 N -3.54 3.04 -4.69 2.28 5.75 -1.26 -4.40 116.55 113.74 1n8p n ASP 366 Ca 0.10 -3.67 -0.37 0.00 -0.01 0.00 0.00 54.79 50.84 1n8p n ASP 366 Cb 0.81 -0.70 -0.08 0.00 -1.03 0.00 0.00 41.12 40.11 1n8p n ASP 366 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1n8p s LEU 367 N -3.24 4.17 -0.34 -2.12 2.96 0.11 -3.81 118.68 116.40 1n8p s LEU 367 Ca 0.49 0.41 -0.11 0.00 -0.22 0.00 0.00 54.13 54.70 1n8p s LEU 367 Cb 0.43 -2.37 0.00 0.00 0.50 0.00 0.00 46.19 44.76 1n8p s LEU 367 CO 0.04 0.01 0.19 -0.69 -1.32 0.00 0.00 176.35 174.59 1n8p s VAL 368 N 0.99 4.74 -0.04 1.68 1.01 0.11 -4.47 120.40 124.43 1n8p s VAL 368 Ca 0.15 -0.53 -0.13 0.00 0.00 0.00 0.00 61.98 61.47 1n8p s VAL 368 Cb -0.14 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 1n8p s VAL 368 CO 0.06 -0.06 0.34 -0.60 0.00 0.00 0.00 175.10 174.83 1n8p s ARG 369 N 1.62 3.82 -0.01 2.72 3.52 0.28 -2.26 118.95 128.64 1n8p s ARG 369 Ca 0.04 0.26 0.01 0.00 -0.13 0.00 0.00 55.73 55.91 1n8p s ARG 369 Cb -0.18 -3.22 0.00 0.00 -1.56 0.00 0.00 34.95 29.99 1n8p s ARG 369 CO 0.07 0.69 -0.02 0.96 -0.81 0.00 0.00 175.30 176.19 1n8p s ILE 370 N -0.97 0.21 -0.40 4.11 -4.36 0.05 -0.26 121.20 119.57 1n8p s ILE 370 Ca 0.21 -0.09 -0.09 0.00 -0.26 0.00 0.00 60.65 60.42 1n8p s ILE 370 Cb -0.15 -0.20 0.07 0.00 1.25 0.00 0.00 42.46 43.43 1n8p s ILE 370 CO 0.11 0.07 0.22 -0.55 0.24 0.00 0.00 174.94 175.03 1n8p s SER 371 N 0.07 5.57 0.03 4.36 0.15 0.21 -1.34 113.70 122.76 1n8p s SER 371 Ca -0.00 -1.39 -0.30 0.00 0.70 0.00 0.00 55.95 54.95 1n8p s SER 371 Cb -0.03 -1.96 -0.06 0.00 -1.71 0.00 0.00 66.02 62.26 1n8p s SER 371 CO -0.00 -0.48 1.31 -0.69 1.20 0.00 0.00 173.24 174.58 1n8p s VAL 372 N 1.43 3.78 0.00 4.45 1.01 -0.49 -1.64 120.40 128.94 1n8p s VAL 372 Ca 0.02 1.23 0.00 0.00 0.00 0.00 0.00 61.98 63.23 1n8p s VAL 372 Cb -0.22 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.37 1n8p s VAL 372 CO 0.03 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.78 1n8p n GLY 373 N 3.45 1.36 0.87 4.51 0.00 -1.26 -4.81 105.19 109.31 1n8p n GLY 373 Ca 0.11 -1.78 0.01 0.00 0.00 0.00 0.00 46.02 44.36 1n8p n GLY 373 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1n8p n ILE 374 N 0.00 2.36 -1.60 -0.61 -5.35 -0.79 -4.40 119.36 108.97 1n8p n ILE 374 Ca 0.00 -2.72 -0.29 0.00 -0.27 0.00 0.00 62.75 59.47 1n8p n ILE 374 Cb 0.00 -0.28 0.13 0.00 -1.74 0.00 0.00 39.64 37.75 1n8p n ILE 374 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1n8p s GLU 375 N -3.16 1.18 0.26 6.28 8.01 -1.26 -4.92 118.70 125.09 1n8p s GLU 375 Ca 0.41 0.22 -0.29 0.00 0.01 0.00 0.00 54.97 55.32 1n8p s GLU 375 Cb 0.38 -1.85 -0.14 0.00 -4.31 0.00 0.00 34.13 28.20 1n8p s GLU 375 CO -0.01 -2.15 1.08 -3.47 0.01 0.00 0.00 175.26 170.72 1n8p n ASP 376 N -3.72 1.43 0.53 -0.19 -0.08 -1.26 -4.85 116.55 108.41 1n8p n ASP 376 Ca 0.07 1.17 -0.21 0.00 -1.51 0.00 0.00 54.79 54.31 1n8p n ASP 376 Cb 0.60 -1.29 -0.10 0.00 2.34 0.00 0.00 41.12 42.67 1n8p n ASP 376 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1n8p h THR 377 N 2.22 0.00 -0.94 5.18 2.02 -1.97 -1.24 112.91 118.17 1n8p h THR 377 Ca -0.41 0.00 0.06 0.00 0.77 0.00 0.00 66.41 66.83 1n8p h THR 377 Cb 1.34 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.68 1n8p h THR 377 CO 0.64 0.00 0.60 0.44 0.37 0.00 0.00 175.52 177.57 1n8p h ASP 378 N -1.35 0.96 -0.69 4.18 3.32 -1.98 0.87 116.42 121.73 1n8p h ASP 378 Ca -0.14 0.01 0.01 0.00 0.02 0.00 0.00 57.03 56.94 1n8p h ASP 378 Cb 1.03 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 40.36 1n8p h ASP 378 CO 0.22 0.61 0.46 0.44 -1.72 0.00 0.00 179.24 179.25 1n8p h ASP 379 N 1.09 0.78 0.01 6.45 5.19 -1.91 0.35 116.42 128.38 1n8p h ASP 379 Ca 0.41 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.78 1n8p h ASP 379 Cb 0.16 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.48 1n8p h ASP 379 CO -0.17 0.56 -0.08 -0.07 -3.12 0.00 0.00 179.24 176.35 1n8p h LEU 380 N 0.92 0.06 0.08 1.55 3.38 0.21 -2.84 115.31 118.67 1n8p h LEU 380 Ca 0.26 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.33 1n8p h LEU 380 Cb -0.08 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1n8p h LEU 380 CO -0.06 0.96 -0.26 0.25 0.09 0.00 0.00 178.44 179.42 1n8p h LEU 381 N -0.83 -0.76 -1.87 1.67 5.85 0.86 0.15 115.31 120.37 1n8p h LEU 381 Ca -0.01 0.08 0.45 0.00 0.84 0.00 0.00 57.88 59.24 1n8p h LEU 381 Cb 0.98 0.28 -0.08 0.00 0.37 0.00 0.00 40.66 42.21 1n8p h LEU 381 CO 0.02 -0.28 1.09 -0.08 -0.34 0.00 0.00 178.44 178.85 1n8p h GLU 382 N -0.38 0.03 -0.12 1.25 4.57 -1.07 0.39 114.58 119.25 1n8p h GLU 382 Ca -0.01 -0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.07 1n8p h GLU 382 Cb 0.37 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1n8p h GLU 382 CO -0.13 0.02 -0.34 0.22 -1.18 0.00 0.00 179.01 177.60 1n8p h ASP 383 N 0.03 0.51 -0.70 1.04 3.58 -0.53 -1.87 116.42 118.48 1n8p h ASP 383 Ca 0.77 -0.59 0.06 0.00 0.42 0.00 0.00 57.03 57.68 1n8p h ASP 383 Cb 2.92 -0.15 -0.05 0.00 1.72 0.00 0.00 39.33 43.77 1n8p h ASP 383 CO -0.09 1.01 0.40 0.40 -2.88 0.00 0.00 179.24 178.08 1n8p h ILE 384 N 0.03 0.99 0.16 2.25 1.08 0.17 -1.95 117.51 120.24 1n8p h ILE 384 Ca -0.01 -0.25 -0.00 0.00 -0.39 0.00 0.00 64.86 64.20 1n8p h ILE 384 Cb 0.96 0.18 -0.01 0.00 -3.07 0.00 0.00 36.82 34.88 1n8p h ILE 384 CO 0.07 0.13 -0.20 0.11 -0.69 0.00 0.00 178.15 177.58 1n8p h LYS 385 N 0.74 -0.36 0.00 2.37 1.57 -1.34 -1.53 116.57 118.01 1n8p h LYS 385 Ca 0.31 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1n8p h LYS 385 Cb 0.17 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1n8p h LYS 385 CO -0.17 -0.24 0.55 0.37 -0.57 0.00 0.00 179.45 179.38 1n8p h GLN 386 N -0.38 0.00 0.00 3.15 -0.00 -0.90 0.22 115.11 117.21 1n8p h GLN 386 Ca -0.02 0.00 -0.12 0.00 -0.00 0.00 0.00 58.65 58.51 1n8p h GLN 386 Cb 0.34 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 27.79 1n8p h GLN 386 CO -0.05 0.00 -2.05 0.00 0.00 0.00 0.00 178.83 176.74 1n8p n ALA 387 N -1.42 2.31 0.05 3.38 0.00 -0.64 -4.00 120.51 120.19 1n8p n ALA 387 Ca -0.00 -0.75 -0.13 0.00 0.00 0.00 0.00 53.44 52.56 1n8p n ALA 387 Cb 0.56 -0.49 -0.08 0.00 0.00 0.00 0.00 19.45 19.43 1n8p n ALA 387 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1n8p h LEU 388 N 0.00 -0.07 0.24 0.00 3.38 0.11 -2.46 115.31 116.50 1n8p h LEU 388 Ca -0.18 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.61 1n8p h LEU 388 Cb 1.36 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 42.09 1n8p h LEU 388 CO 0.01 0.14 -0.43 0.11 0.09 0.00 0.00 178.44 178.36 1n8p h LYS 389 N -0.29 -0.71 -0.77 1.13 1.57 -1.76 0.18 116.57 115.92 1n8p h LYS 389 Ca -0.01 0.05 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 1n8p h LYS 389 Cb 0.25 0.16 -0.10 0.00 0.08 0.00 0.00 32.23 32.63 1n8p h LYS 389 CO 0.01 -0.48 -0.51 1.96 -0.57 0.00 0.00 179.45 179.86 1n8p h GLN 390 N -0.74 -0.07 -0.49 3.15 1.08 -1.68 0.44 115.11 116.79 1n8p h GLN 390 Ca -0.00 0.01 0.10 0.00 -1.45 0.00 0.00 58.65 57.30 1n8p h GLN 390 Cb 0.72 0.02 -0.09 0.00 -0.05 0.00 0.00 27.48 28.08 1n8p h GLN 390 CO -0.18 -0.05 -0.06 0.00 -0.95 0.00 0.00 178.83 177.59 1n8p h ALA 391 N 0.21 0.40 -0.15 3.87 0.00 -0.97 -1.72 119.26 120.90 1n8p h ALA 391 Ca 0.12 0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.25 1n8p h ALA 391 Cb 0.40 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1n8p h ALA 391 CO -0.76 -0.42 -0.13 1.15 0.00 0.00 0.00 179.25 179.09 1n8p h THR 392 N 0.05 0.64 0.00 0.00 2.02 0.21 -3.42 112.91 112.41 1n8p h THR 392 Ca 0.25 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.43 1n8p h THR 392 Cb 0.38 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 1n8p h THR 392 CO -0.46 0.00 0.00 0.59 0.37 0.00 0.00 175.52 176.02