#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 -0.85 0.56 -4.42 0.20 -1.26 -5.11 118.68 107.81 1n8p s LEU 2 Ca 0.00 -0.56 -0.19 0.00 0.69 0.00 0.00 54.13 54.08 1n8p s LEU 2 Cb 0.00 1.21 -0.08 0.00 -0.43 0.00 0.00 46.19 46.89 1n8p s LEU 2 CO 0.00 -0.31 0.66 0.00 -0.29 0.00 0.00 176.35 176.41 1n8p n GLN 3 N 5.09 0.66 -2.91 1.98 6.02 -1.26 -4.97 117.38 121.98 1n8p n GLN 3 Ca 0.04 0.25 -0.13 0.00 -0.01 0.00 0.00 57.00 57.15 1n8p n GLN 3 Cb 0.50 -1.82 0.04 0.00 1.02 0.00 0.00 30.24 29.98 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 -0.23 0.95 -3.32 -1.09 1.02 -1.26 -4.94 120.64 111.77 1n8p n GLU 4 Ca 0.12 -2.45 -0.18 0.00 -0.02 0.00 0.00 57.16 54.64 1n8p n GLU 4 Cb 0.46 -1.31 0.07 0.00 -0.02 0.00 0.00 31.44 30.65 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 0.57 -4.31 -3.44 1.62 7.64 -1.26 -5.02 113.62 109.41 1n8p n SER 5 Ca 0.13 -0.47 -0.20 0.00 1.01 0.00 0.00 58.87 59.34 1n8p n SER 5 Cb 0.67 -4.28 0.14 0.00 -1.01 0.00 0.00 64.21 59.72 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 -2.43 0.24 -4.89 6.43 8.00 -1.26 -5.07 116.55 117.57 1n8p n ASP 6 Ca -0.08 -1.43 -0.29 0.00 0.71 0.00 0.00 54.79 53.69 1n8p n ASP 6 Cb 0.58 -0.68 0.02 0.00 -0.02 0.00 0.00 41.12 41.03 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 -4.94 3.29 0.30 -1.24 -0.14 -1.26 -4.83 119.74 110.93 1n8p s LYS 7 Ca 0.53 0.43 0.06 0.00 -1.36 0.00 0.00 55.97 55.62 1n8p s LYS 7 Cb -0.02 -2.16 0.81 0.00 -1.68 0.00 0.00 37.83 34.78 1n8p s LYS 7 CO 0.37 -0.63 1.66 0.35 -0.76 0.00 0.00 175.35 176.34 1n8p h PHE 8 N -0.26 0.55 -0.33 3.18 3.57 -1.99 0.22 116.94 121.88 1n8p h PHE 8 Ca -0.45 0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.02 1n8p h PHE 8 Cb 1.22 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.85 1n8p h PHE 8 CO 0.57 -0.17 -0.10 0.00 -2.23 0.00 0.00 178.31 176.38 1n8p h ALA 9 N 1.79 1.21 -0.41 2.41 0.00 -1.99 -1.14 119.26 121.12 1n8p h ALA 9 Ca 0.60 -0.27 -0.13 0.00 0.00 0.00 0.00 54.91 55.12 1n8p h ALA 9 Cb 1.25 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1n8p h ALA 9 CO -0.62 0.51 -0.24 1.15 0.00 0.00 0.00 179.25 180.05 1n8p h THR 10 N 0.52 1.28 -0.56 0.00 2.02 -0.98 -2.38 112.91 112.81 1n8p h THR 10 Ca 0.10 -1.39 -0.11 0.00 0.77 0.00 0.00 66.41 65.78 1n8p h THR 10 Cb 0.49 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1n8p h THR 10 CO 0.03 0.47 -0.09 0.11 0.37 0.00 0.00 175.52 176.40 1n8p h LYS 11 N 0.71 1.05 -0.41 6.66 1.57 -1.07 -2.02 116.57 123.06 1n8p h LYS 11 Ca 0.09 -0.38 0.08 0.00 -1.87 0.00 0.00 60.65 58.57 1n8p h LYS 11 Cb 0.81 -0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.98 1n8p h LYS 11 CO 0.07 1.08 -0.02 0.00 -0.57 0.00 0.00 179.45 180.00 1n8p h ALA 12 N 0.94 0.36 0.00 3.86 0.00 -1.03 0.57 119.26 123.96 1n8p h ALA 12 Ca 0.15 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1n8p h ALA 12 Cb 0.66 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1n8p h ALA 12 CO 0.05 -0.41 -0.03 0.82 0.00 0.00 0.00 179.25 179.69 1n8p h ILE 13 N 0.08 0.05 0.00 0.00 1.08 -1.30 -3.40 117.51 114.03 1n8p h ILE 13 Ca 0.20 -0.78 0.00 0.00 -0.39 0.00 0.00 64.86 63.90 1n8p h ILE 13 Cb 0.30 1.74 0.00 0.00 -3.07 0.00 0.00 36.82 35.78 1n8p h ILE 13 CO -0.36 0.02 -0.72 1.41 -0.69 0.00 0.00 178.15 177.82 1n8p n HIS 14 N -3.12 0.00 -1.71 1.37 8.25 -0.77 -4.97 115.22 114.27 1n8p n HIS 14 Ca 0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.06 1n8p n HIS 14 Cb 0.41 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.49 1n8p n HIS 14 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1n8p n ALA 15 N -1.52 2.67 -0.08 -1.41 0.00 0.19 -1.69 120.51 118.68 1n8p n ALA 15 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1n8p n ALA 15 Cb 0.32 -2.53 0.00 0.00 0.00 0.00 0.00 19.45 17.24 1n8p n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n8p n GLY 16 N 3.98 0.95 3.39 0.00 0.00 -1.26 -4.23 105.19 108.02 1n8p n GLY 16 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.08 -0.04 -4.13 1.61 2.13 -0.68 -4.71 120.64 112.74 1n8p n GLU 17 Ca 0.00 0.03 -0.28 0.00 0.66 0.00 0.00 57.16 57.57 1n8p n GLU 17 Cb 0.00 -1.75 -0.03 0.00 0.27 0.00 0.00 31.44 29.92 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 -2.17 1.83 -0.27 4.31 -3.43 -1.26 -4.94 115.29 109.36 1n8p s HIS 18 Ca 0.58 -0.83 -0.03 0.00 -0.80 0.00 0.00 55.06 53.98 1n8p s HIS 18 Cb -0.26 -1.85 0.02 0.00 -1.43 0.00 0.00 32.58 29.06 1n8p s HIS 18 CO 0.65 -0.21 -0.01 0.08 -2.00 0.00 0.00 174.74 173.25 1n8p s VAL 19 N -2.77 3.24 -0.07 -5.38 1.01 -1.26 -5.08 120.40 110.08 1n8p s VAL 19 Ca 0.28 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 1n8p s VAL 19 Cb -0.01 -2.67 0.03 0.00 0.00 0.00 0.00 36.38 33.74 1n8p s VAL 19 CO 0.17 0.13 0.04 -0.62 0.00 0.00 0.00 175.10 174.82 1n8p s ASP 20 N 1.38 1.50 0.22 3.32 3.68 -1.26 -5.01 116.67 120.49 1n8p s ASP 20 Ca 0.00 -0.09 -0.09 0.00 2.13 0.00 0.00 52.55 54.51 1n8p s ASP 20 Cb -0.17 -0.27 0.23 0.00 -1.45 0.00 0.00 42.92 41.26 1n8p s ASP 20 CO -0.02 -0.25 1.85 0.58 0.13 0.00 0.00 175.17 177.46 1n8p h VAL 21 N 6.41 1.07 -0.98 1.11 2.07 -1.99 -0.88 116.25 123.05 1n8p h VAL 21 Ca -0.15 -0.30 0.14 0.00 0.82 0.00 0.00 66.70 67.21 1n8p h VAL 21 Cb 1.12 0.11 -0.09 0.00 -1.52 0.00 0.00 31.29 30.92 1n8p h VAL 21 CO 0.21 0.16 0.60 0.45 0.02 0.00 0.00 177.57 179.01 1n8p h HIS 22 N 0.88 1.08 0.00 1.57 3.86 -2.05 -3.46 115.15 117.03 1n8p h HIS 22 Ca 0.31 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.55 1n8p h HIS 22 Cb 0.07 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 28.21 1n8p h HIS 22 CO -0.04 0.36 0.00 0.41 0.86 0.00 0.00 177.93 179.52 1n8p n GLY 23 N -1.34 1.15 3.68 2.45 0.00 -0.34 -5.05 105.19 105.75 1n8p n GLY 23 Ca 0.20 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.68 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 2.64 0.21 1.61 3.41 -1.26 -4.82 113.62 115.41 1n8p n SER 24 Ca 0.00 1.05 0.08 0.00 -0.26 0.00 0.00 58.87 59.74 1n8p n SER 24 Cb 0.00 -1.23 0.45 0.00 -0.26 0.00 0.00 64.21 63.17 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 4.93 0.81 -3.41 -3.33 2.07 -1.98 -3.41 116.25 111.93 1n8p h VAL 25 Ca -0.47 -1.19 -0.65 0.00 0.82 0.00 0.00 66.70 65.22 1n8p h VAL 25 Cb 1.30 1.73 -0.24 0.00 -1.52 0.00 0.00 31.29 32.57 1n8p h VAL 25 CO 0.93 0.28 -0.67 -0.63 0.02 0.00 0.00 177.57 177.50 1n8p s ILE 26 N -3.84 3.83 0.10 4.57 -1.09 -1.26 -5.03 121.20 118.48 1n8p s ILE 26 Ca -0.01 -0.36 -0.33 0.00 -2.23 0.00 0.00 60.65 57.72 1n8p s ILE 26 Cb 0.12 -2.72 -0.12 0.00 -1.58 0.00 0.00 42.46 38.15 1n8p s ILE 26 CO 0.66 0.44 1.73 1.21 -1.23 0.00 0.00 174.94 177.75 1n8p n GLU 27 N 4.22 2.39 -1.86 2.79 2.13 -1.26 -4.98 120.64 124.07 1n8p n GLU 27 Ca -0.17 0.87 -0.30 0.00 0.66 0.00 0.00 57.16 58.21 1n8p n GLU 27 Cb 0.52 -2.69 0.04 0.00 0.27 0.00 0.00 31.44 29.58 1n8p n GLU 27 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1n8p s PRO 28 N 2.15 2.96 -0.47 5.31 0.04 -1.26 -5.02 135.00 138.71 1n8p s PRO 28 Ca 0.82 0.54 -0.21 0.00 0.04 0.00 0.00 61.00 62.19 1n8p s PRO 28 Cb -0.61 -2.03 0.03 0.00 0.04 0.00 0.00 34.50 31.93 1n8p s PRO 28 CO 0.40 -0.98 0.71 0.42 0.04 0.00 0.00 177.00 177.60 1n8p s ILE 29 N -3.31 4.73 -0.48 0.56 1.01 -1.26 -4.85 121.20 117.61 1n8p s ILE 29 Ca 0.58 0.11 -0.17 0.00 0.00 0.00 0.00 60.65 61.16 1n8p s ILE 29 Cb -0.11 -4.29 0.06 0.00 0.01 0.00 0.00 42.46 38.12 1n8p s ILE 29 CO 0.52 -0.73 0.49 -0.44 0.00 0.00 0.00 174.94 174.79 1n8p s SER 30 N 2.26 6.18 -0.01 3.58 0.01 -1.26 -4.84 113.70 119.63 1n8p s SER 30 Ca 0.24 -1.05 0.18 0.00 1.31 0.00 0.00 55.95 56.63 1n8p s SER 30 Cb -0.14 -2.23 -0.23 0.00 0.21 0.00 0.00 66.02 63.62 1n8p s SER 30 CO 0.19 -0.73 0.64 0.18 0.41 0.00 0.00 173.24 173.92 1n8p n LEU 31 N 5.66 0.54 -4.44 2.44 4.77 -1.26 -4.75 117.00 119.97 1n8p n LEU 31 Ca -0.09 -0.32 -0.52 0.00 -0.03 0.00 0.00 56.01 55.05 1n8p n LEU 31 Cb 0.45 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.49 1n8p n LEU 31 CO 0.50 0.14 0.20 -1.54 -1.33 0.00 0.00 177.39 175.35 1n8p n SER 32 N -1.69 -0.78 0.06 -1.43 3.41 -1.26 -4.86 113.62 107.08 1n8p n SER 32 Ca 0.01 1.14 -0.10 0.00 -0.26 0.00 0.00 58.87 59.66 1n8p n SER 32 Cb 0.36 -0.94 -0.07 0.00 -0.26 0.00 0.00 64.21 63.29 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 1.71 0.71 -5.05 6.66 2.02 -1.99 -3.41 112.91 113.56 1n8p h THR 33 Ca -0.36 -1.08 -0.58 0.00 0.77 0.00 0.00 66.41 65.17 1n8p h THR 33 Cb 1.44 1.20 -0.10 0.00 -1.74 0.00 0.00 68.15 68.94 1n8p h THR 33 CO 0.60 0.19 -0.40 0.35 0.37 0.00 0.00 175.52 176.63 1n8p n THR 34 N -4.94 0.00 -3.88 3.16 -2.24 -1.26 -0.40 114.28 104.72 1n8p n THR 34 Ca -0.07 -2.10 -0.11 0.00 -2.27 0.00 0.00 64.05 59.50 1n8p n THR 34 Cb 0.25 0.35 -0.11 0.00 -2.10 0.00 0.00 70.33 68.72 1n8p n THR 34 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1n8p s PHE 35 N -2.59 0.04 0.91 4.78 0.40 -1.24 -4.95 117.98 115.33 1n8p s PHE 35 Ca 0.04 -0.11 -0.11 0.00 -0.60 0.00 0.00 56.93 56.15 1n8p s PHE 35 Cb -0.00 -0.05 0.13 0.00 0.51 0.00 0.00 43.02 43.61 1n8p s PHE 35 CO 0.03 -0.22 1.09 0.15 0.70 0.00 0.00 175.22 176.97 1n8p s LYS 36 N -1.06 1.17 0.02 0.44 1.02 -1.26 -4.91 119.74 115.15 1n8p s LYS 36 Ca -0.12 0.89 0.04 0.00 0.02 0.00 0.00 55.97 56.80 1n8p s LYS 36 Cb -0.07 -1.79 -0.02 0.00 -0.52 0.00 0.00 37.83 35.43 1n8p s LYS 36 CO 0.01 -2.32 -0.12 -0.65 -0.92 0.00 0.00 175.35 171.35 1n8p s GLN 37 N -4.89 0.87 0.06 1.68 -0.21 -1.26 -1.70 119.66 114.21 1n8p s GLN 37 Ca 0.64 -0.60 -0.27 0.00 0.02 0.00 0.00 55.36 55.15 1n8p s GLN 37 Cb -0.19 -0.85 -0.17 0.00 1.00 0.00 0.00 33.01 32.81 1n8p s GLN 37 CO 0.57 0.22 1.56 0.66 -2.12 0.00 0.00 175.29 176.19 1n8p h SER 38 N 5.30 -0.32 -4.50 5.90 4.64 -0.86 -3.44 113.55 120.28 1n8p h SER 38 Ca -0.35 -0.06 -0.35 0.00 -0.47 0.00 0.00 61.79 60.55 1n8p h SER 38 Cb 1.18 0.08 -0.23 0.00 -0.31 0.00 0.00 62.40 63.12 1n8p h SER 38 CO 0.46 -0.14 -0.76 -0.55 -0.87 0.00 0.00 176.83 174.97 1n8p s SER 39 N -4.95 1.23 0.32 4.97 0.15 -1.17 -5.04 113.70 109.22 1n8p s SER 39 Ca -0.15 -0.50 0.18 0.00 0.70 0.00 0.00 55.95 56.18 1n8p s SER 39 Cb 0.04 -0.03 1.16 0.00 -1.71 0.00 0.00 66.02 65.48 1n8p s SER 39 CO 0.62 -0.09 1.36 -2.65 1.20 0.00 0.00 173.24 173.69 1n8p n PRO 40 N 1.67 -0.05 0.04 5.44 -0.02 -1.26 -1.70 135.00 139.11 1n8p n PRO 40 Ca -0.20 1.19 -0.01 0.00 -2.02 0.00 0.00 63.50 62.45 1n8p n PRO 40 Cb 0.55 -2.14 -0.01 0.00 -0.02 0.00 0.00 33.50 31.89 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 1.72 -1.00 -3.73 3.55 0.00 -1.98 -3.45 119.26 114.37 1n8p h ALA 41 Ca 0.73 -0.02 -0.61 0.00 0.00 0.00 0.00 54.91 55.01 1n8p h ALA 41 Cb 1.94 0.04 -0.32 0.00 0.00 0.00 0.00 17.79 19.45 1n8p h ALA 41 CO -0.66 -0.99 -0.85 -0.80 0.00 0.00 0.00 179.25 175.94 1n8p s ASN 42 N -2.17 2.49 0.00 0.00 0.01 -0.69 -5.08 114.94 109.50 1n8p s ASN 42 Ca -0.01 -0.42 0.00 0.00 -0.71 0.00 0.00 52.86 51.71 1n8p s ASN 42 Cb 0.00 -0.85 0.00 0.00 0.41 0.00 0.00 41.25 40.81 1n8p s ASN 42 CO 0.04 0.16 0.00 -2.65 -1.51 0.00 0.00 177.10 173.14 1n8p n PRO 43 N 3.28 1.37 -1.35 -0.60 -0.02 -1.26 -2.73 135.00 133.69 1n8p n PRO 43 Ca -0.19 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.23 1n8p n PRO 43 Cb 0.53 0.00 0.11 0.00 -0.02 0.00 0.00 33.50 34.12 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 -1.08 2.13 0.00 4.25 -0.00 -0.69 -0.99 119.36 122.98 1n8p n ILE 44 Ca 0.00 -3.46 0.00 0.00 -0.00 0.00 0.00 62.75 59.29 1n8p n ILE 44 Cb 0.00 -0.42 0.00 0.00 -0.00 0.00 0.00 39.64 39.22 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 -0.82 3.66 0.00 3.28 0.00 -1.26 -4.97 105.19 105.09 1n8p n GLY 45 Ca 0.27 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.56 0.00 -4.29 2.61 -1.04 -1.26 -4.42 114.28 105.33 1n8p n THR 46 Ca 0.00 0.24 -0.34 0.00 -2.04 0.00 0.00 64.05 61.91 1n8p n THR 46 Cb 0.00 -1.08 -0.11 0.00 -1.82 0.00 0.00 70.33 67.32 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 -1.33 3.12 -0.05 -1.42 1.51 -1.26 -4.98 117.35 112.95 1n8p s TYR 47 Ca 0.00 -0.06 -0.01 0.00 -1.01 0.00 0.00 57.07 55.99 1n8p s TYR 47 Cb 0.00 -1.95 -0.03 0.00 -0.11 0.00 0.00 41.96 39.88 1n8p s TYR 47 CO 0.00 0.15 -0.05 -0.85 -1.11 0.00 0.00 175.55 173.69 1n8p n GLU 48 N 3.16 0.11 -3.70 -0.62 0.28 -1.26 -4.64 120.64 113.96 1n8p n GLU 48 Ca -0.17 0.04 -0.14 0.00 -0.16 0.00 0.00 57.16 56.72 1n8p n GLU 48 Cb 0.53 -0.88 -0.14 0.00 1.43 0.00 0.00 31.44 32.37 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 -2.09 -0.24 0.10 -1.84 5.04 -1.26 -3.72 117.35 113.34 1n8p s TYR 49 Ca -0.07 0.66 -0.16 0.00 -2.44 0.00 0.00 57.07 55.06 1n8p s TYR 49 Cb 0.02 -0.12 0.01 0.00 0.35 0.00 0.00 41.96 42.23 1n8p s TYR 49 CO 0.10 -0.24 0.89 0.45 -1.34 0.00 0.00 175.55 175.40 1n8p n SER 50 N 4.77 -0.54 0.09 4.32 2.88 0.46 -0.94 113.62 124.67 1n8p n SER 50 Ca -0.16 1.02 -0.12 0.00 -1.33 0.00 0.00 58.87 58.28 1n8p n SER 50 Cb 0.51 -0.16 -0.05 0.00 -0.75 0.00 0.00 64.21 63.75 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 -0.37 -0.08 -1.46 2.43 -1.94 0.02 114.38 112.98 1n8p h ARG 51 Ca 0.13 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.35 1n8p h ARG 51 Cb 0.27 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1n8p h ARG 51 CO -0.55 -0.25 0.12 1.03 -1.51 0.00 0.00 179.97 178.81 1n8p h SER 52 N -0.39 0.00 0.00 -3.80 0.87 -1.39 -3.45 113.55 105.39 1n8p h SER 52 Ca 0.04 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1n8p h SER 52 Cb 0.43 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1n8p h SER 52 CO -0.15 0.00 0.00 1.67 -0.53 0.00 0.00 176.83 177.82 1n8p n GLN 53 N -3.63 0.00 -3.86 2.24 -0.06 -0.02 -5.02 117.38 107.03 1n8p n GLN 53 Ca -0.01 0.00 -0.11 0.00 -2.00 0.00 0.00 57.00 54.88 1n8p n GLN 53 Cb 0.21 0.00 -0.10 0.00 -4.06 0.00 0.00 30.24 26.29 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 -0.01 0.24 1.69 4.22 -1.13 -3.78 114.94 116.17 1n8p s ASN 54 Ca 0.00 -0.11 -0.10 0.00 -2.14 0.00 0.00 52.86 50.51 1n8p s ASN 54 Cb 0.00 0.23 0.36 0.00 1.28 0.00 0.00 41.25 43.12 1n8p s ASN 54 CO 0.00 -0.32 1.60 1.55 -2.04 0.00 0.00 177.10 177.89 1n8p h PRO 55 N 4.53 0.01 -0.94 3.55 0.13 -1.94 -2.35 132.00 134.99 1n8p h PRO 55 Ca -0.30 -0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.85 1n8p h PRO 55 Cb 1.19 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 1n8p h PRO 55 CO 0.40 0.01 0.62 -0.91 -0.23 0.00 0.00 178.00 177.89 1n8p h ASN 56 N 0.01 1.06 0.36 1.44 -0.26 -1.88 0.19 115.58 116.49 1n8p h ASN 56 Ca 0.39 -0.02 -0.02 0.00 -0.56 0.00 0.00 56.30 56.10 1n8p h ASN 56 Cb 0.62 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 37.63 1n8p h ASN 56 CO -0.80 0.75 -0.17 -0.09 -1.06 0.00 0.00 177.43 176.05 1n8p h ARG 57 N 1.24 -0.46 -0.80 0.81 2.43 -1.78 -2.57 114.38 113.25 1n8p h ARG 57 Ca 0.36 0.03 0.14 0.00 -0.81 0.00 0.00 59.98 59.70 1n8p h ARG 57 Cb -0.09 0.10 -0.14 0.00 -0.42 0.00 0.00 29.97 29.42 1n8p h ARG 57 CO -0.09 -0.31 -0.32 1.49 -1.51 0.00 0.00 179.97 179.23 1n8p h GLU 58 N -0.80 -0.06 -0.74 0.20 4.81 -1.40 0.48 114.58 117.07 1n8p h GLU 58 Ca -0.05 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1n8p h GLU 58 Cb 0.37 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.72 1n8p h GLU 58 CO 0.08 -0.04 0.48 -0.91 -0.73 0.00 0.00 179.01 177.90 1n8p h ASN 59 N -0.06 0.85 0.74 1.04 2.35 -0.70 0.05 115.58 119.86 1n8p h ASN 59 Ca 0.32 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 56.01 1n8p h ASN 59 Cb 0.59 -0.21 0.01 0.00 0.05 0.00 0.00 38.32 38.75 1n8p h ASN 59 CO -0.84 0.62 -0.36 0.25 -1.65 0.00 0.00 177.43 175.45 1n8p h LEU 60 N 1.00 -0.85 -0.87 1.61 5.85 0.21 -2.06 115.31 120.21 1n8p h LEU 60 Ca 0.27 0.01 0.23 0.00 0.84 0.00 0.00 57.88 59.23 1n8p h LEU 60 Cb -0.11 0.22 -0.14 0.00 0.37 0.00 0.00 40.66 41.00 1n8p h LEU 60 CO -0.06 -0.55 0.18 -0.33 -0.34 0.00 0.00 178.44 177.33 1n8p h GLU 61 N -1.08 0.16 -0.37 1.25 5.08 -0.11 0.17 114.58 119.68 1n8p h GLU 61 Ca -0.10 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1n8p h GLU 61 Cb 0.78 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1n8p h GLU 61 CO 0.17 0.11 0.21 0.00 -1.00 0.00 0.00 179.01 178.49 1n8p h ARG 62 N 0.17 0.51 0.23 2.33 3.08 -0.82 -1.53 114.38 118.35 1n8p h ARG 62 Ca 0.53 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.51 1n8p h ARG 62 Cb 1.06 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.01 1n8p h ARG 62 CO -0.68 0.41 -0.11 0.00 -1.07 0.00 0.00 179.97 178.52 1n8p h ALA 63 N 1.07 -0.31 -0.12 0.04 0.00 -0.06 -1.16 119.26 118.71 1n8p h ALA 63 Ca 0.13 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1n8p h ALA 63 Cb 0.05 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1n8p h ALA 63 CO -0.02 -0.63 -0.07 0.28 0.00 0.00 0.00 179.25 178.81 1n8p h VAL 64 N -0.41 0.78 -0.52 0.00 2.07 -0.78 -0.88 116.25 116.52 1n8p h VAL 64 Ca -0.03 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.59 1n8p h VAL 64 Cb 0.31 0.78 -0.08 0.00 -1.52 0.00 0.00 31.29 30.78 1n8p h VAL 64 CO 0.05 0.00 0.01 0.00 0.02 0.00 0.00 177.57 177.65 1n8p h ALA 65 N 1.04 0.50 -0.65 1.67 0.00 -1.23 0.30 119.26 120.90 1n8p h ALA 65 Ca 0.07 0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.17 1n8p h ALA 65 Cb 0.17 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1n8p h ALA 65 CO -0.16 -0.38 0.39 0.00 0.00 0.00 0.00 179.25 179.09 1n8p h ALA 66 N 1.46 0.85 0.00 0.00 0.00 -0.66 0.31 119.26 121.21 1n8p h ALA 66 Ca 0.26 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 1n8p h ALA 66 Cb 0.40 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1n8p h ALA 66 CO -0.43 0.12 -0.37 -0.07 0.00 0.00 0.00 179.25 178.51 1n8p h LEU 67 N 0.75 0.00 -1.80 0.00 3.38 0.05 -1.98 115.31 115.72 1n8p h LEU 67 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1n8p h LEU 67 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1n8p h LEU 67 CO -0.12 0.37 0.00 1.21 0.09 0.00 0.00 178.44 179.99 1n8p n GLU 68 N -3.71 2.38 -4.05 1.13 4.07 0.94 -4.79 120.64 116.61 1n8p n GLU 68 Ca -0.01 -1.35 -0.27 0.00 -0.06 0.00 0.00 57.16 55.46 1n8p n GLU 68 Cb 0.46 -1.61 -0.04 0.00 -0.06 0.00 0.00 31.44 30.19 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 0.37 -0.23 -4.22 4.31 5.15 -0.48 -4.80 115.26 115.36 1n8p n ASN 69 Ca 0.12 -1.07 -0.15 0.00 -0.60 0.00 0.00 54.58 52.89 1n8p n ASN 69 Cb 0.52 -2.72 -0.10 0.00 -0.53 0.00 0.00 39.78 36.95 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 -4.01 1.34 0.10 5.20 0.00 0.91 -4.92 121.76 120.39 1n8p s ALA 70 Ca 0.05 -1.35 -0.06 0.00 0.00 0.00 0.00 51.96 50.61 1n8p s ALA 70 Cb -0.03 0.02 -0.18 0.00 0.00 0.00 0.00 23.12 22.93 1n8p s ALA 70 CO 0.92 -0.04 1.23 1.96 0.00 0.00 0.00 175.76 179.82 1n8p h GLN 71 N 3.19 0.40 -5.99 0.00 1.08 -1.83 -3.36 115.11 108.59 1n8p h GLN 71 Ca -0.37 -0.51 -0.53 0.00 -1.45 0.00 0.00 58.65 55.79 1n8p h GLN 71 Cb 1.19 0.16 -0.20 0.00 -0.05 0.00 0.00 27.48 28.59 1n8p h GLN 71 CO 0.57 1.18 -0.80 0.71 -0.95 0.00 0.00 178.83 179.54 1n8p s TYR 72 N -3.05 1.77 0.04 2.96 1.51 0.61 -4.98 117.35 116.21 1n8p s TYR 72 Ca -0.06 -0.45 -0.03 0.00 -1.01 0.00 0.00 57.07 55.52 1n8p s TYR 72 Cb 0.08 -0.92 -0.02 0.00 -0.11 0.00 0.00 41.96 40.99 1n8p s TYR 72 CO 0.88 0.26 0.04 0.20 -1.11 0.00 0.00 175.55 175.82 1n8p s GLY 73 N -2.31 0.25 -0.23 0.71 0.00 -1.26 -1.69 107.32 102.79 1n8p s GLY 73 Ca 0.11 -0.69 -0.09 0.00 0.00 0.00 0.00 44.72 44.05 1n8p s GLY 73 CO 0.05 -0.81 0.51 1.08 0.00 0.00 0.00 173.10 173.94 1n8p s LEU 74 N -2.13 -0.72 0.23 0.66 1.43 -0.50 -4.87 118.68 112.77 1n8p s LEU 74 Ca -0.05 1.20 0.03 0.00 -1.03 0.00 0.00 54.13 54.28 1n8p s LEU 74 Cb -0.01 1.74 -0.03 0.00 0.03 0.00 0.00 46.19 47.91 1n8p s LEU 74 CO -0.05 -0.22 0.37 0.00 0.23 0.00 0.00 176.35 176.68 1n8p s ALA 75 N 2.35 3.89 0.24 4.21 0.00 -1.26 -1.64 121.76 129.55 1n8p s ALA 75 Ca -0.05 -1.07 -0.05 0.00 0.00 0.00 0.00 51.96 50.78 1n8p s ALA 75 Cb -0.10 -1.84 -0.02 0.00 0.00 0.00 0.00 23.12 21.16 1n8p s ALA 75 CO -0.15 0.30 0.30 -0.06 0.00 0.00 0.00 175.76 176.15 1n8p s PHE 76 N -1.95 0.87 0.26 0.00 0.40 0.15 -4.56 117.98 113.15 1n8p s PHE 76 Ca 0.36 -1.13 -0.01 0.00 -0.60 0.00 0.00 56.93 55.54 1n8p s PHE 76 Cb -0.10 -0.24 0.56 0.00 0.51 0.00 0.00 43.02 43.75 1n8p s PHE 76 CO 0.30 -0.83 1.72 0.77 0.70 0.00 0.00 175.22 177.88 1n8p h SER 77 N 2.41 0.32 -5.32 1.36 0.02 -1.44 -1.45 113.55 109.45 1n8p h SER 77 Ca -0.31 0.12 -0.11 0.00 -0.84 0.00 0.00 61.79 60.66 1n8p h SER 77 Cb 1.25 0.10 -0.09 0.00 0.14 0.00 0.00 62.40 63.79 1n8p h SER 77 CO 0.44 0.08 -0.18 -0.94 -1.14 0.00 0.00 176.83 175.09 1n8p s SER 78 N -5.30 0.07 0.10 3.07 1.04 -1.26 -3.20 113.70 108.22 1n8p s SER 78 Ca -0.12 -1.06 -0.26 0.00 0.48 0.00 0.00 55.95 54.98 1n8p s SER 78 Cb 0.22 0.58 -0.11 0.00 0.10 0.00 0.00 66.02 66.81 1n8p s SER 78 CO 0.77 -1.14 1.67 1.23 0.98 0.00 0.00 173.24 176.75 1n8p h GLY 79 N 2.27 -0.39 -0.56 7.32 0.00 -1.80 -2.10 103.07 107.81 1n8p h GLY 79 Ca -0.28 0.22 0.26 0.00 0.00 0.00 0.00 47.33 47.54 1n8p h GLY 79 CO 0.38 -0.18 0.27 1.76 0.00 0.00 0.00 176.54 178.77 1n8p h SER 80 N -0.40 0.02 0.19 0.19 0.02 -1.95 0.70 113.55 112.32 1n8p h SER 80 Ca 0.01 0.21 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 1n8p h SER 80 Cb 0.39 0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1n8p h SER 80 CO -0.07 -0.20 -0.28 0.00 -1.14 0.00 0.00 176.83 175.14 1n8p h ALA 81 N 1.83 1.36 -0.03 3.77 0.00 -1.83 -0.62 119.26 123.74 1n8p h ALA 81 Ca 0.60 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 55.06 1n8p h ALA 81 Cb 1.28 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1n8p h ALA 81 CO -0.69 0.45 -0.67 1.15 0.00 0.00 0.00 179.25 179.48 1n8p h THR 82 N 0.15 1.43 0.05 0.00 2.02 0.10 -0.32 112.91 116.34 1n8p h THR 82 Ca 0.02 -2.19 -0.23 0.00 0.77 0.00 0.00 66.41 64.78 1n8p h THR 82 Cb 0.58 2.16 -0.01 0.00 -1.74 0.00 0.00 68.15 69.14 1n8p h THR 82 CO 0.04 0.64 -1.07 0.74 0.37 0.00 0.00 175.52 176.24 1n8p h THR 83 N 0.11 1.61 -0.28 3.16 2.02 -0.93 -3.14 112.91 115.45 1n8p h THR 83 Ca -0.01 -3.18 -0.05 0.00 0.77 0.00 0.00 66.41 63.93 1n8p h THR 83 Cb 1.20 2.83 -0.01 0.00 -1.74 0.00 0.00 68.15 70.43 1n8p h THR 83 CO 0.10 0.92 -0.03 0.00 0.37 0.00 0.00 175.52 176.88 1n8p h ALA 84 N 0.85 0.39 -0.55 6.16 0.00 -0.79 -1.27 119.26 124.05 1n8p h ALA 84 Ca -0.06 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1n8p h ALA 84 Cb 1.80 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.46 1n8p h ALA 84 CO 0.16 0.16 0.16 1.15 0.00 0.00 0.00 179.25 180.88 1n8p h THR 85 N 0.30 1.22 -0.46 0.00 2.02 -1.15 -1.11 112.91 113.73 1n8p h THR 85 Ca 0.08 -0.77 -0.10 0.00 0.77 0.00 0.00 66.41 66.39 1n8p h THR 85 Cb 0.48 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1n8p h THR 85 CO 0.02 0.29 -0.10 0.40 0.37 0.00 0.00 175.52 176.50 1n8p h ILE 86 N 0.81 1.27 -0.07 3.11 2.04 -1.45 -2.15 117.51 121.06 1n8p h ILE 86 Ca 0.18 -1.21 -0.13 0.00 1.00 0.00 0.00 64.86 64.70 1n8p h ILE 86 Cb 0.26 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1n8p h ILE 86 CO -0.01 0.42 -0.52 -0.07 0.00 0.00 0.00 178.15 177.97 1n8p h LEU 87 N 0.72 0.21 -0.09 1.44 3.38 -0.84 -2.90 115.31 117.23 1n8p h LEU 87 Ca 0.12 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1n8p h LEU 87 Cb 0.64 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1n8p h LEU 87 CO 0.04 0.70 -0.11 0.00 0.09 0.00 0.00 178.44 179.16 1n8p n GLN 88 N -3.93 0.36 0.00 1.13 10.64 -0.45 -2.44 117.38 122.68 1n8p n GLN 88 Ca -0.02 -0.09 0.13 0.00 -1.83 0.00 0.00 57.00 55.19 1n8p n GLN 88 Cb 0.56 -1.50 0.44 0.00 -0.86 0.00 0.00 30.24 28.88 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 -1.24 0.36 -4.80 2.61 3.41 -0.82 -4.87 113.62 108.27 1n8p n SER 89 Ca 0.11 -0.09 -0.32 0.00 -0.26 0.00 0.00 58.87 58.31 1n8p n SER 89 Cb 0.29 -0.05 0.03 0.00 -0.26 0.00 0.00 64.21 64.23 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 -2.88 3.32 0.28 1.04 1.43 -1.02 -4.99 118.68 115.86 1n8p s LEU 90 Ca 0.16 1.77 -0.29 0.00 -1.03 0.00 0.00 54.13 54.74 1n8p s LEU 90 Cb 0.19 -4.52 -0.10 0.00 0.03 0.00 0.00 46.19 41.79 1n8p s LEU 90 CO 0.60 -1.39 1.24 -2.16 0.23 0.00 0.00 176.35 174.87 1n8p s PRO 91 N -4.47 4.45 0.08 1.29 0.04 -1.26 -4.89 135.00 130.24 1n8p s PRO 91 Ca 0.62 2.04 -0.37 0.00 0.04 0.00 0.00 61.00 63.33 1n8p s PRO 91 Cb -0.16 -3.14 -0.17 0.00 0.04 0.00 0.00 34.50 31.06 1n8p s PRO 91 CO 0.45 -0.08 1.28 0.94 0.04 0.00 0.00 177.00 179.63 1n8p n GLN 92 N 1.43 0.93 -2.38 4.56 -0.06 -1.26 -3.25 117.38 117.35 1n8p n GLN 92 Ca 0.01 0.34 -0.01 0.00 -2.00 0.00 0.00 57.00 55.34 1n8p n GLN 92 Cb 0.43 -1.94 0.00 0.00 -4.06 0.00 0.00 30.24 24.67 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 2.31 -0.90 2.75 1.69 0.00 -1.26 -5.08 105.19 104.70 1n8p n GLY 93 Ca 0.18 0.33 -0.22 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.17 1.91 -4.00 1.61 7.64 -1.20 -4.99 113.62 113.42 1n8p n SER 94 Ca 0.02 -2.74 -0.12 0.00 1.01 0.00 0.00 58.87 57.04 1n8p n SER 94 Cb 0.44 0.62 -0.12 0.00 -1.01 0.00 0.00 64.21 64.14 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 -2.65 0.44 0.16 1.43 2.46 0.55 0.12 115.29 117.81 1n8p s HIS 95 Ca 0.10 -0.41 0.01 0.00 0.47 0.00 0.00 55.06 55.23 1n8p s HIS 95 Cb 0.00 -0.28 -0.04 0.00 -0.13 0.00 0.00 32.58 32.13 1n8p s HIS 95 CO 0.07 -0.10 0.02 0.00 -2.47 0.00 0.00 174.74 172.26 1n8p s ALA 96 N -1.13 1.22 -0.00 1.58 0.00 -1.13 0.22 121.76 122.52 1n8p s ALA 96 Ca -0.10 -1.56 0.02 0.00 0.00 0.00 0.00 51.96 50.32 1n8p s ALA 96 Cb -0.08 0.64 -0.01 0.00 0.00 0.00 0.00 23.12 23.68 1n8p s ALA 96 CO -0.00 -0.37 -0.07 0.08 0.00 0.00 0.00 175.76 175.40 1n8p s VAL 97 N -3.77 0.54 0.03 0.00 1.01 0.28 -2.54 120.40 115.96 1n8p s VAL 97 Ca 0.24 -0.31 -0.14 0.00 0.00 0.00 0.00 61.98 61.77 1n8p s VAL 97 Cb 0.07 -0.46 0.02 0.00 0.00 0.00 0.00 36.38 36.01 1n8p s VAL 97 CO 0.03 0.14 0.31 -0.94 0.00 0.00 0.00 175.10 174.64 1n8p s SER 98 N -0.20 -0.14 0.53 3.32 1.04 -1.26 0.23 113.70 117.23 1n8p s SER 98 Ca 0.02 -0.12 -0.22 0.00 0.48 0.00 0.00 55.95 56.11 1n8p s SER 98 Cb -0.03 0.35 -0.06 0.00 0.10 0.00 0.00 66.02 66.38 1n8p s SER 98 CO -0.00 -0.58 1.34 -0.38 0.98 0.00 0.00 173.24 174.60 1n8p n ILE 99 N 0.75 3.65 0.43 -1.02 5.41 -1.09 -1.31 119.36 126.18 1n8p n ILE 99 Ca -0.19 -0.50 -0.20 0.00 1.00 0.00 0.00 62.75 62.86 1n8p n ILE 99 Cb 0.59 -1.65 -0.10 0.00 -0.71 0.00 0.00 39.64 37.77 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 1.51 -1.35 -7.22 7.39 0.00 0.95 -3.36 103.07 100.99 1n8p h GLY 100 Ca -0.50 0.55 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1n8p h GLY 100 CO 0.57 -0.45 0.11 1.22 0.00 0.00 0.00 176.54 177.98 1n8p n ASP 101 N -5.58 1.41 -4.36 0.19 8.00 -1.26 -4.85 116.55 110.09 1n8p n ASP 101 Ca -0.15 -1.83 -0.18 0.00 0.71 0.00 0.00 54.79 53.34 1n8p n ASP 101 Cb 0.50 -1.62 -0.10 0.00 -0.02 0.00 0.00 41.12 39.88 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 14.95 0.79 0.38 2.53 1.01 -1.26 -4.11 120.40 134.69 1n8p s VAL 102 Ca 0.88 -2.00 -0.21 0.00 0.00 0.00 0.00 61.98 60.65 1n8p s VAL 102 Cb -0.13 -2.69 -0.10 0.00 0.00 0.00 0.00 36.38 33.46 1n8p s VAL 102 CO 0.14 -0.01 0.90 -0.47 0.00 0.00 0.00 175.10 175.66 1n8p s TYR 103 N -3.59 3.40 -1.04 5.22 5.04 -1.26 -4.87 117.35 120.25 1n8p s TYR 103 Ca 0.37 1.55 0.00 0.00 -2.44 0.00 0.00 57.07 56.55 1n8p s TYR 103 Cb 0.08 -2.79 0.00 0.00 0.35 0.00 0.00 41.96 39.60 1n8p s TYR 103 CO 0.14 0.00 0.62 0.41 -1.34 0.00 0.00 175.55 175.38 1n8p n GLY 104 N -0.34 -0.19 0.17 8.97 0.00 -1.26 -2.56 105.19 109.99 1n8p n GLY 104 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.32 0.50 -0.02 0.00 -1.98 0.40 103.07 102.28 1n8p h GLY 105 Ca 0.00 0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.42 1n8p h GLY 105 CO 0.00 -0.14 -0.26 -0.91 0.00 0.00 0.00 176.54 175.22 1n8p h THR 106 N 0.02 0.00 0.00 4.70 1.35 -1.89 -0.79 112.91 116.29 1n8p h THR 106 Ca 0.20 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.06 1n8p h THR 106 Cb 0.30 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.72 1n8p h THR 106 CO -0.40 0.00 0.00 1.57 -0.25 0.00 0.00 175.52 176.44 1n8p n HIS 107 N -3.97 0.00 0.00 4.73 -0.00 -0.94 0.10 115.22 115.14 1n8p n HIS 107 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.63 1n8p n HIS 107 Cb 0.28 -0.16 0.00 0.00 -0.00 0.00 0.00 29.99 30.11 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 -1.93 0.00 0.00 1.57 1.74 0.14 -2.45 116.66 115.72 1n8p n ARG 108 Ca 0.00 0.49 0.00 0.00 -0.77 0.00 0.00 57.85 57.57 1n8p n ARG 108 Cb 0.00 -1.25 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 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 -1.62 0.00 -0.24 -1.55 0.53 -0.31 -0.64 117.16 113.34 1n8p n TYR 109 Ca 0.00 0.00 0.24 0.00 -1.02 0.00 0.00 57.90 57.12 1n8p n TYR 109 Cb 0.00 -0.44 0.44 0.00 -1.03 0.00 0.00 39.34 38.30 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 -2.67 0.85 -0.04 -0.72 3.01 0.29 0.37 117.46 118.55 1n8p n PHE 110 Ca 0.00 0.86 -0.15 0.00 1.01 0.00 0.00 57.45 59.17 1n8p n PHE 110 Cb 0.00 -1.29 -0.13 0.00 -0.01 0.00 0.00 39.48 38.05 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 1.69 0.49 4.37 2.02 -0.93 -3.14 112.91 117.41 1n8p h THR 111 Ca 0.63 -2.31 -0.02 0.00 0.77 0.00 0.00 66.41 65.48 1n8p h THR 111 Cb 1.67 3.25 -0.02 0.00 -1.74 0.00 0.00 68.15 71.31 1n8p h THR 111 CO -0.56 0.62 -0.45 0.11 0.37 0.00 0.00 175.52 175.60 1n8p h LYS 112 N -0.79 -0.89 0.00 6.66 6.56 0.23 0.03 116.57 128.37 1n8p h LYS 112 Ca -0.04 0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.62 1n8p h LYS 112 Cb 1.13 0.20 0.00 0.00 -0.57 0.00 0.00 32.23 32.99 1n8p h LYS 112 CO 0.04 -0.59 0.00 0.28 -2.06 0.00 0.00 179.45 177.12 1n8p h VAL 113 N -0.93 0.00 -0.38 0.50 2.07 -1.63 0.21 116.25 116.09 1n8p h VAL 113 Ca -0.06 -0.10 -0.25 0.00 0.82 0.00 0.00 66.70 67.11 1n8p h VAL 113 Cb 0.79 0.91 -0.10 0.00 -1.52 0.00 0.00 31.29 31.37 1n8p h VAL 113 CO -0.03 0.00 0.24 0.00 0.02 0.00 0.00 177.57 177.79 1n8p n ALA 114 N -1.95 5.09 -0.50 1.67 0.00 -0.01 -4.53 120.51 120.28 1n8p n ALA 114 Ca -0.01 -1.40 -0.19 0.00 0.00 0.00 0.00 53.44 51.83 1n8p n ALA 114 Cb 0.11 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.09 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 0.90 0.34 0.00 0.00 3.02 0.73 0.05 115.26 120.30 1n8p n ASN 115 Ca 0.25 0.33 0.00 0.00 -0.03 0.00 0.00 54.58 55.14 1n8p n ASN 115 Cb 0.58 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 1n8p n ASN 115 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n8p n ALA 116 N 1.21 0.00 -1.92 5.41 0.00 -1.26 -1.60 120.51 122.35 1n8p n ALA 116 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 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 0.28 -5.09 115.22 110.41 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 -1.89 3.57 1.57 0.00 0.11 -4.33 105.19 104.21 1n8p n GLY 118 Ca 0.00 0.41 -0.42 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.87 4.76 1.14 1.61 1.01 -1.26 -3.58 120.40 123.22 1n8p s VAL 119 Ca 0.00 0.69 -0.14 0.00 0.00 0.00 0.00 61.98 62.53 1n8p s VAL 119 Cb 0.00 -4.20 0.23 0.00 0.00 0.00 0.00 36.38 32.41 1n8p s VAL 119 CO 0.00 -0.47 0.79 -0.62 0.00 0.00 0.00 175.10 174.80 1n8p n GLU 120 N 6.38 -2.06 -3.26 2.72 1.02 0.33 -4.71 120.64 121.05 1n8p n GLU 120 Ca 0.02 -0.57 0.03 0.00 -0.02 0.00 0.00 57.16 56.62 1n8p n GLU 120 Cb 0.48 -2.07 -0.02 0.00 -0.02 0.00 0.00 31.44 29.81 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 -2.39 -0.71 -0.37 2.62 2.01 -1.26 -2.84 115.64 112.70 1n8p s THR 121 Ca 0.65 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.66 1n8p s THR 121 Cb -0.22 -1.00 0.10 0.00 0.01 0.00 0.00 72.50 71.39 1n8p s THR 121 CO 0.65 0.00 0.11 -0.94 -0.69 0.00 0.00 174.62 173.75 1n8p s SER 122 N 2.82 5.00 0.20 3.53 1.04 -1.05 -4.99 113.70 120.24 1n8p s SER 122 Ca 0.07 -1.98 -0.30 0.00 0.48 0.00 0.00 55.95 54.21 1n8p s SER 122 Cb -0.12 -1.73 -0.09 0.00 0.10 0.00 0.00 66.02 64.18 1n8p s SER 122 CO -0.17 -0.44 1.40 -0.36 0.98 0.00 0.00 173.24 174.65 1n8p s PHE 123 N 1.06 3.15 -0.01 5.02 0.40 -1.26 -4.01 117.98 122.33 1n8p s PHE 123 Ca 0.07 1.04 0.01 0.00 -0.60 0.00 0.00 56.93 57.46 1n8p s PHE 123 Cb -0.21 -3.73 0.00 0.00 0.51 0.00 0.00 43.02 39.60 1n8p s PHE 123 CO -0.05 -2.40 -0.04 0.99 0.70 0.00 0.00 175.22 174.41 1n8p s THR 124 N 0.36 0.35 0.29 0.64 2.01 -0.42 -4.88 115.64 113.98 1n8p s THR 124 Ca 0.60 -0.16 0.06 0.00 0.31 0.00 0.00 61.69 62.50 1n8p s THR 124 Cb -0.39 -0.31 -0.02 0.00 0.01 0.00 0.00 72.50 71.78 1n8p s THR 124 CO 0.38 0.11 0.40 0.21 -0.69 0.00 0.00 174.62 175.03 1n8p s ASN 125 N 0.06 6.06 -0.40 3.53 3.84 -1.26 0.14 114.94 126.92 1n8p s ASN 125 Ca -0.00 -0.10 -0.21 0.00 0.21 0.00 0.00 52.86 52.76 1n8p s ASN 125 Cb -0.04 -1.49 0.03 0.00 -0.55 0.00 0.00 41.25 39.20 1n8p s ASN 125 CO -0.00 -0.26 0.52 -0.67 -2.79 0.00 0.00 177.10 173.90 1n8p n ASP 126 N -1.51 -7.05 0.26 -4.21 2.03 -1.26 -4.77 116.55 100.04 1n8p n ASP 126 Ca -0.04 0.38 -0.15 0.00 0.52 0.00 0.00 54.79 55.50 1n8p n ASP 126 Cb 0.58 -3.88 -0.08 0.00 -0.72 0.00 0.00 41.12 37.01 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 2.24 -0.55 0.00 -2.67 5.85 -1.98 -3.23 115.31 114.97 1n8p h LEU 127 Ca -0.19 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1n8p h LEU 127 Cb 1.04 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1n8p h LEU 127 CO 0.19 -0.26 0.04 0.18 -0.34 0.00 0.00 178.44 178.25 1n8p n LEU 128 N -5.30 0.00 -0.01 2.25 4.77 -1.26 -1.46 117.00 115.99 1n8p n LEU 128 Ca -0.11 0.29 0.02 0.00 -0.03 0.00 0.00 56.01 56.18 1n8p n LEU 128 Cb 0.31 -0.29 -0.06 0.00 -2.33 0.00 0.00 43.42 41.05 1n8p n LEU 128 CO 0.33 -0.29 -0.62 0.59 -1.33 0.00 0.00 177.39 176.07 1n8p n ASN 129 N -1.27 3.24 -0.20 -1.43 3.02 -1.23 -4.66 115.26 112.72 1n8p n ASN 129 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.60 1n8p n ASN 129 Cb 0.04 1.22 -0.00 0.00 -0.61 0.00 0.00 39.78 40.42 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 -1.87 1.13 -0.17 6.41 8.00 -1.03 -4.60 116.55 124.42 1n8p n ASP 130 Ca -0.03 -1.07 -0.06 0.00 0.71 0.00 0.00 54.79 54.34 1n8p n ASP 130 Cb 0.31 0.50 0.11 0.00 -0.02 0.00 0.00 41.12 42.02 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 1.00 0.90 -0.01 0.64 5.85 -1.52 -1.81 115.31 120.36 1n8p h LEU 131 Ca 0.00 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 1n8p h LEU 131 Cb 0.32 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1n8p h LEU 131 CO 0.00 0.92 -0.00 1.55 -0.34 0.00 0.00 178.44 180.57 1n8p h PRO 132 N 0.89 0.01 -0.42 5.25 0.13 -1.85 1.50 132.00 137.51 1n8p h PRO 132 Ca 0.18 -0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.37 1n8p h PRO 132 Cb 0.43 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.53 1n8p h PRO 132 CO 0.01 0.33 0.28 1.96 -0.23 0.00 0.00 178.00 180.35 1n8p h GLN 133 N -0.31 0.27 0.00 0.86 4.20 -1.83 -3.03 115.11 115.28 1n8p h GLN 133 Ca 0.00 -0.02 -0.12 0.00 0.06 0.00 0.00 58.65 58.58 1n8p h GLN 133 Cb 0.32 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1n8p h GLN 133 CO 0.00 0.18 -2.01 1.28 -0.67 0.00 0.00 178.83 177.61 1n8p n LEU 134 N -4.47 0.00 -0.24 1.46 4.77 -0.69 -4.66 117.00 113.17 1n8p n LEU 134 Ca 0.06 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.23 1n8p n LEU 134 Cb 0.28 0.16 0.30 0.00 -2.33 0.00 0.00 43.42 41.84 1n8p n LEU 134 CO 0.35 0.16 0.63 -0.38 -1.33 0.00 0.00 177.39 176.81 1n8p n ILE 135 N -2.35 0.00 -2.46 -0.08 5.41 0.51 -4.26 119.36 116.13 1n8p n ILE 135 Ca -0.13 0.63 0.00 0.00 1.00 0.00 0.00 62.75 64.25 1n8p n ILE 135 Cb 0.71 -1.07 0.00 0.00 -0.71 0.00 0.00 39.64 38.57 1n8p n ILE 135 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1n8p n LYS 136 N -2.60 3.87 0.00 0.38 3.00 -1.26 -4.25 118.16 117.30 1n8p n LYS 136 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 1n8p n LYS 136 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.85 1n8p n LYS 136 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1n8p n GLU 137 N 0.00 0.00 0.00 1.64 2.13 -1.26 -4.25 120.64 118.90 1n8p n GLU 137 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1n8p n GLU 137 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 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 -4.74 4.31 5.15 -1.26 -4.78 115.26 113.95 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 -0.01 0.00 -0.53 0.00 0.00 39.78 39.24 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 -1.03 1.31 0.00 -0.44 -2.24 -1.24 -0.33 114.28 110.31 1n8p n THR 139 Ca 0.00 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1n8p n THR 139 Cb 0.00 -1.86 0.00 0.00 -2.10 0.00 0.00 70.33 66.37 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 1.63 3.43 -4.38 -0.78 4.76 0.58 -4.78 118.16 118.63 1n8p n LYS 140 Ca 0.07 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.30 1n8p n LYS 140 Cb 0.36 -0.50 -0.13 0.00 -1.84 0.00 0.00 35.03 32.92 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 -0.89 2.20 -0.16 -0.35 2.96 -1.14 -1.67 118.68 119.63 1n8p s LEU 141 Ca 0.00 -0.52 -0.01 0.00 -0.22 0.00 0.00 54.13 53.38 1n8p s LEU 141 Cb 0.00 -0.70 0.04 0.00 0.50 0.00 0.00 46.19 46.03 1n8p s LEU 141 CO 0.00 0.05 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.36 1n8p s VAL 142 N -0.94 0.90 -0.23 1.68 1.01 -0.85 -0.55 120.40 121.42 1n8p s VAL 142 Ca 0.03 -0.51 -0.08 0.00 0.00 0.00 0.00 61.98 61.42 1n8p s VAL 142 Cb -0.09 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 1n8p s VAL 142 CO 0.02 0.09 0.09 0.86 0.00 0.00 0.00 175.10 176.16 1n8p s TRP 143 N 1.72 3.15 -0.14 5.22 -0.11 0.64 -0.62 118.94 128.81 1n8p s TRP 143 Ca 0.01 -0.19 0.02 0.00 1.22 0.00 0.00 56.10 57.16 1n8p s TRP 143 Cb -0.15 -2.21 0.00 0.00 -1.50 0.00 0.00 33.47 29.61 1n8p s TRP 143 CO -0.07 -0.18 -0.21 0.42 -4.62 0.00 0.00 176.95 172.30 1n8p s ILE 144 N 1.27 2.23 -0.96 5.86 1.01 0.63 -2.67 121.20 128.56 1n8p s ILE 144 Ca 0.05 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 59.74 1n8p s ILE 144 Cb -0.15 -1.90 0.26 0.00 0.01 0.00 0.00 42.46 40.68 1n8p s ILE 144 CO 0.04 0.54 1.01 1.21 0.00 0.00 0.00 174.94 177.74 1n8p n GLU 145 N 3.95 3.23 0.00 2.79 2.13 -1.26 0.01 120.64 131.48 1n8p n GLU 145 Ca -0.20 -4.51 0.00 0.00 0.66 0.00 0.00 57.16 53.11 1n8p n GLU 145 Cb 0.52 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 29.78 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 2.04 0.00 -3.13 6.31 -2.24 -1.23 -2.54 114.28 113.48 1n8p n THR 146 Ca 0.24 0.40 -0.41 0.00 -2.27 0.00 0.00 64.05 62.01 1n8p n THR 146 Cb 0.37 -0.58 -0.07 0.00 -2.10 0.00 0.00 70.33 67.95 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 -1.48 3.73 0.53 -0.78 0.02 -1.26 -3.78 135.00 131.98 1n8p s PRO 147 Ca 0.00 0.09 -0.21 0.00 0.02 0.00 0.00 61.00 60.89 1n8p s PRO 147 Cb 0.00 -3.79 -0.05 0.00 0.02 0.00 0.00 34.50 30.68 1n8p s PRO 147 CO 0.00 -0.68 1.28 0.95 -0.33 0.00 0.00 177.00 178.23 1n8p s THR 148 N 2.63 2.43 -0.26 0.99 -4.23 -1.05 -4.83 115.64 111.32 1n8p s THR 148 Ca 0.24 0.31 -0.09 0.00 -1.18 0.00 0.00 61.69 60.97 1n8p s THR 148 Cb -0.15 -3.15 -0.04 0.00 1.34 0.00 0.00 72.50 70.50 1n8p s THR 148 CO 0.14 -0.01 0.12 0.21 -0.54 0.00 0.00 174.62 174.53 1n8p s ASN 149 N -1.17 5.55 0.00 3.99 2.47 -1.26 -0.88 114.94 123.65 1n8p s ASN 149 Ca 0.71 -0.10 0.12 0.00 0.42 0.00 0.00 52.86 54.00 1n8p s ASN 149 Cb -0.36 -2.01 0.16 0.00 -1.45 0.00 0.00 41.25 37.59 1n8p s ASN 149 CO 0.42 -0.03 0.99 -0.81 -3.72 0.00 0.00 177.10 173.95 1n8p n PRO 150 N 4.88 1.29 0.01 0.43 -0.04 -1.26 -4.49 135.00 135.82 1n8p n PRO 150 Ca -0.15 -1.46 0.04 0.00 -0.04 0.00 0.00 63.50 61.88 1n8p n PRO 150 Cb 0.52 -1.24 0.43 0.00 -0.04 0.00 0.00 33.50 33.16 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 2.28 1.11 -2.55 0.52 2.02 -1.92 -3.43 112.91 110.94 1n8p h THR 151 Ca 0.00 -0.21 -0.10 0.00 0.77 0.00 0.00 66.41 66.87 1n8p h THR 151 Cb 0.57 0.55 0.04 0.00 -1.74 0.00 0.00 68.15 67.56 1n8p h THR 151 CO 0.00 0.11 -0.19 0.18 0.37 0.00 0.00 175.52 175.99 1n8p n LEU 152 N -4.47 -2.44 -4.66 2.58 4.77 -0.06 -4.79 117.00 107.94 1n8p n LEU 152 Ca 0.03 -0.15 -0.42 0.00 -0.03 0.00 0.00 56.01 55.44 1n8p n LEU 152 Cb 0.07 -1.18 -0.04 0.00 -2.33 0.00 0.00 43.42 39.94 1n8p n LEU 152 CO 0.35 0.15 0.64 -0.75 -1.33 0.00 0.00 177.39 176.45 1n8p s LYS 153 N -4.96 4.26 0.21 3.23 2.20 -1.26 -4.59 119.74 118.84 1n8p s LYS 153 Ca 0.09 1.01 -0.21 0.00 -0.36 0.00 0.00 55.97 56.51 1n8p s LYS 153 Cb -0.04 -3.60 -0.08 0.00 -1.51 0.00 0.00 37.83 32.59 1n8p s LYS 153 CO 0.19 -0.41 0.74 0.08 -0.36 0.00 0.00 175.35 175.59 1n8p s VAL 154 N 2.45 4.52 0.01 4.02 1.01 -1.26 -2.81 120.40 128.34 1n8p s VAL 154 Ca 0.37 1.38 0.08 0.00 0.00 0.00 0.00 61.98 63.81 1n8p s VAL 154 Cb -0.16 -3.91 -0.02 0.00 0.00 0.00 0.00 36.38 32.28 1n8p s VAL 154 CO 0.10 0.27 -0.23 -0.89 0.00 0.00 0.00 175.10 174.35 1n8p s THR 155 N -1.45 1.86 -0.78 3.92 2.01 -1.25 -4.88 115.64 115.08 1n8p s THR 155 Ca 0.42 -1.12 -0.24 0.00 0.31 0.00 0.00 61.69 61.05 1n8p s THR 155 Cb -0.18 -1.57 0.05 0.00 0.01 0.00 0.00 72.50 70.81 1n8p s THR 155 CO 0.22 0.42 1.20 -0.62 -0.69 0.00 0.00 174.62 175.15 1n8p s ASP 156 N -0.82 6.26 0.48 3.53 -1.08 -1.26 -4.88 116.67 118.89 1n8p s ASP 156 Ca 0.09 -0.90 0.25 0.00 -0.52 0.00 0.00 52.55 51.47 1n8p s ASP 156 Cb -0.09 -2.51 1.29 0.00 -1.46 0.00 0.00 42.92 40.15 1n8p s ASP 156 CO 0.00 -1.61 1.88 0.40 0.52 0.00 0.00 175.17 176.37 1n8p h ILE 157 N 6.12 0.62 0.12 4.11 2.04 -1.94 -1.89 117.51 126.70 1n8p h ILE 157 Ca -0.17 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 1n8p h ILE 157 Cb 1.05 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1n8p h ILE 157 CO 1.26 0.03 -0.06 -0.61 0.00 0.00 0.00 178.15 178.78 1n8p h GLN 158 N 0.19 -0.15 -0.81 2.37 5.75 -1.82 -0.69 115.11 119.95 1n8p h GLN 158 Ca 0.43 0.01 0.17 0.00 -0.15 0.00 0.00 58.65 59.11 1n8p h GLN 158 Cb 1.40 0.03 -0.11 0.00 1.07 0.00 0.00 27.48 29.88 1n8p h GLN 158 CO -0.09 0.34 0.33 0.87 -2.65 0.00 0.00 178.83 177.63 1n8p h LYS 159 N -0.84 0.42 -0.23 1.69 1.57 -1.78 0.68 116.57 118.08 1n8p h LYS 159 Ca -0.02 -0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.55 1n8p h LYS 159 Cb 0.56 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1n8p h LYS 159 CO 0.03 0.28 -0.61 0.28 -0.57 0.00 0.00 179.45 178.86 1n8p h VAL 160 N 0.43 1.29 -0.54 0.50 2.07 -1.39 0.14 116.25 118.75 1n8p h VAL 160 Ca 0.47 -1.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.17 1n8p h VAL 160 Cb 0.77 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.26 1n8p h VAL 160 CO -0.45 0.58 0.33 0.00 0.02 0.00 0.00 177.57 178.05 1n8p h ALA 161 N 0.72 0.69 0.62 1.67 0.00 0.00 -2.10 119.26 120.87 1n8p h ALA 161 Ca -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1n8p h ALA 161 Cb 1.21 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.78 1n8p h ALA 161 CO 0.13 0.18 -0.30 -0.44 0.00 0.00 0.00 179.25 178.81 1n8p h ASP 162 N 0.73 -0.71 -0.96 0.00 3.32 -0.83 -2.49 116.42 115.48 1n8p h ASP 162 Ca 0.20 -0.00 0.28 0.00 0.02 0.00 0.00 57.03 57.52 1n8p h ASP 162 Cb -0.02 0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.68 1n8p h ASP 162 CO -0.04 -0.46 0.81 0.25 -1.72 0.00 0.00 179.24 178.09 1n8p h LEU 163 N -0.91 0.00 0.12 1.55 5.85 -0.57 0.30 115.31 121.65 1n8p h LEU 163 Ca -0.09 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.34 1n8p h LEU 163 Cb 0.67 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.73 1n8p h LEU 163 CO 0.14 0.00 -1.25 0.40 -0.34 0.00 0.00 178.44 177.40 1n8p h ILE 164 N 0.00 1.28 0.00 4.05 2.04 -0.95 -2.03 117.51 121.90 1n8p h ILE 164 Ca 0.46 -2.46 -0.02 0.00 1.00 0.00 0.00 64.86 63.84 1n8p h ILE 164 Cb 2.08 2.71 -0.00 0.00 -0.74 0.00 0.00 36.82 40.86 1n8p h ILE 164 CO -0.00 0.75 -0.10 0.11 0.00 0.00 0.00 178.15 178.90 1n8p h LYS 165 N 0.26 0.00 0.00 2.37 1.57 -0.08 -1.06 116.57 119.63 1n8p h LYS 165 Ca -0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 1n8p h LYS 165 Cb 1.92 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.23 1n8p h LYS 165 CO 0.24 0.10 -0.21 -0.22 -0.57 0.00 0.00 179.45 178.79 1n8p h LYS 166 N 0.00 0.00 -0.36 3.15 3.64 -1.29 -3.24 116.57 118.47 1n8p h LYS 166 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1n8p h LYS 166 Cb 0.38 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1n8p h LYS 166 CO 0.01 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.91 1n8p n HIS 167 N -4.25 0.11 -2.58 1.91 8.25 -0.77 -4.25 115.22 113.64 1n8p n HIS 167 Ca -0.03 -0.05 -0.01 0.00 -0.26 0.00 0.00 57.72 57.37 1n8p n HIS 167 Cb 0.11 -0.04 0.06 0.00 1.12 0.00 0.00 29.99 31.23 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 -0.20 0.31 -1.77 -1.41 0.00 -0.40 -4.86 120.51 112.18 1n8p n ALA 168 Ca 0.02 -0.47 -0.39 0.00 0.00 0.00 0.00 53.44 52.60 1n8p n ALA 168 Cb 0.14 -0.65 -0.02 0.00 0.00 0.00 0.00 19.45 18.92 1n8p n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n8p s ALA 169 N 0.06 3.25 0.00 0.00 0.00 -1.22 -3.39 121.76 120.46 1n8p s ALA 169 Ca 0.04 1.10 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1n8p s ALA 169 Cb 0.21 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1n8p s ALA 169 CO -0.06 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.48 1n8p n GLY 170 N 0.71 3.19 2.14 0.00 0.00 -1.26 -4.92 105.19 105.05 1n8p n GLY 170 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.34 2.18 -4.23 1.61 10.64 -1.22 -4.95 117.38 120.07 1n8p n GLN 171 Ca 0.00 -2.80 -0.37 0.00 -1.83 0.00 0.00 57.00 52.00 1n8p n GLN 171 Cb 0.00 -2.10 -0.07 0.00 -0.86 0.00 0.00 30.24 27.21 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 -1.01 -1.67 -4.59 2.61 8.00 -1.26 -4.85 116.55 113.77 1n8p n ASP 172 Ca 0.56 -1.04 -0.42 0.00 0.71 0.00 0.00 54.79 54.60 1n8p n ASP 172 Cb 1.55 -1.47 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 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 -3.03 3.66 0.15 2.53 1.01 -1.26 -4.93 120.40 118.53 1n8p s VAL 173 Ca 0.73 0.63 -0.22 0.00 0.00 0.00 0.00 61.98 63.13 1n8p s VAL 173 Cb -0.42 -4.01 -0.08 0.00 0.00 0.00 0.00 36.38 31.87 1n8p s VAL 173 CO 0.89 -0.72 0.69 0.27 0.00 0.00 0.00 175.10 176.24 1n8p s ILE 174 N 6.51 4.55 -0.24 2.22 -4.36 -0.67 -4.94 121.20 124.26 1n8p s ILE 174 Ca 0.67 1.42 -0.08 0.00 -0.26 0.00 0.00 60.65 62.40 1n8p s ILE 174 Cb -0.16 -3.98 -0.03 0.00 1.25 0.00 0.00 42.46 39.53 1n8p s ILE 174 CO 0.30 0.44 0.09 -0.22 0.24 0.00 0.00 174.94 175.80 1n8p s LEU 175 N -1.38 3.61 -0.11 0.37 2.96 -1.26 -2.01 118.68 120.87 1n8p s LEU 175 Ca 0.36 -0.12 -0.01 0.00 -0.22 0.00 0.00 54.13 54.13 1n8p s LEU 175 Cb -0.20 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.49 1n8p s LEU 175 CO 0.22 -0.00 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.52 1n8p s VAL 176 N 1.44 3.86 -0.14 1.68 1.01 0.21 -0.02 120.40 128.43 1n8p s VAL 176 Ca 0.06 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.65 1n8p s VAL 176 Cb -0.15 -2.63 0.02 0.00 0.00 0.00 0.00 36.38 33.62 1n8p s VAL 176 CO 0.05 0.56 -0.18 -0.69 0.00 0.00 0.00 175.10 174.83 1n8p s VAL 177 N -0.33 1.82 -0.52 2.92 1.01 0.02 -0.27 120.40 125.05 1n8p s VAL 177 Ca 0.05 -0.82 -0.28 0.00 0.00 0.00 0.00 61.98 60.93 1n8p s VAL 177 Cb -0.12 -1.65 0.03 0.00 0.00 0.00 0.00 36.38 34.64 1n8p s VAL 177 CO 0.02 0.50 1.15 -0.62 0.00 0.00 0.00 175.10 176.15 1n8p s ASP 178 N 1.12 6.54 -0.14 3.32 -1.08 0.10 -1.67 116.67 124.87 1n8p s ASP 178 Ca -0.01 0.29 0.16 0.00 -0.52 0.00 0.00 52.55 52.46 1n8p s ASP 178 Cb -0.14 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.40 1n8p s ASP 178 CO -0.06 -1.34 1.54 -3.20 0.52 0.00 0.00 175.17 172.63 1n8p n ASN 179 N 8.06 4.43 0.07 -0.34 5.15 -0.56 -3.56 115.26 128.51 1n8p n ASN 179 Ca 0.10 -2.63 -0.15 0.00 -0.60 0.00 0.00 54.58 51.30 1n8p n ASN 179 Cb 0.49 -0.54 -0.09 0.00 -0.53 0.00 0.00 39.78 39.11 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 3.13 0.00 -0.15 -0.44 2.02 -1.90 -0.87 112.91 114.70 1n8p h THR 180 Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.22 1n8p h THR 180 Cb 1.44 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1n8p h THR 180 CO 0.24 0.00 0.14 -0.26 0.37 0.00 0.00 175.52 176.01 1n8p h PHE 181 N -0.65 0.00 0.00 3.16 -1.00 -1.92 -3.05 116.94 113.47 1n8p h PHE 181 Ca 0.00 0.00 -0.36 0.00 2.81 0.00 0.00 57.97 60.42 1n8p h PHE 181 Cb 0.68 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 40.17 1n8p h PHE 181 CO -0.48 0.00 -2.37 1.28 -1.61 0.00 0.00 178.31 175.13 1n8p n LEU 182 N -4.05 1.04 -0.38 1.54 4.77 -1.20 -4.56 117.00 114.16 1n8p n LEU 182 Ca 0.01 -0.05 0.01 0.00 -0.03 0.00 0.00 56.01 55.96 1n8p n LEU 182 Cb 0.26 0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.35 1n8p n LEU 182 CO 0.30 0.64 -0.14 -1.54 -1.33 0.00 0.00 177.39 175.32 1n8p n SER 183 N -2.90 -2.06 -0.31 -1.43 3.41 -0.34 -3.67 113.62 106.32 1n8p n SER 183 Ca -0.36 0.44 0.24 0.00 -0.26 0.00 0.00 58.87 58.92 1n8p n SER 183 Cb 1.08 -0.77 0.44 0.00 -0.26 0.00 0.00 64.21 64.71 1n8p n SER 183 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1n8p n PRO 184 N -2.05 -0.06 0.12 4.33 -0.02 -1.26 -1.93 135.00 134.13 1n8p n PRO 184 Ca -0.01 1.32 -0.14 0.00 -2.02 0.00 0.00 63.50 62.66 1n8p n PRO 184 Cb 0.14 -2.27 -0.07 0.00 -0.02 0.00 0.00 33.50 31.28 1n8p n PRO 184 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1n8p h TYR 185 N 0.00 -1.07 -0.00 6.00 3.20 -1.87 -3.09 116.97 120.15 1n8p h TYR 185 Ca 0.70 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 62.48 1n8p h TYR 185 Cb 1.74 0.45 -0.02 0.00 1.54 0.00 0.00 36.73 40.44 1n8p h TYR 185 CO -0.18 -0.49 -0.58 0.82 -1.64 0.00 0.00 178.16 176.08 1n8p h ILE 186 N -0.63 1.42 -2.88 1.81 2.04 -1.46 -3.43 117.51 114.38 1n8p h ILE 186 Ca 0.02 -2.00 -0.06 0.00 1.00 0.00 0.00 64.86 63.83 1n8p h ILE 186 Cb 0.65 2.07 -0.15 0.00 -0.74 0.00 0.00 36.82 38.65 1n8p h ILE 186 CO -0.21 0.57 0.03 -0.55 0.00 0.00 0.00 178.15 177.98 1n8p s SER 187 N -6.86 -0.41 -0.50 1.72 0.15 -1.12 0.15 113.70 106.82 1n8p s SER 187 Ca -0.02 0.09 0.05 0.00 0.70 0.00 0.00 55.95 56.77 1n8p s SER 187 Cb 0.13 0.49 0.18 0.00 -1.71 0.00 0.00 66.02 65.11 1n8p s SER 187 CO 0.76 -0.75 0.42 0.59 1.20 0.00 0.00 173.24 175.46 1n8p n ASN 188 N 0.27 0.75 -0.48 5.45 5.03 -1.26 -4.28 115.26 120.74 1n8p n ASN 188 Ca -0.18 -2.68 0.43 0.00 0.87 0.00 0.00 54.58 53.01 1n8p n ASN 188 Cb 0.61 -0.62 0.76 0.00 -1.02 0.00 0.00 39.78 39.50 1n8p n ASN 188 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.26 174.78 1n8p h PRO 189 N 5.36 0.00 -0.67 3.52 0.11 -1.92 -0.26 132.00 138.15 1n8p h PRO 189 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 1n8p h PRO 189 Cb 0.85 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.93 1n8p h PRO 189 CO 0.50 0.00 0.42 -0.07 -0.21 0.00 0.00 178.00 178.64 1n8p h LEU 190 N 0.00 0.79 -0.69 2.35 3.38 -1.87 -0.79 115.31 118.48 1n8p h LEU 190 Ca 0.73 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.65 1n8p h LEU 190 Cb 3.03 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 43.58 1n8p h LEU 190 CO -0.01 0.60 0.00 0.59 0.09 0.00 0.00 178.44 179.71 1n8p n ASN 191 N -4.59 0.09 -1.64 -0.43 3.02 -0.11 -1.47 115.26 110.13 1n8p n ASN 191 Ca 0.05 -0.26 0.02 0.00 -0.03 0.00 0.00 54.58 54.37 1n8p n ASN 191 Cb 0.04 -0.05 0.02 0.00 -0.61 0.00 0.00 39.78 39.18 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 0.15 0.13 -2.73 3.10 3.01 -0.30 -5.03 117.46 115.79 1n8p n PHE 192 Ca 0.00 -0.73 -0.05 0.00 1.01 0.00 0.00 57.45 57.68 1n8p n PHE 192 Cb 0.02 -0.07 0.01 0.00 -0.01 0.00 0.00 39.48 39.43 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 0.27 -1.20 2.99 1.37 0.00 -0.54 -2.99 105.19 105.09 1n8p n GLY 193 Ca 0.02 0.88 -0.12 0.00 0.00 0.00 0.00 46.02 46.80 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 -2.58 -0.27 -0.12 4.61 0.00 -1.25 -4.41 121.76 117.74 1n8p s ALA 194 Ca 0.15 0.30 0.17 0.00 0.00 0.00 0.00 51.96 52.58 1n8p s ALA 194 Cb -0.04 -0.17 -0.18 0.00 0.00 0.00 0.00 23.12 22.73 1n8p s ALA 194 CO 0.66 -0.06 0.68 -0.25 0.00 0.00 0.00 175.76 176.79 1n8p n ASP 195 N 2.97 0.68 -3.80 0.00 8.00 0.97 -4.66 116.55 120.70 1n8p n ASP 195 Ca -0.13 0.30 -0.13 0.00 0.71 0.00 0.00 54.79 55.55 1n8p n ASP 195 Cb 0.59 0.40 -0.12 0.00 -0.02 0.00 0.00 41.12 41.97 1n8p n ASP 195 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1n8p s ILE 196 N -2.88 0.01 -0.19 0.53 1.01 -0.92 -4.54 121.20 114.21 1n8p s ILE 196 Ca -0.04 -0.05 -0.03 0.00 0.00 0.00 0.00 60.65 60.52 1n8p s ILE 196 Cb 0.09 -0.32 -0.01 0.00 0.01 0.00 0.00 42.46 42.22 1n8p s ILE 196 CO 0.82 -0.03 -0.06 -0.69 0.00 0.00 0.00 174.94 174.98 1n8p s VAL 197 N -0.01 3.34 0.07 2.92 1.01 -0.76 -0.80 120.40 126.17 1n8p s VAL 197 Ca -0.01 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.49 1n8p s VAL 197 Cb -0.02 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1n8p s VAL 197 CO 0.00 0.46 -0.01 -0.69 0.00 0.00 0.00 175.10 174.86 1n8p s VAL 198 N 1.10 4.00 -0.01 2.92 1.01 -0.67 -1.70 120.40 127.04 1n8p s VAL 198 Ca 0.01 -0.90 -0.09 0.00 0.00 0.00 0.00 61.98 61.00 1n8p s VAL 198 Cb -0.15 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.38 1n8p s VAL 198 CO -0.01 0.19 0.18 -1.00 0.00 0.00 0.00 175.10 174.47 1n8p s HIS 199 N -1.24 -0.04 -0.46 5.22 3.76 -0.32 -1.50 115.29 120.71 1n8p s HIS 199 Ca 0.24 0.05 -0.12 0.00 -0.15 0.00 0.00 55.06 55.08 1n8p s HIS 199 Cb -0.12 0.00 0.09 0.00 1.11 0.00 0.00 32.58 33.66 1n8p s HIS 199 CO 0.16 -0.28 0.34 0.45 -0.85 0.00 0.00 174.74 174.56 1n8p s SER 200 N -1.15 5.88 0.00 1.40 0.15 -1.26 -2.11 113.70 116.61 1n8p s SER 200 Ca -0.12 -1.52 0.20 0.00 0.70 0.00 0.00 55.95 55.21 1n8p s SER 200 Cb -0.06 -2.08 1.17 0.00 -1.71 0.00 0.00 66.02 63.33 1n8p s SER 200 CO 0.02 -0.63 1.59 0.00 1.20 0.00 0.00 173.24 175.42 1n8p n ALA 201 N 5.05 2.21 0.05 5.45 0.00 0.13 -2.54 120.51 130.87 1n8p n ALA 201 Ca -0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 53.44 53.18 1n8p n ALA 201 Cb 0.43 -1.33 0.22 0.00 0.00 0.00 0.00 19.45 18.77 1n8p n ALA 201 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1n8p h THR 202 N 0.00 1.27 0.00 0.00 2.02 -1.70 -2.33 112.91 112.18 1n8p h THR 202 Ca 0.00 -1.32 0.00 0.00 0.77 0.00 0.00 66.41 65.86 1n8p h THR 202 Cb 0.03 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 1n8p h THR 202 CO 0.00 0.41 0.00 0.29 0.37 0.00 0.00 175.52 176.59 1n8p n LYS 203 N -4.10 0.00 0.00 6.66 4.01 -1.05 -4.29 118.16 119.39 1n8p n LYS 203 Ca -0.01 0.00 -0.05 0.00 -0.51 0.00 0.00 58.31 57.74 1n8p n LYS 203 Cb 0.42 0.00 0.15 0.00 -0.51 0.00 0.00 35.03 35.09 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 0.61 0.25 2.13 -1.99 -1.78 -0.91 116.97 115.28 1n8p h TYR 204 Ca 0.00 -0.16 -0.01 0.00 2.00 0.00 0.00 58.73 60.56 1n8p h TYR 204 Cb 0.00 -0.14 0.00 0.00 2.00 0.00 0.00 36.73 38.59 1n8p h TYR 204 CO 0.00 0.80 -0.12 0.82 -0.00 0.00 0.00 178.16 179.66 1n8p h ILE 205 N 0.45 0.00 -0.09 -2.88 2.04 -1.85 -3.23 117.51 111.95 1n8p h ILE 205 Ca 0.05 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 1n8p h ILE 205 Cb 0.80 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1n8p h ILE 205 CO 0.06 0.00 0.02 -1.13 0.00 0.00 0.00 178.15 177.10 1n8p h ASN 206 N -0.37 0.14 -0.20 1.72 -0.73 -1.58 -2.65 115.58 111.91 1n8p h ASN 206 Ca -0.03 -0.24 -0.09 0.00 1.87 0.00 0.00 56.30 57.81 1n8p h ASN 206 Cb 0.26 -0.04 -0.03 0.00 0.27 0.00 0.00 38.32 38.78 1n8p h ASN 206 CO 0.06 0.35 -0.08 0.61 -0.37 0.00 0.00 177.43 177.99 1n8p n GLY 207 N -0.46 0.46 0.31 1.57 0.00 -0.35 -4.26 105.19 102.45 1n8p n GLY 207 Ca -0.06 -0.03 0.04 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.19 0.25 -1.67 1.61 8.25 -1.26 -2.61 115.22 117.60 1n8p n HIS 208 Ca -0.04 -0.62 -0.19 0.00 -0.26 0.00 0.00 57.72 56.61 1n8p n HIS 208 Cb 0.48 -0.09 -0.07 0.00 1.12 0.00 0.00 29.99 31.43 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 -0.33 -5.31 -0.19 0.41 7.64 -1.26 -4.87 113.62 109.71 1n8p n SER 209 Ca 0.08 0.40 0.09 0.00 1.01 0.00 0.00 58.87 60.45 1n8p n SER 209 Cb 0.44 -4.45 0.16 0.00 -1.01 0.00 0.00 64.21 59.34 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 -1.14 2.20 -3.69 6.43 3.85 -1.26 -5.01 116.55 117.93 1n8p n ASP 210 Ca -0.19 -3.27 -0.12 0.00 -0.71 0.00 0.00 54.79 50.49 1n8p n ASP 210 Cb 0.63 -0.45 -0.09 0.00 -1.35 0.00 0.00 41.12 39.86 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 -2.95 -0.00 -0.33 2.12 1.01 -1.26 -5.05 120.40 113.93 1n8p s VAL 211 Ca 0.33 0.01 -0.03 0.00 0.00 0.00 0.00 61.98 62.30 1n8p s VAL 211 Cb 0.30 -0.74 0.06 0.00 0.00 0.00 0.00 36.38 36.00 1n8p s VAL 211 CO 0.01 0.01 0.07 -0.69 0.00 0.00 0.00 175.10 174.49 1n8p s VAL 212 N 0.56 3.16 -0.08 2.92 1.01 -1.26 -4.19 120.40 122.52 1n8p s VAL 212 Ca -0.02 -1.53 -0.15 0.00 0.00 0.00 0.00 61.98 60.27 1n8p s VAL 212 Cb -0.04 -2.91 0.03 0.00 0.00 0.00 0.00 36.38 33.46 1n8p s VAL 212 CO -0.03 -0.27 0.37 -0.22 0.00 0.00 0.00 175.10 174.95 1n8p s LEU 213 N 1.24 0.60 0.11 3.92 0.20 -1.19 -4.50 118.68 119.06 1n8p s LEU 213 Ca -0.01 0.45 0.09 0.00 0.69 0.00 0.00 54.13 55.35 1n8p s LEU 213 Cb -0.20 1.38 -0.04 0.00 -0.43 0.00 0.00 46.19 46.90 1n8p s LEU 213 CO -0.01 -0.31 -0.21 -0.83 -0.29 0.00 0.00 176.35 174.69 1n8p s GLY 214 N -0.61 1.29 0.00 7.98 0.00 -0.55 0.22 107.32 115.65 1n8p s GLY 214 Ca -0.07 -1.30 -0.08 0.00 0.00 0.00 0.00 44.72 43.27 1n8p s GLY 214 CO 0.03 -1.30 0.16 -1.34 0.00 0.00 0.00 173.10 170.65 1n8p s VAL 215 N -1.25 0.08 0.27 1.40 -7.23 -0.90 0.33 120.40 113.10 1n8p s VAL 215 Ca 0.08 -0.66 0.06 0.00 -1.81 0.00 0.00 61.98 59.66 1n8p s VAL 215 Cb -0.10 -0.46 -0.06 0.00 0.56 0.00 0.00 36.38 36.33 1n8p s VAL 215 CO 0.05 -0.36 -0.06 -1.48 -0.31 0.00 0.00 175.10 172.94 1n8p s LEU 216 N -1.37 2.46 -0.03 1.32 2.34 -0.65 -1.18 118.68 121.58 1n8p s LEU 216 Ca -0.14 -1.18 -0.07 0.00 0.06 0.00 0.00 54.13 52.79 1n8p s LEU 216 Cb -0.07 -0.61 0.01 0.00 -0.56 0.00 0.00 46.19 44.95 1n8p s LEU 216 CO 0.02 -0.34 0.17 0.00 -1.06 0.00 0.00 176.35 175.14 1n8p s ALA 217 N -3.04 -0.42 0.04 1.48 0.00 -0.69 -1.41 121.76 117.72 1n8p s ALA 217 Ca 0.29 0.19 -0.24 0.00 0.00 0.00 0.00 51.96 52.19 1n8p s ALA 217 Cb 0.04 -0.08 0.06 0.00 0.00 0.00 0.00 23.12 23.14 1n8p s ALA 217 CO 0.11 -0.16 0.56 0.95 0.00 0.00 0.00 175.76 177.23 1n8p s THR 218 N -0.73 0.02 -0.44 0.00 -4.23 -0.68 -1.83 115.64 107.75 1n8p s THR 218 Ca -0.08 -0.16 0.22 0.00 -1.18 0.00 0.00 61.69 60.49 1n8p s THR 218 Cb -0.05 -0.97 -0.21 0.00 1.34 0.00 0.00 72.50 72.61 1n8p s THR 218 CO 0.01 -0.09 0.81 0.59 -0.54 0.00 0.00 174.62 175.40 1n8p n ASN 219 N 0.45 0.48 -4.55 3.99 5.03 -1.26 -0.28 115.26 119.12 1n8p n ASN 219 Ca -0.18 -0.23 -0.39 0.00 0.87 0.00 0.00 54.58 54.64 1n8p n ASN 219 Cb 0.60 1.24 -0.03 0.00 -1.02 0.00 0.00 39.78 40.57 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 -4.10 5.84 0.40 6.41 3.04 -1.26 -4.85 114.94 120.42 1n8p s ASN 220 Ca -0.00 -0.28 0.09 0.00 0.04 0.00 0.00 52.86 52.71 1n8p s ASN 220 Cb 0.14 -2.55 0.89 0.00 -1.54 0.00 0.00 41.25 38.19 1n8p s ASN 220 CO 0.85 -2.04 1.99 0.50 -3.04 0.00 0.00 177.10 175.37 1n8p h LYS 221 N 11.72 0.55 -0.14 0.43 3.64 -1.99 -1.08 116.57 129.70 1n8p h LYS 221 Ca -0.22 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 58.93 1n8p h LYS 221 Cb 1.08 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1n8p h LYS 221 CO 1.27 0.36 -0.72 -1.35 -2.27 0.00 0.00 179.45 176.74 1n8p h PRO 222 N 0.57 0.63 -0.05 1.90 0.11 -2.00 -2.52 132.00 130.64 1n8p h PRO 222 Ca 0.26 -0.49 -0.11 0.00 0.11 0.00 0.00 66.00 65.76 1n8p h PRO 222 Cb 0.29 0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1n8p h PRO 222 CO -0.08 1.11 -0.49 1.25 -0.21 0.00 0.00 178.00 179.59 1n8p h LEU 223 N 0.44 0.13 -0.36 2.35 5.85 -1.92 -2.70 115.31 119.10 1n8p h LEU 223 Ca -0.03 -0.06 -0.18 0.00 0.84 0.00 0.00 57.88 58.45 1n8p h LEU 223 Cb 1.32 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 1n8p h LEU 223 CO 0.14 0.60 -0.55 0.22 -0.34 0.00 0.00 178.44 178.50 1n8p h TYR 224 N 0.10 0.98 -0.00 1.25 3.20 -1.15 -2.66 116.97 118.69 1n8p h TYR 224 Ca 0.00 -0.35 -0.16 0.00 3.14 0.00 0.00 58.73 61.36 1n8p h TYR 224 Cb 0.90 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 1n8p h TYR 224 CO 0.01 1.15 -0.74 0.93 -1.64 0.00 0.00 178.16 177.87 1n8p h GLU 225 N 0.59 0.03 0.42 1.82 5.08 -1.31 -1.14 114.58 120.07 1n8p h GLU 225 Ca 0.01 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1n8p h GLU 225 Cb 1.14 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1n8p h GLU 225 CO 0.12 0.75 -0.20 0.00 -1.00 0.00 0.00 179.01 178.68 1n8p h ARG 226 N 0.02 -0.54 -1.00 2.33 3.08 -1.54 -2.49 114.38 114.23 1n8p h ARG 226 Ca -0.01 0.04 0.21 0.00 0.07 0.00 0.00 59.98 60.28 1n8p h ARG 226 Cb 1.31 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 31.38 1n8p h ARG 226 CO 0.10 -0.26 0.62 -0.07 -1.07 0.00 0.00 179.97 179.28 1n8p h LEU 227 N -1.05 0.70 -0.96 3.04 4.07 -1.50 0.75 115.31 120.36 1n8p h LEU 227 Ca -0.06 0.09 -0.10 0.00 0.08 0.00 0.00 57.88 57.89 1n8p h LEU 227 Cb 0.53 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 1n8p h LEU 227 CO 0.09 0.23 -0.48 -0.61 -1.08 0.00 0.00 178.44 176.59 1n8p h GLN 228 N 0.67 0.00 0.18 1.13 4.15 -1.25 -2.33 115.11 117.66 1n8p h GLN 228 Ca 0.57 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.99 1n8p h GLN 228 Cb 1.03 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.72 1n8p h GLN 228 CO -0.36 0.48 -0.09 0.35 -1.93 0.00 0.00 178.83 177.29 1n8p h PHE 229 N 0.00 -0.23 -0.97 3.99 3.57 0.97 -0.46 116.94 123.81 1n8p h PHE 229 Ca -0.00 -0.01 0.32 0.00 3.53 0.00 0.00 57.97 61.81 1n8p h PHE 229 Cb 0.92 0.07 -0.18 0.00 2.79 0.00 0.00 35.95 39.56 1n8p h PHE 229 CO 0.00 -0.14 0.20 1.28 -2.23 0.00 0.00 178.31 177.42 1n8p n LEU 230 N -2.71 0.05 0.17 0.59 4.77 -0.64 -0.19 117.00 119.04 1n8p n LEU 230 Ca -0.03 1.63 -0.16 0.00 -0.03 0.00 0.00 56.01 57.42 1n8p n LEU 230 Cb 0.10 -0.66 -0.08 0.00 -2.33 0.00 0.00 43.42 40.44 1n8p n LEU 230 CO 0.07 -1.71 0.57 -0.61 -1.33 0.00 0.00 177.39 174.38 1n8p h GLN 231 N 0.00 -0.73 -0.43 3.23 4.15 -1.02 0.85 115.11 121.16 1n8p h GLN 231 Ca 0.67 0.05 -0.01 0.00 0.77 0.00 0.00 58.65 60.13 1n8p h GLN 231 Cb 1.55 0.17 -0.02 0.00 0.21 0.00 0.00 27.48 29.39 1n8p h GLN 231 CO -0.85 -0.49 0.24 -0.97 -1.93 0.00 0.00 178.83 174.83 1n8p h ASN 232 N -0.76 0.51 0.66 -0.69 -1.24 0.11 -0.19 115.58 113.98 1n8p h ASN 232 Ca -0.01 -0.03 -0.27 0.00 0.71 0.00 0.00 56.30 56.71 1n8p h ASN 232 Cb 0.73 -0.13 -0.03 0.00 0.73 0.00 0.00 38.32 39.63 1n8p h ASN 232 CO -0.19 0.41 -1.40 0.00 -1.29 0.00 0.00 177.43 174.96 1n8p h ALA 233 N 1.68 0.45 0.00 1.57 0.00 -0.42 -3.34 119.26 119.20 1n8p h ALA 233 Ca 0.15 -1.15 -0.16 0.00 0.00 0.00 0.00 54.91 53.75 1n8p h ALA 233 Cb 0.00 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1n8p h ALA 233 CO -0.03 1.31 -1.33 -0.84 0.00 0.00 0.00 179.25 178.37 1n8p h ILE 234 N 0.02 0.55 -0.02 0.00 3.07 0.76 -3.49 117.51 118.40 1n8p h ILE 234 Ca -0.17 -2.04 -0.01 0.00 1.55 0.00 0.00 64.86 64.19 1n8p h ILE 234 Cb 1.93 2.08 -0.00 0.00 -0.27 0.00 0.00 36.82 40.55 1n8p h ILE 234 CO 0.13 0.31 -0.01 0.61 -1.05 0.00 0.00 178.15 178.14 1n8p n GLY 235 N 1.38 0.42 2.47 0.16 0.00 -0.09 -4.91 105.19 104.62 1n8p n GLY 235 Ca -0.09 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 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 1.01 5.22 -2.78 4.61 0.00 -1.26 -4.86 120.51 122.44 1n8p n ALA 236 Ca -0.01 -2.13 -0.28 0.00 0.00 0.00 0.00 53.44 51.03 1n8p n ALA 236 Cb 0.13 -2.93 -0.03 0.00 0.00 0.00 0.00 19.45 16.61 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 2.85 5.23 0.85 0.00 -4.36 -1.26 -1.53 121.20 122.97 1n8p s ILE 237 Ca 0.46 -0.34 -0.12 0.00 -0.26 0.00 0.00 60.65 60.39 1n8p s ILE 237 Cb 0.14 -3.71 0.10 0.00 1.25 0.00 0.00 42.46 40.24 1n8p s ILE 237 CO -0.03 -0.11 1.13 -2.16 0.24 0.00 0.00 174.94 174.01 1n8p s PRO 238 N -3.15 1.66 0.32 0.37 0.04 -1.26 -4.16 135.00 128.82 1n8p s PRO 238 Ca 0.38 0.36 -0.01 0.00 0.04 0.00 0.00 61.00 61.77 1n8p s PRO 238 Cb -0.11 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1n8p s PRO 238 CO 0.28 -1.85 0.54 -1.54 0.04 0.00 0.00 177.00 174.47 1n8p s SER 239 N -4.12 6.34 0.31 6.66 1.04 -1.26 -4.94 113.70 117.73 1n8p s SER 239 Ca 0.62 0.52 0.00 0.00 0.48 0.00 0.00 55.95 57.57 1n8p s SER 239 Cb -0.14 -2.06 0.52 0.00 0.10 0.00 0.00 66.02 64.44 1n8p s SER 239 CO 0.53 -0.25 1.94 -0.65 0.98 0.00 0.00 173.24 175.79 1n8p h PRO 240 N 1.10 1.00 -0.22 4.02 0.11 -1.97 -1.56 132.00 134.48 1n8p h PRO 240 Ca -0.49 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.51 1n8p h PRO 240 Cb 1.21 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1n8p h PRO 240 CO 0.63 0.66 -0.06 0.35 -0.21 0.00 0.00 178.00 179.38 1n8p h PHE 241 N 1.03 0.48 -0.18 0.65 3.57 -1.93 -1.36 116.94 119.20 1n8p h PHE 241 Ca 0.35 -0.10 -0.08 0.00 3.53 0.00 0.00 57.97 61.66 1n8p h PHE 241 Cb 0.08 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1n8p h PHE 241 CO -0.00 0.67 -0.24 -0.44 -2.23 0.00 0.00 178.31 176.06 1n8p h ASP 242 N 0.16 0.32 -0.22 0.41 3.45 -1.88 -0.36 116.42 118.29 1n8p h ASP 242 Ca 0.06 -0.10 -0.06 0.00 0.43 0.00 0.00 57.03 57.36 1n8p h ASP 242 Cb 0.51 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 1n8p h ASP 242 CO 0.02 0.57 -0.08 0.00 -1.57 0.00 0.00 179.24 178.18 1n8p h ALA 243 N 1.46 0.31 -0.54 3.45 0.00 -1.25 -1.35 119.26 121.34 1n8p h ALA 243 Ca 0.05 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1n8p h ALA 243 Cb 0.59 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1n8p h ALA 243 CO 0.04 0.13 0.26 2.35 0.00 0.00 0.00 179.25 182.03 1n8p h TRP 244 N 0.17 0.78 -0.49 0.00 7.01 -0.85 0.27 115.95 122.85 1n8p h TRP 244 Ca 0.05 -0.04 -0.05 0.00 2.11 0.00 0.00 58.89 60.96 1n8p h TRP 244 Cb 0.56 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.36 1n8p h TRP 244 CO 0.06 0.61 0.09 1.25 -2.79 0.00 0.00 178.44 177.66 1n8p h LEU 245 N 0.73 0.76 0.12 0.65 5.85 -1.09 -1.98 115.31 120.35 1n8p h LEU 245 Ca 0.19 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1n8p h LEU 245 Cb 0.12 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.95 1n8p h LEU 245 CO -0.02 0.82 -0.06 0.74 -0.34 0.00 0.00 178.44 179.58 1n8p h THR 246 N 0.67 1.01 -1.01 1.05 2.02 -1.00 -2.13 112.91 113.53 1n8p h THR 246 Ca 0.15 -0.54 0.23 0.00 0.77 0.00 0.00 66.41 67.03 1n8p h THR 246 Cb 0.37 1.35 -0.11 0.00 -1.74 0.00 0.00 68.15 68.03 1n8p h THR 246 CO 0.01 0.13 0.62 -0.74 0.37 0.00 0.00 175.52 175.91 1n8p h HIS 247 N -0.41 0.91 0.00 3.16 -0.00 -0.40 0.46 115.15 118.87 1n8p h HIS 247 Ca -0.02 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.34 1n8p h HIS 247 Cb 0.33 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.47 1n8p h HIS 247 CO 0.01 0.12 -0.23 -0.09 -0.00 0.00 0.00 177.93 177.74 1n8p h ARG 248 N 0.58 0.00 0.06 5.26 2.43 -1.07 -2.91 114.38 118.73 1n8p h ARG 248 Ca 0.60 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 59.49 1n8p h ARG 248 Cb 1.20 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 1n8p h ARG 248 CO -0.38 0.23 -1.49 0.78 -1.51 0.00 0.00 179.97 177.60 1n8p h GLY 249 N 1.95 0.15 1.92 2.80 0.00 0.47 -3.31 103.07 107.05 1n8p h GLY 249 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1n8p h GLY 249 CO 0.03 0.35 0.04 -2.00 0.00 0.00 0.00 176.54 174.96 1n8p h LEU 250 N 0.04 0.00 -0.68 3.11 6.46 -0.52 -2.54 115.31 121.17 1n8p h LEU 250 Ca -0.21 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.55 1n8p h LEU 250 Cb 1.97 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.90 1n8p h LEU 250 CO 0.13 0.00 0.00 0.29 -0.62 0.00 0.00 178.44 178.24 1n8p n LYS 251 N -3.06 0.13 -0.01 1.25 4.76 -1.22 -2.03 118.16 117.99 1n8p n LYS 251 Ca -0.03 0.45 0.01 0.00 -2.87 0.00 0.00 58.31 55.86 1n8p n LYS 251 Cb 0.11 -1.80 0.01 0.00 -1.84 0.00 0.00 35.03 31.51 1n8p n LYS 251 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1n8p n THR 252 N -2.05 0.42 -0.30 -0.18 -2.24 -0.96 -4.74 114.28 104.23 1n8p n THR 252 Ca 0.01 -0.71 0.13 0.00 -2.27 0.00 0.00 64.05 61.21 1n8p n THR 252 Cb 0.16 0.81 0.29 0.00 -2.10 0.00 0.00 70.33 69.48 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 0.22 0.11 -0.55 3.22 5.85 -1.45 0.31 115.31 123.02 1n8p h LEU 253 Ca 0.00 0.18 -0.15 0.00 0.84 0.00 0.00 57.88 58.75 1n8p h LEU 253 Cb 0.24 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1n8p h LEU 253 CO 0.00 -0.10 -0.41 1.12 -0.34 0.00 0.00 178.44 178.71 1n8p h HIS 254 N 0.27 0.85 -0.14 1.25 2.07 -1.85 -0.73 115.15 116.87 1n8p h HIS 254 Ca 0.54 -0.26 -0.10 0.00 -2.85 0.00 0.00 60.37 57.71 1n8p h HIS 254 Cb 1.07 -0.18 0.00 0.00 2.57 0.00 0.00 27.41 30.87 1n8p h HIS 254 CO -0.22 1.00 -0.31 -0.07 -3.07 0.00 0.00 177.93 175.26 1n8p h LEU 255 N 0.58 0.52 0.69 6.12 3.38 -1.08 -2.62 115.31 122.90 1n8p h LEU 255 Ca 0.05 -0.57 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 1n8p h LEU 255 Cb 0.95 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.56 1n8p h LEU 255 CO 0.09 0.99 -0.33 0.03 0.09 0.00 0.00 178.44 179.31 1n8p h ARG 256 N 0.07 -0.89 -0.20 1.13 3.08 -0.53 -2.71 114.38 114.33 1n8p h ARG 256 Ca 0.00 0.06 0.06 0.00 0.07 0.00 0.00 59.98 60.17 1n8p h ARG 256 Cb 0.92 0.20 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 1n8p h ARG 256 CO 0.07 -0.58 0.14 0.28 -1.07 0.00 0.00 179.97 178.82 1n8p h VAL 257 N -1.00 0.90 -0.39 2.04 2.07 -1.25 -0.48 116.25 118.14 1n8p h VAL 257 Ca -0.09 -0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.28 1n8p h VAL 257 Cb 0.73 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1n8p h VAL 257 CO 0.16 0.00 -0.34 -0.09 0.02 0.00 0.00 177.57 177.32 1n8p h ARG 258 N 0.01 0.90 0.03 1.57 9.65 -1.37 -2.62 114.38 122.54 1n8p h ARG 258 Ca 0.09 -0.44 -0.09 0.00 -1.10 0.00 0.00 59.98 58.44 1n8p h ARG 258 Cb 0.37 -0.00 0.01 0.00 -1.39 0.00 0.00 29.97 28.96 1n8p h ARG 258 CO -0.00 1.09 -0.36 0.37 2.80 0.00 0.00 179.97 183.87 1n8p h GLN 259 N 0.75 0.20 -0.41 0.20 5.75 -1.02 -2.86 115.11 117.72 1n8p h GLN 259 Ca 0.07 -0.25 0.06 0.00 -0.15 0.00 0.00 58.65 58.38 1n8p h GLN 259 Cb 0.91 0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.52 1n8p h GLN 259 CO 0.08 1.02 0.28 0.00 -2.65 0.00 0.00 178.83 177.56 1n8p h ALA 260 N 0.19 1.97 0.07 3.38 0.00 -1.19 -1.44 119.26 122.25 1n8p h ALA 260 Ca -0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1n8p h ALA 260 Cb 1.17 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1n8p h ALA 260 CO 0.07 -0.05 -0.03 0.00 0.00 0.00 0.00 179.25 179.24 1n8p h ALA 261 N 1.78 -0.09 -0.45 0.00 0.00 -1.51 -1.79 119.26 117.20 1n8p h ALA 261 Ca 0.18 -0.29 0.08 0.00 0.00 0.00 0.00 54.91 54.88 1n8p h ALA 261 Cb 0.30 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 1n8p h ALA 261 CO -0.04 -0.20 0.02 -0.07 0.00 0.00 0.00 179.25 178.97 1n8p h LEU 262 N -0.80 -0.13 -0.16 0.00 3.38 -1.25 -0.07 115.31 116.27 1n8p h LEU 262 Ca -0.01 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.09 1n8p h LEU 262 Cb 0.62 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 1n8p h LEU 262 CO 0.02 -0.03 -0.05 0.28 0.09 0.00 0.00 178.44 178.74 1n8p h SER 263 N 0.14 -0.17 -0.32 -0.43 0.02 -1.31 -0.18 113.55 111.28 1n8p h SER 263 Ca 0.22 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.20 1n8p h SER 263 Cb 0.32 0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1n8p h SER 263 CO -0.35 -0.06 0.14 0.00 -1.14 0.00 0.00 176.83 175.42 1n8p h ALA 264 N 1.15 1.54 0.03 3.77 0.00 -0.73 -0.11 119.26 124.91 1n8p h ALA 264 Ca 0.08 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1n8p h ALA 264 Cb 0.14 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1n8p h ALA 264 CO -0.18 0.35 -0.01 -0.97 0.00 0.00 0.00 179.25 178.44 1n8p h ASN 265 N 0.53 -0.03 0.31 0.00 -0.73 -0.58 0.58 115.58 115.65 1n8p h ASN 265 Ca 0.13 -0.38 0.00 0.00 1.87 0.00 0.00 56.30 57.92 1n8p h ASN 265 Cb 0.12 0.01 0.00 0.00 0.27 0.00 0.00 38.32 38.72 1n8p h ASN 265 CO -0.01 0.37 0.00 0.11 -0.37 0.00 0.00 177.43 177.53 1n8p h LYS 266 N -0.45 0.00 0.04 6.67 1.57 -0.52 -0.94 116.57 122.95 1n8p h LYS 266 Ca -0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 1n8p h LYS 266 Cb 0.42 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.69 1n8p h LYS 266 CO 0.01 0.00 -1.74 0.82 -0.57 0.00 0.00 179.45 177.97 1n8p h ILE 267 N 0.00 0.85 -0.25 1.86 2.04 -0.80 -3.23 117.51 117.98 1n8p h ILE 267 Ca 0.00 -2.64 -0.07 0.00 1.00 0.00 0.00 64.86 63.15 1n8p h ILE 267 Cb 0.15 2.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.72 1n8p h ILE 267 CO 0.00 0.64 -0.11 0.00 0.00 0.00 0.00 178.15 178.69 1n8p h ALA 268 N 0.71 0.35 -1.00 1.87 0.00 -0.04 -1.54 119.26 119.61 1n8p h ALA 268 Ca -0.31 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.36 1n8p h ALA 268 Cb 2.01 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.65 1n8p h ALA 268 CO 0.09 0.20 0.65 0.93 0.00 0.00 0.00 179.25 181.12 1n8p h GLU 269 N 0.24 1.18 -0.26 0.00 5.08 -1.36 0.32 114.58 119.77 1n8p h GLU 269 Ca 0.06 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1n8p h GLU 269 Cb 0.60 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1n8p h GLU 269 CO 0.03 0.78 0.13 0.35 -1.00 0.00 0.00 179.01 179.31 1n8p h PHE 270 N 1.21 0.37 0.00 4.33 3.57 -1.50 -1.49 116.94 123.43 1n8p h PHE 270 Ca 0.42 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.90 1n8p h PHE 270 Cb 0.10 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.72 1n8p h PHE 270 CO -0.00 0.33 0.00 1.28 -2.23 0.00 0.00 178.31 177.69 1n8p n LEU 271 N -4.82 0.00 -2.15 0.59 4.77 -0.61 -3.06 117.00 111.72 1n8p n LEU 271 Ca -0.02 0.45 -0.29 0.00 -0.03 0.00 0.00 56.01 56.12 1n8p n LEU 271 Cb 0.09 -0.45 0.05 0.00 -2.33 0.00 0.00 43.42 40.78 1n8p n LEU 271 CO 0.35 -0.15 0.72 0.00 -1.33 0.00 0.00 177.39 176.99 1n8p n ALA 272 N -1.45 5.58 -1.76 -1.18 0.00 0.10 -4.11 120.51 117.69 1n8p n ALA 272 Ca 0.06 -3.65 0.00 0.00 0.00 0.00 0.00 53.44 49.84 1n8p n ALA 272 Cb 0.21 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.72 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 -0.80 0.00 -2.07 0.00 0.00 -1.14 -4.92 120.51 111.58 1n8p n ALA 273 Ca 0.52 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.58 1n8p n ALA 273 Cb 0.84 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.30 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 0.00 7.37 -0.52 0.00 -0.08 -1.19 -4.79 116.55 117.34 1n8p n ASP 274 Ca 0.00 -3.55 0.41 0.00 -1.51 0.00 0.00 54.79 50.13 1n8p n ASP 274 Cb 0.21 -1.18 0.65 0.00 2.34 0.00 0.00 41.12 43.13 1n8p n ASP 274 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 1n8p n LYS 275 N 0.26 -0.01 0.00 -0.67 -0.00 -1.26 -2.61 118.16 113.87 1n8p n LYS 275 Ca 0.52 0.97 0.00 0.00 -0.00 0.00 0.00 58.31 59.80 1n8p n LYS 275 Cb 0.30 -2.10 0.00 0.00 -0.00 0.00 0.00 35.03 33.23 1n8p n LYS 275 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1n8p n GLU 276 N -3.92 0.00 0.01 -1.58 -0.58 -1.26 -4.38 120.64 108.93 1n8p n GLU 276 Ca 0.36 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 57.24 1n8p n GLU 276 Cb 1.55 -0.92 0.57 0.00 -0.57 0.00 0.00 31.44 32.07 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 -0.47 0.14 -4.28 1.62 5.03 -1.14 -4.71 115.26 111.46 1n8p n ASN 277 Ca 0.00 0.46 -0.37 0.00 0.87 0.00 0.00 54.58 55.54 1n8p n ASN 277 Cb 0.00 -0.48 -0.13 0.00 -1.02 0.00 0.00 39.78 38.15 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 -3.01 3.65 0.00 2.41 1.01 -1.07 0.26 120.40 123.64 1n8p s VAL 278 Ca 0.13 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1n8p s VAL 278 Cb 0.18 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.60 1n8p s VAL 278 CO 0.55 -0.01 0.22 0.52 0.00 0.00 0.00 175.10 176.39 1n8p n VAL 279 N 4.80 0.00 -4.28 2.92 0.31 -0.20 -4.67 118.33 117.21 1n8p n VAL 279 Ca -0.14 0.61 -0.24 0.00 -0.01 0.00 0.00 64.34 64.55 1n8p n VAL 279 Cb 0.46 -1.37 -0.08 0.00 -0.91 0.00 0.00 33.84 31.94 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 -2.47 3.26 -0.04 3.52 0.00 -1.22 -4.98 121.76 119.82 1n8p s ALA 280 Ca 0.00 -1.90 -0.02 0.00 0.00 0.00 0.00 51.96 50.03 1n8p s ALA 280 Cb 0.00 -0.48 0.02 0.00 0.00 0.00 0.00 23.12 22.66 1n8p s ALA 280 CO 0.00 0.08 0.09 0.08 0.00 0.00 0.00 175.76 176.01 1n8p s VAL 281 N -2.48 -0.03 -0.21 0.00 1.01 -1.26 -1.42 120.40 116.00 1n8p s VAL 281 Ca 0.35 0.10 -0.01 0.00 0.00 0.00 0.00 61.98 62.42 1n8p s VAL 281 Cb -0.01 -0.15 0.02 0.00 0.00 0.00 0.00 36.38 36.23 1n8p s VAL 281 CO 0.20 0.04 -0.11 0.20 0.00 0.00 0.00 175.10 175.43 1n8p s ASN 282 N 0.62 3.86 -0.29 3.32 0.01 0.68 -4.96 114.94 118.17 1n8p s ASN 282 Ca -0.05 -0.68 -0.05 0.00 -0.71 0.00 0.00 52.86 51.37 1n8p s ASN 282 Cb -0.07 -1.61 0.16 0.00 0.41 0.00 0.00 41.25 40.15 1n8p s ASN 282 CO -0.02 -0.05 0.60 -0.47 -1.51 0.00 0.00 177.10 175.65 1n8p s TYR 283 N 1.34 -1.44 -1.03 2.20 5.04 -1.26 -1.55 117.35 120.65 1n8p s TYR 283 Ca 0.03 1.92 0.00 0.00 -2.44 0.00 0.00 57.07 56.58 1n8p s TYR 283 Cb -0.15 0.63 0.00 0.00 0.35 0.00 0.00 41.96 42.79 1n8p s TYR 283 CO -0.07 -0.77 0.77 -2.30 -1.34 0.00 0.00 175.55 171.83 1n8p n PRO 284 N 5.43 0.00 0.00 4.97 -0.02 -1.26 -1.63 135.00 142.49 1n8p n PRO 284 Ca -0.06 0.30 0.12 0.00 -2.02 0.00 0.00 63.50 61.84 1n8p n PRO 284 Cb 0.50 -1.57 0.24 0.00 -0.02 0.00 0.00 33.50 32.65 1n8p n PRO 284 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n8p n GLY 285 N -1.27 0.06 3.61 -1.23 0.00 -1.26 -4.74 105.19 100.36 1n8p n GLY 285 Ca 0.00 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.07 1n8p n GLY 285 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n8p s LEU 286 N -2.28 4.11 0.57 0.99 1.43 -0.65 -4.88 118.68 117.98 1n8p s LEU 286 Ca 0.26 0.55 0.09 0.00 -1.03 0.00 0.00 54.13 54.00 1n8p s LEU 286 Cb 0.19 -2.83 0.50 0.00 0.03 0.00 0.00 46.19 44.09 1n8p s LEU 286 CO 0.45 -0.43 1.23 0.11 0.23 0.00 0.00 176.35 177.94 1n8p h LYS 287 N 8.06 0.00 -0.20 1.70 1.57 -1.89 1.55 116.57 127.36 1n8p h LYS 287 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1n8p h LYS 287 Cb 1.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.43 1n8p h LYS 287 CO 0.79 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.92 1n8p n THR 288 N -2.44 0.26 -2.30 -0.16 -2.24 -1.26 -4.77 114.28 101.36 1n8p n THR 288 Ca -0.01 -0.33 -0.42 0.00 -2.27 0.00 0.00 64.05 61.02 1n8p n THR 288 Cb 0.73 0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 69.16 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 -1.74 3.35 0.46 4.78 5.04 0.53 -4.88 115.29 122.82 1n8p s HIS 289 Ca 0.27 1.16 0.38 0.00 -1.54 0.00 0.00 55.06 55.33 1n8p s HIS 289 Cb 0.14 -3.54 1.50 0.00 0.04 0.00 0.00 32.58 30.73 1n8p s HIS 289 CO 0.21 -1.76 1.47 -2.30 -2.34 0.00 0.00 174.74 170.02 1n8p n PRO 290 N 3.78 -0.02 -0.41 2.88 -0.02 -1.26 0.72 135.00 140.67 1n8p n PRO 290 Ca 0.10 1.12 0.07 0.00 -2.02 0.00 0.00 63.50 62.77 1n8p n PRO 290 Cb 0.44 -2.34 0.17 0.00 -0.02 0.00 0.00 33.50 31.75 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 -4.27 1.92 -0.09 2.55 3.02 -1.26 -4.78 115.26 112.35 1n8p n ASN 291 Ca 0.40 -3.49 0.25 0.00 -0.03 0.00 0.00 54.58 51.70 1n8p n ASN 291 Cb 1.66 -0.48 0.55 0.00 -0.61 0.00 0.00 39.78 40.91 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 0.58 0.00 -0.54 3.10 3.20 -0.00 0.80 116.97 124.10 1n8p h TYR 292 Ca -0.01 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.77 1n8p h TYR 292 Cb 1.03 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 1n8p h TYR 292 CO 0.42 0.00 -0.03 0.38 -1.64 0.00 0.00 178.16 177.30 1n8p h ASP 293 N 0.00 0.92 -0.20 -2.11 2.03 -1.86 -1.97 116.42 113.23 1n8p h ASP 293 Ca 0.37 -0.26 -0.19 0.00 -0.73 0.00 0.00 57.03 56.22 1n8p h ASP 293 Cb 2.20 -0.25 0.01 0.00 -0.83 0.00 0.00 39.33 40.46 1n8p h ASP 293 CO -0.00 1.00 -0.62 0.58 -1.03 0.00 0.00 179.24 179.17 1n8p h VAL 294 N 0.87 1.29 -0.09 4.15 2.07 0.23 -3.18 116.25 121.58 1n8p h VAL 294 Ca 0.16 -1.83 0.04 0.00 0.82 0.00 0.00 66.70 65.89 1n8p h VAL 294 Cb 0.54 1.87 -0.06 0.00 -1.52 0.00 0.00 31.29 32.13 1n8p h VAL 294 CO 0.03 0.58 -0.36 0.58 0.02 0.00 0.00 177.57 178.42 1n8p h VAL 295 N 0.50 0.23 0.00 2.57 2.07 -1.31 0.18 116.25 120.50 1n8p h VAL 295 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1n8p h VAL 295 Cb 1.24 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1n8p h VAL 295 CO 0.13 0.00 0.05 0.18 0.02 0.00 0.00 177.57 177.95 1n8p n LEU 296 N -5.43 0.21 -0.00 2.57 4.77 -0.76 -0.47 117.00 117.89 1n8p n LEU 296 Ca -0.04 0.56 0.04 0.00 -0.03 0.00 0.00 56.01 56.54 1n8p n LEU 296 Cb 0.34 -0.58 -0.06 0.00 -2.33 0.00 0.00 43.42 40.79 1n8p n LEU 296 CO 0.15 -0.63 -0.51 2.29 -1.33 0.00 0.00 177.39 177.35 1n8p n LYS 297 N -1.76 0.83 -0.04 3.23 2.85 -0.02 -4.77 118.16 118.48 1n8p n LYS 297 Ca -0.01 -0.06 -0.04 0.00 -1.05 0.00 0.00 58.31 57.16 1n8p n LYS 297 Cb 0.06 -1.14 -0.07 0.00 -0.65 0.00 0.00 35.03 33.23 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 -1.69 2.37 -3.31 -1.58 6.02 0.44 -5.01 117.38 114.62 1n8p n GLN 298 Ca -0.01 -0.01 -0.38 0.00 -0.01 0.00 0.00 57.00 56.59 1n8p n GLN 298 Cb 0.20 -1.22 -0.06 0.00 1.02 0.00 0.00 30.24 30.17 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 -2.25 3.51 0.26 1.08 3.76 0.38 -4.37 115.29 117.65 1n8p s HIS 299 Ca -0.04 0.89 -0.31 0.00 -0.15 0.00 0.00 55.06 55.45 1n8p s HIS 299 Cb 0.03 -2.56 -0.12 0.00 1.11 0.00 0.00 32.58 31.04 1n8p s HIS 299 CO 0.36 0.16 1.60 -2.13 -0.85 0.00 0.00 174.74 173.88 1n8p n ARG 300 N 3.71 2.61 -0.47 1.40 0.63 0.39 -2.00 116.66 122.92 1n8p n ARG 300 Ca -0.07 0.93 0.00 0.00 -0.92 0.00 0.00 57.85 57.79 1n8p n ARG 300 Cb 0.52 -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 2.68 -2.83 -1.14 6.15 8.00 -1.26 -0.38 116.55 127.78 1n8p n ASP 301 Ca 0.11 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.52 1n8p n ASP 301 Cb 0.35 -1.92 0.00 0.00 -0.02 0.00 0.00 41.12 39.53 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 0.48 -0.31 -2.13 2.24 0.00 -0.85 -4.99 120.51 114.96 1n8p n ALA 302 Ca 0.00 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 53.11 1n8p n ALA 302 Cb 0.24 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 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 -2.71 4.39 0.37 0.00 1.43 0.49 -4.69 118.68 117.96 1n8p s LEU 303 Ca 0.04 2.32 0.24 0.00 -1.03 0.00 0.00 54.13 55.70 1n8p s LEU 303 Cb -0.02 -3.60 0.46 0.00 0.03 0.00 0.00 46.19 43.07 1n8p s LEU 303 CO 0.05 -0.58 1.64 1.23 0.23 0.00 0.00 176.35 178.92 1n8p h GLY 304 N 6.21 0.00 0.00 -3.19 0.00 -1.87 -3.45 103.07 100.77 1n8p h GLY 304 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1n8p h GLY 304 CO 0.82 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.97 1n8p n GLY 305 N 1.16 -0.38 0.08 4.60 0.00 -1.26 -4.41 105.19 104.97 1n8p n GLY 305 Ca 0.04 -2.17 0.01 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.84 3.57 -0.02 0.00 -1.26 -3.65 105.19 102.99 1n8p n GLY 306 Ca 0.00 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.40 3.88 0.36 1.61 -1.94 -1.26 -0.19 119.30 121.36 1n8p s MET 307 Ca 0.02 -0.38 0.08 0.00 -1.71 0.00 0.00 55.69 53.71 1n8p s MET 307 Cb 0.02 -3.34 -0.06 0.00 2.01 0.00 0.00 34.83 33.46 1n8p s MET 307 CO 0.04 0.04 0.05 0.42 -0.01 0.00 0.00 175.02 175.56 1n8p s ILE 308 N 1.02 2.49 -0.19 2.53 1.01 -0.38 -4.79 121.20 122.90 1n8p s ILE 308 Ca 0.05 -1.92 -0.15 0.00 0.00 0.00 0.00 60.65 58.63 1n8p s ILE 308 Cb -0.14 -2.86 0.05 0.00 0.01 0.00 0.00 42.46 39.52 1n8p s ILE 308 CO 0.03 -0.14 0.49 -0.55 0.00 0.00 0.00 174.94 174.78 1n8p s SER 309 N -3.75 -0.55 0.19 3.58 0.15 -0.60 -2.19 113.70 110.53 1n8p s SER 309 Ca 0.36 1.02 -0.23 0.00 0.70 0.00 0.00 55.95 57.80 1n8p s SER 309 Cb 0.02 0.99 0.06 0.00 -1.71 0.00 0.00 66.02 65.37 1n8p s SER 309 CO 0.20 -0.18 0.64 0.72 1.20 0.00 0.00 173.24 175.82 1n8p s PHE 310 N 0.65 -0.44 -0.07 3.44 -0.12 0.54 0.25 117.98 122.23 1n8p s PHE 310 Ca -0.03 0.16 0.05 0.00 -0.05 0.00 0.00 56.93 57.05 1n8p s PHE 310 Cb -0.05 0.60 -0.00 0.00 -0.63 0.00 0.00 43.02 42.94 1n8p s PHE 310 CO -0.04 -0.96 -0.22 -0.98 -0.05 0.00 0.00 175.22 172.97 1n8p s ARG 311 N -3.79 2.48 0.40 1.99 1.70 -0.51 0.13 118.95 121.36 1n8p s ARG 311 Ca 0.04 -0.78 -0.08 0.00 -0.47 0.00 0.00 55.73 54.44 1n8p s ARG 311 Cb -0.02 -2.01 -0.05 0.00 -0.57 0.00 0.00 34.95 32.30 1n8p s ARG 311 CO -0.07 0.24 0.74 0.96 -1.08 0.00 0.00 175.30 176.09 1n8p s ILE 312 N 0.15 4.86 0.00 4.99 -4.36 -1.21 -1.03 121.20 124.60 1n8p s ILE 312 Ca -0.10 0.41 0.00 0.00 -0.26 0.00 0.00 60.65 60.70 1n8p s ILE 312 Cb -0.15 -3.77 0.00 0.00 1.25 0.00 0.00 42.46 39.79 1n8p s ILE 312 CO 0.05 -0.57 0.00 2.29 0.24 0.00 0.00 174.94 176.96 1n8p n LYS 313 N -1.47 0.00 0.00 0.37 2.85 0.73 -4.45 118.16 116.19 1n8p n LYS 313 Ca 0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.27 1n8p n LYS 313 Cb 0.54 -1.46 0.00 0.00 -0.65 0.00 0.00 35.03 33.46 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 1.51 4.44 3.31 2.58 0.00 -1.26 -5.00 105.19 110.78 1n8p n GLY 314 Ca 0.00 -0.52 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 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 1.06 0.00 -0.02 0.00 -1.26 -4.96 107.32 102.14 1n8p s GLY 315 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 44.72 43.34 1n8p s GLY 315 CO 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 173.10 171.96 1n8p n ALA 316 N -0.27 0.00 0.22 3.20 0.00 -1.26 0.65 120.51 123.04 1n8p n ALA 316 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 1n8p n ALA 316 Cb 0.64 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.05 1n8p n ALA 316 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1n8p h GLU 317 N 0.00 -0.57 -1.20 0.00 4.39 -1.96 -0.42 114.58 114.82 1n8p h GLU 317 Ca 0.00 0.04 0.45 0.00 0.34 0.00 0.00 59.36 60.19 1n8p h GLU 317 Cb 0.00 0.13 -0.16 0.00 -0.10 0.00 0.00 28.75 28.62 1n8p h GLU 317 CO 0.00 -0.38 0.72 0.00 -1.16 0.00 0.00 179.01 178.19 1n8p n ALA 318 N -2.53 1.20 0.02 3.43 0.00 0.21 0.15 120.51 122.99 1n8p n ALA 318 Ca -0.07 0.93 -0.08 0.00 0.00 0.00 0.00 53.44 54.22 1n8p n ALA 318 Cb 0.23 -1.03 -0.06 0.00 0.00 0.00 0.00 19.45 18.59 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 1.76 -0.17 -0.90 0.00 0.00 -1.60 0.07 119.26 118.43 1n8p h ALA 319 Ca 0.86 -0.18 0.17 0.00 0.00 0.00 0.00 54.91 55.75 1n8p h ALA 319 Cb 2.55 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 20.33 1n8p h ALA 319 CO -0.60 -0.19 0.58 1.03 0.00 0.00 0.00 179.25 180.07 1n8p h SER 320 N -0.97 0.58 0.90 0.00 0.87 0.79 0.19 113.55 115.91 1n8p h SER 320 Ca -0.02 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.55 1n8p h SER 320 Cb 0.42 -0.06 0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1n8p h SER 320 CO 0.03 0.27 -0.43 0.50 -0.53 0.00 0.00 176.83 176.66 1n8p h LYS 321 N 0.60 -1.16 -0.56 2.24 1.63 0.14 -3.03 116.57 116.42 1n8p h LYS 321 Ca 0.47 0.08 0.11 0.00 -0.85 0.00 0.00 60.65 60.45 1n8p h LYS 321 Cb 0.88 0.26 -0.11 0.00 -0.60 0.00 0.00 32.23 32.67 1n8p h LYS 321 CO -0.21 -0.78 -0.29 0.35 -3.45 0.00 0.00 179.45 175.07 1n8p h PHE 322 N -1.23 -0.79 0.00 1.91 3.57 0.07 0.44 116.94 120.91 1n8p h PHE 322 Ca -0.12 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.44 1n8p h PHE 322 Cb 0.93 0.43 0.00 0.00 2.79 0.00 0.00 35.95 40.10 1n8p h PHE 322 CO 0.02 -0.36 0.18 0.00 -2.23 0.00 0.00 178.31 175.92 1n8p n ALA 323 N -3.10 0.63 0.00 2.41 0.00 0.57 -2.20 120.51 118.81 1n8p n ALA 323 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1n8p n ALA 323 Cb 0.35 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1n8p n ALA 323 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1n8p n SER 324 N -1.26 4.20 0.25 0.00 7.64 0.13 -4.38 113.62 120.19 1n8p n SER 324 Ca 0.00 0.00 0.17 0.00 1.01 0.00 0.00 58.87 60.05 1n8p n SER 324 Cb 0.18 0.39 0.81 0.00 -1.01 0.00 0.00 64.21 64.59 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 0.00 0.00 -3.49 6.43 0.02 -0.40 -3.44 113.55 112.68 1n8p h SER 325 Ca 0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 1n8p h SER 325 Cb 0.85 0.00 0.04 0.00 0.14 0.00 0.00 62.40 63.43 1n8p h SER 325 CO 0.00 0.00 0.63 0.42 -1.14 0.00 0.00 176.83 176.74 1n8p s THR 326 N -3.74 3.18 -0.24 -2.27 -4.23 -1.17 -4.87 115.64 102.30 1n8p s THR 326 Ca -0.01 1.01 -0.16 0.00 -1.18 0.00 0.00 61.69 61.35 1n8p s THR 326 Cb 0.10 -3.64 -0.17 0.00 1.34 0.00 0.00 72.50 70.13 1n8p s THR 326 CO 0.40 0.17 -0.05 -1.14 -0.54 0.00 0.00 174.62 173.47 1n8p n ARG 327 N 2.27 0.60 0.12 3.99 0.63 -1.26 -4.62 116.66 118.38 1n8p n ARG 327 Ca 0.05 0.39 -0.23 0.00 -0.92 0.00 0.00 57.85 57.14 1n8p n ARG 327 Cb 0.43 -1.62 -0.15 0.00 0.45 0.00 0.00 32.46 31.56 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 -0.85 0.71-10.03 6.15 3.38 -1.93 -3.45 115.31 109.29 1n8p h LEU 328 Ca -0.52 -0.84 -0.45 0.00 0.09 0.00 0.00 57.88 56.16 1n8p h LEU 328 Cb 1.53 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 1n8p h LEU 328 CO -0.27 1.67 0.35 -0.36 0.09 0.00 0.00 178.44 179.92 1n8p s PHE 329 N -2.60 3.32 -0.16 1.13 0.40 -1.26 -4.60 117.98 114.21 1n8p s PHE 329 Ca -0.10 1.63 0.01 0.00 -0.60 0.00 0.00 56.93 57.87 1n8p s PHE 329 Cb 0.05 -2.90 0.01 0.00 0.51 0.00 0.00 43.02 40.68 1n8p s PHE 329 CO 0.91 -0.19 -0.19 0.99 0.70 0.00 0.00 175.22 177.44 1n8p s THR 330 N -2.05 2.26 -0.14 0.64 2.01 -0.73 -4.83 115.64 112.80 1n8p s THR 330 Ca 0.61 -0.90 -0.29 0.00 0.31 0.00 0.00 61.69 61.42 1n8p s THR 330 Cb -0.12 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.41 1n8p s THR 330 CO 0.16 0.53 1.74 -0.22 -0.69 0.00 0.00 174.62 176.15 1n8p s LEU 331 N 0.97 4.02 0.00 4.42 2.96 -1.26 -2.06 118.68 127.74 1n8p s LEU 331 Ca -0.03 1.95 -0.02 0.00 -0.22 0.00 0.00 54.13 55.81 1n8p s LEU 331 Cb -0.15 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.02 1n8p s LEU 331 CO -0.04 -1.23 0.11 0.00 -1.32 0.00 0.00 176.35 173.87 1n8p n ALA 332 N 8.37 -0.29 -3.22 5.97 0.00 -1.16 -4.95 120.51 125.22 1n8p n ALA 332 Ca 0.20 -0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.43 1n8p n ALA 332 Cb 0.44 0.04 0.02 0.00 0.00 0.00 0.00 19.45 19.95 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 -0.08 0.93 -0.06 0.00 -0.58 -1.26 -4.43 120.64 115.16 1n8p n GLU 333 Ca -0.00 -1.39 0.01 0.00 -0.42 0.00 0.00 57.16 55.36 1n8p n GLU 333 Cb 0.06 -0.02 -0.00 0.00 -0.57 0.00 0.00 31.44 30.90 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 -2.46 -3.41 -1.34 1.62 2.88 -1.26 -5.00 113.62 104.65 1n8p n SER 334 Ca 0.05 0.06 0.01 0.00 -1.33 0.00 0.00 58.87 57.65 1n8p n SER 334 Cb 0.26 -0.18 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 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 0.00 2.46 -0.00 -1.26 -4.94 117.00 113.26 1n8p n LEU 335 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 56.01 56.00 1n8p n LEU 335 Cb 0.03 0.18 0.00 0.00 -0.00 0.00 0.00 43.42 43.62 1n8p n LEU 335 CO 0.00 -0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.00 1n8p n GLY 336 N -0.11 0.13 3.76 1.47 0.00 -1.26 -4.59 105.19 104.59 1n8p n GLY 336 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.00 1.64 0.44 -0.02 0.00 -1.26 -3.87 107.32 102.24 1n8p s GLY 337 Ca 0.00 -0.02 0.20 0.00 0.00 0.00 0.00 44.72 44.91 1n8p s GLY 337 CO 0.00 0.41 1.92 1.19 0.00 0.00 0.00 173.10 176.63 1n8p h ILE 338 N -1.28 0.88 -3.44 0.90 2.10 -1.85 -3.42 117.51 111.41 1n8p h ILE 338 Ca -0.47 -0.95 -0.66 0.00 1.08 0.00 0.00 64.86 63.86 1n8p h ILE 338 Cb 1.26 1.56 -0.19 0.00 -1.09 0.00 0.00 36.82 38.36 1n8p h ILE 338 CO 0.55 0.24 -0.67 -1.83 -1.08 0.00 0.00 178.15 175.36 1n8p s GLU 339 N -4.12 3.20 0.35 2.19 1.03 -1.26 -1.89 118.70 118.21 1n8p s GLU 339 Ca -0.02 -0.51 -0.25 0.00 0.03 0.00 0.00 54.97 54.22 1n8p s GLU 339 Cb 0.13 -2.77 -0.13 0.00 -0.80 0.00 0.00 34.13 30.56 1n8p s GLU 339 CO 0.66 0.49 0.82 0.43 -1.33 0.00 0.00 175.26 176.32 1n8p n SER 340 N 2.78 0.36 -3.97 0.83 7.64 -1.26 -4.62 113.62 115.38 1n8p n SER 340 Ca -0.18 1.06 -0.09 0.00 1.01 0.00 0.00 58.87 60.67 1n8p n SER 340 Cb 0.53 -1.22 -0.09 0.00 -1.01 0.00 0.00 64.21 62.42 1n8p n SER 340 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1n8p s LEU 341 N 0.87 2.01 -0.05 -3.43 1.43 -0.15 -1.77 118.68 117.59 1n8p s LEU 341 Ca 0.62 -0.68 -0.09 0.00 -1.03 0.00 0.00 54.13 52.95 1n8p s LEU 341 Cb -0.66 0.48 0.02 0.00 0.03 0.00 0.00 46.19 46.06 1n8p s LEU 341 CO 0.58 -0.54 0.21 -1.48 0.23 0.00 0.00 176.35 175.35 1n8p s LEU 342 N -2.38 1.24 0.14 1.79 2.34 -0.87 -0.00 118.68 120.93 1n8p s LEU 342 Ca -0.01 0.19 -0.08 0.00 0.06 0.00 0.00 54.13 54.29 1n8p s LEU 342 Cb 0.01 0.81 -0.01 0.00 -0.56 0.00 0.00 46.19 46.44 1n8p s LEU 342 CO -0.07 -0.22 0.22 -0.70 -1.06 0.00 0.00 176.35 174.53 1n8p s GLU 343 N -0.55 1.04 -0.63 1.48 -6.30 0.16 -2.96 118.70 110.93 1n8p s GLU 343 Ca -0.07 -1.16 0.03 0.00 -2.50 0.00 0.00 54.97 51.27 1n8p s GLU 343 Cb -0.04 0.35 0.16 0.00 0.00 0.00 0.00 34.13 34.59 1n8p s GLU 343 CO 0.01 -0.36 0.41 0.08 0.02 0.00 0.00 175.26 175.43 1n8p s VAL 344 N -3.95 3.04 0.18 3.70 1.01 -1.26 -0.49 120.40 122.63 1n8p s VAL 344 Ca 0.15 -3.63 0.04 0.00 0.00 0.00 0.00 61.98 58.55 1n8p s VAL 344 Cb 0.04 -3.02 0.22 0.00 0.00 0.00 0.00 36.38 33.62 1n8p s VAL 344 CO -0.02 -0.91 0.86 -0.81 0.00 0.00 0.00 175.10 174.22 1n8p n PRO 345 N 2.73 -0.04 0.01 2.72 -0.04 -1.26 -1.17 135.00 137.95 1n8p n PRO 345 Ca 0.12 0.80 -0.14 0.00 -0.04 0.00 0.00 63.50 64.24 1n8p n PRO 345 Cb 0.34 -1.32 -0.08 0.00 -0.04 0.00 0.00 33.50 32.40 1n8p n PRO 345 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n8p h ALA 346 N 1.10 -0.77 -0.28 0.55 0.00 -1.83 0.97 119.26 119.00 1n8p h ALA 346 Ca 0.37 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1n8p h ALA 346 Cb 0.84 0.89 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1n8p h ALA 346 CO -0.49 -1.02 0.00 1.33 0.00 0.00 0.00 179.25 179.07 1n8p n VAL 347 N -5.44 0.00 -0.04 0.00 0.24 -0.32 -3.81 118.33 108.96 1n8p n VAL 347 Ca -0.05 0.45 -0.15 0.00 -2.04 0.00 0.00 64.34 62.55 1n8p n VAL 347 Cb 0.38 -1.37 -0.10 0.00 -1.47 0.00 0.00 33.84 31.28 1n8p n VAL 347 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 1n8p h MET 348 N 0.00 -0.53 0.00 7.34 2.86 -1.66 -3.33 114.93 119.61 1n8p h MET 348 Ca 0.00 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1n8p h MET 348 Cb 0.00 0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1n8p h MET 348 CO 0.00 -0.35 0.00 2.41 1.06 0.00 0.00 176.91 180.03 1n8p n THR 349 N -5.42 0.00 -1.08 2.22 -1.04 -0.99 -4.60 114.28 103.36 1n8p n THR 349 Ca -0.06 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.54 1n8p n THR 349 Cb 0.37 -0.05 -0.07 0.00 -1.82 0.00 0.00 70.33 68.76 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 -0.52 1.46 0.00 -1.42 8.25 0.33 -4.70 115.22 118.62 1n8p n HIS 350 Ca 0.00 -1.41 0.00 0.00 -0.26 0.00 0.00 57.72 56.05 1n8p n HIS 350 Cb 0.00 -1.58 0.00 0.00 1.12 0.00 0.00 29.99 29.53 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 4.80 -0.32 2.08 -1.41 0.00 -1.25 -4.42 105.19 104.66 1n8p n GLY 351 Ca 0.48 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.48 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 1.94 1.42 2.66 -0.02 0.00 -1.26 -4.47 105.19 105.47 1n8p n GLY 352 Ca 0.00 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 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 1.81 -0.23 0.18 -0.61 1.01 -1.26 -5.14 121.20 116.96 1n8p s ILE 353 Ca 0.11 -0.45 -0.28 0.00 0.00 0.00 0.00 60.65 60.03 1n8p s ILE 353 Cb 0.05 -0.86 -0.17 0.00 0.01 0.00 0.00 42.46 41.50 1n8p s ILE 353 CO 0.00 -0.47 0.54 -2.65 0.00 0.00 0.00 174.94 172.36 1n8p n PRO 354 N 5.29 0.00 -0.49 2.79 -0.02 -1.26 -4.57 135.00 136.73 1n8p n PRO 354 Ca -0.05 0.00 0.40 0.00 -2.02 0.00 0.00 63.50 61.83 1n8p n PRO 354 Cb 0.46 -1.00 0.69 0.00 -0.02 0.00 0.00 33.50 33.63 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 1.10 0.06 -0.72 -0.52 3.64 -1.93 0.20 116.57 118.40 1n8p h LYS 355 Ca -0.29 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.16 1n8p h LYS 355 Cb 1.39 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 33.11 1n8p h LYS 355 CO 0.55 0.04 -0.42 0.39 -2.27 0.00 0.00 179.45 177.74 1n8p n GLU 356 N -4.52 -0.32 0.00 1.90 1.02 -1.26 -0.38 120.64 117.08 1n8p n GLU 356 Ca 0.38 1.14 -0.18 0.00 -0.02 0.00 0.00 57.16 58.49 1n8p n GLU 356 Cb 1.55 -1.68 -0.09 0.00 -0.02 0.00 0.00 31.44 31.19 1n8p n GLU 356 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1n8p h ALA 357 N 0.30 0.17 0.00 0.62 0.00 -0.91 -3.33 119.26 116.12 1n8p h ALA 357 Ca 0.12 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 1n8p h ALA 357 Cb 0.29 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1n8p h ALA 357 CO -0.68 0.54 0.17 0.54 0.00 0.00 0.00 179.25 179.82 1n8p n ARG 358 N -4.04 0.32 0.00 0.00 1.74 0.49 0.24 116.66 115.41 1n8p n ARG 358 Ca -0.09 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.87 1n8p n ARG 358 Cb 0.74 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 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 2.44 0.00 0.00 5.56 -0.58 -1.18 -4.06 120.64 122.81 1n8p n GLU 359 Ca 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 1n8p n GLU 359 Cb 0.15 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.02 1n8p n GLU 359 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n8p n ALA 360 N 0.00 0.00 0.17 0.62 0.00 0.65 -4.26 120.51 117.69 1n8p n ALA 360 Ca 0.00 -0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.46 1n8p n ALA 360 Cb 0.00 0.00 0.33 0.00 0.00 0.00 0.00 19.45 19.78 1n8p n ALA 360 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1n8p h SER 361 N 0.00 0.00 0.00 0.00 0.87 -1.86 -3.43 113.55 109.13 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 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 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 -1.27 1.14 2.87 5.77 0.00 -1.26 -4.88 105.19 107.56 1n8p n GLY 362 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.87 0.79 -1.55 1.61 0.31 -1.26 -4.84 118.33 112.51 1n8p n VAL 363 Ca 0.00 -0.47 -0.44 0.00 -0.01 0.00 0.00 64.34 63.42 1n8p n VAL 363 Cb 0.00 -1.70 -0.01 0.00 -0.91 0.00 0.00 33.84 31.22 1n8p n VAL 363 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1n8p n PHE 364 N 4.73 0.81 0.27 3.52 0.99 -1.26 -4.34 117.46 122.18 1n8p n PHE 364 Ca 0.14 0.69 0.14 0.00 -0.00 0.00 0.00 57.45 58.43 1n8p n PHE 364 Cb 0.04 -2.18 0.74 0.00 -1.00 0.00 0.00 39.48 37.08 1n8p n PHE 364 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.76 176.98 1n8p h ASP 365 N 1.63 0.00 -0.71 4.37 1.82 -1.90 -2.58 116.42 119.04 1n8p h ASP 365 Ca -0.39 0.00 -0.38 0.00 -0.39 0.00 0.00 57.03 55.87 1n8p h ASP 365 Cb 1.36 0.00 -0.22 0.00 0.68 0.00 0.00 39.33 41.15 1n8p h ASP 365 CO 0.58 0.10 0.32 -0.90 -1.61 0.00 0.00 179.24 177.74 1n8p n ASP 366 N -3.43 3.25 -4.64 2.28 5.75 -1.26 -4.34 116.55 114.16 1n8p n ASP 366 Ca -0.01 -3.70 -0.36 0.00 -0.01 0.00 0.00 54.79 50.71 1n8p n ASP 366 Cb 0.26 -0.75 -0.10 0.00 -1.03 0.00 0.00 41.12 39.50 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 -3.30 4.00 -0.20 -2.12 2.96 -0.97 -3.28 118.68 115.77 1n8p s LEU 367 Ca 0.52 0.08 -0.07 0.00 -0.22 0.00 0.00 54.13 54.43 1n8p s LEU 367 Cb 0.45 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 45.04 1n8p s LEU 367 CO 0.06 0.08 0.06 -0.69 -1.32 0.00 0.00 176.35 174.53 1n8p s VAL 368 N 0.99 4.60 -0.17 1.68 1.01 0.34 -4.39 120.40 124.46 1n8p s VAL 368 Ca 0.07 -0.09 -0.03 0.00 0.00 0.00 0.00 61.98 61.92 1n8p s VAL 368 Cb -0.13 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 1n8p s VAL 368 CO 0.04 0.42 -0.05 -0.60 0.00 0.00 0.00 175.10 174.90 1n8p s ARG 369 N 0.75 3.54 -0.02 2.72 3.52 0.36 -0.34 118.95 129.47 1n8p s ARG 369 Ca 0.03 -0.58 0.06 0.00 -0.13 0.00 0.00 55.73 55.11 1n8p s ARG 369 Cb -0.13 -2.89 -0.01 0.00 -1.56 0.00 0.00 34.95 30.35 1n8p s ARG 369 CO 0.02 0.12 -0.20 0.96 -0.81 0.00 0.00 175.30 175.39 1n8p s ILE 370 N 0.66 1.64 -0.63 4.11 -4.36 -0.93 0.39 121.20 122.07 1n8p s ILE 370 Ca -0.03 -0.87 -0.12 0.00 -0.26 0.00 0.00 60.65 59.37 1n8p s ILE 370 Cb -0.15 -1.37 0.16 0.00 1.25 0.00 0.00 42.46 42.35 1n8p s ILE 370 CO 0.02 0.46 0.54 -0.55 0.24 0.00 0.00 174.94 175.65 1n8p s SER 371 N -0.36 6.11 0.12 4.36 0.15 1.00 -1.24 113.70 123.83 1n8p s SER 371 Ca 0.05 -2.26 -0.31 0.00 0.70 0.00 0.00 55.95 54.12 1n8p s SER 371 Cb -0.09 -2.11 -0.08 0.00 -1.71 0.00 0.00 66.02 62.03 1n8p s SER 371 CO 0.00 -0.66 1.42 -0.69 1.20 0.00 0.00 173.24 174.52 1n8p s VAL 372 N 0.84 3.21 0.00 4.45 1.01 0.74 -0.98 120.40 129.67 1n8p s VAL 372 Ca 0.10 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1n8p s VAL 372 Cb -0.21 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.62 1n8p s VAL 372 CO -0.03 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.74 1n8p n GLY 373 N 3.55 1.56 0.22 4.51 0.00 -1.26 -4.82 105.19 108.96 1n8p n GLY 373 Ca 0.12 -1.74 0.07 0.00 0.00 0.00 0.00 46.02 44.47 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 1.68 -0.65 -0.61 -5.35 -0.79 -4.20 119.36 109.44 1n8p n ILE 374 Ca 0.00 -1.81 -0.30 0.00 -0.27 0.00 0.00 62.75 60.37 1n8p n ILE 374 Cb 0.00 -0.01 0.26 0.00 -1.74 0.00 0.00 39.64 38.15 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 -2.29 -1.99 0.48 6.28 8.01 -1.26 -4.90 118.70 123.02 1n8p s GLU 375 Ca 0.25 0.20 -0.23 0.00 0.01 0.00 0.00 54.97 55.20 1n8p s GLU 375 Cb 0.21 -1.48 -0.08 0.00 -4.31 0.00 0.00 34.13 28.47 1n8p s GLU 375 CO 0.04 -4.27 1.18 -3.47 0.01 0.00 0.00 175.26 168.75 1n8p n ASP 376 N -5.21 2.00 -0.02 -0.19 -0.08 -1.26 -4.93 116.55 106.86 1n8p n ASP 376 Ca 0.11 1.02 -0.12 0.00 -1.51 0.00 0.00 54.79 54.28 1n8p n ASP 376 Cb 0.59 -1.47 -0.07 0.00 2.34 0.00 0.00 41.12 42.51 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 1.57 1.25 -0.63 5.18 2.02 -1.98 -2.90 112.91 117.43 1n8p h THR 377 Ca -0.48 -0.78 -0.07 0.00 0.77 0.00 0.00 66.41 65.85 1n8p h THR 377 Cb 1.32 1.61 -0.03 0.00 -1.74 0.00 0.00 68.15 69.31 1n8p h THR 377 CO 0.57 0.22 0.13 0.44 0.37 0.00 0.00 175.52 177.25 1n8p h ASP 378 N -0.13 0.97 -0.69 4.18 3.32 -1.98 0.18 116.42 122.28 1n8p h ASP 378 Ca 0.02 -0.25 0.07 0.00 0.02 0.00 0.00 57.03 56.90 1n8p h ASP 378 Cb 0.34 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.59 1n8p h ASP 378 CO 0.00 0.97 0.45 0.44 -1.72 0.00 0.00 179.24 179.39 1n8p h ASP 379 N 0.94 0.58 0.21 6.45 5.19 -1.95 0.92 116.42 128.76 1n8p h ASP 379 Ca 0.19 0.01 -0.29 0.00 -0.62 0.00 0.00 57.03 56.32 1n8p h ASP 379 Cb 0.39 -0.12 0.03 0.00 0.18 0.00 0.00 39.33 39.81 1n8p h ASP 379 CO 0.01 0.37 -1.34 -0.07 -3.12 0.00 0.00 179.24 175.09 1n8p h LEU 380 N 0.66 0.69 0.47 1.55 3.38 -1.24 -2.28 115.31 118.54 1n8p h LEU 380 Ca 0.30 -0.93 -0.02 0.00 0.09 0.00 0.00 57.88 57.32 1n8p h LEU 380 Cb 0.33 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1n8p h LEU 380 CO -0.10 1.63 -0.22 0.25 0.09 0.00 0.00 178.44 180.09 1n8p h LEU 381 N -0.03 -0.53 -2.73 1.67 5.85 -0.11 -1.07 115.31 118.36 1n8p h LEU 381 Ca -0.24 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1n8p h LEU 381 Cb 1.99 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 43.16 1n8p h LEU 381 CO 0.22 -0.32 0.08 -0.08 -0.34 0.00 0.00 178.44 178.00 1n8p h GLU 382 N -0.71 0.00 0.00 1.25 4.57 0.76 -0.48 114.58 119.96 1n8p h GLU 382 Ca -0.06 0.00 -0.17 0.00 -1.18 0.00 0.00 59.36 57.95 1n8p h GLU 382 Cb 0.52 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.09 1n8p h GLU 382 CO 0.11 0.00 -1.09 0.22 -1.18 0.00 0.00 179.01 177.06 1n8p h ASP 383 N 0.00 0.00 -0.14 1.04 3.58 -0.69 -2.69 116.42 117.52 1n8p h ASP 383 Ca 0.00 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.29 1n8p h ASP 383 Cb 0.17 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.22 1n8p h ASP 383 CO -0.00 0.68 -0.56 0.40 -2.88 0.00 0.00 179.24 176.88 1n8p h ILE 384 N 0.00 1.33 0.46 2.25 1.08 0.12 -2.95 117.51 119.80 1n8p h ILE 384 Ca -0.10 -1.82 -0.02 0.00 -0.39 0.00 0.00 64.86 62.53 1n8p h ILE 384 Cb 1.61 2.05 -0.01 0.00 -3.07 0.00 0.00 36.82 37.40 1n8p h ILE 384 CO 0.07 0.56 -0.33 0.11 -0.69 0.00 0.00 178.15 177.87 1n8p h LYS 385 N 0.29 -0.73 0.00 2.37 1.57 -1.51 -1.61 116.57 116.94 1n8p h LYS 385 Ca -0.03 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1n8p h LYS 385 Cb 1.19 0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1n8p h LYS 385 CO 0.12 -0.49 0.48 0.37 -0.57 0.00 0.00 179.45 179.35 1n8p h GLN 386 N -0.76 0.00 0.00 3.15 -0.00 -1.56 0.92 115.11 116.87 1n8p h GLN 386 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.59 1n8p h GLN 386 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.10 1n8p h GLN 386 CO 0.03 0.00 -1.58 0.00 0.00 0.00 0.00 178.83 177.28 1n8p n ALA 387 N -1.55 2.90 -0.04 3.38 0.00 -0.71 -3.91 120.51 120.59 1n8p n ALA 387 Ca -0.01 -0.41 -0.13 0.00 0.00 0.00 0.00 53.44 52.90 1n8p n ALA 387 Cb 0.49 -0.58 -0.08 0.00 0.00 0.00 0.00 19.45 19.29 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 0.20 -0.52 0.00 3.38 0.09 -2.68 115.31 115.78 1n8p h LEU 388 Ca 0.00 -0.42 0.06 0.00 0.09 0.00 0.00 57.88 57.61 1n8p h LEU 388 Cb 0.69 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 1n8p h LEU 388 CO 0.00 0.58 0.22 0.11 0.09 0.00 0.00 178.44 179.44 1n8p h LYS 389 N -0.17 0.41 -0.39 1.13 1.57 -1.73 0.04 116.57 117.42 1n8p h LYS 389 Ca 0.02 -0.02 0.08 0.00 -1.87 0.00 0.00 60.65 58.86 1n8p h LYS 389 Cb 0.51 -0.09 -0.08 0.00 0.08 0.00 0.00 32.23 32.65 1n8p h LYS 389 CO 0.01 0.27 -0.13 1.96 -0.57 0.00 0.00 179.45 180.99 1n8p h GLN 390 N 0.42 -0.04 -0.76 3.15 1.08 -1.65 0.35 115.11 117.66 1n8p h GLN 390 Ca 0.25 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.40 1n8p h GLN 390 Cb 0.24 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.64 1n8p h GLN 390 CO -0.23 -0.03 0.26 0.00 -0.95 0.00 0.00 178.83 177.89 1n8p h ALA 391 N 1.30 1.03 0.86 3.87 0.00 -1.05 -2.98 119.26 122.30 1n8p h ALA 391 Ca 0.19 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1n8p h ALA 391 Cb 0.34 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1n8p h ALA 391 CO -0.43 0.66 -0.49 1.15 0.00 0.00 0.00 179.25 180.14 1n8p h THR 392 N 1.11 0.00 0.00 0.00 2.02 0.21 -3.42 112.91 112.83 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 0.27 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 1n8p h THR 392 CO -0.01 0.00 0.00 0.59 0.37 0.00 0.00 175.52 176.47