#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n1h h SER 3 N 0.00 0.41 -0.46 -3.46 0.02 -1.96 0.73 113.55 108.83 1n1h h SER 3 Ca 0.00 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 60.74 1n1h h SER 3 Cb 0.00 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 1n1h h SER 3 CO 0.00 0.74 0.11 -0.03 -1.14 0.00 0.00 176.83 176.51 1n1h h MET 4 N 0.34 0.73 -0.15 3.45 1.85 -1.99 0.25 114.93 119.41 1n1h h MET 4 Ca 0.04 -0.18 -0.16 0.00 -0.61 0.00 0.00 59.70 58.80 1n1h h MET 4 Cb 0.79 -0.10 0.01 0.00 0.43 0.00 0.00 31.60 32.73 1n1h h MET 4 CO 0.06 0.73 -0.52 0.82 -0.40 0.00 0.00 176.91 177.60 1n1h h ILE 5 N 0.61 1.34 0.04 1.77 1.08 -1.86 -3.05 117.51 117.44 1n1h h ILE 5 Ca 0.14 -1.78 -0.00 0.00 -0.39 0.00 0.00 64.86 62.83 1n1h h ILE 5 Cb 0.33 2.03 0.00 0.00 -3.07 0.00 0.00 36.82 36.11 1n1h h ILE 5 CO 0.00 0.55 -0.02 -0.07 -0.69 0.00 0.00 178.15 177.92 1n1h h LEU 6 N 0.27 -0.05 -0.50 1.44 3.38 0.55 -0.96 115.31 119.43 1n1h h LEU 6 Ca -0.02 -0.16 0.10 0.00 0.09 0.00 0.00 57.88 57.89 1n1h h LEU 6 Cb 1.14 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.82 1n1h h LEU 6 CO 0.11 0.13 -0.02 0.74 0.09 0.00 0.00 178.44 179.49 1n1h h THR 7 N -0.23 0.58 -0.01 0.22 2.02 -0.59 0.87 112.91 115.78 1n1h h THR 7 Ca -0.01 -0.03 -0.17 0.00 0.77 0.00 0.00 66.41 66.97 1n1h h THR 7 Cb 0.20 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1n1h h THR 7 CO 0.01 0.02 -0.78 1.56 0.37 0.00 0.00 175.52 176.69 1n1h h GLN 8 N 0.09 0.10 0.00 6.66 1.08 -1.49 -3.36 115.11 118.20 1n1h h GLN 8 Ca 0.25 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 1n1h h GLN 8 Cb 0.39 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1n1h h GLN 8 CO -0.44 0.83 0.00 1.19 -0.95 0.00 0.00 178.83 179.46 1n1h n PHE 9 N -3.68 0.00 0.00 2.96 3.72 -0.37 -4.91 117.46 115.19 1n1h n PHE 9 Ca -0.02 -0.33 0.00 0.00 -0.05 0.00 0.00 57.45 57.05 1n1h n PHE 9 Cb 0.75 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.25 1n1h n PHE 9 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1n1h n GLY 10 N -0.33 -1.62 0.33 1.37 0.00 0.30 -0.79 105.19 104.45 1n1h n GLY 10 Ca 0.00 0.33 0.12 0.00 0.00 0.00 0.00 46.02 46.47 1n1h n GLY 10 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n1h h PRO 11 N 0.00 0.57 -0.18 1.61 0.11 -1.91 -2.18 132.00 130.02 1n1h h PRO 11 Ca 0.00 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 1n1h h PRO 11 Cb 0.00 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 1n1h h PRO 11 CO 0.00 0.38 0.05 0.35 -0.21 0.00 0.00 178.00 178.57 1n1h h PHE 12 N 0.59 0.29 -0.97 0.65 3.57 -1.44 -2.11 116.94 117.51 1n1h h PHE 12 Ca 0.55 -0.03 0.16 0.00 3.53 0.00 0.00 57.97 62.18 1n1h h PHE 12 Cb 0.93 -0.08 -0.10 0.00 2.79 0.00 0.00 35.95 39.49 1n1h h PHE 12 CO -0.07 0.39 0.58 0.82 -2.23 0.00 0.00 178.31 177.80 1n1h h ILE 13 N 0.11 0.77 -0.05 1.41 2.04 -0.32 -0.18 117.51 121.28 1n1h h ILE 13 Ca 0.06 -0.28 -0.14 0.00 1.00 0.00 0.00 64.86 65.50 1n1h h ILE 13 Cb 0.24 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.20 1n1h h ILE 13 CO -0.00 0.15 -0.60 -0.33 0.00 0.00 0.00 178.15 177.37 1n1h h GLU 14 N 0.80 0.18 0.00 2.37 5.08 -1.18 -2.74 114.58 119.09 1n1h h GLU 14 Ca 0.53 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.68 1n1h h GLU 14 Cb 0.74 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.99 1n1h h GLU 14 CO -0.35 0.72 -0.43 0.66 -1.00 0.00 0.00 179.01 178.62 1n1h h SER 15 N 0.13 0.00 -0.44 1.42 4.64 -0.37 -1.62 113.55 117.32 1n1h h SER 15 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1n1h h SER 15 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1n1h h SER 15 CO 0.09 0.43 0.00 2.30 -0.87 0.00 0.00 176.83 178.78 1n1h n ILE 16 N -3.79 0.60 0.30 0.95 -5.35 -0.86 -3.96 119.36 107.25 1n1h n ILE 16 Ca -0.01 -0.80 0.06 0.00 -0.27 0.00 0.00 62.75 61.73 1n1h n ILE 16 Cb 0.49 0.88 0.08 0.00 -1.74 0.00 0.00 39.64 39.36 1n1h n ILE 16 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1n1h n SER 17 N 1.44 2.24 -0.24 7.28 7.64 -1.04 -4.65 113.62 126.29 1n1h n SER 17 Ca 0.19 -1.63 -0.03 0.00 1.01 0.00 0.00 58.87 58.42 1n1h n SER 17 Cb 0.59 -0.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.71 1n1h n SER 17 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n1h n GLY 18 N 0.63 0.63 0.10 0.23 0.00 -1.18 -4.84 105.19 100.77 1n1h n GLY 18 Ca 0.08 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 1n1h n GLY 18 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1n1h n ILE 19 N -2.87 1.65 -4.14 -0.61 5.41 -0.69 -4.67 119.36 113.44 1n1h n ILE 19 Ca -0.03 -0.75 -0.10 0.00 1.00 0.00 0.00 62.75 62.87 1n1h n ILE 19 Cb 0.12 -1.24 -0.10 0.00 -0.71 0.00 0.00 39.64 37.71 1n1h n ILE 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1n1h s THR 20 N -2.57 0.58 0.72 1.39 -1.32 -0.73 -4.99 115.64 108.71 1n1h s THR 20 Ca -0.12 -1.75 -0.14 0.00 -1.21 0.00 0.00 61.69 58.47 1n1h s THR 20 Cb 0.07 -1.45 0.03 0.00 -1.51 0.00 0.00 72.50 69.65 1n1h s THR 20 CO 0.80 -0.80 1.16 -1.81 -2.21 0.00 0.00 174.62 171.75 1n1h s ASP 21 N -2.75 4.45 0.31 8.08 1.11 -1.26 -4.09 116.67 122.52 1n1h s ASP 21 Ca 0.07 2.17 -0.07 0.00 0.18 0.00 0.00 52.55 54.90 1n1h s ASP 21 Cb 0.03 -2.57 -0.06 0.00 1.07 0.00 0.00 42.92 41.39 1n1h s ASP 21 CO -0.05 -2.08 0.61 -1.10 1.18 0.00 0.00 175.17 173.73 1n1h s GLN 22 N -4.10 3.70 -0.18 8.23 -0.21 0.65 -4.63 119.66 123.11 1n1h s GLN 22 Ca 0.70 0.16 -0.27 0.00 0.02 0.00 0.00 55.36 55.97 1n1h s GLN 22 Cb -0.25 -2.58 0.07 0.00 1.00 0.00 0.00 33.01 31.25 1n1h s GLN 22 CO 0.46 0.17 0.73 -1.54 -2.12 0.00 0.00 175.29 172.98 1n1h s SER 23 N -3.03 -0.69 0.49 5.90 1.04 -1.26 -4.78 113.70 111.38 1n1h s SER 23 Ca 0.46 1.10 0.16 0.00 0.48 0.00 0.00 55.95 58.15 1n1h s SER 23 Cb -0.11 1.04 1.19 0.00 0.10 0.00 0.00 66.02 68.25 1n1h s SER 23 CO 0.29 -0.39 2.09 -1.13 0.98 0.00 0.00 173.24 175.08 1n1h h ASN 24 N 4.11 0.12 -0.48 7.02 -1.24 -1.98 -1.48 115.58 121.65 1n1h h ASN 24 Ca -0.28 -0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.70 1n1h h ASN 24 Cb 1.15 -0.03 -0.02 0.00 0.73 0.00 0.00 38.32 40.15 1n1h h ASN 24 CO 0.19 0.08 0.18 0.44 -1.29 0.00 0.00 177.43 177.03 1n1h h ASP 25 N 0.14 0.68 -0.14 1.15 3.32 -1.96 0.10 116.42 119.71 1n1h h ASP 25 Ca 0.09 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 1n1h h ASP 25 Cb 0.20 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 1n1h h ASP 25 CO -0.01 0.68 -0.14 0.58 -1.72 0.00 0.00 179.24 178.62 1n1h h VAL 26 N 0.64 1.35 0.26 -1.35 2.07 -1.89 -2.62 116.25 114.72 1n1h h VAL 26 Ca 0.16 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.37 1n1h h VAL 26 Cb 0.22 1.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1n1h h VAL 26 CO -0.01 0.38 -0.38 0.15 0.02 0.00 0.00 177.57 177.73 1n1h h PHE 27 N -0.04 -1.05 0.00 1.57 3.57 -1.16 0.91 116.94 120.75 1n1h h PHE 27 Ca 0.02 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 1n1h h PHE 27 Cb 0.68 0.42 -0.00 0.00 2.79 0.00 0.00 35.95 39.84 1n1h h PHE 27 CO 0.09 -0.51 -0.15 0.93 -2.23 0.00 0.00 178.31 176.44 1n1h h GLU 28 N -0.71 0.00 -0.08 1.11 5.08 -0.88 0.10 114.58 119.20 1n1h h GLU 28 Ca -0.01 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.17 1n1h h GLU 28 Cb 0.67 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1n1h h GLU 28 CO -0.13 0.15 -0.71 -0.44 -1.00 0.00 0.00 179.01 176.87 1n1h h ASP 29 N 0.00 0.48 -0.42 1.42 3.32 -0.99 -0.86 116.42 119.37 1n1h h ASP 29 Ca -0.00 -0.31 -0.11 0.00 0.02 0.00 0.00 57.03 56.62 1n1h h ASP 29 Cb 0.30 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1n1h h ASP 29 CO 0.02 1.04 -0.19 0.00 -1.72 0.00 0.00 179.24 178.40 1n1h h ALA 30 N 0.95 0.59 -0.45 3.45 0.00 0.36 -0.65 119.26 123.52 1n1h h ALA 30 Ca -0.03 -0.37 0.05 0.00 0.00 0.00 0.00 54.91 54.57 1n1h h ALA 30 Cb 1.28 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 1n1h h ALA 30 CO 0.12 0.54 0.17 0.00 0.00 0.00 0.00 179.25 180.08 1n1h h ALA 31 N 0.83 0.54 -0.48 0.00 0.00 -0.60 0.29 119.26 119.84 1n1h h ALA 31 Ca 0.10 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1n1h h ALA 31 Cb 0.75 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1n1h h ALA 31 CO 0.06 -0.22 0.08 -0.22 0.00 0.00 0.00 179.25 178.95 1n1h h LYS 32 N 0.34 0.74 -0.41 0.00 3.64 -0.92 -0.47 116.57 119.50 1n1h h LYS 32 Ca 0.21 -0.15 -0.06 0.00 -1.27 0.00 0.00 60.65 59.38 1n1h h LYS 32 Cb 0.19 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 1n1h h LYS 32 CO -0.20 0.69 0.03 0.00 -2.27 0.00 0.00 179.45 177.70 1n1h h ALA 33 N 1.39 0.54 -0.51 5.00 0.00 0.36 -1.91 119.26 124.13 1n1h h ALA 33 Ca 0.15 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1n1h h ALA 33 Cb 0.31 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1n1h h ALA 33 CO 0.00 0.30 0.31 0.74 0.00 0.00 0.00 179.25 180.60 1n1h h PHE 34 N 0.54 0.58 0.00 0.00 0.04 -0.07 -2.23 116.94 115.80 1n1h h PHE 34 Ca 0.12 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.88 1n1h h PHE 34 Cb 0.43 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 38.39 1n1h h PHE 34 CO 0.03 0.34 -0.12 0.77 -0.60 0.00 0.00 178.31 178.73 1n1h h SER 35 N 0.62 0.00 -0.13 2.17 0.02 -0.82 -2.65 113.55 112.76 1n1h h SER 35 Ca 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1n1h h SER 35 Cb -0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1n1h h SER 35 CO -0.08 0.12 0.00 0.23 -1.14 0.00 0.00 176.83 175.96 1n1h n MET 36 N -4.09 2.22 -2.66 3.45 2.81 -0.74 -4.87 117.12 113.24 1n1h n MET 36 Ca -0.02 -1.80 -0.43 0.00 -1.81 0.00 0.00 57.70 53.64 1n1h n MET 36 Cb 0.21 -1.47 -0.02 0.00 -0.71 0.00 0.00 33.22 31.22 1n1h n MET 36 CO 0.00 0.00 0.00 0.12 1.51 0.00 0.00 175.97 177.60 1n1h s PHE 37 N -1.85 3.45 0.47 2.03 5.36 -0.89 -5.02 117.98 121.53 1n1h s PHE 37 Ca 0.33 1.53 -0.11 0.00 -0.96 0.00 0.00 56.93 57.72 1n1h s PHE 37 Cb 0.21 -3.23 -0.06 0.00 -0.34 0.00 0.00 43.02 39.60 1n1h s PHE 37 CO 0.31 -0.39 0.86 0.95 -1.46 0.00 0.00 175.22 175.48 1n1h s THR 38 N 2.20 4.74 0.14 0.12 -4.23 -1.26 -4.97 115.64 112.38 1n1h s THR 38 Ca 0.49 0.71 -0.26 0.00 -1.18 0.00 0.00 61.69 61.44 1n1h s THR 38 Cb -0.19 -3.77 -0.01 0.00 1.34 0.00 0.00 72.50 69.87 1n1h s THR 38 CO 0.17 -0.71 1.60 0.03 -0.54 0.00 0.00 174.62 175.17 1n1h h ARG 39 N 0.76 -0.38 -0.06 3.99 3.08 -1.99 -0.54 114.38 119.24 1n1h h ARG 39 Ca -0.47 0.03 0.02 0.00 0.07 0.00 0.00 59.98 59.63 1n1h h ARG 39 Cb 1.19 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 31.32 1n1h h ARG 39 CO 0.63 -0.25 0.14 0.77 -1.07 0.00 0.00 179.97 180.18 1n1h h SER 40 N -0.39 0.00 0.42 7.04 0.02 -1.93 -0.36 113.55 118.34 1n1h h SER 40 Ca 0.10 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.95 1n1h h SER 40 Cb 0.56 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 1n1h h SER 40 CO -0.39 0.00 -0.48 0.44 -1.14 0.00 0.00 176.83 175.27 1n1h h ASP 41 N 0.00 0.08 -0.07 3.07 3.32 -1.47 -1.90 116.42 119.46 1n1h h ASP 41 Ca 0.03 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 56.94 1n1h h ASP 41 Cb 0.30 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 1n1h h ASP 41 CO -0.00 0.55 -0.27 0.58 -1.72 0.00 0.00 179.24 178.37 1n1h h VAL 42 N 0.06 1.27 -0.06 -1.35 2.07 -1.02 0.19 116.25 117.41 1n1h h VAL 42 Ca 0.00 -1.32 -0.14 0.00 0.82 0.00 0.00 66.70 66.06 1n1h h VAL 42 Cb 0.87 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 32.00 1n1h h VAL 42 CO 0.07 0.42 -0.61 1.88 0.02 0.00 0.00 177.57 179.35 1n1h h TYR 43 N 0.45 0.26 -0.34 1.57 0.05 -1.51 -0.28 116.97 117.17 1n1h h TYR 43 Ca 0.06 -0.10 -0.07 0.00 0.05 0.00 0.00 58.73 58.67 1n1h h TYR 43 Cb 0.71 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 1n1h h TYR 43 CO 0.02 0.76 -0.05 0.87 -1.05 0.00 0.00 178.16 178.72 1n1h h LYS 44 N 0.15 0.63 -0.67 4.88 1.57 -0.71 -0.97 116.57 121.45 1n1h h LYS 44 Ca -0.01 -0.23 0.03 0.00 -1.87 0.00 0.00 60.65 58.58 1n1h h LYS 44 Cb 1.11 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.33 1n1h h LYS 44 CO 0.09 0.78 0.42 0.00 -0.57 0.00 0.00 179.45 180.17 1n1h h ALA 45 N 0.83 0.88 -0.37 3.86 0.00 -0.35 -1.54 119.26 122.56 1n1h h ALA 45 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1n1h h ALA 45 Cb 0.53 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1n1h h ALA 45 CO 0.03 0.18 0.24 -0.07 0.00 0.00 0.00 179.25 179.63 1n1h h LEU 46 N 0.82 0.43 -1.48 0.00 3.38 -0.63 -1.66 115.31 116.17 1n1h h LEU 46 Ca 0.27 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 1n1h h LEU 46 Cb 0.02 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1n1h h LEU 46 CO -0.11 0.31 -0.26 0.44 0.09 0.00 0.00 178.44 178.92 1n1h h ASP 47 N 0.50 0.00 0.71 -0.43 3.32 -0.14 -2.69 116.42 117.69 1n1h h ASP 47 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1n1h h ASP 47 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1n1h h ASP 47 CO -0.03 0.26 0.00 -0.62 -1.72 0.00 0.00 179.24 177.13 1n1h n GLU 48 N -3.89 0.20 -2.59 3.56 1.02 -0.62 -4.75 120.64 113.57 1n1h n GLU 48 Ca -0.02 0.44 -0.43 0.00 -0.02 0.00 0.00 57.16 57.14 1n1h n GLU 48 Cb 0.34 -1.89 -0.02 0.00 -0.02 0.00 0.00 31.44 29.84 1n1h n GLU 48 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1n1h s ILE 49 N -3.34 4.56 -1.46 -3.67 1.01 -1.01 -4.32 121.20 112.96 1n1h s ILE 49 Ca 0.04 1.85 -0.12 0.00 0.00 0.00 0.00 60.65 62.42 1n1h s ILE 49 Cb 0.09 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1n1h s ILE 49 CO 0.39 -0.03 2.55 -0.81 0.00 0.00 0.00 174.94 177.04 1n1h n PRO 50 N 5.33 3.11 -1.62 2.79 -0.04 -1.26 -4.99 135.00 138.31 1n1h n PRO 50 Ca 0.10 -2.28 -0.43 0.00 -0.04 0.00 0.00 63.50 60.85 1n1h n PRO 50 Cb 0.47 -2.98 -0.01 0.00 -0.04 0.00 0.00 33.50 30.95 1n1h n PRO 50 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1n1h n PHE 51 N 4.87 1.53 -2.78 0.54 3.72 -1.26 -4.76 117.46 119.31 1n1h n PHE 51 Ca 0.64 0.62 -0.27 0.00 -0.05 0.00 0.00 57.45 58.40 1n1h n PHE 51 Cb 0.30 -2.29 -0.00 0.00 -0.94 0.00 0.00 39.48 36.54 1n1h n PHE 51 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1n1h s SER 52 N -0.53 6.24 0.38 4.37 0.15 0.15 -4.99 113.70 119.47 1n1h s SER 52 Ca 0.59 0.82 0.07 0.00 0.70 0.00 0.00 55.95 58.12 1n1h s SER 52 Cb -0.63 -2.18 0.76 0.00 -1.71 0.00 0.00 66.02 62.27 1n1h s SER 52 CO 0.60 -0.54 1.97 0.44 1.20 0.00 0.00 173.24 176.91 1n1h h ASP 53 N 0.32 0.42 0.22 5.45 3.32 -1.94 -1.84 116.42 122.38 1n1h h ASP 53 Ca -0.47 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 56.53 1n1h h ASP 53 Cb 1.21 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 1n1h h ASP 53 CO 0.61 0.42 -0.01 -2.24 -1.72 0.00 0.00 179.24 176.31 1n1h h ASP 54 N 0.46 0.00 -0.05 6.45 3.04 -1.94 -0.44 116.42 123.95 1n1h h ASP 54 Ca 0.11 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.90 1n1h h ASP 54 Cb 0.16 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.45 1n1h h ASP 54 CO -0.01 0.01 0.00 0.00 -2.04 0.00 0.00 179.24 177.20 1n1h n ALA 55 N -2.11 2.59 -2.57 4.15 0.00 -0.69 -4.88 120.51 117.00 1n1h n ALA 55 Ca -0.02 -0.37 -0.29 0.00 0.00 0.00 0.00 53.44 52.76 1n1h n ALA 55 Cb 0.13 -1.24 -0.10 0.00 0.00 0.00 0.00 19.45 18.24 1n1h n ALA 55 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1n1h s MET 56 N -1.94 2.07 -0.05 0.00 -1.94 -0.18 -4.26 119.30 113.00 1n1h s MET 56 Ca 0.37 -1.10 -0.25 0.00 -1.71 0.00 0.00 55.69 53.00 1n1h s MET 56 Cb 0.19 -2.25 0.05 0.00 2.01 0.00 0.00 34.83 34.84 1n1h s MET 56 CO 0.31 0.48 0.55 -0.48 -0.01 0.00 0.00 175.02 175.87 1n1h s LEU 57 N -2.37 -0.13 -0.26 -0.03 2.34 -1.26 -5.04 118.68 111.92 1n1h s LEU 57 Ca 0.22 0.55 -0.40 0.00 0.06 0.00 0.00 54.13 54.56 1n1h s LEU 57 Cb -0.10 2.08 -0.15 0.00 -0.56 0.00 0.00 46.19 47.46 1n1h s LEU 57 CO 0.14 -0.52 1.77 -2.65 -1.06 0.00 0.00 176.35 174.02 1n1h n PRO 58 N 1.18 1.26 -3.47 1.48 -0.02 -1.26 -4.95 135.00 129.22 1n1h n PRO 58 Ca -0.19 0.46 -0.42 0.00 -2.02 0.00 0.00 63.50 61.33 1n1h n PRO 58 Cb 0.57 -2.17 -0.10 0.00 -0.02 0.00 0.00 33.50 31.78 1n1h n PRO 58 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1n1h s ILE 59 N 3.65 5.25 -0.12 4.25 1.01 -1.26 -5.04 121.20 128.94 1n1h s ILE 59 Ca 0.98 -0.41 -0.38 0.00 0.00 0.00 0.00 60.65 60.84 1n1h s ILE 59 Cb -1.03 -3.84 -0.15 0.00 0.01 0.00 0.00 42.46 37.44 1n1h s ILE 59 CO 0.64 -0.18 1.65 -2.65 0.00 0.00 0.00 174.94 174.40 1n1h n PRO 60 N 5.18 1.37 0.24 2.79 -0.02 -1.26 -4.90 135.00 138.40 1n1h n PRO 60 Ca -0.11 0.50 0.08 0.00 -2.02 0.00 0.00 63.50 61.95 1n1h n PRO 60 Cb 0.48 -2.20 0.58 0.00 -0.02 0.00 0.00 33.50 32.34 1n1h n PRO 60 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1n1h h PRO 61 N 6.71 0.00 0.00 0.52 0.11 -2.00 -2.56 132.00 134.78 1n1h h PRO 61 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1n1h h PRO 61 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1n1h h PRO 61 CO 0.90 0.17 0.00 0.25 -0.21 0.00 0.00 178.00 179.12 1n1h n THR 62 N -4.06 0.52 0.25 -1.15 -2.24 -1.26 -2.07 114.28 104.27 1n1h n THR 62 Ca -0.02 0.13 0.14 0.00 -2.27 0.00 0.00 64.05 62.03 1n1h n THR 62 Cb 0.25 -0.87 0.53 0.00 -2.10 0.00 0.00 70.33 68.14 1n1h n THR 62 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1n1h h ILE 63 N 0.00 0.22 0.00 2.28 2.04 -1.72 -3.26 117.51 117.07 1n1h h ILE 63 Ca 0.00 -0.83 -0.17 0.00 1.00 0.00 0.00 64.86 64.86 1n1h h ILE 63 Cb 0.14 1.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 1n1h h ILE 63 CO 0.00 0.09 -2.13 -1.22 0.00 0.00 0.00 178.15 174.89 1n1h n TYR 64 N -3.20 0.06 -3.70 1.37 4.01 -0.88 -4.81 117.16 110.01 1n1h n TYR 64 Ca 0.01 0.02 -0.38 0.00 -0.16 0.00 0.00 57.90 57.38 1n1h n TYR 64 Cb 0.39 -0.76 -0.11 0.00 -0.31 0.00 0.00 39.34 38.55 1n1h n TYR 64 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1n1h s THR 65 N -3.03 3.83 0.20 -0.72 -4.23 -1.23 -4.54 115.64 105.92 1n1h s THR 65 Ca -0.09 -1.48 0.11 0.00 -1.18 0.00 0.00 61.69 59.05 1n1h s THR 65 Cb 0.10 -3.35 -0.04 0.00 1.34 0.00 0.00 72.50 70.54 1n1h s THR 65 CO 0.87 -0.44 -0.22 -0.54 -0.54 0.00 0.00 174.62 173.75 1n1h s LYS 66 N 1.35 1.48 0.50 3.99 -0.14 -1.26 -4.86 119.74 120.80 1n1h s LYS 66 Ca 0.02 -1.54 -0.08 0.00 -1.36 0.00 0.00 55.97 53.01 1n1h s LYS 66 Cb -0.22 -1.69 0.13 0.00 -1.68 0.00 0.00 37.83 34.37 1n1h s LYS 66 CO 0.01 0.35 0.42 -2.30 -0.76 0.00 0.00 175.35 173.07 1n1h n PRO 67 N 0.12 -2.05 -2.79 -1.68 -0.02 -1.26 -4.00 135.00 123.32 1n1h n PRO 67 Ca -0.11 -0.68 -0.31 0.00 -2.02 0.00 0.00 63.50 60.37 1n1h n PRO 67 Cb 0.57 -0.67 -0.04 0.00 -0.02 0.00 0.00 33.50 33.34 1n1h n PRO 67 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n1h s SER 68 N -2.65 6.64 0.27 2.55 0.15 -1.26 -1.39 113.70 118.01 1n1h s SER 68 Ca 0.28 1.33 0.04 0.00 0.70 0.00 0.00 55.95 58.30 1n1h s SER 68 Cb -0.03 -2.40 0.37 0.00 -1.71 0.00 0.00 66.02 62.24 1n1h s SER 68 CO 0.22 -0.41 1.66 1.12 1.20 0.00 0.00 173.24 177.03 1n1h h HIS 69 N 1.43 0.42 -0.96 3.44 2.07 -1.95 -3.35 115.15 116.25 1n1h h HIS 69 Ca -0.47 -0.12 0.32 0.00 -2.85 0.00 0.00 60.37 57.25 1n1h h HIS 69 Cb 1.18 -0.09 -0.18 0.00 2.57 0.00 0.00 27.41 30.89 1n1h h HIS 69 CO 0.62 0.71 0.21 -0.40 -3.07 0.00 0.00 177.93 176.01 1n1h n ASP 70 N -4.03 0.06 0.00 3.10 5.75 -1.26 0.02 116.55 120.19 1n1h n ASP 70 Ca -0.01 1.62 0.10 0.00 -0.01 0.00 0.00 54.79 56.48 1n1h n ASP 70 Cb 0.49 -0.67 0.52 0.00 -1.03 0.00 0.00 41.12 40.43 1n1h n ASP 70 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1n1h n SER 71 N -5.33 0.00 -0.92 -1.12 3.41 -1.26 -2.98 113.62 105.42 1n1h n SER 71 Ca 0.28 -0.05 0.12 0.00 -0.26 0.00 0.00 58.87 58.96 1n1h n SER 71 Cb 0.93 -0.26 0.19 0.00 -0.26 0.00 0.00 64.21 64.81 1n1h n SER 71 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1n1h n TYR 72 N -1.26 0.11 -4.44 7.33 4.01 0.10 -4.91 117.16 118.11 1n1h n TYR 72 Ca 0.10 -0.06 -0.22 0.00 -0.16 0.00 0.00 57.90 57.56 1n1h n TYR 72 Cb 0.15 0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.09 1n1h n TYR 72 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1n1h s TYR 73 N -1.89 1.75 -0.03 -0.72 2.02 -1.16 -0.91 117.35 116.41 1n1h s TYR 73 Ca 0.32 -1.28 -0.30 0.00 -0.37 0.00 0.00 57.07 55.43 1n1h s TYR 73 Cb 0.21 -1.06 0.11 0.00 -0.40 0.00 0.00 41.96 40.82 1n1h s TYR 73 CO 0.31 -0.35 1.19 1.52 -1.57 0.00 0.00 175.55 176.65 1n1h s TYR 74 N -3.37 -0.09 -0.20 2.71 -0.85 -0.26 -4.69 117.35 110.60 1n1h s TYR 74 Ca 0.30 -0.03 -0.05 0.00 -0.52 0.00 0.00 57.07 56.77 1n1h s TYR 74 Cb 0.04 0.55 -0.03 0.00 0.38 0.00 0.00 41.96 42.91 1n1h s TYR 74 CO 0.16 -0.37 0.01 0.42 -1.52 0.00 0.00 175.55 174.25 1n1h s ILE 75 N -2.61 4.05 0.91 -3.49 -1.09 -1.26 0.07 121.20 117.78 1n1h s ILE 75 Ca 0.12 -0.28 -0.12 0.00 -2.23 0.00 0.00 60.65 58.14 1n1h s ILE 75 Cb 0.02 -2.83 0.19 0.00 -1.58 0.00 0.00 42.46 38.26 1n1h s ILE 75 CO -0.03 0.43 1.24 1.51 -1.23 0.00 0.00 174.94 176.86 1n1h s ASP 76 N 0.91 3.36 0.62 3.58 1.47 -0.96 -4.86 116.67 120.79 1n1h s ASP 76 Ca 0.01 0.04 0.38 0.00 1.18 0.00 0.00 52.55 54.16 1n1h s ASP 76 Cb -0.14 -0.14 2.06 0.00 -0.34 0.00 0.00 42.92 44.36 1n1h s ASP 76 CO 0.02 -2.56 2.16 0.00 0.68 0.00 0.00 175.17 175.47 1n1h h ALA 77 N -1.38 1.09 -0.67 2.11 0.00 -2.00 0.30 119.26 118.71 1n1h h ALA 77 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1n1h h ALA 77 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1n1h h ALA 77 CO 0.37 -0.09 0.00 1.28 0.00 0.00 0.00 179.25 180.81 1n1h n LEU 78 N -2.92 4.26 0.00 0.00 4.77 -1.26 -4.95 117.00 116.91 1n1h n LEU 78 Ca -0.03 -2.21 0.00 0.00 -0.03 0.00 0.00 56.01 53.75 1n1h n LEU 78 Cb 0.15 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 1n1h n LEU 78 CO 0.17 0.90 0.00 -3.20 -1.33 0.00 0.00 177.39 173.93 1n1h n ASN 79 N 1.33 -3.06 -4.79 -1.43 5.15 0.10 -4.99 115.26 107.57 1n1h n ASN 79 Ca 0.24 0.00 -0.39 0.00 -0.60 0.00 0.00 54.58 53.84 1n1h n ASN 79 Cb 0.73 -1.87 -0.06 0.00 -0.53 0.00 0.00 39.78 38.05 1n1h n ASN 79 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1n1h s ARG 80 N -0.90 4.31 0.26 1.20 1.70 -1.26 -4.75 118.95 119.50 1n1h s ARG 80 Ca 0.00 0.84 -0.30 0.00 -0.47 0.00 0.00 55.73 55.80 1n1h s ARG 80 Cb 0.00 -3.27 -0.10 0.00 -0.57 0.00 0.00 34.95 31.01 1n1h s ARG 80 CO 0.00 0.56 1.45 0.08 -1.08 0.00 0.00 175.30 176.31 1n1h s VAL 81 N -0.90 2.60 0.06 4.99 1.01 -1.26 -2.27 120.40 124.63 1n1h s VAL 81 Ca 0.31 0.51 0.03 0.00 0.00 0.00 0.00 61.98 62.83 1n1h s VAL 81 Cb -0.20 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 1n1h s VAL 81 CO 0.20 0.08 -0.09 -0.13 0.00 0.00 0.00 175.10 175.17 1n1h s ARG 82 N -0.44 0.65 0.04 2.72 1.81 0.11 -4.94 118.95 118.90 1n1h s ARG 82 Ca 0.59 -0.91 -0.29 0.00 -1.72 0.00 0.00 55.73 53.40 1n1h s ARG 82 Cb -0.42 -0.39 -0.04 0.00 -0.45 0.00 0.00 34.95 33.65 1n1h s ARG 82 CO 0.44 0.06 0.92 0.50 -0.68 0.00 0.00 175.30 176.54 1n1h s ARG 83 N -2.06 4.59 -0.29 3.54 6.06 -1.26 -1.11 118.95 128.42 1n1h s ARG 83 Ca -0.04 1.34 -0.17 0.00 -2.50 0.00 0.00 55.73 54.35 1n1h s ARG 83 Cb -0.07 -3.42 -0.02 0.00 0.06 0.00 0.00 34.95 31.50 1n1h s ARG 83 CO -0.00 0.10 0.48 0.21 -2.50 0.00 0.00 175.30 173.59 1n1h s LYS 84 N 0.48 3.91 0.23 5.12 2.36 -0.09 -4.88 119.74 126.88 1n1h s LYS 84 Ca 0.47 0.09 -0.30 0.00 -2.55 0.00 0.00 55.97 53.68 1n1h s LYS 84 Cb -0.21 -3.70 -0.09 0.00 -1.05 0.00 0.00 37.83 32.77 1n1h s LYS 84 CO 0.27 -0.43 1.27 0.99 1.55 0.00 0.00 175.35 179.00 1n1h s THR 85 N 2.27 3.19 0.00 3.43 2.01 -1.26 -4.76 115.64 120.52 1n1h s THR 85 Ca 0.19 1.04 0.00 0.00 0.31 0.00 0.00 61.69 63.23 1n1h s THR 85 Cb -0.16 -3.67 0.00 0.00 0.01 0.00 0.00 72.50 68.69 1n1h s THR 85 CO 0.11 0.19 0.00 -1.22 -0.69 0.00 0.00 174.62 173.00 1n1h n TYR 86 N 2.07 0.00 0.66 4.92 4.01 -1.26 -4.83 117.16 122.73 1n1h n TYR 86 Ca 0.04 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.88 1n1h n TYR 86 Cb 0.43 0.10 0.28 0.00 -0.31 0.00 0.00 39.34 39.84 1n1h n TYR 86 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1n1h n GLN 87 N -2.16 2.15 0.00 -0.72 1.13 -1.26 -5.04 117.38 111.49 1n1h n GLN 87 Ca 0.00 -1.75 0.00 0.00 -1.94 0.00 0.00 57.00 53.31 1n1h n GLN 87 Cb 0.19 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.10 1n1h n GLN 87 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1n1h n GLY 88 N 1.33 2.32 0.45 1.08 0.00 -1.26 -4.80 105.19 104.30 1n1h n GLY 88 Ca 0.18 -2.02 0.28 0.00 0.00 0.00 0.00 46.02 44.45 1n1h n GLY 88 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n1h h PRO 89 N 0.00 0.23 -0.47 1.61 0.11 -1.97 -1.23 132.00 130.28 1n1h h PRO 89 Ca 0.00 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.97 1n1h h PRO 89 Cb 0.00 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 1n1h h PRO 89 CO 0.00 0.16 -0.19 -0.44 -0.21 0.00 0.00 178.00 177.31 1n1h h ASP 90 N 0.24 0.99 -0.01 -2.05 3.32 -2.03 -3.40 116.42 113.47 1n1h h ASP 90 Ca 0.59 -0.39 -0.25 0.00 0.02 0.00 0.00 57.03 57.00 1n1h h ASP 90 Cb 1.81 -0.27 0.06 0.00 0.22 0.00 0.00 39.33 41.15 1n1h h ASP 90 CO -0.21 1.16 0.85 -0.67 -1.72 0.00 0.00 179.24 178.65 1n1h n ASP 91 N -4.15 0.13 0.00 6.45 2.03 -0.46 -4.11 116.55 116.43 1n1h n ASP 91 Ca -0.00 -1.79 0.00 0.00 0.52 0.00 0.00 54.79 53.52 1n1h n ASP 91 Cb 0.44 -0.57 0.00 0.00 -0.72 0.00 0.00 41.12 40.27 1n1h n ASP 91 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1n1h n VAL 92 N 6.05 0.00 -0.77 5.18 0.31 -1.26 -4.37 118.33 123.47 1n1h n VAL 92 Ca 0.27 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1n1h n VAL 92 Cb 0.39 1.30 0.00 0.00 -0.91 0.00 0.00 33.84 34.62 1n1h n VAL 92 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1n1h n TYR 93 N -0.11 -2.75 -2.46 3.52 4.01 -1.26 -4.66 117.16 113.46 1n1h n TYR 93 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 1n1h n TYR 93 Cb 0.08 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.08 1n1h n TYR 93 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1n1h s VAL 94 N -0.62 4.11 0.45 -0.72 1.01 -1.25 -4.98 120.40 118.39 1n1h s VAL 94 Ca 0.00 1.53 -0.11 0.00 0.00 0.00 0.00 61.98 63.40 1n1h s VAL 94 Cb 0.00 -3.98 -0.06 0.00 0.00 0.00 0.00 36.38 32.34 1n1h s VAL 94 CO 0.00 0.13 0.83 -2.16 0.00 0.00 0.00 175.10 173.89 1n1h s PRO 95 N 0.98 3.77 -0.70 2.72 0.04 -1.26 -4.32 135.00 136.23 1n1h s PRO 95 Ca 0.58 0.54 -0.25 0.00 0.04 0.00 0.00 61.00 61.91 1n1h s PRO 95 Cb -0.29 -2.33 0.05 0.00 0.04 0.00 0.00 34.50 31.98 1n1h s PRO 95 CO 0.29 -0.13 1.12 -0.80 0.04 0.00 0.00 177.00 177.52 1n1h s ASN 96 N -3.31 6.17 0.33 6.66 -0.87 0.12 -4.77 114.94 119.27 1n1h s ASN 96 Ca 0.52 -0.72 0.07 0.00 -1.57 0.00 0.00 52.86 51.16 1n1h s ASN 96 Cb -0.10 -2.49 -0.03 0.00 -0.02 0.00 0.00 41.25 38.61 1n1h s ASN 96 CO 0.34 -1.64 0.27 0.00 -2.57 0.00 0.00 177.10 173.50 1n1h s SER 98 N -3.38 4.10 0.00 0.00 1.04 -0.48 -2.29 113.70 112.68 1n1h s SER 98 Ca 0.40 1.23 0.00 0.00 0.48 0.00 0.00 55.95 58.06 1n1h s SER 98 Cb 0.02 -1.92 0.00 0.00 0.10 0.00 0.00 66.02 64.22 1n1h s SER 98 CO 0.27 -2.21 0.00 0.00 0.98 0.00 0.00 173.24 172.28 1n1h n ILE 99 N -3.58 0.00 -0.34 -1.02 3.06 -1.26 -4.63 119.36 111.59 1n1h n ILE 99 Ca 0.07 0.00 0.08 0.00 -2.50 0.00 0.00 62.75 60.40 1n1h n ILE 99 Cb 0.57 0.00 0.26 0.00 0.54 0.00 0.00 39.64 41.01 1n1h n ILE 99 CO 0.00 0.00 0.00 1.62 -2.50 0.00 0.00 176.55 175.67 1n1h h VAL 100 N 0.00 0.92 0.00 9.51 3.04 -1.86 -1.32 116.25 126.54 1n1h h VAL 100 Ca 0.00 -0.33 0.00 0.00 -1.01 0.00 0.00 66.70 65.36 1n1h h VAL 100 Cb 0.00 -0.12 0.00 0.00 -2.01 0.00 0.00 31.29 29.16 1n1h h VAL 100 CO 0.00 0.17 0.19 1.05 -1.01 0.00 0.00 177.57 177.97 1n1h h GLU 101 N 0.95 0.00 -0.34 4.17 9.09 -1.95 -0.88 114.58 125.62 1n1h h GLU 101 Ca 0.48 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.89 1n1h h GLU 101 Cb 0.51 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.61 1n1h h GLU 101 CO -0.25 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.09 1n1h n LEU 102 N -2.28 4.30 -4.54 3.06 4.77 -0.50 -5.02 117.00 116.80 1n1h n LEU 102 Ca -0.01 -2.95 -0.24 0.00 -0.03 0.00 0.00 56.01 52.78 1n1h n LEU 102 Cb 0.22 -0.57 -0.09 0.00 -2.33 0.00 0.00 43.42 40.65 1n1h n LEU 102 CO 0.09 0.67 -0.42 -0.76 -1.33 0.00 0.00 177.39 175.64 1n1h s LEU 103 N -2.73 2.84 -0.15 2.23 1.43 -0.34 -1.91 118.68 120.04 1n1h s LEU 103 Ca 0.45 -0.88 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 1n1h s LEU 103 Cb 0.35 -1.35 0.01 0.00 0.03 0.00 0.00 46.19 45.24 1n1h s LEU 103 CO 0.11 0.02 -0.21 -1.61 0.23 0.00 0.00 176.35 174.89 1n1h s GLU 104 N -3.58 2.95 0.50 1.70 2.02 -0.31 -4.72 118.70 117.26 1n1h s GLU 104 Ca 0.31 -0.82 -0.20 0.00 0.02 0.00 0.00 54.97 54.27 1n1h s GLU 104 Cb -0.05 -2.45 -0.11 0.00 0.10 0.00 0.00 34.13 31.62 1n1h s GLU 104 CO 0.17 -0.09 0.53 -2.30 0.02 0.00 0.00 175.26 173.59 1n1h n PRO 105 N 4.30 0.56 -2.90 0.39 -0.02 -1.26 -2.87 135.00 133.20 1n1h n PRO 105 Ca -0.20 0.21 -0.37 0.00 -2.02 0.00 0.00 63.50 61.12 1n1h n PRO 105 Cb 0.51 -1.61 -0.06 0.00 -0.02 0.00 0.00 33.50 32.31 1n1h n PRO 105 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1n1h s HIS 106 N -1.61 3.70 -0.86 6.00 2.46 0.26 -4.85 115.29 120.39 1n1h s HIS 106 Ca 0.66 1.65 -0.25 0.00 0.47 0.00 0.00 55.06 57.59 1n1h s HIS 106 Cb -0.51 -2.82 -0.01 0.00 -0.13 0.00 0.00 32.58 29.12 1n1h s HIS 106 CO 0.56 0.28 1.71 -1.83 -2.47 0.00 0.00 174.74 173.00 1n1h s GLU 107 N -1.93 2.94 0.00 2.88 1.03 -1.26 -2.71 118.70 119.64 1n1h s GLU 107 Ca 0.47 -0.35 0.00 0.00 0.03 0.00 0.00 54.97 55.11 1n1h s GLU 107 Cb -0.19 -4.92 0.00 0.00 -0.80 0.00 0.00 34.13 28.23 1n1h s GLU 107 CO 0.23 -2.78 0.00 2.41 -1.33 0.00 0.00 175.26 173.79 1n1h n THR 108 N 7.30 0.00 -1.67 1.83 -1.04 -1.26 -4.90 114.28 114.54 1n1h n THR 108 Ca 0.30 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.99 1n1h n THR 108 Cb 0.49 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.96 1n1h n THR 108 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1n1h n LEU 109 N 0.00 7.12 -0.43 -4.42 4.77 -1.22 -4.79 117.00 118.03 1n1h n LEU 109 Ca 0.00 -4.37 0.35 0.00 -0.03 0.00 0.00 56.01 51.96 1n1h n LEU 109 Cb 0.00 -1.30 0.57 0.00 -2.33 0.00 0.00 43.42 40.35 1n1h n LEU 109 CO 0.00 1.88 1.02 0.35 -1.33 0.00 0.00 177.39 179.31 1n1h n THR 110 N 1.38 -0.13 1.49 -5.08 -2.24 -1.10 0.11 114.28 108.72 1n1h n THR 110 Ca 0.55 1.31 0.15 0.00 -2.27 0.00 0.00 64.05 63.79 1n1h n THR 110 Cb 0.44 -2.16 0.70 0.00 -2.10 0.00 0.00 70.33 67.21 1n1h n THR 110 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1n1h n SER 111 N -3.97 0.27 -4.57 3.42 7.64 -1.26 -4.35 113.62 110.80 1n1h n SER 111 Ca 0.33 -0.49 -0.27 0.00 1.01 0.00 0.00 58.87 59.44 1n1h n SER 111 Cb 1.35 -0.14 -0.09 0.00 -1.01 0.00 0.00 64.21 64.31 1n1h n SER 111 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1n1h s TYR 112 N -2.44 2.64 0.06 1.43 2.02 0.31 0.11 117.35 121.48 1n1h s TYR 112 Ca 0.31 -0.22 -0.11 0.00 -0.37 0.00 0.00 57.07 56.69 1n1h s TYR 112 Cb 0.20 -1.31 0.01 0.00 -0.40 0.00 0.00 41.96 40.46 1n1h s TYR 112 CO 0.45 0.49 0.24 0.20 -1.57 0.00 0.00 175.55 175.37 1n1h s GLY 113 N -2.71 -0.01 0.52 0.71 0.00 0.61 0.91 107.32 107.34 1n1h s GLY 113 Ca 0.24 -0.30 0.04 0.00 0.00 0.00 0.00 44.72 44.70 1n1h s GLY 113 CO 0.15 -0.49 0.22 -1.60 0.00 0.00 0.00 173.10 171.37 1n1h s ARG 114 N -3.07 2.23 0.21 2.90 3.52 -1.14 -1.32 118.95 122.27 1n1h s ARG 114 Ca -0.01 -2.16 -0.31 0.00 -0.13 0.00 0.00 55.73 53.11 1n1h s ARG 114 Cb 0.01 -1.85 -0.11 0.00 -1.56 0.00 0.00 34.95 31.44 1n1h s ARG 114 CO -0.07 -0.47 1.57 -1.17 -0.81 0.00 0.00 175.30 174.35 1n1h s LEU 115 N -4.08 4.37 -0.08 -0.88 2.96 -1.26 -1.16 118.68 118.54 1n1h s LEU 115 Ca 0.23 2.71 -0.37 0.00 -0.22 0.00 0.00 54.13 56.48 1n1h s LEU 115 Cb -0.00 -3.61 -0.15 0.00 0.50 0.00 0.00 46.19 42.94 1n1h s LEU 115 CO 0.14 -0.84 1.66 -0.24 -1.32 0.00 0.00 176.35 175.75 1n1h n SER 116 N 3.40 2.58 0.28 3.68 2.88 -0.80 -4.69 113.62 120.95 1n1h n SER 116 Ca 0.12 1.06 0.16 0.00 -1.33 0.00 0.00 58.87 58.88 1n1h n SER 116 Cb 0.38 -1.25 0.83 0.00 -0.75 0.00 0.00 64.21 63.42 1n1h n SER 116 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1n1h h GLU 117 N 6.89 0.00 -0.34 -1.46 4.81 -1.93 -1.45 114.58 121.10 1n1h h GLU 117 Ca -0.47 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.69 1n1h h GLU 117 Cb 1.30 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 1n1h h GLU 117 CO 0.90 0.07 -0.05 0.00 -0.73 0.00 0.00 179.01 179.20 1n1h h ALA 118 N 1.93 0.47 -0.53 2.92 0.00 -2.00 -2.43 119.26 119.62 1n1h h ALA 118 Ca -0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 1n1h h ALA 118 Cb 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1n1h h ALA 118 CO 0.01 0.28 0.21 0.82 0.00 0.00 0.00 179.25 180.56 1n1h h ILE 119 N 0.43 1.22 -0.78 0.00 2.04 -1.63 -2.61 117.51 116.18 1n1h h ILE 119 Ca 0.09 -0.69 -0.04 0.00 1.00 0.00 0.00 64.86 65.22 1n1h h ILE 119 Cb 0.54 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 1n1h h ILE 119 CO 0.03 0.26 0.34 -0.33 0.00 0.00 0.00 178.15 178.45 1n1h h GLU 120 N 0.72 1.15 -0.63 2.37 5.08 -1.42 -0.85 114.58 121.00 1n1h h GLU 120 Ca 0.18 -0.19 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 1n1h h GLU 120 Cb 0.21 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1n1h h GLU 120 CO -0.01 0.92 0.06 -0.91 -1.00 0.00 0.00 179.01 178.06 1n1h h ASN 121 N 1.12 1.04 -0.41 1.42 -0.26 -1.36 0.33 115.58 117.46 1n1h h ASN 121 Ca 0.26 -0.28 -0.07 0.00 -0.56 0.00 0.00 56.30 55.65 1n1h h ASN 121 Cb 0.17 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.13 1n1h h ASN 121 CO -0.03 1.07 0.02 0.03 -1.06 0.00 0.00 177.43 177.46 1n1h h ARG 122 N 0.99 0.79 -0.07 0.81 3.08 -1.21 -0.34 114.38 118.43 1n1h h ARG 122 Ca 0.19 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1n1h h ARG 122 Cb 0.50 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 1n1h h ARG 122 CO 0.02 0.79 -0.01 0.00 -1.07 0.00 0.00 179.97 179.70 1n1h h ALA 123 N 1.27 0.10 0.00 0.04 0.00 -0.56 -1.53 119.26 118.58 1n1h h ALA 123 Ca 0.15 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1n1h h ALA 123 Cb 0.42 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1n1h h ALA 123 CO 0.02 -0.20 -0.02 0.87 0.00 0.00 0.00 179.25 179.91 1n1h h LYS 124 N -0.17 0.00 -0.05 0.00 1.57 -0.08 -0.76 116.57 117.09 1n1h h LYS 124 Ca 0.02 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1n1h h LYS 124 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1n1h h LYS 124 CO 0.01 0.02 -0.16 -0.44 -0.57 0.00 0.00 179.45 178.31 1n1h h ASP 125 N 0.00 0.22 0.00 0.86 5.19 -0.59 -3.48 116.42 118.62 1n1h h ASP 125 Ca -0.00 -0.63 0.00 0.00 -0.62 0.00 0.00 57.03 55.78 1n1h h ASP 125 Cb 0.14 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1n1h h ASP 125 CO 0.00 0.81 0.00 0.61 -3.12 0.00 0.00 179.24 177.55 1n1h n GLY 126 N 0.63 -0.94 3.65 2.75 0.00 -0.29 -5.10 105.19 105.89 1n1h n GLY 126 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1n1h n GLY 126 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n1h s ASP 127 N 0.00 6.54 0.11 1.61 2.15 -0.65 -4.92 116.67 121.50 1n1h s ASP 127 Ca 0.00 2.14 -0.33 0.00 0.43 0.00 0.00 52.55 54.80 1n1h s ASP 127 Cb 0.00 -2.53 -0.13 0.00 -0.30 0.00 0.00 42.92 39.96 1n1h s ASP 127 CO 0.00 -1.05 1.53 0.28 -0.17 0.00 0.00 175.17 175.76 1n1h h SER 128 N 10.11 -1.59 -0.99 -0.34 0.02 -1.93 -0.86 113.55 117.98 1n1h h SER 128 Ca -0.39 0.18 0.21 0.00 -0.84 0.00 0.00 61.79 60.95 1n1h h SER 128 Cb 1.18 0.61 -0.09 0.00 0.14 0.00 0.00 62.40 64.23 1n1h h SER 128 CO 0.96 -0.49 0.62 -0.61 -1.14 0.00 0.00 176.83 176.17 1n1h h GLN 129 N -0.63 0.56 -0.16 3.45 4.15 -1.98 -0.30 115.11 120.20 1n1h h GLN 129 Ca 0.01 -0.03 -0.17 0.00 0.77 0.00 0.00 58.65 59.23 1n1h h GLN 129 Cb 0.68 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.24 1n1h h GLN 129 CO -0.35 0.37 -0.61 0.00 -1.93 0.00 0.00 178.83 176.31 1n1h h ALA 130 N 1.63 0.63 -0.09 3.38 0.00 -1.71 -2.56 119.26 120.54 1n1h h ALA 130 Ca 0.56 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1n1h h ALA 130 Cb 1.12 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1n1h h ALA 130 CO -0.31 0.71 0.01 0.00 0.00 0.00 0.00 179.25 179.65 1n1h h ARG 131 N 0.41 0.15 -0.53 0.00 3.08 0.29 0.47 114.38 118.24 1n1h h ARG 131 Ca -0.01 -0.04 0.11 0.00 0.07 0.00 0.00 59.98 60.11 1n1h h ARG 131 Cb 1.18 -0.02 -0.10 0.00 0.08 0.00 0.00 29.97 31.11 1n1h h ARG 131 CO 0.11 0.38 -0.07 0.82 -1.07 0.00 0.00 179.97 180.15 1n1h h ILE 132 N -0.10 0.52 -0.37 2.04 1.08 -1.16 0.75 117.51 120.26 1n1h h ILE 132 Ca 0.03 -0.02 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1n1h h ILE 132 Cb 0.31 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 34.50 1n1h h ILE 132 CO 0.00 0.01 0.21 0.00 -0.69 0.00 0.00 178.15 177.69 1n1h h ALA 133 N 1.51 0.47 -0.25 1.87 0.00 -1.21 -1.61 119.26 120.03 1n1h h ALA 133 Ca 0.27 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1n1h h ALA 133 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1n1h h ALA 133 CO -0.50 -0.01 0.08 1.15 0.00 0.00 0.00 179.25 179.96 1n1h h THR 134 N 0.48 1.20 0.34 0.00 2.02 -0.05 0.76 112.91 117.65 1n1h h THR 134 Ca 0.13 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.67 1n1h h THR 134 Cb 0.03 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.55 1n1h h THR 134 CO -0.02 0.21 -0.46 0.74 0.37 0.00 0.00 175.52 176.35 1n1h h THR 135 N 0.24 0.09 -0.96 3.16 2.02 -0.76 0.71 112.91 117.42 1n1h h THR 135 Ca 0.08 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.40 1n1h h THR 135 Cb 0.25 0.09 -0.08 0.00 -1.74 0.00 0.00 68.15 66.67 1n1h h THR 135 CO -0.00 0.00 0.61 0.22 0.37 0.00 0.00 175.52 176.72 1n1h h TYR 136 N -0.84 1.02 -0.13 3.16 3.20 -1.24 0.19 116.97 122.32 1n1h h TYR 136 Ca -0.03 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1n1h h TYR 136 Cb 0.78 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 1n1h h TYR 136 CO -0.30 0.38 0.02 0.78 -1.64 0.00 0.00 178.16 177.40 1n1h h GLY 137 N 0.86 0.24 1.31 1.82 0.00 0.59 -0.29 103.07 107.60 1n1h h GLY 137 Ca 0.49 -0.16 -0.11 0.00 0.00 0.00 0.00 47.33 47.54 1n1h h GLY 137 CO -0.25 0.15 -0.20 3.21 0.00 0.00 0.00 176.54 179.45 1n1h h ARG 138 N 0.00 0.80 -0.05 4.80 3.08 0.11 -2.17 114.38 120.95 1n1h h ARG 138 Ca 0.04 -0.31 -0.24 0.00 0.07 0.00 0.00 59.98 59.54 1n1h h ARG 138 Cb 0.30 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.32 1n1h h ARG 138 CO 0.00 0.93 -0.92 0.97 -1.07 0.00 0.00 179.97 179.88 1n1h h ILE 139 N 0.70 1.32 -0.95 2.04 6.09 -0.63 -1.63 117.51 124.46 1n1h h ILE 139 Ca 0.10 -2.21 0.00 0.00 -1.37 0.00 0.00 64.86 61.39 1n1h h ILE 139 Cb 0.71 2.25 -0.05 0.00 0.47 0.00 0.00 36.82 40.21 1n1h h ILE 139 CO 0.05 0.68 0.61 0.00 -3.07 0.00 0.00 178.15 176.42 1n1h h ALA 140 N 0.58 1.29 -0.46 0.18 0.00 -1.00 -0.05 119.26 119.79 1n1h h ALA 140 Ca -0.09 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1n1h h ALA 140 Cb 1.55 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1n1h h ALA 140 CO 0.18 0.64 -0.04 1.49 0.00 0.00 0.00 179.25 181.51 1n1h h GLU 141 N 1.29 0.84 -0.99 0.00 4.81 -1.32 -2.89 114.58 116.33 1n1h h GLU 141 Ca 0.34 -0.29 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1n1h h GLU 141 Cb -0.11 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.14 1n1h h GLU 141 CO -0.07 0.92 0.65 1.03 -0.73 0.00 0.00 179.01 180.80 1n1h h SER 142 N 0.69 1.08 -0.12 1.04 0.87 -0.44 0.04 113.55 116.70 1n1h h SER 142 Ca 0.12 -0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1n1h h SER 142 Cb 0.57 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 1n1h h SER 142 CO 0.03 0.73 0.03 -0.61 -0.53 0.00 0.00 176.83 176.48 1n1h h GLN 143 N 1.25 0.29 0.00 2.24 4.15 -0.84 -2.30 115.11 119.89 1n1h h GLN 143 Ca 0.40 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.78 1n1h h GLN 143 Cb 0.01 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.65 1n1h h GLN 143 CO -0.13 0.29 -0.00 0.00 -1.93 0.00 0.00 178.83 177.06 1n1h h ALA 144 N 1.75 1.00 0.00 3.38 0.00 -0.84 -3.29 119.26 121.26 1n1h h ALA 144 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1n1h h ALA 144 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1n1h h ALA 144 CO 0.00 0.00 -0.19 0.54 0.00 0.00 0.00 179.25 179.60 1n1h n ARG 145 N -2.94 0.21 -0.02 0.00 1.74 -0.76 -4.42 116.66 110.48 1n1h n ARG 145 Ca 0.04 0.13 0.00 0.00 -0.77 0.00 0.00 57.85 57.25 1n1h n ARG 145 Cb 0.51 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1n1h n ARG 145 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1n1h n GLN 146 N -2.04 0.16 -4.26 5.56 1.13 -1.23 -4.72 117.38 111.97 1n1h n GLN 146 Ca 0.05 0.00 -0.17 0.00 -1.94 0.00 0.00 57.00 54.95 1n1h n GLN 146 Cb 0.41 -1.42 -0.11 0.00 0.11 0.00 0.00 30.24 29.24 1n1h n GLN 146 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1n1h s ILE 147 N 1.01 1.33 0.16 5.09 -4.36 -1.23 0.38 121.20 123.58 1n1h s ILE 147 Ca 0.00 -1.90 -0.12 0.00 -0.26 0.00 0.00 60.65 58.37 1n1h s ILE 147 Cb 0.00 -1.71 0.05 0.00 1.25 0.00 0.00 42.46 42.05 1n1h s ILE 147 CO 0.00 -0.56 1.65 0.11 0.24 0.00 0.00 174.94 176.39 1n1h h LYS 148 N 3.13 0.91 0.00 0.37 1.57 0.95 -3.42 116.57 120.08 1n1h h LYS 148 Ca -0.38 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.16 1n1h h LYS 148 Cb 1.20 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1n1h h LYS 148 CO 0.57 0.87 0.19 0.00 -0.57 0.00 0.00 179.45 180.51 1n1h n ALA 149 N -2.42 -1.11 -1.75 3.86 0.00 -1.26 -5.07 120.51 112.76 1n1h n ALA 149 Ca 0.02 -0.71 -0.39 0.00 0.00 0.00 0.00 53.44 52.36 1n1h n ALA 149 Cb 0.26 0.54 0.03 0.00 0.00 0.00 0.00 19.45 20.29 1n1h n ALA 149 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1n1h n PRO 150 N -0.33 2.03 0.04 0.00 -0.02 -1.26 -4.87 135.00 130.58 1n1h n PRO 150 Ca -0.05 0.73 0.03 0.00 -2.02 0.00 0.00 63.50 62.20 1n1h n PRO 150 Cb 0.34 -2.61 0.42 0.00 -0.02 0.00 0.00 33.50 31.63 1n1h n PRO 150 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1n1h h LEU 151 N 1.94 0.41 -2.26 2.45 3.38 -1.96 -2.87 115.31 116.40 1n1h h LEU 151 Ca -0.51 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.47 1n1h h LEU 151 Cb 1.28 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1n1h h LEU 151 CO 0.59 0.35 0.14 -0.33 0.09 0.00 0.00 178.44 179.29 1n1h h GLU 152 N 0.46 0.00 -0.19 1.13 3.07 -1.98 -1.60 114.58 115.48 1n1h h GLU 152 Ca 0.12 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.77 1n1h h GLU 152 Cb 0.06 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 27.98 1n1h h GLU 152 CO -0.02 0.00 -0.69 0.87 -1.40 0.00 0.00 179.01 177.78 1n1h h LYS 153 N 0.00 0.79 -0.50 2.33 1.79 -1.88 -0.54 116.57 118.57 1n1h h LYS 153 Ca 0.07 -0.61 -0.12 0.00 -2.18 0.00 0.00 60.65 57.81 1n1h h LYS 153 Cb 0.35 0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.10 1n1h h LYS 153 CO -0.00 1.22 -0.17 0.74 -1.08 0.00 0.00 179.45 180.16 1n1h h PHE 154 N 0.53 1.10 -0.17 -1.35 0.04 -1.45 -1.94 116.94 113.71 1n1h h PHE 154 Ca -0.03 -0.25 -0.02 0.00 2.80 0.00 0.00 57.97 60.47 1n1h h PHE 154 Cb 1.31 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 39.19 1n1h h PHE 154 CO 0.09 1.06 0.02 0.28 -0.60 0.00 0.00 178.31 179.16 1n1h h VAL 155 N 0.85 1.23 -0.28 -0.55 2.07 -1.38 -1.82 116.25 116.37 1n1h h VAL 155 Ca 0.12 -0.74 0.02 0.00 0.82 0.00 0.00 66.70 66.92 1n1h h VAL 155 Cb 0.73 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1n1h h VAL 155 CO 0.06 0.22 0.15 0.25 0.02 0.00 0.00 177.57 178.26 1n1h h LEU 156 N 0.06 0.22 -1.06 2.57 5.85 -0.98 0.66 115.31 122.64 1n1h h LEU 156 Ca 0.05 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1n1h h LEU 156 Cb 0.32 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.26 1n1h h LEU 156 CO 0.00 0.17 0.63 0.00 -0.34 0.00 0.00 178.44 178.90 1n1h h ALA 157 N 1.14 1.35 -0.85 1.25 0.00 -1.31 0.13 119.26 120.97 1n1h h ALA 157 Ca 0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1n1h h ALA 157 Cb 0.03 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.41 1n1h h ALA 157 CO -0.08 0.58 0.46 1.25 0.00 0.00 0.00 179.25 181.46 1n1h h LEU 158 N 1.26 1.07 0.16 0.00 5.85 -0.34 0.16 115.31 123.46 1n1h h LEU 158 Ca 0.37 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 1n1h h LEU 158 Cb -0.07 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.69 1n1h h LEU 158 CO -0.10 0.86 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.72 1n1h h LEU 159 N 1.19 -0.19 0.23 2.25 3.38 0.61 -1.00 115.31 121.79 1n1h h LEU 159 Ca 0.30 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1n1h h LEU 159 Cb 0.04 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1n1h h LEU 159 CO -0.05 -0.04 -0.24 0.58 0.09 0.00 0.00 178.44 178.79 1n1h h VAL 160 N -0.32 0.48 -0.11 1.22 2.07 -0.42 -1.44 116.25 117.73 1n1h h VAL 160 Ca -0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.54 1n1h h VAL 160 Cb 0.25 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 1n1h h VAL 160 CO 0.04 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 177.46 1n1h h ALA 161 N 0.18 -0.12 0.00 1.67 0.00 -0.67 -2.53 119.26 117.79 1n1h h ALA 161 Ca -0.00 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1n1h h ALA 161 Cb 0.47 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1n1h h ALA 161 CO -0.06 -0.63 -0.01 0.93 0.00 0.00 0.00 179.25 179.48 1n1h h GLU 162 N -0.22 0.00 0.00 0.00 4.39 -1.10 -2.21 114.58 115.44 1n1h h GLU 162 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1n1h h GLU 162 Cb 0.35 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1n1h h GLU 162 CO -0.24 0.01 0.00 0.00 -1.16 0.00 0.00 179.01 177.62 1n1h n ALA 163 N -2.10 1.23 0.48 3.43 0.00 -0.55 -1.75 120.51 121.24 1n1h n ALA 163 Ca -0.00 0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.70 1n1h n ALA 163 Cb 0.25 -1.30 0.44 0.00 0.00 0.00 0.00 19.45 18.84 1n1h n ALA 163 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1n1h h GLY 164 N 0.70 0.00 -0.17 0.00 0.00 -1.50 -3.50 103.07 98.60 1n1h h GLY 164 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 1n1h h GLY 164 CO 0.00 0.00 -0.03 0.61 0.00 0.00 0.00 176.54 177.12 1n1h n GLY 165 N 0.68 -1.98 3.70 4.60 0.00 -0.72 -4.87 105.19 106.59 1n1h n GLY 165 Ca 0.04 -1.38 -0.39 0.00 0.00 0.00 0.00 46.02 44.28 1n1h n GLY 165 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1n1h n SER 166 N -0.26 2.21 -4.78 1.61 7.64 -1.26 -4.99 113.62 113.78 1n1h n SER 166 Ca 0.00 0.97 -0.36 0.00 1.01 0.00 0.00 58.87 60.49 1n1h n SER 166 Cb 0.03 -1.51 -0.08 0.00 -1.01 0.00 0.00 64.21 61.64 1n1h n SER 166 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1n1h s LEU 167 N -2.68 4.05 -0.26 -3.43 2.01 -1.26 -4.92 118.68 112.19 1n1h s LEU 167 Ca 0.70 0.30 -0.25 0.00 0.01 0.00 0.00 54.13 54.89 1n1h s LEU 167 Cb -0.44 -1.98 -0.00 0.00 0.01 0.00 0.00 46.19 43.78 1n1h s LEU 167 CO 0.51 0.36 0.86 -0.47 1.01 0.00 0.00 176.35 178.61 1n1h s TYR 168 N -0.72 3.27 -0.06 0.29 5.04 -1.26 -1.82 117.35 122.09 1n1h s TYR 168 Ca 0.12 1.09 -0.30 0.00 -2.44 0.00 0.00 57.07 55.55 1n1h s TYR 168 Cb -0.12 -3.16 -0.04 0.00 0.35 0.00 0.00 41.96 38.99 1n1h s TYR 168 CO 0.03 -0.48 1.29 0.34 -1.34 0.00 0.00 175.55 175.39 1n1h s ASP 169 N 1.42 6.95 0.27 4.32 -1.08 -0.08 -4.91 116.67 123.57 1n1h s ASP 169 Ca 0.36 1.89 -0.01 0.00 -0.52 0.00 0.00 52.55 54.28 1n1h s ASP 169 Cb -0.15 -2.55 0.38 0.00 -1.46 0.00 0.00 42.92 39.14 1n1h s ASP 169 CO 0.09 -0.68 1.78 -0.65 0.52 0.00 0.00 175.17 176.24 1n1h h PRO 170 N 7.83 0.75 0.00 4.34 0.11 -1.90 0.16 132.00 143.29 1n1h h PRO 170 Ca -0.34 -0.19 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 1n1h h PRO 170 Cb 1.15 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1n1h h PRO 170 CO 0.91 0.75 -0.12 0.28 -0.21 0.00 0.00 178.00 179.61 1n1h h VAL 171 N 0.70 0.75 0.00 3.15 2.07 -1.95 -3.34 116.25 117.63 1n1h h VAL 171 Ca 0.14 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 66.07 1n1h h VAL 171 Cb 0.42 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1n1h h VAL 171 CO 0.02 0.26 0.00 -0.07 0.02 0.00 0.00 177.57 177.79 1n1h h LEU 172 N -1.00 0.00 -1.50 2.57 3.38 -1.97 -3.47 115.31 113.32 1n1h h LEU 172 Ca -0.02 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.53 1n1h h LEU 172 Cb 0.51 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.31 1n1h h LEU 172 CO -0.01 0.00 -0.79 0.00 0.09 0.00 0.00 178.44 177.72 1n1h n GLN 173 N -2.74 -5.56 -3.45 1.13 6.02 0.56 -4.99 117.38 108.34 1n1h n GLN 173 Ca 0.01 0.66 -0.12 0.00 -0.01 0.00 0.00 57.00 57.55 1n1h n GLN 173 Cb 0.28 -5.41 -0.02 0.00 1.02 0.00 0.00 30.24 26.10 1n1h n GLN 173 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 1n1h s LYS 174 N -6.07 1.13 0.38 -1.09 -2.85 -1.21 -4.95 119.74 105.08 1n1h s LYS 174 Ca 0.20 -0.34 -0.24 0.00 -1.00 0.00 0.00 55.97 54.60 1n1h s LYS 174 Cb -0.10 0.52 -0.10 0.00 -2.06 0.00 0.00 37.83 36.09 1n1h s LYS 174 CO 0.80 -0.48 0.98 0.71 0.10 0.00 0.00 175.35 177.46 1n1h s TYR 175 N -3.26 3.43 0.90 1.78 2.02 -1.26 -0.90 117.35 120.05 1n1h s TYR 175 Ca 0.01 1.68 -0.12 0.00 -0.37 0.00 0.00 57.07 58.27 1n1h s TYR 175 Cb -0.01 -2.97 0.13 0.00 -0.40 0.00 0.00 41.96 38.71 1n1h s TYR 175 CO -0.09 -0.18 1.10 0.16 -1.57 0.00 0.00 175.55 174.97 1n1h s ASP 176 N -1.77 3.54 -0.30 2.29 1.47 -0.76 -4.91 116.67 116.24 1n1h s ASP 176 Ca 0.56 1.24 0.08 0.00 1.18 0.00 0.00 52.55 55.61 1n1h s ASP 176 Cb -0.17 -1.91 0.46 0.00 -0.34 0.00 0.00 42.92 40.96 1n1h s ASP 176 CO 0.22 -2.56 1.30 -0.62 0.68 0.00 0.00 175.17 174.19 1n1h n GLU 177 N -3.81 2.72 -2.33 2.11 1.02 -1.26 -4.75 120.64 114.35 1n1h n GLU 177 Ca 0.06 -3.72 -0.43 0.00 -0.02 0.00 0.00 57.16 53.06 1n1h n GLU 177 Cb 0.57 -2.03 -0.02 0.00 -0.02 0.00 0.00 31.44 29.94 1n1h n GLU 177 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1n1h s ILE 178 N -4.04 4.10 0.36 -3.67 1.01 -1.26 -4.96 121.20 112.75 1n1h s ILE 178 Ca 0.47 1.32 -0.24 0.00 0.00 0.00 0.00 60.65 62.21 1n1h s ILE 178 Cb 0.41 -3.89 -0.13 0.00 0.01 0.00 0.00 42.46 38.85 1n1h s ILE 178 CO -0.00 -0.16 0.64 -2.65 0.00 0.00 0.00 174.94 172.77 1n1h n PRO 179 N 6.82 0.66 -1.99 2.79 -0.02 -1.26 -4.92 135.00 137.08 1n1h n PRO 179 Ca 0.15 0.24 -0.29 0.00 -2.02 0.00 0.00 63.50 61.57 1n1h n PRO 179 Cb 0.45 -1.51 0.19 0.00 -0.02 0.00 0.00 33.50 32.61 1n1h n PRO 179 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 1n1h s ASP 180 N -0.87 3.04 0.59 2.55 3.84 -1.26 -4.92 116.67 119.64 1n1h s ASP 180 Ca 0.62 0.14 0.29 0.00 -0.00 0.00 0.00 52.55 53.61 1n1h s ASP 180 Cb -0.67 -0.15 1.70 0.00 -1.38 0.00 0.00 42.92 42.41 1n1h s ASP 180 CO 0.58 -2.77 2.13 -0.07 -0.00 0.00 0.00 175.17 175.05 1n1h h LEU 181 N -1.62 0.00 0.00 2.11 3.38 -1.93 -1.79 115.31 115.46 1n1h h LEU 181 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1n1h h LEU 181 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1n1h h LEU 181 CO 0.35 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.34 1n1h n SER 182 N -3.79 0.00 -0.12 -0.43 3.41 -1.26 -1.17 113.62 110.25 1n1h n SER 182 Ca 0.01 -0.23 0.01 0.00 -0.26 0.00 0.00 58.87 58.39 1n1h n SER 182 Cb 0.28 -0.09 0.02 0.00 -0.26 0.00 0.00 64.21 64.16 1n1h n SER 182 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1n1h n HIS 183 N -1.09 0.04 -2.62 7.33 8.25 -0.67 0.32 115.22 126.78 1n1h n HIS 183 Ca 0.08 -0.18 -0.42 0.00 -0.26 0.00 0.00 57.72 56.95 1n1h n HIS 183 Cb 0.06 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.12 1n1h n HIS 183 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1n1h s ASN 184 N -0.50 6.23 0.20 0.41 3.84 -0.32 -4.61 114.94 120.20 1n1h s ASN 184 Ca 0.04 -0.41 -0.08 0.00 0.21 0.00 0.00 52.86 52.62 1n1h s ASN 184 Cb 0.02 -2.53 0.13 0.00 -0.55 0.00 0.00 41.25 38.32 1n1h s ASN 184 CO 0.03 -1.67 1.73 0.00 -2.79 0.00 0.00 177.10 174.40 1n1h h PRO 186 N 1.11 0.21 -0.90 0.00 0.11 -1.87 -2.58 132.00 128.08 1n1h h PRO 186 Ca 0.23 -0.01 0.12 0.00 0.11 0.00 0.00 66.00 66.46 1n1h h PRO 186 Cb 0.34 -0.05 -0.08 0.00 0.11 0.00 0.00 31.00 31.32 1n1h h PRO 186 CO -0.00 0.14 0.52 1.25 -0.21 0.00 0.00 178.00 179.69 1n1h h LEU 187 N 0.21 0.72 -0.48 2.35 6.46 -1.79 -0.09 115.31 122.69 1n1h h LEU 187 Ca 0.07 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1n1h h LEU 187 Cb 0.00 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 1n1h h LEU 187 CO -0.04 0.36 0.30 -0.25 -0.62 0.00 0.00 178.44 178.19 1n1h h TRP 188 N 0.80 0.63 -0.38 1.25 7.01 -1.27 -0.31 115.95 123.68 1n1h h TRP 188 Ca 0.46 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.44 1n1h h TRP 188 Cb 0.52 -0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.36 1n1h h TRP 188 CO -0.05 0.43 0.16 0.00 -2.79 0.00 0.00 178.44 176.19 1n1h h PHE 190 N 0.47 0.71 -0.08 0.00 3.57 -0.74 0.20 116.94 121.08 1n1h h PHE 190 Ca 0.13 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 1n1h h PHE 190 Cb 0.18 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.69 1n1h h PHE 190 CO -0.00 0.36 -0.04 -0.09 -2.23 0.00 0.00 178.31 176.31 1n1h h ARG 191 N 0.73 0.17 -0.43 1.11 2.43 -0.63 -2.70 114.38 115.05 1n1h h ARG 191 Ca 0.29 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.33 1n1h h ARG 191 Cb 0.14 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1n1h h ARG 191 CO -0.16 0.53 0.03 0.93 -1.51 0.00 0.00 179.97 179.78 1n1h h GLU 192 N -0.19 0.74 -0.45 0.20 4.39 -0.65 0.12 114.58 118.74 1n1h h GLU 192 Ca 0.02 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.49 1n1h h GLU 192 Cb 0.47 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.03 1n1h h GLU 192 CO 0.01 0.80 0.24 0.82 -1.16 0.00 0.00 179.01 179.72 1n1h h ILE 193 N 0.58 1.17 -0.18 3.13 2.04 -0.69 -0.29 117.51 123.27 1n1h h ILE 193 Ca 0.12 -0.44 -0.07 0.00 1.00 0.00 0.00 64.86 65.48 1n1h h ILE 193 Cb 0.45 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1n1h h ILE 193 CO 0.02 0.18 -0.18 0.00 0.00 0.00 0.00 178.15 178.17 1n1h h ARG 195 N 0.08 0.96 0.00 0.00 2.43 -0.63 -0.99 114.38 116.24 1n1h h ARG 195 Ca 0.03 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 1n1h h ARG 195 Cb 0.71 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1n1h h ARG 195 CO 0.04 0.64 -0.19 1.25 -1.51 0.00 0.00 179.97 180.20 1n1h h HIS 196 N 0.99 0.00 0.00 2.20 2.76 -1.00 -0.68 115.15 119.42 1n1h h HIS 196 Ca 0.34 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.47 1n1h h HIS 196 Cb 0.06 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.01 1n1h h HIS 196 CO -0.03 0.19 -0.20 0.82 -1.30 0.00 0.00 177.93 177.42 1n1h h ILE 197 N 0.00 1.60 -0.38 6.26 2.04 -0.86 -3.32 117.51 122.86 1n1h h ILE 197 Ca -0.00 -2.27 0.00 0.00 1.00 0.00 0.00 64.86 63.59 1n1h h ILE 197 Cb 0.42 3.10 -0.02 0.00 -0.74 0.00 0.00 36.82 39.58 1n1h h ILE 197 CO 0.02 0.54 0.24 0.77 0.00 0.00 0.00 178.15 179.73 1n1h h SER 198 N -1.00 0.44 0.00 1.72 4.64 -1.21 -3.45 113.55 114.69 1n1h h SER 198 Ca -0.05 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1n1h h SER 198 Cb 1.01 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1n1h h SER 198 CO -0.03 0.32 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 1n1h n GLY 199 N -1.46 3.23 0.00 -0.77 0.00 -0.27 -0.62 105.19 105.30 1n1h n GLY 199 Ca 0.03 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.08 1n1h n GLY 199 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1n1h n PRO 200 N 14.00 0.59 -2.67 1.61 -0.04 -1.26 -4.84 135.00 142.39 1n1h n PRO 200 Ca 0.00 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.05 1n1h n PRO 200 Cb 0.00 -1.42 -0.05 0.00 -0.04 0.00 0.00 33.50 31.99 1n1h n PRO 200 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1n1h s LEU 201 N -1.84 4.56 0.42 1.53 1.43 0.21 -4.95 118.68 120.03 1n1h s LEU 201 Ca 0.24 1.95 0.10 0.00 -1.03 0.00 0.00 54.13 55.39 1n1h s LEU 201 Cb 0.11 -3.60 0.88 0.00 0.03 0.00 0.00 46.19 43.61 1n1h s LEU 201 CO 0.18 -0.02 1.99 -0.65 0.23 0.00 0.00 176.35 178.08 1n1h h PRO 202 N 4.80 0.28 -6.25 1.29 0.11 -1.88 -3.41 132.00 126.94 1n1h h PRO 202 Ca -0.44 -0.04 -0.56 0.00 0.11 0.00 0.00 66.00 65.07 1n1h h PRO 202 Cb 1.21 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 1n1h h PRO 202 CO 0.70 0.31 0.58 -0.51 -0.21 0.00 0.00 178.00 178.87 1n1h s ASP 203 N -6.86 7.24 0.01 -2.05 1.01 -1.26 -4.95 116.67 109.80 1n1h s ASP 203 Ca -0.06 1.52 0.22 0.00 0.71 0.00 0.00 52.55 54.94 1n1h s ASP 203 Cb 0.16 -2.56 -0.14 0.00 1.01 0.00 0.00 42.92 41.40 1n1h s ASP 203 CO 0.72 -0.46 0.88 0.54 0.21 0.00 0.00 175.17 177.06 1n1h n ARG 204 N 5.08 0.21 -2.92 8.23 5.12 -1.26 -4.79 116.66 126.32 1n1h n ARG 204 Ca 0.09 -0.04 -0.41 0.00 -1.93 0.00 0.00 57.85 55.56 1n1h n ARG 204 Cb 0.49 -1.53 -0.04 0.00 -1.16 0.00 0.00 32.46 30.22 1n1h n ARG 204 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1n1h s ALA 205 N -3.16 3.32 0.35 7.54 0.00 -1.26 -4.73 121.76 123.83 1n1h s ALA 205 Ca 0.04 0.23 0.30 0.00 0.00 0.00 0.00 51.96 52.52 1n1h s ALA 205 Cb 0.15 -3.12 1.47 0.00 0.00 0.00 0.00 23.12 21.63 1n1h s ALA 205 CO 0.85 -0.24 2.06 -1.35 0.00 0.00 0.00 175.76 177.07 1n1h h PRO 206 N 6.88 0.00 -2.47 0.00 0.11 -1.91 -3.43 132.00 131.18 1n1h h PRO 206 Ca -0.39 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.80 1n1h h PRO 206 Cb 1.19 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.16 1n1h h PRO 206 CO 0.77 0.10 0.42 1.52 -0.21 0.00 0.00 178.00 180.60 1n1h s TYR 207 N -4.03 -0.38 -0.17 0.65 -0.85 -1.26 -2.22 117.35 109.10 1n1h s TYR 207 Ca -0.02 0.22 0.01 0.00 -0.52 0.00 0.00 57.07 56.76 1n1h s TYR 207 Cb 0.12 0.55 0.01 0.00 0.38 0.00 0.00 41.96 43.02 1n1h s TYR 207 CO 0.57 -0.64 -0.20 -0.51 -1.52 0.00 0.00 175.55 173.25 1n1h s LEU 208 N -2.57 2.16 -0.48 -3.49 1.43 -0.13 -4.98 118.68 110.63 1n1h s LEU 208 Ca 0.04 -0.62 -0.24 0.00 -1.03 0.00 0.00 54.13 52.29 1n1h s LEU 208 Cb -0.01 -1.48 0.03 0.00 0.03 0.00 0.00 46.19 44.76 1n1h s LEU 208 CO -0.09 0.03 0.85 -0.47 0.23 0.00 0.00 176.35 176.90 1n1h s TYR 209 N 1.11 2.93 0.00 0.29 5.04 -1.26 -2.30 117.35 123.16 1n1h s TYR 209 Ca 0.00 0.16 0.00 0.00 -2.44 0.00 0.00 57.07 54.80 1n1h s TYR 209 Cb -0.14 -3.84 0.00 0.00 0.35 0.00 0.00 41.96 38.33 1n1h s TYR 209 CO -0.08 -1.10 0.00 1.28 -1.34 0.00 0.00 175.55 174.31 1n1h n LEU 210 N 6.99 0.00 -0.13 6.97 7.99 -0.78 -4.66 117.00 133.39 1n1h n LEU 210 Ca 0.03 0.00 -0.22 0.00 -0.01 0.00 0.00 56.01 55.81 1n1h n LEU 210 Cb 0.48 0.00 -0.10 0.00 -0.11 0.00 0.00 43.42 43.69 1n1h n LEU 210 CO 0.61 0.00 -1.34 -1.54 -1.51 0.00 0.00 177.39 173.61 1n1h n SER 211 N -0.24 1.98 0.00 -1.43 3.41 -1.26 -4.19 113.62 111.88 1n1h n SER 211 Ca 0.00 0.08 0.04 0.00 -0.26 0.00 0.00 58.87 58.73 1n1h n SER 211 Cb 0.00 -0.56 0.24 0.00 -0.26 0.00 0.00 64.21 63.63 1n1h n SER 211 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1h n ALA 212 N -3.66 1.81 0.00 7.33 0.00 -1.26 -4.92 120.51 119.81 1n1h n ALA 212 Ca -0.47 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1n1h n ALA 212 Cb 0.91 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 19.23 1n1h n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1h n GLY 213 N -0.47 0.32 3.75 0.00 0.00 -1.26 -5.03 105.19 102.49 1n1h n GLY 213 Ca 0.06 -2.27 -0.36 0.00 0.00 0.00 0.00 46.02 43.46 1n1h n GLY 213 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1h s VAL 214 N 0.00 4.74 -0.05 1.61 1.01 -1.26 -1.86 120.40 124.59 1n1h s VAL 214 Ca 0.00 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 61.95 1n1h s VAL 214 Cb 0.00 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 1n1h s VAL 214 CO 0.00 0.60 -0.21 -0.36 0.00 0.00 0.00 175.10 175.13 1n1h s PHE 215 N -0.86 2.07 -0.10 5.22 0.08 -0.97 -4.75 117.98 118.67 1n1h s PHE 215 Ca 0.13 -0.58 -0.06 0.00 0.12 0.00 0.00 56.93 56.55 1n1h s PHE 215 Cb -0.12 -1.37 -0.04 0.00 -0.57 0.00 0.00 43.02 40.93 1n1h s PHE 215 CO 0.03 -0.17 0.12 -1.58 -0.10 0.00 0.00 175.22 173.51 1n1h s TRP 216 N -0.13 3.51 0.10 0.36 0.52 -0.43 -0.95 118.94 121.90 1n1h s TRP 216 Ca -0.02 0.45 -0.31 0.00 0.02 0.00 0.00 56.10 56.24 1n1h s TRP 216 Cb -0.12 -1.90 -0.08 0.00 -1.15 0.00 0.00 33.47 30.23 1n1h s TRP 216 CO 0.02 0.68 1.41 -1.17 0.02 0.00 0.00 176.95 177.91 1n1h s LEU 217 N -1.09 4.36 -0.31 2.99 2.96 -0.94 -0.29 118.68 126.36 1n1h s LEU 217 Ca 0.16 2.31 -0.03 0.00 -0.22 0.00 0.00 54.13 56.34 1n1h s LEU 217 Cb -0.12 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 42.91 1n1h s LEU 217 CO 0.05 -0.68 1.78 0.23 -1.32 0.00 0.00 176.35 176.41 1n1h n MET 218 N 4.26 1.14 -4.52 1.98 2.81 0.30 -4.85 117.12 118.24 1n1h n MET 218 Ca 0.12 -0.78 -0.34 0.00 -1.81 0.00 0.00 57.70 54.89 1n1h n MET 218 Cb 0.42 -2.00 -0.11 0.00 -0.71 0.00 0.00 33.22 30.83 1n1h n MET 218 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1n1h s SER 219 N 3.19 4.85 0.00 7.83 0.15 -1.26 -4.98 113.70 123.48 1n1h s SER 219 Ca 0.28 0.02 0.17 0.00 0.70 0.00 0.00 55.95 57.11 1n1h s SER 219 Cb 0.10 -1.35 0.92 0.00 -1.71 0.00 0.00 66.02 63.99 1n1h s SER 219 CO -0.01 0.34 1.44 -0.81 1.20 0.00 0.00 173.24 175.40 1n1h n PRO 220 N 2.37 0.39 0.00 5.44 -0.04 -1.26 -2.10 135.00 139.79 1n1h n PRO 220 Ca -0.18 0.06 0.10 0.00 -0.04 0.00 0.00 63.50 63.45 1n1h n PRO 220 Cb 0.53 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 1n1h n PRO 220 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1n1h n ARG 221 N -1.14 0.09 -2.10 0.54 1.74 -1.26 -4.89 116.66 109.64 1n1h n ARG 221 Ca 0.10 -0.02 -0.33 0.00 -0.77 0.00 0.00 57.85 56.83 1n1h n ARG 221 Cb 0.09 -1.51 0.01 0.00 -1.02 0.00 0.00 32.46 30.03 1n1h n ARG 221 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1n1h s MET 222 N -3.07 3.32 0.04 5.56 1.75 -0.89 -4.64 119.30 121.36 1n1h s MET 222 Ca 0.06 1.30 -0.02 0.00 -1.25 0.00 0.00 55.69 55.78 1n1h s MET 222 Cb 0.16 -2.03 -0.03 0.00 2.84 0.00 0.00 34.83 35.78 1n1h s MET 222 CO 0.85 -0.83 0.01 0.99 -0.65 0.00 0.00 175.02 175.40 1n1h s THR 223 N -2.28 0.17 -0.88 10.11 2.01 -1.26 -4.30 115.64 119.21 1n1h s THR 223 Ca 0.66 -1.37 0.13 0.00 0.31 0.00 0.00 61.69 61.42 1n1h s THR 223 Cb -0.18 -1.05 0.12 0.00 0.01 0.00 0.00 72.50 71.41 1n1h s THR 223 CO 0.34 -0.76 1.41 -1.54 -0.69 0.00 0.00 174.62 173.38 1n1h n SER 224 N 0.63 0.13 -0.15 3.53 3.41 -0.97 -1.78 113.62 118.43 1n1h n SER 224 Ca -0.18 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.09 1n1h n SER 224 Cb 0.59 -0.56 0.12 0.00 -0.26 0.00 0.00 64.21 64.10 1n1h n SER 224 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1h n ALA 225 N -1.56 3.81 -0.02 7.33 0.00 -1.26 -4.44 120.51 124.37 1n1h n ALA 225 Ca 0.02 -0.49 -0.12 0.00 0.00 0.00 0.00 53.44 52.85 1n1h n ALA 225 Cb 0.14 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.55 1n1h n ALA 225 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1n1h h ILE 226 N 0.72 1.23 -0.22 0.00 1.08 -1.73 -2.50 117.51 116.09 1n1h h ILE 226 Ca 0.00 -0.72 0.06 0.00 -0.39 0.00 0.00 64.86 63.81 1n1h h ILE 226 Cb 0.55 1.56 -0.07 0.00 -3.07 0.00 0.00 36.82 35.79 1n1h h ILE 226 CO 0.00 0.20 -0.36 -0.65 -0.69 0.00 0.00 178.15 176.66 1n1h h PRO 227 N -0.12 -0.36 -0.33 2.37 0.11 -1.78 0.37 132.00 132.25 1n1h h PRO 227 Ca 0.02 0.02 0.07 0.00 0.11 0.00 0.00 66.00 66.23 1n1h h PRO 227 Cb 0.31 0.08 -0.07 0.00 0.11 0.00 0.00 31.00 31.44 1n1h h PRO 227 CO 0.00 -0.24 -0.10 -1.35 -0.21 0.00 0.00 178.00 176.10 1n1h h PRO 228 N -0.38 -0.02 -0.09 1.05 0.11 -1.83 -0.90 132.00 129.95 1n1h h PRO 228 Ca 0.11 0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.27 1n1h h PRO 228 Cb 0.57 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.63 1n1h h PRO 228 CO -0.43 -0.01 -0.24 1.25 -0.21 0.00 0.00 178.00 178.36 1n1h h LEU 229 N -0.02 -0.73 -0.60 2.35 5.85 -0.92 -1.25 115.31 119.99 1n1h h LEU 229 Ca 0.16 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.97 1n1h h LEU 229 Cb 0.27 0.32 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1n1h h LEU 229 CO -0.36 -0.29 0.28 -0.07 -0.34 0.00 0.00 178.44 177.66 1n1h h LEU 230 N -0.33 0.80 -0.92 2.25 3.38 -0.66 -1.94 115.31 117.90 1n1h h LEU 230 Ca 0.09 -0.14 0.09 0.00 0.09 0.00 0.00 57.88 58.00 1n1h h LEU 230 Cb 0.45 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 1n1h h LEU 230 CO -0.27 0.72 0.56 0.77 0.09 0.00 0.00 178.44 180.31 1n1h h SER 231 N 0.83 0.85 -0.62 -0.43 4.64 -0.86 -0.47 113.55 117.49 1n1h h SER 231 Ca 0.21 0.03 -0.08 0.00 -0.47 0.00 0.00 61.79 61.48 1n1h h SER 231 Cb 0.14 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1n1h h SER 231 CO -0.02 0.50 0.08 0.44 -0.87 0.00 0.00 176.83 176.95 1n1h h ASP 232 N 0.96 1.01 -0.41 4.97 3.32 -0.72 -2.76 116.42 122.80 1n1h h ASP 232 Ca 0.43 -0.27 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 1n1h h ASP 232 Cb 0.32 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1n1h h ASP 232 CO -0.22 1.03 -0.10 -0.07 -1.72 0.00 0.00 179.24 178.16 1n1h h LEU 233 N 0.96 0.85 -0.76 1.55 3.38 -0.60 -2.10 115.31 118.59 1n1h h LEU 233 Ca 0.19 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1n1h h LEU 233 Cb 0.47 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1n1h h LEU 233 CO 0.02 0.97 0.23 0.58 0.09 0.00 0.00 178.44 180.33 1n1h h VAL 234 N 0.78 1.26 -0.49 1.22 2.07 -0.99 0.74 116.25 120.84 1n1h h VAL 234 Ca 0.13 -0.92 -0.06 0.00 0.82 0.00 0.00 66.70 66.67 1n1h h VAL 234 Cb 0.61 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1n1h h VAL 234 CO 0.04 0.36 0.06 0.78 0.02 0.00 0.00 177.57 178.83 1n1h h ASN 235 N 1.12 0.80 -0.45 0.57 2.35 -1.30 -2.00 115.58 116.67 1n1h h ASN 235 Ca 0.24 -0.27 -0.12 0.00 -0.55 0.00 0.00 56.30 55.60 1n1h h ASN 235 Cb 0.31 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 1n1h h ASN 235 CO -0.01 0.87 -0.16 -0.07 -1.65 0.00 0.00 177.43 176.41 1n1h h LEU 236 N 0.70 0.95 -0.36 1.61 3.38 -1.12 -2.21 115.31 118.26 1n1h h LEU 236 Ca 0.15 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.83 1n1h h LEU 236 Cb 0.42 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1n1h h LEU 236 CO 0.01 1.09 0.14 0.00 0.09 0.00 0.00 178.44 179.78 1n1h h ALA 237 N 0.98 0.42 -0.35 1.53 0.00 -0.65 -0.63 119.26 120.56 1n1h h ALA 237 Ca 0.12 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1n1h h ALA 237 Cb 0.71 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1n1h h ALA 237 CO 0.05 -0.25 -0.34 0.82 0.00 0.00 0.00 179.25 179.54 1n1h h ILE 238 N 0.30 1.28 -0.18 0.00 2.04 -1.30 -3.19 117.51 116.46 1n1h h ILE 238 Ca 0.16 -1.50 -0.16 0.00 1.00 0.00 0.00 64.86 64.36 1n1h h ILE 238 Cb 0.12 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1n1h h ILE 238 CO -0.15 0.49 -0.55 -0.07 0.00 0.00 0.00 178.15 177.88 1n1h h LEU 239 N 0.67 0.59 -2.36 1.44 3.38 -1.17 0.12 115.31 117.98 1n1h h LEU 239 Ca 0.07 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1n1h h LEU 239 Cb 0.89 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1n1h h LEU 239 CO 0.08 1.02 -0.03 -0.61 0.09 0.00 0.00 178.44 178.99 1n1h h GLN 240 N 0.41 0.00 0.00 1.13 4.15 -1.11 0.67 115.11 120.36 1n1h h GLN 240 Ca 0.01 0.00 -0.35 0.00 0.77 0.00 0.00 58.65 59.08 1n1h h GLN 240 Cb 1.09 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.71 1n1h h GLN 240 CO 0.10 0.03 -2.17 1.04 -1.93 0.00 0.00 178.83 175.90 1n1h n GLN 241 N -3.80 0.67 -0.06 1.69 1.13 -1.05 -3.61 117.38 112.35 1n1h n GLN 241 Ca -0.03 0.10 -0.02 0.00 -1.94 0.00 0.00 57.00 55.12 1n1h n GLN 241 Cb 0.11 -1.61 -0.15 0.00 0.11 0.00 0.00 30.24 28.71 1n1h n GLN 241 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1n1h n THR 242 N -2.88 0.76 0.56 5.09 -2.24 0.40 -4.29 114.28 111.67 1n1h n THR 242 Ca -0.28 -0.64 0.10 0.00 -2.27 0.00 0.00 64.05 60.96 1n1h n THR 242 Cb 1.12 -0.30 0.14 0.00 -2.10 0.00 0.00 70.33 69.19 1n1h n THR 242 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n1h n ALA 243 N -2.48 2.43 -2.80 6.98 0.00 0.23 -1.33 120.51 123.54 1n1h n ALA 243 Ca -0.19 -0.82 -0.22 0.00 0.00 0.00 0.00 53.44 52.21 1n1h n ALA 243 Cb 0.86 -0.74 0.02 0.00 0.00 0.00 0.00 19.45 19.59 1n1h n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1h n GLY 244 N 1.24 -0.51 3.70 0.00 0.00 -1.10 -4.72 105.19 103.78 1n1h n GLY 244 Ca 0.15 0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 1n1h n GLY 244 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n1h n LEU 245 N -3.64 5.03 -4.68 0.99 4.77 -1.22 -4.93 117.00 113.31 1n1h n LEU 245 Ca -0.16 0.71 -0.42 0.00 -0.03 0.00 0.00 56.01 56.11 1n1h n LEU 245 Cb 0.64 -1.51 -0.03 0.00 -2.33 0.00 0.00 43.42 40.19 1n1h n LEU 245 CO 0.40 -1.43 1.04 -0.62 -1.33 0.00 0.00 177.39 175.46 1n1h s ASP 246 N -1.70 6.96 0.37 -1.43 -1.08 -1.26 -4.84 116.67 113.68 1n1h s ASP 246 Ca 0.78 1.88 0.05 0.00 -0.52 0.00 0.00 52.55 54.74 1n1h s ASP 246 Cb -0.34 -2.55 0.73 0.00 -1.46 0.00 0.00 42.92 39.30 1n1h s ASP 246 CO 0.46 -0.67 2.00 -0.65 0.52 0.00 0.00 175.17 176.82 1n1h h PRO 247 N 7.82 0.72 -0.73 4.34 0.11 -1.94 -1.41 132.00 140.92 1n1h h PRO 247 Ca -0.34 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.68 1n1h h PRO 247 Cb 1.15 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 1n1h h PRO 247 CO 0.91 0.48 0.26 0.66 -0.21 0.00 0.00 178.00 180.10 1n1h h SER 248 N 0.74 1.03 -0.18 -2.05 4.64 -1.97 -1.70 113.55 114.06 1n1h h SER 248 Ca 0.25 -0.17 -0.09 0.00 -0.47 0.00 0.00 61.79 61.30 1n1h h SER 248 Cb 0.06 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 61.88 1n1h h SER 248 CO -0.07 0.94 -0.24 -0.07 -0.87 0.00 0.00 176.83 176.52 1n1h h LEU 249 N 1.08 0.52 -0.95 5.97 3.38 -1.86 -3.16 115.31 120.29 1n1h h LEU 249 Ca 0.24 -0.51 0.16 0.00 0.09 0.00 0.00 57.88 57.86 1n1h h LEU 249 Cb 0.25 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 40.76 1n1h h LEU 249 CO -0.01 0.93 0.56 0.58 0.09 0.00 0.00 178.44 180.58 1n1h h VAL 250 N 0.13 0.76 -0.26 1.22 2.07 -0.94 0.27 116.25 119.50 1n1h h VAL 250 Ca 0.02 -0.26 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 1n1h h VAL 250 Cb 0.81 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1n1h h VAL 250 CO 0.06 0.14 0.02 0.11 0.02 0.00 0.00 177.57 177.92 1n1h h LYS 251 N 0.77 0.38 -0.91 1.57 1.57 -1.29 -1.61 116.57 117.05 1n1h h LYS 251 Ca 0.52 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 59.24 1n1h h LYS 251 Cb 0.73 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.93 1n1h h LYS 251 CO -0.35 0.40 0.56 -0.07 -0.57 0.00 0.00 179.45 179.42 1n1h h LEU 252 N 0.38 1.08 -0.89 2.94 3.38 -0.44 -1.86 115.31 119.89 1n1h h LEU 252 Ca 0.09 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1n1h h LEU 252 Cb 0.22 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1n1h h LEU 252 CO 0.00 0.81 -0.52 1.23 0.09 0.00 0.00 178.44 180.05 1n1h h GLY 253 N 1.24 0.09 1.54 0.83 0.00 -0.98 -2.80 103.07 103.00 1n1h h GLY 253 Ca 0.33 -0.10 -0.12 0.00 0.00 0.00 0.00 47.33 47.44 1n1h h GLY 253 CO -0.06 0.09 -0.34 -2.08 0.00 0.00 0.00 176.54 174.14 1n1h h VAL 254 N 0.07 1.29 -0.37 4.60 2.07 -0.75 -2.89 116.25 120.27 1n1h h VAL 254 Ca -0.00 -1.46 -0.03 0.00 0.82 0.00 0.00 66.70 66.03 1n1h h VAL 254 Cb 0.94 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1n1h h VAL 254 CO 0.07 0.46 0.13 1.56 0.02 0.00 0.00 177.57 179.81 1n1h h GLN 255 N 0.44 0.58 -0.29 1.57 4.20 -1.11 0.32 115.11 120.82 1n1h h GLN 255 Ca 0.05 -0.12 0.02 0.00 0.06 0.00 0.00 58.65 58.66 1n1h h GLN 255 Cb 0.81 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 1n1h h GLN 255 CO 0.07 0.58 0.13 0.82 -0.67 0.00 0.00 178.83 179.75 1n1h h ILE 256 N 0.46 0.97 -0.50 2.54 2.04 -1.46 0.12 117.51 121.67 1n1h h ILE 256 Ca 0.12 -0.09 0.04 0.00 1.00 0.00 0.00 64.86 65.93 1n1h h ILE 256 Cb 0.24 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 1n1h h ILE 256 CO -0.01 0.05 0.27 0.00 0.00 0.00 0.00 178.15 178.46 1n1h h LEU 258 N 0.52 0.57 -0.92 0.00 3.38 -0.46 0.44 115.31 118.84 1n1h h LEU 258 Ca 0.22 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.99 1n1h h LEU 258 Cb 0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1n1h h LEU 258 CO -0.14 0.58 -0.43 0.45 0.09 0.00 0.00 178.44 178.99 1n1h h HIS 259 N 0.60 0.27 -0.05 1.13 3.86 0.52 0.37 115.15 121.86 1n1h h HIS 259 Ca 0.14 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.26 1n1h h HIS 259 Cb 0.25 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 1n1h h HIS 259 CO 0.01 0.62 0.00 0.00 0.86 0.00 0.00 177.93 179.43 1n1h h ALA 260 N 1.37 0.06 0.00 2.45 0.00 0.11 0.46 119.26 123.71 1n1h h ALA 260 Ca 0.02 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1n1h h ALA 260 Cb 0.84 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1n1h h ALA 260 CO 0.07 -0.27 -0.22 0.00 0.00 0.00 0.00 179.25 178.83 1n1h h ALA 261 N 0.72 1.20 -0.09 0.00 0.00 -0.87 -2.66 119.26 117.56 1n1h h ALA 261 Ca 0.01 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.56 1n1h h ALA 261 Cb 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1n1h h ALA 261 CO 0.00 0.27 -0.65 0.00 0.00 0.00 0.00 179.25 178.88 1n1h h ALA 262 N 1.78 0.72 -3.00 0.00 0.00 -0.49 -3.43 119.26 114.85 1n1h h ALA 262 Ca -0.00 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1n1h h ALA 262 Cb 0.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1n1h h ALA 262 CO 0.03 0.74 0.00 -1.13 0.00 0.00 0.00 179.25 178.89 1n1h n SER 263 N -3.87 -0.34 -0.19 0.00 3.41 0.11 -4.82 113.62 107.93 1n1h n SER 263 Ca -0.03 -0.08 0.11 0.00 -0.26 0.00 0.00 58.87 58.60 1n1h n SER 263 Cb 0.65 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.56 1n1h n SER 263 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1n1h n SER 264 N -0.76 1.35 -3.16 4.04 3.41 -1.26 -4.77 113.62 112.47 1n1h n SER 264 Ca 0.00 -1.15 0.03 0.00 -0.26 0.00 0.00 58.87 57.49 1n1h n SER 264 Cb 0.00 0.74 -0.00 0.00 -0.26 0.00 0.00 64.21 64.69 1n1h n SER 264 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1n1h s SER 265 N -2.79 -1.57 0.19 4.04 0.15 -1.26 0.14 113.70 112.59 1n1h s SER 265 Ca 0.13 -0.11 -0.24 0.00 0.70 0.00 0.00 55.95 56.43 1n1h s SER 265 Cb 0.17 1.99 0.09 0.00 -1.71 0.00 0.00 66.02 66.56 1n1h s SER 265 CO 0.74 -0.25 1.56 0.22 1.20 0.00 0.00 173.24 176.71 1n1h h TYR 266 N 7.66 -1.31 -0.01 3.44 3.20 -1.75 -0.65 116.97 127.55 1n1h h TYR 266 Ca 0.01 0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1n1h h TYR 266 Cb 1.19 0.69 -0.00 0.00 1.54 0.00 0.00 36.73 40.14 1n1h h TYR 266 CO 0.22 -0.41 0.00 0.77 -1.64 0.00 0.00 178.16 177.10 1n1h h SER 267 N -0.11 0.01 -0.24 -2.11 0.02 -1.90 -1.21 113.55 108.01 1n1h h SER 267 Ca 0.23 -0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.20 1n1h h SER 267 Cb 0.55 -0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.01 1n1h h SER 267 CO -0.83 0.05 -0.24 -0.25 -1.14 0.00 0.00 176.83 174.41 1n1h h TRP 268 N -0.04 -0.65 0.33 3.45 7.01 -1.69 -0.17 115.95 124.19 1n1h h TRP 268 Ca 0.00 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.04 1n1h h TRP 268 Cb 0.04 0.32 -0.03 0.00 -2.10 0.00 0.00 29.16 27.40 1n1h h TRP 268 CO -0.06 -0.32 -0.37 0.35 -2.79 0.00 0.00 178.44 175.24 1n1h h PHE 269 N -0.25 -1.01 -0.91 2.65 3.57 -1.02 -0.71 116.94 119.26 1n1h h PHE 269 Ca 0.14 0.01 0.23 0.00 3.53 0.00 0.00 57.97 61.88 1n1h h PHE 269 Cb 0.46 0.40 -0.13 0.00 2.79 0.00 0.00 35.95 39.47 1n1h h PHE 269 CO -0.40 -0.51 0.42 0.82 -2.23 0.00 0.00 178.31 176.41 1n1h h ILE 270 N -0.74 0.46 -0.17 1.41 1.08 -0.81 -1.10 117.51 117.65 1n1h h ILE 270 Ca -0.02 -0.14 -0.03 0.00 -0.39 0.00 0.00 64.86 64.29 1n1h h ILE 270 Cb 0.68 0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.44 1n1h h ILE 270 CO -0.09 0.07 0.01 0.25 -0.69 0.00 0.00 178.15 177.70 1n1h h LEU 271 N 0.41 0.29 -0.23 1.44 5.85 -0.40 -0.89 115.31 121.77 1n1h h LEU 271 Ca 0.58 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 59.00 1n1h h LEU 271 Cb 1.12 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1n1h h LEU 271 CO -0.53 0.52 0.00 0.29 -0.34 0.00 0.00 178.44 178.37 1n1h n LYS 272 N -4.74 0.06 0.00 1.25 4.76 -0.33 -3.33 118.16 115.83 1n1h n LYS 272 Ca -0.05 0.32 0.00 0.00 -2.87 0.00 0.00 58.31 55.71 1n1h n LYS 272 Cb 0.21 -1.62 0.00 0.00 -1.84 0.00 0.00 35.03 31.78 1n1h n LYS 272 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1n1h n THR 273 N -1.73 0.00 0.07 -0.18 -2.24 -0.79 -4.82 114.28 104.58 1n1h n THR 273 Ca 0.03 -0.39 0.02 0.00 -2.27 0.00 0.00 64.05 61.44 1n1h n THR 273 Cb 0.18 1.18 0.13 0.00 -2.10 0.00 0.00 70.33 69.72 1n1h n THR 273 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1n1h n LYS 274 N -0.12 0.03 -0.22 -0.78 2.85 -0.35 -1.04 118.16 118.54 1n1h n LYS 274 Ca 0.00 0.38 0.11 0.00 -1.05 0.00 0.00 58.31 57.74 1n1h n LYS 274 Cb 0.05 -1.92 0.22 0.00 -0.65 0.00 0.00 35.03 32.72 1n1h n LYS 274 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1n1h n SER 275 N -1.57 3.42 0.11 -5.58 3.41 -1.26 -4.59 113.62 107.56 1n1h n SER 275 Ca -0.00 -1.96 -0.13 0.00 -0.26 0.00 0.00 58.87 56.52 1n1h n SER 275 Cb 0.32 -0.28 -0.06 0.00 -0.26 0.00 0.00 64.21 63.92 1n1h n SER 275 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1n1h h ILE 276 N 4.01 0.73 -0.13 -1.33 2.04 -1.48 -0.51 117.51 120.85 1n1h h ILE 276 Ca 0.00 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 1n1h h ILE 276 Cb 0.93 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 37.73 1n1h h ILE 276 CO 0.00 0.00 0.01 -0.26 0.00 0.00 0.00 178.15 177.90 1n1h h PHE 277 N -0.27 0.24 -0.54 1.37 0.04 -1.83 -2.39 116.94 113.55 1n1h h PHE 277 Ca 0.00 -0.04 0.05 0.00 2.80 0.00 0.00 57.97 60.78 1n1h h PHE 277 Cb 0.26 -0.06 -0.05 0.00 2.20 0.00 0.00 35.95 38.30 1n1h h PHE 277 CO -0.12 0.43 0.27 -1.35 -0.60 0.00 0.00 178.31 176.95 1n1h h PRO 278 N -0.03 0.51 -0.45 1.51 0.11 -1.83 -2.94 132.00 128.88 1n1h h PRO 278 Ca 0.04 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.02 1n1h h PRO 278 Cb 0.33 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 1n1h h PRO 278 CO 0.00 0.34 -0.09 1.96 -0.21 0.00 0.00 178.00 180.00 1n1h h GLN 279 N 0.52 0.86 -0.64 1.05 1.08 -1.10 -1.05 115.11 115.83 1n1h h GLN 279 Ca 0.24 -0.32 0.00 0.00 -1.45 0.00 0.00 58.65 57.12 1n1h h GLN 279 Cb 0.15 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1n1h h GLN 279 CO -0.17 0.95 0.00 0.09 -0.95 0.00 0.00 178.83 178.75 1n1h n ASN 280 N -4.29 3.05 0.00 1.46 3.02 -0.90 -3.95 115.26 113.65 1n1h n ASN 280 Ca -0.00 -2.32 0.00 0.00 -0.03 0.00 0.00 54.58 52.23 1n1h n ASN 280 Cb 0.37 -0.48 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 1n1h n ASN 280 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1n1h n THR 281 N 0.46 0.00 -0.27 3.41 -2.24 -1.12 -4.25 114.28 110.26 1n1h n THR 281 Ca 0.14 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.83 1n1h n THR 281 Cb 0.61 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.78 1n1h n THR 281 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1n1h h LEU 282 N 0.00 -1.77 -0.33 3.22 5.85 -1.63 -0.06 115.31 120.59 1n1h h LEU 282 Ca 0.00 0.28 0.00 0.00 0.84 0.00 0.00 57.88 59.00 1n1h h LEU 282 Cb 0.00 0.79 0.00 0.00 0.37 0.00 0.00 40.66 41.82 1n1h h LEU 282 CO 0.00 -0.32 0.00 1.41 -0.34 0.00 0.00 178.44 179.19 1n1h n HIS 283 N -5.36 0.00 -1.35 1.25 8.25 -0.44 -3.36 115.22 114.21 1n1h n HIS 283 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1n1h n HIS 283 Cb 0.33 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.41 1n1h n HIS 283 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1n1h n SER 284 N -0.31 0.00 -4.78 0.41 7.64 -0.11 -4.83 113.62 111.65 1n1h n SER 284 Ca 0.00 -1.34 -0.36 0.00 1.01 0.00 0.00 58.87 58.18 1n1h n SER 284 Cb 0.07 -0.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.20 1n1h n SER 284 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1n1h s MET 285 N 0.00 3.60 -1.43 1.43 -1.94 -0.76 -4.17 119.30 116.04 1n1h s MET 285 Ca 0.00 1.64 -0.09 0.00 -1.71 0.00 0.00 55.69 55.53 1n1h s MET 285 Cb 0.00 -2.20 0.02 0.00 2.01 0.00 0.00 34.83 34.67 1n1h s MET 285 CO 0.00 -0.65 1.02 0.66 -0.01 0.00 0.00 175.02 176.04 1n1h n TYR 286 N -0.88 -2.59 0.30 -0.03 4.01 -1.26 -4.55 117.16 112.16 1n1h n TYR 286 Ca 0.09 0.89 0.19 0.00 -0.16 0.00 0.00 57.90 58.91 1n1h n TYR 286 Cb 0.50 -4.70 0.97 0.00 -0.31 0.00 0.00 39.34 35.80 1n1h n TYR 286 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 1n1h h GLU 287 N -2.30 0.00 -4.96 -0.72 5.08 -1.89 0.11 114.58 109.89 1n1h h GLU 287 Ca -0.56 0.00 -0.44 0.00 -1.00 0.00 0.00 59.36 57.36 1n1h h GLU 287 Cb 1.37 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 30.33 1n1h h GLU 287 CO 0.58 0.00 -0.79 0.45 -1.00 0.00 0.00 179.01 178.25 1n1h s SER 288 N -5.08 1.34 -0.06 1.42 0.15 -1.26 -4.23 113.70 105.98 1n1h s SER 288 Ca -0.04 -0.21 -0.02 0.00 0.70 0.00 0.00 55.95 56.38 1n1h s SER 288 Cb 0.12 -0.17 0.04 0.00 -1.71 0.00 0.00 66.02 64.30 1n1h s SER 288 CO 0.40 0.13 0.13 -0.22 1.20 0.00 0.00 173.24 174.88 1n1h s LEU 289 N -0.22 0.66 -0.12 3.45 2.96 -1.26 -4.60 118.68 119.54 1n1h s LEU 289 Ca 0.04 0.25 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 1n1h s LEU 289 Cb -0.05 0.26 -0.08 0.00 0.50 0.00 0.00 46.19 46.83 1n1h s LEU 289 CO -0.00 -0.16 -0.11 -0.62 -1.32 0.00 0.00 176.35 174.14 1n1h n GLU 290 N 4.38 0.30 0.00 1.98 1.02 0.50 -1.86 120.64 126.96 1n1h n GLU 290 Ca -0.23 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 1n1h n GLU 290 Cb 0.51 -1.24 0.00 0.00 -0.02 0.00 0.00 31.44 30.69 1n1h n GLU 290 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1n1h n GLY 291 N 2.92 3.73 0.00 0.62 0.00 -1.25 -4.45 105.19 106.77 1n1h n GLY 291 Ca -0.21 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1n1h n GLY 291 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n1h n GLY 292 N 0.00 1.50 3.10 -0.02 0.00 -1.26 -2.78 105.19 105.73 1n1h n GLY 292 Ca 0.00 -2.01 -0.22 0.00 0.00 0.00 0.00 46.02 43.78 1n1h n GLY 292 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n1h s TYR 293 N -2.03 1.28 0.35 1.61 2.02 -1.24 -1.06 117.35 118.28 1n1h s TYR 293 Ca 0.00 -0.26 0.09 0.00 -0.37 0.00 0.00 57.07 56.53 1n1h s TYR 293 Cb 0.00 -0.83 -0.07 0.00 -0.40 0.00 0.00 41.96 40.66 1n1h s TYR 293 CO 0.00 -0.04 -0.08 0.00 -1.57 0.00 0.00 175.55 173.87 1n1h s PRO 295 N -3.63 1.34 -0.31 0.00 0.02 -1.26 -0.23 135.00 130.93 1n1h s PRO 295 Ca 0.33 1.18 -0.01 0.00 0.02 0.00 0.00 61.00 62.52 1n1h s PRO 295 Cb 0.04 -1.79 0.10 0.00 0.02 0.00 0.00 34.50 32.86 1n1h s PRO 295 CO 0.17 -2.29 0.09 1.21 -0.33 0.00 0.00 177.00 175.85 1n1h s ASN 296 N -3.09 4.02 0.13 2.53 2.47 -0.83 -4.36 114.94 115.81 1n1h s ASN 296 Ca 0.64 -1.63 0.09 0.00 0.42 0.00 0.00 52.86 52.38 1n1h s ASN 296 Cb -0.20 -0.88 -0.04 0.00 -1.45 0.00 0.00 41.25 38.68 1n1h s ASN 296 CO 0.58 -0.41 -0.14 -0.76 -3.72 0.00 0.00 177.10 172.64 1n1h s LEU 297 N 1.61 2.84 -0.08 3.21 1.02 -1.26 0.58 118.68 126.59 1n1h s LEU 297 Ca 0.09 -0.53 0.02 0.00 0.02 0.00 0.00 54.13 53.74 1n1h s LEU 297 Cb -0.17 -1.63 -0.02 0.00 0.02 0.00 0.00 46.19 44.38 1n1h s LEU 297 CO -0.24 0.16 -0.14 -0.70 0.02 0.00 0.00 176.35 175.45 1n1h s GLU 298 N -2.34 2.86 -0.43 1.70 2.12 -0.43 -4.95 118.70 117.25 1n1h s GLU 298 Ca 0.20 -0.69 -0.19 0.00 0.36 0.00 0.00 54.97 54.65 1n1h s GLU 298 Cb -0.10 -2.48 0.02 0.00 0.26 0.00 0.00 34.13 31.83 1n1h s GLU 298 CO 0.12 0.45 0.53 -0.46 -0.54 0.00 0.00 175.26 175.36 1n1h s TRP 299 N -0.29 3.12 0.93 5.30 -0.11 -1.26 -1.32 118.94 125.31 1n1h s TRP 299 Ca 0.02 -0.22 -0.11 0.00 1.22 0.00 0.00 56.10 57.01 1n1h s TRP 299 Cb -0.13 -3.09 0.15 0.00 -1.50 0.00 0.00 33.47 28.90 1n1h s TRP 299 CO 0.03 -0.77 1.09 -0.51 -4.62 0.00 0.00 176.95 172.17 1n1h s LEU 300 N 2.44 2.28 -0.08 5.86 1.02 -0.35 -4.91 118.68 124.93 1n1h s LEU 300 Ca 0.17 1.71 -0.05 0.00 0.02 0.00 0.00 54.13 55.98 1n1h s LEU 300 Cb -0.16 -4.08 -0.04 0.00 0.02 0.00 0.00 46.19 41.93 1n1h s LEU 300 CO 0.16 -2.92 0.14 -1.61 0.02 0.00 0.00 176.35 172.14 1n1h s GLU 301 N -4.78 3.39 0.20 1.70 0.41 -1.26 -3.17 118.70 115.18 1n1h s GLU 301 Ca 0.65 -0.22 -0.23 0.00 -0.41 0.00 0.00 54.97 54.75 1n1h s GLU 301 Cb -0.20 -3.12 -0.08 0.00 -1.78 0.00 0.00 34.13 28.95 1n1h s GLU 301 CO 0.58 0.74 0.77 -1.25 -0.49 0.00 0.00 175.26 175.61 1n1h s PRO 302 N -1.31 4.45 0.57 0.39 0.04 -1.26 -5.01 135.00 132.87 1n1h s PRO 302 Ca 0.19 1.06 0.32 0.00 0.04 0.00 0.00 61.00 62.61 1n1h s PRO 302 Cb -0.12 -3.09 1.44 0.00 0.04 0.00 0.00 34.50 32.77 1n1h s PRO 302 CO 0.09 0.49 1.79 0.00 0.04 0.00 0.00 177.00 179.40 1n1h h ARG 303 N 3.91 0.00 0.00 4.56 3.08 -1.89 -0.27 114.38 123.77 1n1h h ARG 303 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1n1h h ARG 303 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 1n1h h ARG 303 CO 0.66 0.00 0.06 0.66 -1.07 0.00 0.00 179.97 180.28 1n1h h SER 304 N 0.00 0.00 1.47 7.04 4.64 -1.88 -0.48 113.55 124.34 1n1h h SER 304 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 1n1h h SER 304 Cb 1.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.95 1n1h h SER 304 CO -0.00 0.00 0.00 0.44 -0.87 0.00 0.00 176.83 176.40 1n1h h ASP 305 N 0.00 0.00 -6.04 4.97 5.19 -1.38 -3.47 116.42 115.68 1n1h h ASP 305 Ca 0.00 0.00 -0.43 0.00 -0.62 0.00 0.00 57.03 55.98 1n1h h ASP 305 Cb 0.13 0.00 0.06 0.00 0.18 0.00 0.00 39.33 39.70 1n1h h ASP 305 CO 0.00 0.00 -0.72 -1.22 -3.12 0.00 0.00 179.24 174.18 1n1h n TYR 306 N -2.58 -2.61 -4.26 4.55 4.01 -0.19 -4.27 117.16 111.82 1n1h n TYR 306 Ca 0.04 0.97 -0.34 0.00 -0.16 0.00 0.00 57.90 58.41 1n1h n TYR 306 Cb 0.42 -4.58 -0.13 0.00 -0.31 0.00 0.00 39.34 34.74 1n1h n TYR 306 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1n1h s LYS 307 N -6.42 3.52 0.21 -0.72 2.20 -1.26 -1.84 119.74 115.44 1n1h s LYS 307 Ca 0.59 -0.58 0.08 0.00 -0.36 0.00 0.00 55.97 55.70 1n1h s LYS 307 Cb -0.28 -2.93 -0.05 0.00 -1.51 0.00 0.00 37.83 33.07 1n1h s LYS 307 CO 0.77 0.06 -0.14 -0.06 -0.36 0.00 0.00 175.35 175.62 1n1h s PHE 308 N 0.83 1.77 -0.07 4.03 0.08 -0.36 -1.21 117.98 123.04 1n1h s PHE 308 Ca -0.01 -0.56 0.01 0.00 0.12 0.00 0.00 56.93 56.49 1n1h s PHE 308 Cb -0.15 -0.83 0.02 0.00 -0.57 0.00 0.00 43.02 41.50 1n1h s PHE 308 CO 0.01 0.38 -0.10 -1.64 -0.10 0.00 0.00 175.22 173.78 1n1h s MET 309 N -3.64 1.54 0.10 0.44 -1.94 -0.43 -4.73 119.30 110.64 1n1h s MET 309 Ca 0.23 -0.33 -0.31 0.00 -1.71 0.00 0.00 55.69 53.57 1n1h s MET 309 Cb -0.01 -1.37 -0.08 0.00 2.01 0.00 0.00 34.83 35.38 1n1h s MET 309 CO 0.08 -0.06 1.40 -0.47 -0.01 0.00 0.00 175.02 175.96 1n1h s TYR 310 N 0.95 3.19 -0.15 -0.03 5.04 -1.26 -1.31 117.35 123.78 1n1h s TYR 310 Ca -0.09 0.93 0.15 0.00 -2.44 0.00 0.00 57.07 55.62 1n1h s TYR 310 Cb -0.15 -3.69 0.43 0.00 0.35 0.00 0.00 41.96 38.90 1n1h s TYR 310 CO 0.00 -2.43 1.20 -1.33 -1.34 0.00 0.00 175.55 171.66 1n1h n MET 311 N 4.11 1.22 0.00 4.97 2.81 0.20 -4.97 117.12 125.46 1n1h n MET 311 Ca 0.12 -2.97 0.00 0.00 -1.81 0.00 0.00 57.70 53.04 1n1h n MET 311 Cb 0.42 -1.18 0.00 0.00 -0.71 0.00 0.00 33.22 31.76 1n1h n MET 311 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n1h n GLY 312 N -0.61 -1.75 3.80 3.03 0.00 -1.25 -4.87 105.19 103.53 1n1h n GLY 312 Ca 0.16 -2.02 -0.29 0.00 0.00 0.00 0.00 46.02 43.88 1n1h n GLY 312 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1n1h s VAL 313 N 0.00 4.58 -0.39 1.61 -7.23 -1.26 -1.96 120.40 115.75 1n1h s VAL 313 Ca 0.00 -0.87 -0.08 0.00 -1.81 0.00 0.00 61.98 59.22 1n1h s VAL 313 Cb 0.00 -3.27 0.06 0.00 0.56 0.00 0.00 36.38 33.73 1n1h s VAL 313 CO 0.00 0.02 0.20 -0.32 -0.31 0.00 0.00 175.10 174.69 1n1h s MET 314 N -2.71 2.59 0.37 4.82 0.00 0.69 -4.85 119.30 120.19 1n1h s MET 314 Ca 0.30 -1.35 -0.28 0.00 0.00 0.00 0.00 55.69 54.36 1n1h s MET 314 Cb -0.11 -3.65 -0.11 0.00 0.00 0.00 0.00 34.83 30.96 1n1h s MET 314 CO 0.23 -0.84 1.45 -2.14 0.00 0.00 0.00 175.02 173.73 1n1h s PRO 315 N 1.41 4.16 0.22 4.11 0.02 -1.26 -1.60 135.00 142.05 1n1h s PRO 315 Ca 0.02 2.51 0.06 0.00 0.02 0.00 0.00 61.00 63.60 1n1h s PRO 315 Cb -0.21 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.28 1n1h s PRO 315 CO 0.02 -0.47 0.18 -0.51 -0.33 0.00 0.00 177.00 175.89 1n1h s LEU 316 N -2.03 3.83 0.32 -5.54 1.43 -0.23 -4.91 118.68 111.56 1n1h s LEU 316 Ca 0.52 -0.19 -0.18 0.00 -1.03 0.00 0.00 54.13 53.26 1n1h s LEU 316 Cb -0.45 -2.40 0.07 0.00 0.03 0.00 0.00 46.19 43.44 1n1h s LEU 316 CO 0.61 0.00 0.89 -0.94 0.23 0.00 0.00 176.35 177.15 1n1h s SER 317 N -3.54 0.03 0.55 2.29 1.04 -1.26 -4.18 113.70 108.62 1n1h s SER 317 Ca 0.32 -1.02 0.34 0.00 0.48 0.00 0.00 55.95 56.07 1n1h s SER 317 Cb -0.09 0.73 1.51 0.00 0.10 0.00 0.00 66.02 68.27 1n1h s SER 317 CO 0.24 -1.46 1.83 0.00 0.98 0.00 0.00 173.24 174.84 1n1h h ALA 318 N 2.00 2.95 0.00 5.32 0.00 -1.61 0.48 119.26 128.40 1n1h h ALA 318 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1n1h h ALA 318 Cb 1.24 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1n1h h ALA 318 CO 0.41 -1.29 0.17 -0.22 0.00 0.00 0.00 179.25 178.32 1n1h h LYS 319 N 0.00 0.00 -0.04 0.00 3.64 -1.95 -1.56 116.57 116.66 1n1h h LYS 319 Ca 0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.87 1n1h h LYS 319 Cb 2.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.82 1n1h h LYS 319 CO -0.01 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.83 1n1h n TYR 320 N -2.59 0.05 -0.81 1.91 4.01 0.17 -4.90 117.16 115.00 1n1h n TYR 320 Ca -0.02 -0.32 -0.33 0.00 -0.16 0.00 0.00 57.90 57.07 1n1h n TYR 320 Cb 0.21 -0.03 0.11 0.00 -0.31 0.00 0.00 39.34 39.32 1n1h n TYR 320 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1n1h n ALA 321 N -0.16 -3.04 -1.62 -0.72 0.00 -0.59 -4.71 120.51 109.67 1n1h n ALA 321 Ca 0.02 -0.65 -0.51 0.00 0.00 0.00 0.00 53.44 52.30 1n1h n ALA 321 Cb 0.20 -1.70 -0.06 0.00 0.00 0.00 0.00 19.45 17.89 1n1h n ALA 321 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1n1h n ARG 322 N -1.20 1.63 -0.01 0.00 0.63 0.37 -4.82 116.66 113.25 1n1h n ARG 322 Ca 0.05 0.56 0.09 0.00 -0.92 0.00 0.00 57.85 57.63 1n1h n ARG 322 Cb 0.54 -2.51 -0.13 0.00 0.45 0.00 0.00 32.46 30.81 1n1h n ARG 322 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1n1h n SER 323 N 7.61 0.87 -4.74 6.15 3.41 -1.26 -4.84 113.62 120.82 1n1h n SER 323 Ca 0.29 -0.19 -0.34 0.00 -0.26 0.00 0.00 58.87 58.37 1n1h n SER 323 Cb 0.25 1.65 0.07 0.00 -0.26 0.00 0.00 64.21 65.92 1n1h n SER 323 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1h s ALA 324 N -3.12 2.29 0.43 7.33 0.00 -1.26 -4.87 121.76 122.55 1n1h s ALA 324 Ca -0.04 0.79 -0.24 0.00 0.00 0.00 0.00 51.96 52.47 1n1h s ALA 324 Cb 0.12 -3.42 -0.11 0.00 0.00 0.00 0.00 23.12 19.71 1n1h s ALA 324 CO 0.74 -1.59 0.90 -2.30 0.00 0.00 0.00 175.76 173.52 1n1h n PRO 325 N -2.47 1.13 -2.74 0.00 -0.02 -1.26 -4.94 135.00 124.70 1n1h n PRO 325 Ca 0.12 0.41 -0.42 0.00 -2.02 0.00 0.00 63.50 61.59 1n1h n PRO 325 Cb 0.51 -1.92 -0.03 0.00 -0.02 0.00 0.00 33.50 32.04 1n1h n PRO 325 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1n1h s SER 326 N -0.82 7.30 0.00 2.55 0.15 -1.26 -4.93 113.70 116.69 1n1h s SER 326 Ca 0.64 1.57 0.20 0.00 0.70 0.00 0.00 55.95 59.07 1n1h s SER 326 Cb -0.57 -2.55 0.58 0.00 -1.71 0.00 0.00 66.02 61.78 1n1h s SER 326 CO 0.56 -0.30 1.46 -0.46 1.20 0.00 0.00 173.24 175.71 1n1h n ASN 327 N 4.21 2.36 -0.26 5.45 6.94 -1.26 -4.58 115.26 128.12 1n1h n ASN 327 Ca 0.06 -1.85 -0.09 0.00 -0.02 0.00 0.00 54.58 52.68 1n1h n ASN 327 Cb 0.50 -0.19 -0.05 0.00 -2.36 0.00 0.00 39.78 37.69 1n1h n ASN 327 CO 0.00 0.00 0.00 -0.78 -1.03 0.00 0.00 177.26 175.45 1n1h h ASP 328 N 3.00 -1.70 0.02 0.53 3.58 -1.95 -0.68 116.42 119.21 1n1h h ASP 328 Ca 0.00 0.27 0.03 0.00 0.42 0.00 0.00 57.03 57.75 1n1h h ASP 328 Cb 0.66 0.77 -0.05 0.00 1.72 0.00 0.00 39.33 42.42 1n1h h ASP 328 CO 0.00 -0.32 -0.42 0.50 -2.88 0.00 0.00 179.24 176.12 1n1h h LYS 329 N -0.18 -0.57 -0.77 0.28 3.64 -2.00 -0.09 116.57 116.87 1n1h h LYS 329 Ca 0.18 0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.57 1n1h h LYS 329 Cb 0.54 0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.45 1n1h h LYS 329 CO -0.76 -0.38 0.36 0.87 -2.27 0.00 0.00 179.45 177.27 1n1h h LYS 330 N -0.59 1.10 -0.31 1.90 1.57 -1.86 -1.50 116.57 116.87 1n1h h LYS 330 Ca 0.04 -0.16 0.03 0.00 -1.87 0.00 0.00 60.65 58.69 1n1h h LYS 330 Cb 0.66 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 1n1h h LYS 330 CO -0.31 0.86 0.11 0.00 -0.57 0.00 0.00 179.45 179.54 1n1h h ALA 331 N 1.30 0.35 -0.06 3.86 0.00 -0.59 0.94 119.26 125.06 1n1h h ALA 331 Ca 0.26 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.10 1n1h h ALA 331 Cb 0.12 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1n1h h ALA 331 CO -0.03 -0.29 -0.48 0.00 0.00 0.00 0.00 179.25 178.44 1n1h h ARG 332 N 0.24 0.16 -0.07 0.00 3.08 -0.78 -2.51 114.38 114.50 1n1h h ARG 332 Ca 0.14 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1n1h h ARG 332 Cb 0.11 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1n1h h ARG 332 CO -0.15 0.61 0.01 0.93 -1.07 0.00 0.00 179.97 180.30 1n1h h GLU 333 N 0.13 0.11 -0.52 0.04 5.08 -0.64 -0.33 114.58 118.44 1n1h h GLU 333 Ca 0.01 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.40 1n1h h GLU 333 Cb 0.90 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.08 1n1h h GLU 333 CO 0.07 0.31 0.20 1.25 -1.00 0.00 0.00 179.01 179.85 1n1h h LEU 334 N -0.11 0.23 -0.83 1.33 6.46 -0.73 0.15 115.31 121.80 1n1h h LEU 334 Ca 0.02 0.06 -0.00 0.00 -0.12 0.00 0.00 57.88 57.83 1n1h h LEU 334 Cb 0.26 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.17 1n1h h LEU 334 CO 0.00 0.16 0.51 1.23 -0.62 0.00 0.00 178.44 179.72 1n1h h GLY 335 N 0.39 1.20 1.04 3.75 0.00 -1.27 -2.83 103.07 105.36 1n1h h GLY 335 Ca 0.25 -0.49 -0.07 0.00 0.00 0.00 0.00 47.33 47.01 1n1h h GLY 335 CO -0.23 0.48 0.11 0.83 0.00 0.00 0.00 176.54 177.73 1n1h h GLU 336 N 1.14 1.03 0.00 4.80 4.39 0.14 0.21 114.58 126.28 1n1h h GLU 336 Ca 0.30 -0.27 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 1n1h h GLU 336 Cb -0.06 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.47 1n1h h GLU 336 CO -0.06 0.95 -0.06 -0.22 -1.16 0.00 0.00 179.01 178.46 1n1h h LYS 337 N 0.94 0.00 -0.08 2.33 3.64 -0.79 -3.16 116.57 119.45 1n1h h LYS 337 Ca 0.19 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.54 1n1h h LYS 337 Cb 0.41 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1n1h h LYS 337 CO 0.01 0.06 -0.24 0.66 -2.27 0.00 0.00 179.45 177.67 1n1h n TYR 338 N -3.23 0.26 -2.82 1.91 4.01 -1.09 -4.97 117.16 111.24 1n1h n TYR 338 Ca -0.00 -1.33 -0.20 0.00 -0.16 0.00 0.00 57.90 56.22 1n1h n TYR 338 Cb 0.30 -0.27 0.01 0.00 -0.31 0.00 0.00 39.34 39.06 1n1h n TYR 338 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n1h n GLY 339 N -1.17 -0.50 0.06 2.72 0.00 -1.11 -4.86 105.19 100.33 1n1h n GLY 339 Ca 0.21 0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.35 1n1h n GLY 339 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1n1h n LEU 340 N -3.44 2.08 0.33 0.99 4.77 0.66 -4.75 117.00 117.64 1n1h n LEU 340 Ca -0.13 -2.57 0.21 0.00 -0.03 0.00 0.00 56.01 53.50 1n1h n LEU 340 Cb 0.61 -0.26 1.13 0.00 -2.33 0.00 0.00 43.42 42.58 1n1h n LEU 340 CO 0.37 0.60 1.16 0.77 -1.33 0.00 0.00 177.39 178.96 1n1h h SER 341 N 0.00 0.00 -0.24 -1.43 4.64 -1.72 -0.93 113.55 113.87 1n1h h SER 341 Ca 0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 1n1h h SER 341 Cb 0.85 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.93 1n1h h SER 341 CO 0.00 0.00 -0.07 -1.28 -0.87 0.00 0.00 176.83 174.61 1n1h h SER 342 N 0.00 0.48 0.03 4.97 0.87 -1.89 -2.40 113.55 115.61 1n1h h SER 342 Ca 0.00 -0.37 -0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1n1h h SER 342 Cb 0.10 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1n1h h SER 342 CO 0.00 0.74 -0.01 0.58 -0.53 0.00 0.00 176.83 177.61 1n1h h VAL 343 N 0.21 1.34 -0.61 2.23 2.07 -1.57 -2.78 116.25 117.15 1n1h h VAL 343 Ca 0.06 -1.18 0.10 0.00 0.82 0.00 0.00 66.70 66.50 1n1h h VAL 343 Cb 0.54 2.12 -0.08 0.00 -1.52 0.00 0.00 31.29 32.35 1n1h h VAL 343 CO 0.03 0.30 0.20 0.58 0.02 0.00 0.00 177.57 178.69 1n1h h VAL 344 N -0.55 0.73 -0.73 2.57 2.07 -1.48 -1.43 116.25 117.42 1n1h h VAL 344 Ca -0.00 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 1n1h h VAL 344 Cb 0.52 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1n1h h VAL 344 CO 0.01 0.07 0.29 1.23 0.02 0.00 0.00 177.57 179.18 1n1h h GLY 345 N 0.36 1.19 1.53 2.17 0.00 -1.47 -1.81 103.07 105.04 1n1h h GLY 345 Ca 0.31 -0.65 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1n1h h GLY 345 CO -0.34 0.61 -0.06 -2.09 0.00 0.00 0.00 176.54 174.67 1n1h h GLU 346 N 1.06 0.57 -0.24 4.80 4.57 -1.13 -1.97 114.58 122.24 1n1h h GLU 346 Ca 0.24 -0.15 -0.17 0.00 -1.18 0.00 0.00 59.36 58.11 1n1h h GLU 346 Cb 0.22 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.74 1n1h h GLU 346 CO -0.02 0.64 -0.53 -0.07 -1.18 0.00 0.00 179.01 177.84 1n1h h LEU 347 N 0.54 0.79 -0.40 1.64 3.38 -0.95 -2.68 115.31 117.62 1n1h h LEU 347 Ca 0.11 -0.42 -0.08 0.00 0.09 0.00 0.00 57.88 57.58 1n1h h LEU 347 Cb 0.43 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1n1h h LEU 347 CO 0.02 1.17 -0.05 0.03 0.09 0.00 0.00 178.44 179.70 1n1h h ARG 348 N 0.55 0.74 -0.35 1.13 2.47 -1.07 -1.89 114.38 115.96 1n1h h ARG 348 Ca 0.01 -0.26 0.03 0.00 -1.26 0.00 0.00 59.98 58.50 1n1h h ARG 348 Cb 1.11 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 29.34 1n1h h ARG 348 CO 0.11 0.85 0.15 -0.22 0.56 0.00 0.00 179.97 181.43 1n1h h LYS 349 N 0.56 0.31 -0.31 0.04 3.64 -1.34 -2.61 116.57 116.86 1n1h h LYS 349 Ca 0.11 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.33 1n1h h LYS 349 Cb 0.55 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.30 1n1h h LYS 349 CO 0.03 0.21 -0.34 0.00 -2.27 0.00 0.00 179.45 177.08 1n1h h ARG 350 N 0.32 0.78 -0.61 1.90 3.08 -1.43 -3.10 114.38 115.31 1n1h h ARG 350 Ca 0.15 -0.42 0.10 0.00 0.07 0.00 0.00 59.98 59.88 1n1h h ARG 350 Cb 0.09 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 1n1h h ARG 350 CO -0.12 1.05 0.41 1.15 -1.07 0.00 0.00 179.97 181.38 1n1h h THR 351 N 0.54 0.89 0.00 2.04 2.02 -1.21 -0.14 112.91 117.05 1n1h h THR 351 Ca 0.05 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1n1h h THR 351 Cb 0.92 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1n1h h THR 351 CO 0.08 0.08 0.00 0.11 0.37 0.00 0.00 175.52 176.16 1n1h h LYS 352 N 0.42 0.00 0.00 6.66 1.57 -1.39 -3.06 116.57 120.77 1n1h h LYS 352 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1n1h h LYS 352 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1n1h h LYS 352 CO -0.08 0.00 0.00 1.79 -0.57 0.00 0.00 179.45 180.59 1n1h h THR 353 N 0.00 0.00 -2.92 -0.16 1.35 -1.06 -3.41 112.91 106.70 1n1h h THR 353 Ca 0.00 -0.90 -0.60 0.00 -0.55 0.00 0.00 66.41 64.35 1n1h h THR 353 Cb 0.59 1.90 -0.12 0.00 -1.73 0.00 0.00 68.15 68.78 1n1h h THR 353 CO 0.00 0.00 0.64 -0.31 -0.25 0.00 0.00 175.52 175.60 1n1h s TYR 354 N -3.27 2.68 -0.98 4.73 2.02 -1.16 -4.82 117.35 116.55 1n1h s TYR 354 Ca 0.06 -0.16 0.09 0.00 -0.37 0.00 0.00 57.07 56.69 1n1h s TYR 354 Cb 0.06 -4.24 0.18 0.00 -0.40 0.00 0.00 41.96 37.57 1n1h s TYR 354 CO 0.65 -1.55 1.04 1.33 -1.57 0.00 0.00 175.55 175.45 1n1h n VAL 355 N 6.16 0.56 -4.60 0.71 0.24 -1.26 -4.35 118.33 115.79 1n1h n VAL 355 Ca 0.00 -0.78 -0.23 0.00 -2.04 0.00 0.00 64.34 61.30 1n1h n VAL 355 Cb 0.47 0.81 -0.15 0.00 -1.47 0.00 0.00 33.84 33.49 1n1h n VAL 355 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1n1h s LYS 356 N -0.91 1.24 -0.32 7.34 1.02 -1.26 -0.37 119.74 126.47 1n1h s LYS 356 Ca 0.16 -0.46 -0.22 0.00 0.02 0.00 0.00 55.97 55.47 1n1h s LYS 356 Cb 0.09 -1.14 -0.00 0.00 -0.52 0.00 0.00 37.83 36.26 1n1h s LYS 356 CO 0.13 0.22 0.74 -1.58 -0.92 0.00 0.00 175.35 173.93 1n1h s HIS 357 N -0.05 3.19 0.01 3.18 5.65 -1.12 -4.68 115.29 121.47 1n1h s HIS 357 Ca -0.00 0.68 -0.01 0.00 0.25 0.00 0.00 55.06 55.98 1n1h s HIS 357 Cb -0.08 -3.18 0.00 0.00 -1.18 0.00 0.00 32.58 28.14 1n1h s HIS 357 CO 0.01 -0.57 0.03 -0.40 -0.65 0.00 0.00 174.74 173.16 1n1h n ASP 358 N 6.14 -0.08 -0.11 9.88 5.68 -1.26 -3.73 116.55 133.07 1n1h n ASP 358 Ca 0.02 -1.05 -0.07 0.00 -0.50 0.00 0.00 54.79 53.19 1n1h n ASP 358 Cb 0.48 0.13 0.01 0.00 -1.14 0.00 0.00 41.12 40.60 1n1h n ASP 358 CO 0.00 0.00 0.00 -0.26 -1.33 0.00 0.00 177.20 175.61 1n1h h PHE 359 N 1.04 0.31 -0.24 2.11 0.04 -1.94 -2.49 116.94 115.77 1n1h h PHE 359 Ca -0.01 0.02 0.05 0.00 2.80 0.00 0.00 57.97 60.82 1n1h h PHE 359 Cb 0.05 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 1n1h h PHE 359 CO 0.00 0.16 -0.07 0.00 -0.60 0.00 0.00 178.31 177.80 1n1h h ALA 360 N 1.19 0.14 -0.17 2.45 0.00 -1.96 -1.70 119.26 119.21 1n1h h ALA 360 Ca 0.15 0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 1n1h h ALA 360 Cb 0.08 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1n1h h ALA 360 CO -0.12 -0.49 -0.45 0.66 0.00 0.00 0.00 179.25 178.85 1n1h h SER 361 N -0.02 0.46 1.10 0.00 4.64 -1.79 -2.30 113.55 115.63 1n1h h SER 361 Ca 0.12 -0.21 -0.11 0.00 -0.47 0.00 0.00 61.79 61.11 1n1h h SER 361 Cb 0.20 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.15 1n1h h SER 361 CO -0.26 0.85 -0.54 -0.37 -0.87 0.00 0.00 176.83 175.64 1n1h h VAL 362 N 0.34 1.05 -0.08 0.95 -1.51 -1.37 -2.57 116.25 113.07 1n1h h VAL 362 Ca 0.02 -2.14 -0.13 0.00 -1.23 0.00 0.00 66.70 63.22 1n1h h VAL 362 Cb 0.94 2.28 -0.01 0.00 -2.13 0.00 0.00 31.29 32.37 1n1h h VAL 362 CO 0.08 0.53 -0.52 -0.09 -1.23 0.00 0.00 177.57 176.35 1n1h h ARG 363 N 0.00 0.21 -0.38 5.19 2.43 -1.17 -1.21 114.38 119.45 1n1h h ARG 363 Ca -0.01 -0.12 -0.09 0.00 -0.81 0.00 0.00 59.98 58.96 1n1h h ARG 363 Cb 1.24 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 1n1h h ARG 363 CO 0.07 0.68 -0.10 -0.92 -1.51 0.00 0.00 179.97 178.19 1n1h h TYR 364 N 0.17 0.83 0.11 2.20 3.20 -1.15 0.12 116.97 122.45 1n1h h TYR 364 Ca 0.00 -0.18 -0.01 0.00 3.14 0.00 0.00 58.73 61.69 1n1h h TYR 364 Cb 0.97 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 39.04 1n1h h TYR 364 CO 0.02 0.88 -0.05 0.82 -1.64 0.00 0.00 178.16 178.19 1n1h h ILE 365 N 0.54 0.96 0.04 1.81 2.04 -1.25 0.10 117.51 121.76 1n1h h ILE 365 Ca 0.10 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.71 1n1h h ILE 365 Cb 0.62 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 1n1h h ILE 365 CO 0.04 0.07 -0.42 -0.09 0.00 0.00 0.00 178.15 177.75 1n1h h ARG 366 N -0.28 -0.58 -0.61 2.37 1.12 -1.15 0.31 114.38 115.57 1n1h h ARG 366 Ca -0.02 0.04 0.12 0.00 -1.11 0.00 0.00 59.98 59.01 1n1h h ARG 366 Cb 0.23 0.13 -0.09 0.00 -0.01 0.00 0.00 29.97 30.23 1n1h h ARG 366 CO 0.03 -0.39 0.13 -0.44 -3.11 0.00 0.00 179.97 176.19 1n1h h ASP 367 N -0.60 -0.00 -0.63 -3.80 5.19 -0.64 -0.72 116.42 115.22 1n1h h ASP 367 Ca 0.04 0.11 0.06 0.00 -0.62 0.00 0.00 57.03 56.63 1n1h h ASP 367 Cb 0.66 0.16 -0.06 0.00 0.18 0.00 0.00 39.33 40.27 1n1h h ASP 367 CO -0.29 0.01 0.33 0.00 -3.12 0.00 0.00 179.24 176.16 1n1h h ALA 368 N 1.49 0.84 0.00 3.45 0.00 0.08 -2.68 119.26 122.44 1n1h h ALA 368 Ca 0.32 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1n1h h ALA 368 Cb 0.48 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1n1h h ALA 368 CO -0.41 -0.02 0.00 -1.33 0.00 0.00 0.00 179.25 177.49 1n1h n MET 369 N -4.84 0.10 0.03 0.00 2.81 -0.00 -2.86 117.12 112.35 1n1h n MET 369 Ca 0.08 0.06 0.13 0.00 -1.81 0.00 0.00 57.70 56.16 1n1h n MET 369 Cb 0.19 -1.50 0.37 0.00 -0.71 0.00 0.00 33.22 31.57 1n1h n MET 369 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1n1h n ALA 370 N -1.44 2.80 1.33 3.04 0.00 -0.90 -3.65 120.51 121.68 1n1h n ALA 370 Ca 0.08 -0.19 0.15 0.00 0.00 0.00 0.00 53.44 53.47 1n1h n ALA 370 Cb 0.27 -1.30 0.71 0.00 0.00 0.00 0.00 19.45 19.13 1n1h n ALA 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1h s THR 372 N -2.66 3.65 0.35 0.00 2.01 -1.24 -4.67 115.64 113.08 1n1h s THR 372 Ca 0.25 1.63 -0.25 0.00 0.31 0.00 0.00 61.69 63.63 1n1h s THR 372 Cb 0.20 -4.02 -0.13 0.00 0.01 0.00 0.00 72.50 68.55 1n1h s THR 372 CO 0.48 0.36 0.73 -0.24 -0.69 0.00 0.00 174.62 175.26 1n1h n SER 373 N 1.15 -0.07 -0.65 3.53 2.88 -1.26 -4.65 113.62 114.55 1n1h n SER 373 Ca -0.01 1.04 0.06 0.00 -1.33 0.00 0.00 58.87 58.62 1n1h n SER 373 Cb 0.46 -1.16 0.16 0.00 -0.75 0.00 0.00 64.21 62.91 1n1h n SER 373 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1n1h n GLY 374 N 1.59 2.84 3.76 0.46 0.00 -1.26 -4.63 105.19 107.95 1n1h n GLY 374 Ca 0.12 -0.41 -0.38 0.00 0.00 0.00 0.00 46.02 45.35 1n1h n GLY 374 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1n1h s ILE 375 N -1.10 2.75 -0.56 -0.61 -4.36 -1.26 -4.68 121.20 111.38 1n1h s ILE 375 Ca 0.24 0.58 -0.23 0.00 -0.26 0.00 0.00 60.65 60.98 1n1h s ILE 375 Cb 0.13 -3.30 0.05 0.00 1.25 0.00 0.00 42.46 40.59 1n1h s ILE 375 CO 0.15 0.01 0.89 -0.36 0.24 0.00 0.00 174.94 175.87 1n1h s PHE 376 N -1.44 2.82 0.52 1.37 0.08 -1.26 -3.28 117.98 116.79 1n1h s PHE 376 Ca 0.65 -0.20 -0.20 0.00 0.12 0.00 0.00 56.93 57.29 1n1h s PHE 376 Cb -0.33 -4.02 -0.09 0.00 -0.57 0.00 0.00 43.02 38.01 1n1h s PHE 376 CO 0.40 -1.35 0.78 1.28 -0.10 0.00 0.00 175.22 176.23 1n1h n LEU 377 N 7.28 1.99 -3.86 -0.37 4.32 -0.87 -4.85 117.00 120.65 1n1h n LEU 377 Ca -0.01 0.86 -0.12 0.00 -0.02 0.00 0.00 56.01 56.73 1n1h n LEU 377 Cb 0.47 -1.27 -0.12 0.00 -1.62 0.00 0.00 43.42 40.88 1n1h n LEU 377 CO 0.62 -2.27 -0.23 -0.69 -1.22 0.00 0.00 177.39 173.61 1n1h s VAL 378 N -1.51 0.04 0.19 4.08 1.01 -1.26 -4.42 120.40 118.52 1n1h s VAL 378 Ca 0.68 -0.31 -0.20 0.00 0.00 0.00 0.00 61.98 62.16 1n1h s VAL 378 Cb -0.49 -0.26 0.04 0.00 0.00 0.00 0.00 36.38 35.67 1n1h s VAL 378 CO 0.53 -0.17 0.56 0.00 0.00 0.00 0.00 175.10 176.03 1n1h s ARG 379 N -0.54 1.37 0.53 2.72 1.70 -1.26 -3.94 118.95 119.52 1n1h s ARG 379 Ca -0.06 -0.73 -0.21 0.00 -0.47 0.00 0.00 55.73 54.26 1n1h s ARG 379 Cb -0.04 0.55 -0.06 0.00 -0.57 0.00 0.00 34.95 34.83 1n1h s ARG 379 CO 0.00 -0.59 1.17 0.95 -1.08 0.00 0.00 175.30 175.76 1n1h s THR 380 N -3.83 2.95 0.18 4.99 -4.23 -1.26 -4.86 115.64 109.58 1n1h s THR 380 Ca 0.06 0.64 -0.20 0.00 -1.18 0.00 0.00 61.69 61.02 1n1h s THR 380 Cb -0.01 -3.29 0.11 0.00 1.34 0.00 0.00 72.50 70.65 1n1h s THR 380 CO -0.06 -0.08 1.62 -0.65 -0.54 0.00 0.00 174.62 174.91 1n1h h PRO 381 N 1.44 -0.15 -0.87 3.99 0.11 -1.98 -1.66 132.00 132.88 1n1h h PRO 381 Ca -0.50 0.01 0.17 0.00 0.11 0.00 0.00 66.00 65.79 1n1h h PRO 381 Cb 1.27 0.03 -0.16 0.00 0.11 0.00 0.00 31.00 32.25 1n1h h PRO 381 CO 0.58 -0.10 -0.25 1.15 -0.21 0.00 0.00 178.00 179.17 1n1h h THR 382 N -0.15 0.11 -0.43 -1.15 2.02 -1.94 0.34 112.91 111.70 1n1h h THR 382 Ca 0.21 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.35 1n1h h THR 382 Cb 0.48 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 1n1h h THR 382 CO -0.54 0.00 0.10 -0.33 0.37 0.00 0.00 175.52 175.11 1n1h h GLU 383 N -0.02 0.70 0.01 6.66 4.39 -1.69 -1.34 114.58 123.29 1n1h h GLU 383 Ca 0.39 -0.17 0.01 0.00 0.34 0.00 0.00 59.36 59.93 1n1h h GLU 383 Cb 0.63 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1n1h h GLU 383 CO -0.89 0.71 -0.06 1.15 -1.16 0.00 0.00 179.01 178.75 1n1h h THR 384 N 0.56 0.84 -0.77 1.13 2.02 -0.47 -0.21 112.91 116.01 1n1h h THR 384 Ca 0.13 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.33 1n1h h THR 384 Cb 0.33 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 1n1h h THR 384 CO 0.00 0.00 0.50 0.58 0.37 0.00 0.00 175.52 176.98 1n1h h VAL 385 N -0.11 1.17 0.00 3.16 2.07 -1.06 0.73 116.25 122.20 1n1h h VAL 385 Ca 0.02 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1n1h h VAL 385 Cb 0.14 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.98 1n1h h VAL 385 CO -0.06 0.18 0.00 -0.07 0.02 0.00 0.00 177.57 177.64 1n1h h LEU 386 N 1.01 0.00 0.00 2.57 3.38 -0.99 -1.27 115.31 120.02 1n1h h LEU 386 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1n1h h LEU 386 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1n1h h LEU 386 CO -0.08 0.00 -1.37 1.67 0.09 0.00 0.00 178.44 178.75 1n1h n GLN 387 N -3.09 0.55 -0.05 1.13 7.27 -0.11 -4.20 117.38 118.88 1n1h n GLN 387 Ca 0.02 -0.02 -0.02 0.00 0.07 0.00 0.00 57.00 57.05 1n1h n GLN 387 Cb 0.42 -1.66 -0.11 0.00 2.41 0.00 0.00 30.24 31.30 1n1h n GLN 387 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1n1h n GLU 388 N -2.35 1.25 -1.40 3.69 -0.58 0.20 -4.52 120.64 116.93 1n1h n GLU 388 Ca -0.01 -0.05 -0.25 0.00 -0.42 0.00 0.00 57.16 56.43 1n1h n GLU 388 Cb 0.53 -1.36 0.10 0.00 -0.57 0.00 0.00 31.44 30.14 1n1h n GLU 388 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1n1h n TYR 389 N -2.34 2.67 0.01 -0.32 4.01 -0.48 -4.63 117.16 116.08 1n1h n TYR 389 Ca -0.16 -2.40 -0.03 0.00 -0.16 0.00 0.00 57.90 55.16 1n1h n TYR 389 Cb 0.75 -0.91 -0.01 0.00 -0.31 0.00 0.00 39.34 38.86 1n1h n TYR 389 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1n1h n THR 390 N -0.93 0.83 -1.95 -0.72 -1.04 -1.26 -4.83 114.28 104.37 1n1h n THR 390 Ca 0.52 0.19 -0.41 0.00 -2.04 0.00 0.00 64.05 62.31 1n1h n THR 390 Cb 0.94 -1.64 -0.02 0.00 -1.82 0.00 0.00 70.33 67.80 1n1h n THR 390 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1n1h s GLN 391 N -2.10 4.23 0.03 -2.82 -0.21 -1.26 -5.03 119.66 112.50 1n1h s GLN 391 Ca -0.05 2.38 0.06 0.00 0.02 0.00 0.00 55.36 57.78 1n1h s GLN 391 Cb 0.01 -3.06 -0.03 0.00 1.00 0.00 0.00 33.01 30.93 1n1h s GLN 391 CO 0.06 -0.44 -0.16 -1.12 -2.12 0.00 0.00 175.29 171.52 1n1h s SER 392 N 0.14 3.91 0.61 5.90 0.01 -1.26 -4.88 113.70 118.13 1n1h s SER 392 Ca 0.57 -0.37 -0.19 0.00 1.31 0.00 0.00 55.95 57.27 1n1h s SER 392 Cb -0.43 -0.69 -0.02 0.00 0.21 0.00 0.00 66.02 65.08 1n1h s SER 392 CO 0.49 0.27 1.30 -2.84 0.41 0.00 0.00 173.24 172.87 1n1h s PRO 393 N -1.37 2.77 -0.58 12.44 0.02 -1.26 -4.97 135.00 142.06 1n1h s PRO 393 Ca 0.15 2.07 -0.10 0.00 0.02 0.00 0.00 61.00 63.13 1n1h s PRO 393 Cb -0.11 -1.96 0.15 0.00 0.02 0.00 0.00 34.50 32.60 1n1h s PRO 393 CO 0.05 -1.43 0.47 -2.00 -0.33 0.00 0.00 177.00 173.76 1n1h s GLU 394 N -3.25 2.79 -0.84 5.54 2.12 -1.26 -4.96 118.70 118.84 1n1h s GLU 394 Ca 0.79 -2.02 -0.25 0.00 0.36 0.00 0.00 54.97 53.85 1n1h s GLU 394 Cb -0.37 -4.05 0.01 0.00 0.26 0.00 0.00 34.13 29.97 1n1h s GLU 394 CO 0.40 -1.23 1.62 0.42 -0.54 0.00 0.00 175.26 175.94 1n1h s ILE 395 N 0.93 3.64 0.45 -3.70 -1.09 -1.26 -3.51 121.20 116.66 1n1h s ILE 395 Ca 0.09 -0.19 0.29 0.00 -2.23 0.00 0.00 60.65 58.62 1n1h s ILE 395 Cb -0.23 -4.53 0.32 0.00 -1.58 0.00 0.00 42.46 36.44 1n1h s ILE 395 CO -0.02 -1.46 2.12 0.11 -1.23 0.00 0.00 174.94 174.46 1n1h h LYS 396 N 11.28 0.00 -2.65 2.79 1.57 -1.39 -3.33 116.57 124.84 1n1h h LYS 396 Ca -0.03 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.15 1n1h h LYS 396 Cb 1.05 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.96 1n1h h LYS 396 CO 1.30 0.09 -0.83 0.08 -0.57 0.00 0.00 179.45 179.51 1n1h s VAL 397 N -4.24 1.19 0.84 0.50 1.01 -0.87 -4.98 120.40 113.85 1n1h s VAL 397 Ca -0.03 -3.08 -0.13 0.00 0.00 0.00 0.00 61.98 58.74 1n1h s VAL 397 Cb 0.13 -1.81 0.06 0.00 0.00 0.00 0.00 36.38 34.76 1n1h s VAL 397 CO 0.56 -1.12 0.88 -2.65 0.00 0.00 0.00 175.10 172.77 1n1h n PRO 398 N 2.71 0.01 -2.74 2.72 -0.02 -1.25 -4.81 135.00 131.62 1n1h n PRO 398 Ca 0.24 0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 61.37 1n1h n PRO 398 Cb 0.42 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 1n1h n PRO 398 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1n1h s ILE 399 N -2.21 4.75 0.23 4.25 1.01 -1.26 -4.97 121.20 123.00 1n1h s ILE 399 Ca 0.67 1.88 -0.31 0.00 0.00 0.00 0.00 60.65 62.90 1n1h s ILE 399 Cb -0.28 -4.25 -0.15 0.00 0.01 0.00 0.00 42.46 37.80 1n1h s ILE 399 CO 0.57 -0.11 1.17 -2.65 0.00 0.00 0.00 174.94 173.92 1n1h n PRO 400 N 5.94 1.41 0.02 2.79 -0.02 -1.26 -4.86 135.00 139.02 1n1h n PRO 400 Ca 0.09 0.50 0.07 0.00 -2.02 0.00 0.00 63.50 62.14 1n1h n PRO 400 Cb 0.47 -1.99 0.48 0.00 -0.02 0.00 0.00 33.50 32.44 1n1h n PRO 400 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1n1h h GLN 401 N 3.09 0.41 0.00 -0.52 4.15 -1.99 -1.28 115.11 118.97 1n1h h GLN 401 Ca -0.42 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 58.97 1n1h h GLN 401 Cb 1.33 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.92 1n1h h GLN 401 CO 0.68 0.27 0.00 0.36 -1.93 0.00 0.00 178.83 178.21 1n1h n LYS 402 N -4.48 0.11 -0.09 1.69 2.85 -1.26 -2.96 118.16 114.02 1n1h n LYS 402 Ca 0.04 0.43 0.08 0.00 -1.05 0.00 0.00 58.31 57.81 1n1h n LYS 402 Cb 0.15 -1.75 0.30 0.00 -0.65 0.00 0.00 35.03 33.08 1n1h n LYS 402 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1n1h n ASP 403 N -1.97 1.35 -4.66 -5.58 8.00 -0.48 -4.86 116.55 108.35 1n1h n ASP 403 Ca 0.01 -1.78 -0.29 0.00 0.71 0.00 0.00 54.79 53.45 1n1h n ASP 403 Cb 0.15 -0.12 -0.08 0.00 -0.02 0.00 0.00 41.12 41.05 1n1h n ASP 403 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1n1h s TRP 404 N -1.76 2.89 0.14 1.24 0.52 -1.15 -0.99 118.94 119.83 1n1h s TRP 404 Ca 0.26 -0.09 -0.01 0.00 0.02 0.00 0.00 56.10 56.28 1n1h s TRP 404 Cb 0.14 -1.46 0.03 0.00 -1.15 0.00 0.00 33.47 31.03 1n1h s TRP 404 CO 0.20 0.48 0.20 0.25 0.02 0.00 0.00 176.95 178.10 1n1h n THR 405 N 0.33 0.00 -1.62 2.01 -2.24 -0.50 -4.88 114.28 107.38 1n1h n THR 405 Ca -0.11 -0.22 -0.29 0.00 -2.27 0.00 0.00 64.05 61.16 1n1h n THR 405 Cb 0.53 -1.59 0.16 0.00 -2.10 0.00 0.00 70.33 67.33 1n1h n THR 405 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1n1h s GLY 406 N -3.16 1.63 0.62 3.38 0.00 -0.88 -4.65 107.32 104.27 1n1h s GLY 406 Ca 0.12 -0.79 -0.17 0.00 0.00 0.00 0.00 44.72 43.88 1n1h s GLY 406 CO 0.08 -0.13 1.14 -4.14 0.00 0.00 0.00 173.10 170.05 1n1h s PRO 407 N -5.51 2.94 -0.43 2.90 0.02 -1.25 -3.93 135.00 129.75 1n1h s PRO 407 Ca 0.67 1.58 0.03 0.00 0.02 0.00 0.00 61.00 63.30 1n1h s PRO 407 Cb -0.10 -1.95 0.16 0.00 0.02 0.00 0.00 34.50 32.63 1n1h s PRO 407 CO 0.53 -1.17 0.33 0.42 -0.33 0.00 0.00 177.00 176.78 1n1h s ILE 408 N -1.99 0.58 0.00 2.83 1.01 0.16 0.12 121.20 123.91 1n1h s ILE 408 Ca 0.71 -2.67 0.00 0.00 0.00 0.00 0.00 60.65 58.69 1n1h s ILE 408 Cb -0.24 -1.41 0.00 0.00 0.01 0.00 0.00 42.46 40.82 1n1h s ILE 408 CO 0.36 -1.17 0.00 0.61 0.00 0.00 0.00 174.94 174.73 1n1h n GLY 409 N 2.95 1.87 0.01 6.18 0.00 -0.14 -2.62 105.19 113.43 1n1h n GLY 409 Ca 0.26 -0.31 0.09 0.00 0.00 0.00 0.00 46.02 46.06 1n1h n GLY 409 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1n1h n GLU 410 N 3.73 0.67 -3.88 1.61 -0.58 -1.26 -4.96 120.64 115.96 1n1h n GLU 410 Ca 0.00 -0.11 -0.21 0.00 -0.42 0.00 0.00 57.16 56.42 1n1h n GLU 410 Cb 0.00 -1.43 -0.02 0.00 -0.57 0.00 0.00 31.44 29.42 1n1h n GLU 410 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 1n1h s ILE 411 N -3.13 5.09 -0.03 -3.67 -5.25 -1.08 -4.97 121.20 108.17 1n1h s ILE 411 Ca -0.02 -0.98 0.02 0.00 -0.99 0.00 0.00 60.65 58.69 1n1h s ILE 411 Cb 0.13 -3.80 0.01 0.00 2.95 0.00 0.00 42.46 41.75 1n1h s ILE 411 CO 0.79 -0.31 -0.08 -0.13 -1.79 0.00 0.00 174.94 173.42 1n1h s ARG 412 N -4.02 0.85 0.16 0.37 0.52 -1.26 -0.67 118.95 114.90 1n1h s ARG 412 Ca 0.36 -0.25 -0.26 0.00 -0.52 0.00 0.00 55.73 55.06 1n1h s ARG 412 Cb -0.09 -0.81 -0.08 0.00 0.52 0.00 0.00 34.95 34.49 1n1h s ARG 412 CO 0.29 0.08 0.80 0.42 0.02 0.00 0.00 175.30 176.91 1n1h s ILE 413 N 0.27 4.38 -0.64 1.52 1.01 -1.26 -4.73 121.20 121.75 1n1h s ILE 413 Ca -0.04 1.75 -0.28 0.00 0.00 0.00 0.00 60.65 62.08 1n1h s ILE 413 Cb -0.09 -4.16 0.03 0.00 0.01 0.00 0.00 42.46 38.25 1n1h s ILE 413 CO 0.00 0.50 1.27 -0.22 0.00 0.00 0.00 174.94 176.49 1n1h s LEU 414 N -0.99 3.32 0.21 2.97 0.20 -1.26 -1.42 118.68 121.72 1n1h s LEU 414 Ca 0.37 -0.09 -0.31 0.00 0.69 0.00 0.00 54.13 54.79 1n1h s LEU 414 Cb -0.23 -2.90 -0.15 0.00 -0.43 0.00 0.00 46.19 42.48 1n1h s LEU 414 CO 0.27 -1.67 1.13 0.29 -0.29 0.00 0.00 176.35 176.07 1n1h n LYS 415 N 8.86 1.27 0.00 1.98 5.02 -0.16 -4.77 118.16 130.36 1n1h n LYS 415 Ca 0.07 0.45 0.06 0.00 -2.02 0.00 0.00 58.31 56.87 1n1h n LYS 415 Cb 0.49 -1.92 0.37 0.00 -0.02 0.00 0.00 35.03 33.96 1n1h n LYS 415 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1n1h n ASP 416 N 1.82 0.00 0.00 4.39 5.68 -1.26 -1.86 116.55 125.32 1n1h n ASP 416 Ca 0.13 -0.57 0.11 0.00 -0.50 0.00 0.00 54.79 53.96 1n1h n ASP 416 Cb 0.27 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.36 1n1h n ASP 416 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1n1h n THR 417 N -0.91 0.01 -1.69 2.12 -2.24 -1.26 -4.95 114.28 105.37 1n1h n THR 417 Ca 0.09 -0.02 -0.40 0.00 -2.27 0.00 0.00 64.05 61.46 1n1h n THR 417 Cb 0.04 0.49 0.03 0.00 -2.10 0.00 0.00 70.33 68.80 1n1h n THR 417 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1n1h n THR 418 N -1.53 3.11 0.02 4.28 5.66 -0.78 -4.89 114.28 120.16 1n1h n THR 418 Ca 0.05 -0.50 0.07 0.00 -3.05 0.00 0.00 64.05 60.62 1n1h n THR 418 Cb 0.34 -1.48 0.15 0.00 -1.55 0.00 0.00 70.33 67.80 1n1h n THR 418 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1n1h n SER 419 N -0.28 2.88 -4.78 1.09 3.41 -1.26 -4.90 113.62 109.78 1n1h n SER 419 Ca 0.09 -1.88 -0.35 0.00 -0.26 0.00 0.00 58.87 56.47 1n1h n SER 419 Cb 0.42 -0.21 -0.01 0.00 -0.26 0.00 0.00 64.21 64.16 1n1h n SER 419 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1n1h s SER 420 N -1.05 5.95 0.30 4.04 0.15 -1.26 -4.90 113.70 116.92 1n1h s SER 420 Ca 0.26 2.17 0.22 0.00 0.70 0.00 0.00 55.95 59.30 1n1h s SER 420 Cb 0.14 -2.58 1.11 0.00 -1.71 0.00 0.00 66.02 62.98 1n1h s SER 420 CO 0.19 -1.06 1.67 0.00 1.20 0.00 0.00 173.24 175.24 1n1h n ILE 421 N -1.02 0.99 0.30 6.45 0.13 -1.26 -1.19 119.36 123.76 1n1h n ILE 421 Ca 0.10 0.59 0.19 0.00 -1.10 0.00 0.00 62.75 62.53 1n1h n ILE 421 Cb 0.50 -1.57 0.92 0.00 -0.84 0.00 0.00 39.64 38.65 1n1h n ILE 421 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1n1h h ALA 422 N 2.08 1.04 -0.61 1.51 0.00 -1.97 -2.94 119.26 118.36 1n1h h ALA 422 Ca 0.00 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1n1h h ALA 422 Cb 0.11 -0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.78 1n1h h ALA 422 CO 0.00 0.02 -0.15 -0.09 0.00 0.00 0.00 179.25 179.03 1n1h h ARG 423 N 0.00 0.00 0.00 0.00 2.43 -1.50 0.20 114.38 115.51 1n1h h ARG 423 Ca -0.00 -0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1n1h h ARG 423 Cb 0.28 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1n1h h ARG 423 CO 0.00 0.00 -0.54 1.88 -1.51 0.00 0.00 179.97 179.80 1n1h h TYR 424 N 0.00 0.00 -0.37 2.20 0.05 -1.75 -2.56 116.97 114.54 1n1h h TYR 424 Ca 0.29 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.91 1n1h h TYR 424 Cb 0.45 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.18 1n1h h TYR 424 CO -0.50 0.54 -0.39 1.25 -1.05 0.00 0.00 178.16 178.02 1n1h h LEU 425 N 0.00 0.99 -0.89 3.88 5.85 -1.36 -2.79 115.31 121.00 1n1h h LEU 425 Ca -0.01 -0.47 -0.10 0.00 0.84 0.00 0.00 57.88 58.14 1n1h h LEU 425 Cb 1.17 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 1n1h h LEU 425 CO 0.07 1.26 -0.26 0.22 -0.34 0.00 0.00 178.44 179.39 1n1h h TYR 426 N 0.74 0.58 0.11 1.25 5.03 -0.92 -3.06 116.97 120.71 1n1h h TYR 426 Ca 0.06 -0.13 -0.01 0.00 2.58 0.00 0.00 58.73 61.23 1n1h h TYR 426 Cb 0.99 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 39.13 1n1h h TYR 426 CO 0.06 0.74 -0.06 0.00 -1.32 0.00 0.00 178.16 177.58 1n1h h ARG 427 N 0.45 -0.15 -0.59 1.82 3.08 -1.33 -1.72 114.38 115.94 1n1h h ARG 427 Ca 0.06 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.21 1n1h h ARG 427 Cb 0.70 0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.71 1n1h h ARG 427 CO 0.05 0.18 0.24 1.15 -1.07 0.00 0.00 179.97 180.52 1n1h h THR 428 N -0.48 0.81 0.00 2.04 2.02 -1.53 -0.50 112.91 115.27 1n1h h THR 428 Ca -0.02 -0.15 -0.12 0.00 0.77 0.00 0.00 66.41 66.89 1n1h h THR 428 Cb 0.39 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 1n1h h THR 428 CO 0.03 0.08 -0.58 -0.50 0.37 0.00 0.00 175.52 174.92 1n1h h TRP 429 N 0.43 0.00 -0.09 3.16 4.06 -1.54 -1.19 115.95 120.78 1n1h h TRP 429 Ca 0.29 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.16 1n1h h TRP 429 Cb 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.49 1n1h h TRP 429 CO -0.15 0.58 -0.27 -0.92 -3.56 0.00 0.00 178.44 174.12 1n1h h TYR 430 N 0.00 0.44 -0.03 0.49 3.20 -0.84 -1.24 116.97 119.00 1n1h h TYR 430 Ca -0.01 -0.18 0.01 0.00 3.14 0.00 0.00 58.73 61.70 1n1h h TYR 430 Cb 1.05 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.24 1n1h h TYR 430 CO 0.00 0.88 -0.03 1.25 -1.64 0.00 0.00 178.16 178.63 1n1h h LEU 431 N -0.13 -0.08 -0.12 2.82 7.12 -1.08 -0.51 115.31 123.33 1n1h h LEU 431 Ca -0.01 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.02 1n1h h LEU 431 Cb 0.89 0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 41.06 1n1h h LEU 431 CO 0.06 -0.04 0.08 0.00 -0.13 0.00 0.00 178.44 178.41 1n1h h ALA 432 N 0.99 0.15 -0.66 1.25 0.00 -1.26 -2.33 119.26 117.41 1n1h h ALA 432 Ca 0.02 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.99 1n1h h ALA 432 Cb 0.06 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 1n1h h ALA 432 CO -0.05 -0.35 0.34 0.00 0.00 0.00 0.00 179.25 179.19 1n1h h ALA 433 N 1.04 0.89 -0.56 0.00 0.00 -0.99 0.24 119.26 119.88 1n1h h ALA 433 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1n1h h ALA 433 Cb -0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1n1h h ALA 433 CO -0.01 -0.01 0.35 0.00 0.00 0.00 0.00 179.25 179.58 1n1h h ALA 434 N 1.37 0.71 -0.16 0.00 0.00 -0.71 -1.61 119.26 118.86 1n1h h ALA 434 Ca 0.31 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.99 1n1h h ALA 434 Cb 0.25 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1n1h h ALA 434 CO -0.22 0.17 -0.62 0.00 0.00 0.00 0.00 179.25 178.59 1n1h h ARG 435 N 0.76 0.55 0.20 0.00 3.08 -0.89 -2.00 114.38 116.08 1n1h h ARG 435 Ca 0.20 -0.38 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 1n1h h ARG 435 Cb -0.05 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1n1h h ARG 435 CO -0.04 1.00 -0.10 1.98 -1.07 0.00 0.00 179.97 181.74 1n1h h MET 436 N 0.40 -0.26 0.00 0.04 4.05 -0.81 -2.65 114.93 115.70 1n1h h MET 436 Ca -0.01 0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1n1h h MET 436 Cb 1.18 0.06 0.00 0.00 -0.80 0.00 0.00 31.60 32.04 1n1h h MET 436 CO 0.11 -0.01 0.00 0.00 0.23 0.00 0.00 176.91 177.25 1n1h n ALA 437 N -2.33 1.60 0.15 0.39 0.00 -0.62 -2.09 120.51 117.61 1n1h n ALA 437 Ca -0.09 0.03 0.05 0.00 0.00 0.00 0.00 53.44 53.43 1n1h n ALA 437 Cb 0.20 -1.30 0.05 0.00 0.00 0.00 0.00 19.45 18.40 1n1h n ALA 437 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1h h ALA 438 N 2.34 0.75 -2.79 0.00 0.00 -1.01 -3.43 119.26 115.12 1n1h h ALA 438 Ca 0.00 -0.34 -0.53 0.00 0.00 0.00 0.00 54.91 54.04 1n1h h ALA 438 Cb 0.28 -0.02 0.07 0.00 0.00 0.00 0.00 17.79 18.13 1n1h h ALA 438 CO 0.00 0.45 0.82 -0.65 0.00 0.00 0.00 179.25 179.86 1n1h s GLN 439 N -3.05 4.19 0.15 0.00 -0.21 -0.89 -4.93 119.66 114.93 1n1h s GLN 439 Ca 0.04 2.45 -0.13 0.00 0.02 0.00 0.00 55.36 57.73 1n1h s GLN 439 Cb 0.07 -3.06 0.03 0.00 1.00 0.00 0.00 33.01 31.06 1n1h s GLN 439 CO 0.73 -0.52 1.67 -1.35 -2.12 0.00 0.00 175.29 173.71 1n1h h PRO 440 N 4.76 0.79 -1.01 2.91 0.11 -1.89 -2.85 132.00 134.84 1n1h h PRO 440 Ca -0.47 -0.18 0.22 0.00 0.11 0.00 0.00 66.00 65.69 1n1h h PRO 440 Cb 1.22 -0.11 -0.11 0.00 0.11 0.00 0.00 31.00 32.11 1n1h h PRO 440 CO 0.77 0.74 0.61 -0.09 -0.21 0.00 0.00 178.00 179.83 1n1h h ARG 441 N 0.69 0.61 -0.84 1.05 2.43 -1.95 -0.61 114.38 115.75 1n1h h ARG 441 Ca 0.16 -0.04 0.20 0.00 -0.81 0.00 0.00 59.98 59.50 1n1h h ARG 441 Cb 0.29 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.65 1n1h h ARG 441 CO -0.00 0.40 0.57 1.15 -1.51 0.00 0.00 179.97 180.58 1n1h h THR 442 N 0.63 0.67 -0.28 0.20 2.02 -1.80 0.12 112.91 114.46 1n1h h THR 442 Ca 0.60 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.69 1n1h h THR 442 Cb 1.12 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1n1h h THR 442 CO -0.40 0.05 0.00 0.79 0.37 0.00 0.00 175.52 176.33 1n1h n TRP 443 N -4.44 0.36 -2.58 3.16 7.02 -0.24 -4.66 117.44 116.06 1n1h n TRP 443 Ca 0.18 -0.18 -0.42 0.00 -1.02 0.00 0.00 57.50 56.05 1n1h n TRP 443 Cb 0.73 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.59 1n1h n TRP 443 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1n1h s ASP 444 N -1.48 7.23 0.51 -0.99 -1.08 0.40 -4.92 116.67 116.34 1n1h s ASP 444 Ca 0.35 1.79 0.31 0.00 -0.52 0.00 0.00 52.55 54.47 1n1h s ASP 444 Cb 0.19 -2.57 1.43 0.00 -1.46 0.00 0.00 42.92 40.51 1n1h s ASP 444 CO 0.28 -0.37 1.84 -0.65 0.52 0.00 0.00 175.17 176.79 1n1h h PRO 445 N 6.87 0.08 -0.01 4.34 0.11 -1.91 -1.99 132.00 139.49 1n1h h PRO 445 Ca -0.40 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 1n1h h PRO 445 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1n1h h PRO 445 CO 0.79 0.05 -0.08 1.25 -0.21 0.00 0.00 178.00 179.80 1n1h h LEU 446 N 0.09 0.10 -0.56 2.35 5.85 -1.91 -2.11 115.31 119.11 1n1h h LEU 446 Ca 0.50 -0.68 0.06 0.00 0.84 0.00 0.00 57.88 58.60 1n1h h LEU 446 Cb 1.84 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.79 1n1h h LEU 446 CO -0.06 0.76 0.28 0.15 -0.34 0.00 0.00 178.44 179.23 1n1h h PHE 447 N -0.56 0.50 0.00 1.25 3.57 -1.65 0.41 116.94 120.47 1n1h h PHE 447 Ca -0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1n1h h PHE 447 Cb 0.76 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.36 1n1h h PHE 447 CO 0.16 0.23 0.00 1.96 -2.23 0.00 0.00 178.31 178.42 1n1h h GLN 448 N 0.52 0.00 0.11 1.11 4.20 -1.48 -0.28 115.11 119.29 1n1h h GLN 448 Ca 0.26 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.82 1n1h h GLN 448 Cb 0.19 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.99 1n1h h GLN 448 CO -0.19 0.00 -0.64 0.00 -0.67 0.00 0.00 178.83 177.32 1n1h h ALA 449 N 2.01 -0.07 -0.11 3.87 0.00 -0.13 -2.60 119.26 122.23 1n1h h ALA 449 Ca 0.00 -0.65 0.04 0.00 0.00 0.00 0.00 54.91 54.30 1n1h h ALA 449 Cb 0.46 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1n1h h ALA 449 CO 0.00 0.30 -0.15 0.82 0.00 0.00 0.00 179.25 180.22 1n1h h ILE 450 N -0.48 0.61 -0.26 0.00 2.04 0.31 -0.32 117.51 119.41 1n1h h ILE 450 Ca -0.11 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.81 1n1h h ILE 450 Cb 1.50 0.61 -0.06 0.00 -0.74 0.00 0.00 36.82 38.13 1n1h h ILE 450 CO 0.12 0.00 -0.12 0.24 0.00 0.00 0.00 178.15 178.40 1n1h h MET 451 N -0.19 -0.07 0.00 2.37 2.86 -1.16 -0.05 114.93 118.68 1n1h h MET 451 Ca 0.09 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1n1h h MET 451 Cb 0.32 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1n1h h MET 451 CO -0.22 -0.05 0.00 0.00 1.06 0.00 0.00 176.91 177.70 1n1h h ARG 452 N -0.08 0.00 0.00 1.72 3.08 -0.97 -1.98 114.38 116.16 1n1h h ARG 452 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1n1h h ARG 452 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1n1h h ARG 452 CO -0.31 0.00 -1.38 -1.13 -1.07 0.00 0.00 179.97 176.08 1n1h n SER 453 N -2.41 0.47 -0.02 7.04 3.41 -0.12 -4.37 113.62 117.62 1n1h n SER 453 Ca -0.01 -0.18 -0.09 0.00 -0.26 0.00 0.00 58.87 58.34 1n1h n SER 453 Cb 0.10 1.22 -0.02 0.00 -0.26 0.00 0.00 64.21 65.24 1n1h n SER 453 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1n1h h GLN 454 N 0.00 -0.23 -0.16 4.33 4.15 -0.51 -2.37 115.11 120.32 1n1h h GLN 454 Ca 0.00 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1n1h h GLN 454 Cb 0.83 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.57 1n1h h GLN 454 CO 0.00 -0.16 0.00 2.48 -1.93 0.00 0.00 178.83 179.22 1n1h n TYR 455 N -5.35 0.20 -2.93 3.99 0.18 -1.26 -4.58 117.16 107.41 1n1h n TYR 455 Ca -0.02 -0.10 -0.44 0.00 1.88 0.00 0.00 57.90 59.23 1n1h n TYR 455 Cb 0.27 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.22 1n1h n TYR 455 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1n1h s VAL 456 N -1.80 4.87 0.34 -3.48 1.01 -0.89 -4.83 120.40 115.61 1n1h s VAL 456 Ca 0.32 -2.11 0.05 0.00 0.00 0.00 0.00 61.98 60.23 1n1h s VAL 456 Cb 0.17 -4.86 -0.07 0.00 0.00 0.00 0.00 36.38 31.63 1n1h s VAL 456 CO 0.26 -1.58 0.03 0.42 0.00 0.00 0.00 175.10 174.23 1n1h s THR 457 N 2.17 1.44 -1.13 3.92 -4.23 -1.26 -4.80 115.64 111.75 1n1h s THR 457 Ca 0.38 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.87 1n1h s THR 457 Cb -0.04 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 71.02 1n1h s THR 457 CO -0.04 -0.05 0.56 0.00 -0.54 0.00 0.00 174.62 174.55 1n1h n ALA 458 N -0.73 2.50 -2.15 3.99 0.00 -1.26 -2.43 120.51 120.42 1n1h n ALA 458 Ca -0.03 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.20 1n1h n ALA 458 Cb 0.66 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.11 1n1h n ALA 458 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1n1h s ARG 459 N -1.13 2.54 0.76 0.00 1.81 -1.26 -4.86 118.95 116.82 1n1h s ARG 459 Ca 0.00 -1.54 -0.11 0.00 -1.72 0.00 0.00 55.73 52.36 1n1h s ARG 459 Cb 0.00 -2.49 0.05 0.00 -0.45 0.00 0.00 34.95 32.06 1n1h s ARG 459 CO 0.00 -0.39 1.09 0.20 -0.68 0.00 0.00 175.30 175.52 1n1h s GLY 460 N -4.31 1.63 -0.25 -3.53 0.00 -1.26 -1.29 107.32 98.32 1n1h s GLY 460 Ca 0.51 -0.15 0.13 0.00 0.00 0.00 0.00 44.72 45.20 1n1h s GLY 460 CO 0.30 0.24 1.36 0.61 0.00 0.00 0.00 173.10 175.62 1n1h n GLY 461 N -2.16 1.68 3.83 0.20 0.00 -1.26 -4.70 105.19 102.77 1n1h n GLY 461 Ca 0.07 -0.31 -0.25 0.00 0.00 0.00 0.00 46.02 45.53 1n1h n GLY 461 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1n1h n SER 462 N -1.03 -2.42 -0.29 1.61 7.64 -1.21 -3.33 113.62 114.59 1n1h n SER 462 Ca -0.15 -0.84 0.10 0.00 1.01 0.00 0.00 58.87 59.00 1n1h n SER 462 Cb 0.85 -3.83 0.27 0.00 -1.01 0.00 0.00 64.21 60.48 1n1h n SER 462 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1n1h h GLY 463 N -1.93 1.42 0.83 0.23 0.00 -1.93 -2.54 103.07 99.15 1n1h h GLY 463 Ca -0.60 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 46.55 1n1h h GLY 463 CO 0.62 -0.19 -0.04 0.00 0.00 0.00 0.00 176.54 176.93 1n1h h ALA 464 N 1.65 -0.11 -0.84 3.60 0.00 -1.96 -1.76 119.26 119.83 1n1h h ALA 464 Ca 0.51 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 55.39 1n1h h ALA 464 Cb 0.89 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.67 1n1h h ALA 464 CO -0.48 -0.48 0.55 0.00 0.00 0.00 0.00 179.25 178.85 1n1h h ALA 465 N 0.62 1.60 -0.28 0.00 0.00 -1.84 -2.04 119.26 117.33 1n1h h ALA 465 Ca -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1n1h h ALA 465 Cb 0.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1n1h h ALA 465 CO 0.02 0.26 0.09 1.25 0.00 0.00 0.00 179.25 180.87 1n1h h LEU 466 N 0.91 0.40 -1.83 0.00 6.46 -1.27 -1.03 115.31 118.94 1n1h h LEU 466 Ca 0.37 -0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 57.92 1n1h h LEU 466 Cb 0.25 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.07 1n1h h LEU 466 CO -0.14 0.49 0.00 -0.09 -0.62 0.00 0.00 178.44 178.09 1n1h h ARG 467 N 0.29 0.10 0.00 1.25 2.43 -0.63 -2.50 114.38 115.31 1n1h h ARG 467 Ca 0.09 -0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 59.08 1n1h h ARG 467 Cb 0.23 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 1n1h h ARG 467 CO -0.00 0.11 -1.30 1.05 -1.51 0.00 0.00 179.97 178.32 1n1h h GLU 468 N 0.10 0.00 -0.30 0.20 4.11 -1.19 -2.69 114.58 114.81 1n1h h GLU 468 Ca 0.03 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.35 1n1h h GLU 468 Cb 0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1n1h h GLU 468 CO 0.00 0.34 -0.25 0.66 0.07 0.00 0.00 179.01 179.83 1n1h h SER 469 N 0.00 0.60 -0.25 3.06 4.64 -0.86 -2.02 113.55 118.72 1n1h h SER 469 Ca -0.15 -0.21 -0.19 0.00 -0.47 0.00 0.00 61.79 60.77 1n1h h SER 469 Cb 1.58 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 1n1h h SER 469 CO 0.05 0.83 -0.58 -0.07 -0.87 0.00 0.00 176.83 176.20 1n1h h LEU 470 N 0.52 0.96 -2.09 5.97 4.07 -1.54 -2.99 115.31 120.20 1n1h h LEU 470 Ca 0.07 -0.53 -0.00 0.00 0.08 0.00 0.00 57.88 57.50 1n1h h LEU 470 Cb 0.70 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 42.17 1n1h h LEU 470 CO 0.05 1.32 -0.02 0.22 -1.08 0.00 0.00 178.44 178.94 1n1h h TYR 471 N 0.64 0.00 0.00 1.13 5.03 -1.10 -1.24 116.97 121.44 1n1h h TYR 471 Ca 0.01 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.32 1n1h h TYR 471 Cb 1.19 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.47 1n1h h TYR 471 CO 0.07 0.02 0.00 0.00 -1.32 0.00 0.00 178.16 176.93 1n1h h ALA 472 N 1.98 1.00 -0.13 1.82 0.00 -1.22 -1.04 119.26 121.67 1n1h h ALA 472 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1n1h h ALA 472 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1n1h h ALA 472 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.69 1n1h n ILE 473 N -3.03 2.04 -3.34 0.00 -5.35 -0.52 -4.99 119.36 104.16 1n1h n ILE 473 Ca -0.01 -2.03 -0.16 0.00 -0.27 0.00 0.00 62.75 60.27 1n1h n ILE 473 Cb 0.19 -0.22 0.08 0.00 -1.74 0.00 0.00 39.64 37.95 1n1h n ILE 473 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1n1h n ASN 474 N -0.94 -4.78 -3.75 7.28 2.85 -0.39 -5.02 115.26 110.50 1n1h n ASN 474 Ca 0.18 -0.69 -0.28 0.00 -0.11 0.00 0.00 54.58 53.68 1n1h n ASN 474 Cb 0.75 -5.10 -0.16 0.00 1.24 0.00 0.00 39.78 36.51 1n1h n ASN 474 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1n1h s VAL 475 N -3.39 0.67 -0.18 3.44 1.01 -0.87 -5.00 120.40 116.09 1n1h s VAL 475 Ca 0.28 -0.77 -0.09 0.00 0.00 0.00 0.00 61.98 61.40 1n1h s VAL 475 Cb -0.04 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 1n1h s VAL 475 CO 0.74 -0.28 0.12 -0.94 0.00 0.00 0.00 175.10 174.74 1n1h s SER 476 N 1.78 6.16 0.27 3.32 1.04 -1.26 -3.61 113.70 121.39 1n1h s SER 476 Ca 0.00 0.26 -0.08 0.00 0.48 0.00 0.00 55.95 56.61 1n1h s SER 476 Cb -0.17 -2.06 -0.06 0.00 0.10 0.00 0.00 66.02 63.82 1n1h s SER 476 CO -0.11 0.23 0.57 -0.76 0.98 0.00 0.00 173.24 174.15 1n1h s LEU 477 N 0.08 4.10 0.34 2.42 1.43 -1.26 -5.03 118.68 120.75 1n1h s LEU 477 Ca 0.09 0.88 -0.29 0.00 -1.03 0.00 0.00 54.13 53.78 1n1h s LEU 477 Cb -0.11 -3.67 -0.11 0.00 0.03 0.00 0.00 46.19 42.32 1n1h s LEU 477 CO -0.01 -0.14 1.52 -2.65 0.23 0.00 0.00 176.35 175.30 1n1h n PRO 478 N -0.50 2.65 0.00 1.29 -0.02 -1.26 -4.91 135.00 132.25 1n1h n PRO 478 Ca -0.00 0.94 0.10 0.00 -2.02 0.00 0.00 63.50 62.51 1n1h n PRO 478 Cb 0.53 -2.68 -0.05 0.00 -0.02 0.00 0.00 33.50 31.28 1n1h n PRO 478 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1n1h n ASP 479 N 1.16 1.48 -4.24 2.55 5.75 -1.26 -4.76 116.55 117.22 1n1h n ASP 479 Ca 0.04 -1.24 -0.31 0.00 -0.01 0.00 0.00 54.79 53.27 1n1h n ASP 479 Cb 0.38 0.70 -0.07 0.00 -1.03 0.00 0.00 41.12 41.10 1n1h n ASP 479 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1n1h n PHE 480 N -0.66 -1.37 -1.67 2.11 3.72 -1.26 -4.74 117.46 113.58 1n1h n PHE 480 Ca 0.06 0.66 -0.46 0.00 -0.05 0.00 0.00 57.45 57.66 1n1h n PHE 480 Cb 0.38 -2.96 -0.04 0.00 -0.94 0.00 0.00 39.48 35.92 1n1h n PHE 480 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1n1h n LYS 481 N -4.48 2.41 0.00 -1.08 4.81 -1.26 -2.59 118.16 115.98 1n1h n LYS 481 Ca -0.26 0.88 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 1n1h n LYS 481 Cb 0.66 -2.78 0.00 0.00 0.02 0.00 0.00 35.03 32.93 1n1h n LYS 481 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1n1h n GLY 482 N 4.49 0.86 3.80 3.14 0.00 -1.26 -4.97 105.19 111.25 1n1h n GLY 482 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 1n1h n GLY 482 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1h s LEU 483 N 0.00 4.45 0.00 0.99 1.43 -1.07 -4.28 118.68 120.21 1n1h s LEU 483 Ca 0.00 1.04 0.00 0.00 -1.03 0.00 0.00 54.13 54.14 1n1h s LEU 483 Cb 0.00 -2.72 0.00 0.00 0.03 0.00 0.00 46.19 43.50 1n1h s LEU 483 CO 0.00 0.24 1.11 -2.65 0.23 0.00 0.00 176.35 175.28 1n1h n PRO 484 N 2.17 0.97 -4.27 1.29 -0.02 -1.26 -4.88 135.00 128.99 1n1h n PRO 484 Ca -0.11 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.10 1n1h n PRO 484 Cb 0.52 -1.01 -0.09 0.00 -0.02 0.00 0.00 33.50 32.89 1n1h n PRO 484 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1n1h s VAL 485 N 0.03 3.29 -0.02 -1.45 -7.23 -1.26 -4.67 120.40 109.09 1n1h s VAL 485 Ca 0.00 -1.62 -0.30 0.00 -1.81 0.00 0.00 61.98 58.25 1n1h s VAL 485 Cb 0.00 -2.64 -0.05 0.00 0.56 0.00 0.00 36.38 34.26 1n1h s VAL 485 CO 0.00 -0.11 1.35 -0.75 -0.31 0.00 0.00 175.10 175.27 1n1h s LYS 486 N -2.86 4.30 0.32 4.82 2.20 -0.75 -4.93 119.74 122.83 1n1h s LYS 486 Ca 0.25 1.88 0.14 0.00 -0.36 0.00 0.00 55.97 57.89 1n1h s LYS 486 Cb -0.09 -3.59 0.47 0.00 -1.51 0.00 0.00 37.83 33.12 1n1h s LYS 486 CO 0.16 -0.55 1.65 0.00 -0.36 0.00 0.00 175.35 176.25 1n1h h ALA 487 N 7.78 0.95 -0.32 3.13 0.00 -1.96 -3.32 119.26 125.52 1n1h h ALA 487 Ca -0.36 -0.47 -0.50 0.00 0.00 0.00 0.00 54.91 53.58 1n1h h ALA 487 Cb 1.17 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.78 1n1h h ALA 487 CO 0.90 0.64 1.27 0.00 0.00 0.00 0.00 179.25 182.06 1n1h n ALA 488 N -2.35 6.72 -2.56 0.00 0.00 -1.26 -4.60 120.51 116.46 1n1h n ALA 488 Ca -0.01 -3.05 -0.23 0.00 0.00 0.00 0.00 53.44 50.16 1n1h n ALA 488 Cb 0.58 -2.56 -0.15 0.00 0.00 0.00 0.00 19.45 17.33 1n1h n ALA 488 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1n1h s THR 489 N -0.32 1.19 -0.03 0.00 -4.23 -1.25 -4.02 115.64 106.98 1n1h s THR 489 Ca 0.62 -0.74 0.28 0.00 -1.18 0.00 0.00 61.69 60.67 1n1h s THR 489 Cb 0.28 -1.01 0.28 0.00 1.34 0.00 0.00 72.50 73.39 1n1h s THR 489 CO -0.10 0.26 1.85 0.11 -0.54 0.00 0.00 174.62 176.20 1n1h h LYS 490 N 5.56 0.00 -0.30 3.99 1.57 -0.84 0.12 116.57 126.67 1n1h h LYS 490 Ca -0.36 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.34 1n1h h LYS 490 Cb 1.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 1n1h h LYS 490 CO 0.48 0.00 -0.11 0.82 -0.57 0.00 0.00 179.45 180.06 1n1h h ILE 491 N 0.00 1.29 -0.52 1.86 2.04 -1.76 0.30 117.51 120.72 1n1h h ILE 491 Ca 0.00 -1.19 -0.04 0.00 1.00 0.00 0.00 64.86 64.63 1n1h h ILE 491 Cb 0.08 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 1n1h h ILE 491 CO 0.00 0.38 0.16 0.15 0.00 0.00 0.00 178.15 178.84 1n1h h PHE 492 N 0.35 0.83 -0.25 1.37 3.57 -1.08 -2.23 116.94 119.51 1n1h h PHE 492 Ca 0.07 -0.08 0.04 0.00 3.53 0.00 0.00 57.97 61.52 1n1h h PHE 492 Cb 0.62 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 1n1h h PHE 492 CO 0.06 0.72 0.02 1.96 -2.23 0.00 0.00 178.31 178.83 1n1h h GLN 493 N 0.71 0.09 -0.37 1.11 4.20 -0.98 -1.84 115.11 118.03 1n1h h GLN 493 Ca 0.17 -0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.94 1n1h h GLN 493 Cb 0.28 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 27.97 1n1h h GLN 493 CO -0.01 0.06 -0.10 0.00 -0.67 0.00 0.00 178.83 178.12 1n1h h ALA 494 N 1.20 0.23 -1.01 3.87 0.00 -0.10 -1.57 119.26 121.89 1n1h h ALA 494 Ca 0.12 0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.20 1n1h h ALA 494 Cb 0.14 0.29 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1n1h h ALA 494 CO -0.18 -0.46 0.66 0.00 0.00 0.00 0.00 179.25 179.27 1n1h h ALA 495 N 1.35 1.34 0.00 0.00 0.00 -0.88 0.19 119.26 121.25 1n1h h ALA 495 Ca 0.18 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1n1h h ALA 495 Cb 0.28 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1n1h h ALA 495 CO -0.38 0.57 -0.22 1.96 0.00 0.00 0.00 179.25 181.18 1n1h h GLN 496 N 1.28 0.00 0.00 0.00 4.20 -0.50 -3.14 115.11 116.95 1n1h h GLN 496 Ca 0.40 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.11 1n1h h GLN 496 Cb -0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1n1h h GLN 496 CO -0.12 0.22 -1.81 1.28 -0.67 0.00 0.00 178.83 177.72 1n1h n LEU 497 N -3.53 0.16 -0.21 1.46 4.77 -0.74 -4.42 117.00 114.50 1n1h n LEU 497 Ca -0.01 -0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.17 1n1h n LEU 497 Cb 0.38 -0.01 0.37 0.00 -2.33 0.00 0.00 43.42 41.83 1n1h n LEU 497 CO 0.33 0.00 0.66 0.00 -1.33 0.00 0.00 177.39 177.05 1n1h n ALA 498 N -2.19 0.66 -2.49 -1.18 0.00 0.58 -1.28 120.51 114.62 1n1h n ALA 498 Ca -0.03 0.61 -0.25 0.00 0.00 0.00 0.00 53.44 53.77 1n1h n ALA 498 Cb 0.55 -0.63 0.00 0.00 0.00 0.00 0.00 19.45 19.37 1n1h n ALA 498 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1n1h n ASN 499 N -4.32 4.44 -3.93 0.00 3.02 -1.26 -4.49 115.26 108.71 1n1h n ASN 499 Ca 0.24 -3.63 -0.20 0.00 -0.03 0.00 0.00 54.58 50.95 1n1h n ASN 499 Cb 0.81 -0.46 -0.16 0.00 -0.61 0.00 0.00 39.78 39.36 1n1h n ASN 499 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1n1h s LEU 500 N -3.51 1.49 0.43 3.41 1.43 -0.40 -5.13 118.68 116.39 1n1h s LEU 500 Ca 0.46 -0.16 -0.26 0.00 -1.03 0.00 0.00 54.13 53.15 1n1h s LEU 500 Cb 0.40 -0.50 -0.08 0.00 0.03 0.00 0.00 46.19 46.04 1n1h s LEU 500 CO -0.17 -0.02 1.36 -2.84 0.23 0.00 0.00 176.35 174.92 1n1h s PRO 501 N 0.69 3.84 0.46 1.29 0.02 -1.26 -4.90 135.00 135.14 1n1h s PRO 501 Ca -0.10 2.28 0.23 0.00 0.02 0.00 0.00 61.00 63.43 1n1h s PRO 501 Cb -0.13 -2.71 1.23 0.00 0.02 0.00 0.00 34.50 32.91 1n1h s PRO 501 CO 0.01 -0.64 1.85 0.35 -0.33 0.00 0.00 177.00 178.23 1n1h h PHE 502 N 2.51 0.38 0.00 6.54 3.57 -1.99 0.73 116.94 128.68 1n1h h PHE 502 Ca -0.50 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 60.99 1n1h h PHE 502 Cb 1.26 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.88 1n1h h PHE 502 CO 0.52 0.08 -0.09 0.66 -2.23 0.00 0.00 178.31 177.25 1n1h h SER 503 N 0.27 0.00 0.98 0.41 4.64 -1.96 -1.61 113.55 116.27 1n1h h SER 503 Ca 0.48 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.69 1n1h h SER 503 Cb 1.44 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.51 1n1h h SER 503 CO -0.14 0.09 -1.08 0.45 -0.87 0.00 0.00 176.83 175.27 1n1h h HIS 504 N 0.00 0.00 -0.02 4.77 3.86 -1.21 -3.36 115.15 119.19 1n1h h HIS 504 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1n1h h HIS 504 Cb 0.31 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.78 1n1h h HIS 504 CO 0.00 0.39 -0.06 0.25 0.86 0.00 0.00 177.93 179.37 1n1h n THR 505 N -2.91 0.00 -0.30 2.45 -2.24 -1.05 -4.55 114.28 105.68 1n1h n THR 505 Ca -0.05 -0.47 0.04 0.00 -2.27 0.00 0.00 64.05 61.31 1n1h n THR 505 Cb 0.73 1.36 0.19 0.00 -2.10 0.00 0.00 70.33 70.51 1n1h n THR 505 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1n1h h SER 506 N 3.40 0.70 -0.18 3.42 0.02 -1.45 -1.55 113.55 117.91 1n1h h SER 506 Ca 0.00 0.05 0.05 0.00 -0.84 0.00 0.00 61.79 61.05 1n1h h SER 506 Cb 0.75 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1n1h h SER 506 CO 0.00 0.39 0.17 -0.37 -1.14 0.00 0.00 176.83 175.88 1n1h h VAL 507 N 0.81 0.59 0.00 2.27 -1.51 -1.86 -0.54 116.25 116.02 1n1h h VAL 507 Ca 0.42 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.88 1n1h h VAL 507 Cb 0.41 0.87 -0.00 0.00 -2.13 0.00 0.00 31.29 30.44 1n1h h VAL 507 CO -0.26 0.00 -0.06 0.00 -1.23 0.00 0.00 177.57 176.01 1n1h h ALA 508 N 1.83 1.17 0.00 5.19 0.00 -1.61 -1.36 119.26 124.48 1n1h h ALA 508 Ca 0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1n1h h ALA 508 Cb 0.43 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1n1h h ALA 508 CO -0.00 0.08 -0.00 0.82 0.00 0.00 0.00 179.25 180.14 1n1h h ILE 509 N 0.00 0.05 -0.36 0.00 2.04 -1.22 -0.43 117.51 117.59 1n1h h ILE 509 Ca -0.00 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1n1h h ILE 509 Cb 0.28 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1n1h h ILE 509 CO 0.01 0.00 0.00 0.18 0.00 0.00 0.00 178.15 178.34 1n1h n LEU 510 N -3.14 3.47 -4.62 1.44 4.77 -0.51 -4.85 117.00 113.54 1n1h n LEU 510 Ca -0.02 -2.38 -0.29 0.00 -0.03 0.00 0.00 56.01 53.29 1n1h n LEU 510 Cb 0.12 -0.38 0.19 0.00 -2.33 0.00 0.00 43.42 41.02 1n1h n LEU 510 CO 0.22 0.73 0.61 0.00 -1.33 0.00 0.00 177.39 177.62 1n1h s ALA 511 N -1.69 0.70 1.16 -1.18 0.00 -0.17 -4.96 121.76 115.62 1n1h s ALA 511 Ca 0.33 -0.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.02 1n1h s ALA 511 Cb 0.22 -3.22 0.27 0.00 0.00 0.00 0.00 23.12 20.39 1n1h s ALA 511 CO 0.15 -3.03 1.13 -0.51 0.00 0.00 0.00 175.76 173.50 1n1h s ASP 512 N -3.04 1.28 -0.07 0.00 1.01 -1.26 -4.73 116.67 109.85 1n1h s ASP 512 Ca 0.66 0.63 0.03 0.00 0.71 0.00 0.00 52.55 54.58 1n1h s ASP 512 Cb -0.21 -0.89 0.01 0.00 1.01 0.00 0.00 42.92 42.84 1n1h s ASP 512 CO 0.60 -3.90 -0.17 -0.89 0.21 0.00 0.00 175.17 171.02 1n1h s THR 513 N -3.10 1.46 0.65 -1.27 2.01 0.56 -4.77 115.64 111.19 1n1h s THR 513 Ca 0.71 -0.68 -0.12 0.00 0.31 0.00 0.00 61.69 61.91 1n1h s THR 513 Cb -0.10 -1.29 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 1n1h s THR 513 CO 0.56 0.43 1.05 -0.44 -0.69 0.00 0.00 174.62 175.52 1n1h s SER 514 N 0.48 5.67 0.26 3.53 0.01 -1.26 -0.56 113.70 121.83 1n1h s SER 514 Ca -0.15 1.62 -0.28 0.00 1.31 0.00 0.00 55.95 58.45 1n1h s SER 514 Cb -0.16 -2.50 -0.09 0.00 0.21 0.00 0.00 66.02 63.48 1n1h s SER 514 CO 0.05 -1.25 0.93 -0.32 0.41 0.00 0.00 173.24 173.06 1n1h s MET 515 N -4.84 4.73 -0.16 12.44 1.75 -1.15 -4.33 119.30 127.75 1n1h s MET 515 Ca 0.58 1.40 -0.08 0.00 -1.25 0.00 0.00 55.69 56.34 1n1h s MET 515 Cb -0.14 -3.10 0.06 0.00 2.84 0.00 0.00 34.83 34.49 1n1h s MET 515 CO 0.50 0.44 0.37 0.20 -0.65 0.00 0.00 175.02 175.88 1n1h s GLY 516 N -1.34 -0.29 0.22 2.11 0.00 -1.24 -5.00 107.32 101.79 1n1h s GLY 516 Ca 0.44 1.41 0.07 0.00 0.00 0.00 0.00 44.72 46.64 1n1h s GLY 516 CO 0.29 1.63 -0.11 1.08 0.00 0.00 0.00 173.10 175.98 1n1h s LEU 517 N 1.44 2.51 -0.07 0.66 1.43 -1.26 0.75 118.68 124.14 1n1h s LEU 517 Ca -0.09 -1.07 -0.03 0.00 -1.03 0.00 0.00 54.13 51.91 1n1h s LEU 517 Cb -0.09 -0.62 0.04 0.00 0.03 0.00 0.00 46.19 45.55 1n1h s LEU 517 CO -0.12 -0.24 0.13 -0.13 0.23 0.00 0.00 176.35 176.22 1n1h s ARG 518 N -3.68 0.03 -0.01 1.70 0.52 -0.30 -4.83 118.95 112.38 1n1h s ARG 518 Ca 0.24 0.44 -0.08 0.00 -0.52 0.00 0.00 55.73 55.81 1n1h s ARG 518 Cb 0.01 -0.27 -0.05 0.00 0.52 0.00 0.00 34.95 35.16 1n1h s ARG 518 CO 0.08 -0.25 0.28 -0.80 0.02 0.00 0.00 175.30 174.63 1n1h s ASN 519 N 1.78 6.53 0.17 0.23 0.01 -1.26 -1.15 114.94 121.25 1n1h s ASN 519 Ca -0.02 0.62 0.04 0.00 -0.71 0.00 0.00 52.86 52.79 1n1h s ASN 519 Cb -0.12 -2.12 -0.05 0.00 0.41 0.00 0.00 41.25 39.38 1n1h s ASN 519 CO -0.05 0.28 -0.07 -1.10 -1.51 0.00 0.00 177.10 174.65 1n1h s GLN 520 N -1.56 1.13 0.24 -0.60 -0.21 -1.26 -4.87 119.66 112.53 1n1h s GLN 520 Ca 0.25 -1.51 -0.26 0.00 0.02 0.00 0.00 55.36 53.87 1n1h s GLN 520 Cb -0.14 -0.57 -0.09 0.00 1.00 0.00 0.00 33.01 33.22 1n1h s GLN 520 CO 0.14 0.01 0.86 0.08 -2.12 0.00 0.00 175.29 174.25 1n1h s VAL 521 N -3.40 4.29 -1.30 1.09 1.01 -1.26 -2.04 120.40 118.79 1n1h s VAL 521 Ca 0.20 1.75 0.00 0.00 0.00 0.00 0.00 61.98 63.93 1n1h s VAL 521 Cb 0.04 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1n1h s VAL 521 CO 0.03 0.34 0.00 0.00 0.00 0.00 0.00 175.10 175.46 1n1h n GLN 522 N 1.07 -1.58 -3.99 2.72 6.02 -1.20 -4.91 117.38 115.50 1n1h n GLN 522 Ca -0.02 0.72 -0.10 0.00 -0.01 0.00 0.00 57.00 57.60 1n1h n GLN 522 Cb 0.49 -5.09 -0.07 0.00 1.02 0.00 0.00 30.24 26.59 1n1h n GLN 522 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1n1h s ARG 523 N -3.74 1.20 0.49 -1.09 3.52 -1.25 -5.01 118.95 113.06 1n1h s ARG 523 Ca 0.00 -1.23 -0.13 0.00 -0.13 0.00 0.00 55.73 54.24 1n1h s ARG 523 Cb 0.00 0.37 -0.06 0.00 -1.56 0.00 0.00 34.95 33.70 1n1h s ARG 523 CO 0.00 -0.44 0.90 -0.98 -0.81 0.00 0.00 175.30 173.97 1n1h s ARG 524 N -3.99 3.80 0.58 5.12 1.70 -1.26 -4.24 118.95 120.66 1n1h s ARG 524 Ca 0.20 0.69 -0.19 0.00 -0.47 0.00 0.00 55.73 55.96 1n1h s ARG 524 Cb 0.03 -2.23 -0.04 0.00 -0.57 0.00 0.00 34.95 32.14 1n1h s ARG 524 CO 0.02 -0.23 1.19 -2.14 -1.08 0.00 0.00 175.30 173.05 1n1h s PRO 525 N -4.23 3.06 0.01 3.89 0.02 -1.26 -4.59 135.00 131.90 1n1h s PRO 525 Ca 0.55 1.76 0.06 0.00 0.02 0.00 0.00 61.00 63.39 1n1h s PRO 525 Cb -0.10 -1.95 -0.02 0.00 0.02 0.00 0.00 34.50 32.45 1n1h s PRO 525 CO 0.36 -1.12 -0.19 -0.98 -0.33 0.00 0.00 177.00 174.74 1n1h s ARG 526 N -3.34 1.46 0.52 5.54 1.70 -0.30 -4.97 118.95 119.57 1n1h s ARG 526 Ca 0.76 -0.77 -0.08 0.00 -0.47 0.00 0.00 55.73 55.17 1n1h s ARG 526 Cb -0.28 -1.47 -0.04 0.00 -0.57 0.00 0.00 34.95 32.59 1n1h s ARG 526 CO 0.32 0.39 0.87 -1.54 -1.08 0.00 0.00 175.30 174.26 1n1h s SER 527 N -0.73 6.27 0.07 -2.89 1.04 -1.26 -1.15 113.70 115.05 1n1h s SER 527 Ca 0.07 1.11 0.03 0.00 0.48 0.00 0.00 55.95 57.64 1n1h s SER 527 Cb -0.08 -2.33 -0.03 0.00 0.10 0.00 0.00 66.02 63.68 1n1h s SER 527 CO 0.00 -0.67 -0.09 -0.51 0.98 0.00 0.00 173.24 172.96 1n1h s ILE 528 N -2.87 0.72 -0.33 -1.02 1.10 0.23 -4.91 121.20 114.12 1n1h s ILE 528 Ca 0.50 -1.39 -0.02 0.00 -0.51 0.00 0.00 60.65 59.24 1n1h s ILE 528 Cb -0.11 -1.02 0.06 0.00 0.15 0.00 0.00 42.46 41.55 1n1h s ILE 528 CO 0.47 -0.49 0.06 -0.04 -2.11 0.00 0.00 174.94 172.82 1n1h s MET 529 N -2.28 2.31 -1.08 3.50 -1.94 -1.26 -3.61 119.30 114.93 1n1h s MET 529 Ca -0.02 -1.41 -0.21 0.00 -1.71 0.00 0.00 55.69 52.35 1n1h s MET 529 Cb -0.06 -3.29 0.08 0.00 2.01 0.00 0.00 34.83 33.57 1n1h s MET 529 CO -0.00 -0.74 1.47 -2.14 -0.01 0.00 0.00 175.02 173.60 1n1h s PRO 530 N 1.22 3.72 0.66 2.03 0.02 -1.26 -2.49 135.00 138.90 1n1h s PRO 530 Ca -0.01 -1.53 -0.17 0.00 0.02 0.00 0.00 61.00 59.32 1n1h s PRO 530 Cb -0.20 -5.31 -0.00 0.00 0.02 0.00 0.00 34.50 29.00 1n1h s PRO 530 CO -0.02 -2.12 1.18 -0.51 -0.33 0.00 0.00 177.00 175.20 1n1h s LEU 531 N 4.22 3.48 0.60 -5.54 1.43 -1.26 -3.29 118.68 118.32 1n1h s LEU 531 Ca 0.46 2.28 -0.05 0.00 -1.03 0.00 0.00 54.13 55.79 1n1h s LEU 531 Cb 0.00 -4.58 0.02 0.00 0.03 0.00 0.00 46.19 41.66 1n1h s LEU 531 CO -0.05 -1.83 0.90 0.54 0.23 0.00 0.00 176.35 176.14 1n1h s ASN 532 N -1.99 5.39 0.22 2.29 2.20 -1.21 -4.45 114.94 117.39 1n1h s ASN 532 Ca 0.74 0.54 -0.10 0.00 -0.94 0.00 0.00 52.86 53.09 1n1h s ASN 532 Cb -0.27 -1.46 0.32 0.00 -2.00 0.00 0.00 41.25 37.84 1n1h s ASN 532 CO 0.39 -1.17 1.67 0.58 -2.94 0.00 0.00 177.10 175.62 1n1h h VAL 533 N -0.21 0.50 -0.63 3.54 2.07 -1.91 0.18 116.25 119.79 1n1h h VAL 533 Ca -0.45 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.05 1n1h h VAL 533 Cb 1.27 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 1n1h h VAL 533 CO 0.59 0.03 0.39 -0.65 0.02 0.00 0.00 177.57 177.95 1n1h h PRO 534 N 0.14 0.74 -0.56 1.57 0.11 -1.93 0.16 132.00 132.22 1n1h h PRO 534 Ca 0.33 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.34 1n1h h PRO 534 Cb 0.54 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 1n1h h PRO 534 CO -0.52 0.49 0.10 1.96 -0.21 0.00 0.00 178.00 179.81 1n1h h GLN 535 N 0.76 0.89 -0.14 1.05 4.20 -1.59 -1.73 115.11 118.56 1n1h h GLN 535 Ca 0.25 -0.21 -0.16 0.00 0.06 0.00 0.00 58.65 58.60 1n1h h GLN 535 Cb 0.02 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1n1h h GLN 535 CO -0.10 0.83 -0.59 1.96 -0.67 0.00 0.00 178.83 180.25 1n1h h GLN 536 N 0.85 0.46 0.36 1.46 1.08 -0.39 -2.91 115.11 116.02 1n1h h GLN 536 Ca 0.18 -0.31 -0.02 0.00 -1.45 0.00 0.00 58.65 57.05 1n1h h GLN 536 Cb 0.36 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1n1h h GLN 536 CO 0.01 0.91 -0.17 0.37 -0.95 0.00 0.00 178.83 179.00 1n1h h GLN 537 N 0.35 -0.46 0.00 1.46 4.15 -0.26 -2.63 115.11 117.72 1n1h h GLN 537 Ca -0.00 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1n1h h GLN 537 Cb 1.12 0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.92 1n1h h GLN 537 CO 0.10 -0.26 0.00 -0.24 -1.93 0.00 0.00 178.83 176.50 1n1h h VAL 538 N -0.54 0.00 -0.00 2.39 3.04 -1.35 -2.34 116.25 117.44 1n1h h VAL 538 Ca -0.05 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 1n1h h VAL 538 Cb 0.41 0.87 0.00 0.00 -2.01 0.00 0.00 31.29 30.55 1n1h h VAL 538 CO 0.08 0.00 -0.07 -1.20 -1.01 0.00 0.00 177.57 175.37 1n1h n SER 539 N -2.63 0.23 0.06 3.17 7.64 -0.99 -4.45 113.62 116.65 1n1h n SER 539 Ca -0.01 -0.29 -0.16 0.00 1.01 0.00 0.00 58.87 59.43 1n1h n SER 539 Cb 0.11 -0.18 -0.10 0.00 -1.01 0.00 0.00 64.21 63.03 1n1h n SER 539 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1n1h h ALA 540 N 3.45 -0.95 -1.00 -0.43 0.00 -1.48 -2.29 119.26 116.56 1n1h h ALA 540 Ca 0.00 -0.09 0.29 0.00 0.00 0.00 0.00 54.91 55.11 1n1h h ALA 540 Cb 0.34 0.94 -0.14 0.00 0.00 0.00 0.00 17.79 18.94 1n1h h ALA 540 CO 0.00 -1.11 0.58 -1.35 0.00 0.00 0.00 179.25 177.37 1n1h h PRO 541 N -0.68 0.41 0.19 0.00 0.11 -1.85 0.26 132.00 130.44 1n1h h PRO 541 Ca 0.01 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1n1h h PRO 541 Cb 0.72 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1n1h h PRO 541 CO -0.35 0.27 -0.09 1.25 -0.21 0.00 0.00 178.00 178.87 1n1h h HIS 542 N 0.42 -0.24 -0.42 0.65 2.76 -1.77 -2.28 115.15 114.27 1n1h h HIS 542 Ca 0.70 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.87 1n1h h HIS 542 Cb 1.49 0.08 -0.02 0.00 1.55 0.00 0.00 27.41 30.51 1n1h h HIS 542 CO -0.01 0.02 0.27 1.15 -1.30 0.00 0.00 177.93 178.06 1n1h h THR 543 N -0.48 1.08 -0.50 6.26 2.02 -0.09 -2.24 112.91 118.96 1n1h h THR 543 Ca -0.03 -0.19 -0.08 0.00 0.77 0.00 0.00 66.41 66.89 1n1h h THR 543 Cb 0.37 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 1n1h h THR 543 CO 0.04 0.10 0.01 -0.07 0.37 0.00 0.00 175.52 175.97 1n1h h LEU 544 N 0.54 0.86 -1.15 2.58 3.38 -0.76 -1.56 115.31 119.19 1n1h h LEU 544 Ca 0.16 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 1n1h h LEU 544 Cb -0.04 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1n1h h LEU 544 CO -0.05 0.95 -0.15 0.74 0.09 0.00 0.00 178.44 180.02 1n1h h THR 545 N 0.75 1.22 -0.31 0.22 2.02 -1.30 -0.17 112.91 115.34 1n1h h THR 545 Ca 0.14 -1.01 -0.17 0.00 0.77 0.00 0.00 66.41 66.15 1n1h h THR 545 Cb 0.51 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 68.12 1n1h h THR 545 CO 0.02 0.32 -0.46 0.00 0.37 0.00 0.00 175.52 175.77 1n1h h ALA 546 N 1.47 0.48 -0.55 6.16 0.00 -1.25 -2.30 119.26 123.26 1n1h h ALA 546 Ca 0.07 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.46 1n1h h ALA 546 Cb 0.49 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1n1h h ALA 546 CO 0.03 0.63 0.20 -0.44 0.00 0.00 0.00 179.25 179.67 1n1h h ASP 547 N 0.65 0.78 -1.01 0.00 3.32 -0.88 -0.94 116.42 118.34 1n1h h ASP 547 Ca 0.03 -0.19 0.03 0.00 0.02 0.00 0.00 57.03 56.93 1n1h h ASP 547 Cb 1.07 -0.20 -0.06 0.00 0.22 0.00 0.00 39.33 40.36 1n1h h ASP 547 CO 0.11 0.75 0.66 0.22 -1.72 0.00 0.00 179.24 179.26 1n1h h TYR 548 N 0.75 1.24 -0.11 4.55 3.20 -0.95 0.22 116.97 125.87 1n1h h TYR 548 Ca 0.18 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 1n1h h TYR 548 Cb 0.23 -0.42 -0.00 0.00 1.54 0.00 0.00 36.73 38.08 1n1h h TYR 548 CO 0.01 0.73 0.00 0.82 -1.64 0.00 0.00 178.16 178.08 1n1h h ILE 549 N 1.29 1.24 0.00 1.81 2.04 -0.83 -1.55 117.51 121.51 1n1h h ILE 549 Ca 0.40 -0.78 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 1n1h h ILE 549 Cb -0.02 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 1n1h h ILE 549 CO -0.12 0.22 -0.22 0.78 0.00 0.00 0.00 178.15 178.82 1n1h h ASN 550 N -0.06 0.00 0.73 1.72 2.35 -0.72 0.69 115.58 120.28 1n1h h ASN 550 Ca 0.03 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.53 1n1h h ASN 550 Cb 0.34 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.67 1n1h h ASN 550 CO 0.00 0.22 -1.36 0.22 -1.65 0.00 0.00 177.43 174.86 1n1h h TYR 551 N 0.00 0.03 0.00 1.19 3.20 -0.90 -3.40 116.97 117.09 1n1h h TYR 551 Ca -0.00 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 1n1h h TYR 551 Cb 0.43 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1n1h h TYR 551 CO 0.00 1.03 -1.17 0.72 -1.64 0.00 0.00 178.16 177.10 1n1h n HIS 552 N -3.22 0.00 0.71 -3.82 8.25 -0.59 -4.85 115.22 111.70 1n1h n HIS 552 Ca -0.09 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.44 1n1h n HIS 552 Cb 1.00 -0.11 -0.07 0.00 1.12 0.00 0.00 29.99 31.92 1n1h n HIS 552 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1n1h n MET 553 N -1.95 1.97 -4.24 -0.41 2.81 0.24 -5.04 117.12 110.50 1n1h n MET 553 Ca -0.03 -0.11 -0.17 0.00 -1.81 0.00 0.00 57.70 55.58 1n1h n MET 553 Cb 0.43 -1.22 -0.08 0.00 -0.71 0.00 0.00 33.22 31.64 1n1h n MET 553 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1n1h s ASN 554 N -2.35 1.20 -0.61 7.83 2.20 -1.11 -4.78 114.94 117.33 1n1h s ASN 554 Ca 0.07 -1.63 -0.12 0.00 -0.94 0.00 0.00 52.86 50.23 1n1h s ASN 554 Cb 0.12 0.52 0.15 0.00 -2.00 0.00 0.00 41.25 40.04 1n1h s ASN 554 CO 0.59 -1.03 0.52 -0.22 -2.94 0.00 0.00 177.10 174.02 1n1h s LEU 555 N -3.30 6.12 0.05 3.54 2.96 -1.21 -4.78 118.68 122.06 1n1h s LEU 555 Ca 0.39 -2.17 0.00 0.00 -0.22 0.00 0.00 54.13 52.14 1n1h s LEU 555 Cb 0.03 -2.12 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 1n1h s LEU 555 CO 0.23 -0.69 -0.04 -0.94 -1.32 0.00 0.00 176.35 173.59 1n1h s SER 556 N 2.68 0.58 0.08 3.68 1.04 -1.26 -2.59 113.70 117.91 1n1h s SER 556 Ca 0.09 -0.79 0.07 0.00 0.48 0.00 0.00 55.95 55.80 1n1h s SER 556 Cb -0.23 0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.99 1n1h s SER 556 CO -0.02 -0.43 -0.11 -2.84 0.98 0.00 0.00 173.24 170.82 1n1h s PRO 557 N -2.86 2.16 -0.69 4.02 0.02 -1.12 -4.94 135.00 131.59 1n1h s PRO 557 Ca -0.01 -0.99 0.04 0.00 0.02 0.00 0.00 61.00 60.06 1n1h s PRO 557 Cb -0.00 -2.31 0.17 0.00 0.02 0.00 0.00 34.50 32.38 1n1h s PRO 557 CO -0.05 0.52 0.47 0.99 -0.33 0.00 0.00 177.00 178.61 1n1h s THR 558 N -1.15 3.00 0.43 0.99 2.01 -1.26 -4.57 115.64 115.09 1n1h s THR 558 Ca 0.20 -4.03 0.05 0.00 0.31 0.00 0.00 61.69 58.22 1n1h s THR 558 Cb -0.11 -2.98 0.01 0.00 0.01 0.00 0.00 72.50 69.43 1n1h s THR 558 CO 0.12 -0.97 0.60 -0.55 -0.69 0.00 0.00 174.62 173.13 1n1h s SER 559 N -1.06 5.69 0.00 3.53 0.15 -1.26 -5.07 113.70 115.68 1n1h s SER 559 Ca 0.23 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.72 1n1h s SER 559 Cb -0.09 -1.00 0.00 0.00 -1.71 0.00 0.00 66.02 63.22 1n1h s SER 559 CO -0.13 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.18 1n1h n GLY 560 N -1.93 0.42 0.00 9.45 0.00 -1.26 -5.05 105.19 106.82 1n1h n GLY 560 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1n1h n GLY 560 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1n1h n SER 561 N 0.00 1.13 -4.75 1.61 2.88 -1.26 -5.04 113.62 108.18 1n1h n SER 561 Ca 0.00 -0.10 -0.40 0.00 -1.33 0.00 0.00 58.87 57.04 1n1h n SER 561 Cb 0.00 0.43 -0.06 0.00 -0.75 0.00 0.00 64.21 63.83 1n1h n SER 561 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n1h s ALA 562 N -0.66 3.36 0.52 -1.46 0.00 -1.26 -4.95 121.76 117.31 1n1h s ALA 562 Ca 0.00 0.55 0.20 0.00 0.00 0.00 0.00 51.96 52.71 1n1h s ALA 562 Cb 0.00 -3.15 1.33 0.00 0.00 0.00 0.00 23.12 21.29 1n1h s ALA 562 CO 0.00 0.21 2.08 0.28 0.00 0.00 0.00 175.76 178.33 1n1h h VAL 563 N 3.26 0.88 0.00 0.00 2.07 -2.00 -1.44 116.25 119.02 1n1h h VAL 563 Ca -0.45 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1n1h h VAL 563 Cb 1.20 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1n1h h VAL 563 CO 0.68 0.00 0.00 0.16 0.02 0.00 0.00 177.57 178.43 1n1h h ILE 564 N 0.01 0.00 -0.07 4.57 3.07 -1.95 -3.08 117.51 120.07 1n1h h ILE 564 Ca 0.12 -0.17 0.00 0.00 1.55 0.00 0.00 64.86 66.36 1n1h h ILE 564 Cb 0.47 0.89 0.00 0.00 -0.27 0.00 0.00 36.82 37.91 1n1h h ILE 564 CO -0.00 0.00 0.00 -0.62 -1.05 0.00 0.00 178.15 176.48 1n1h n GLU 565 N -2.48 2.23 -0.93 0.16 1.02 -0.54 -4.49 120.64 115.61 1n1h n GLU 565 Ca 0.00 -2.19 -0.05 0.00 -0.02 0.00 0.00 57.16 54.90 1n1h n GLU 565 Cb 0.15 -1.35 0.28 0.00 -0.02 0.00 0.00 31.44 30.50 1n1h n GLU 565 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1n1h n LYS 566 N -0.81 3.29 -3.51 3.49 5.02 -1.16 -4.37 118.16 120.10 1n1h n LYS 566 Ca 0.11 -3.07 -0.24 0.00 -2.02 0.00 0.00 58.31 53.09 1n1h n LYS 566 Cb 0.52 -2.12 0.01 0.00 -0.02 0.00 0.00 35.03 33.43 1n1h n LYS 566 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1n1h n VAL 567 N -0.39 -5.25 -0.24 -0.18 0.31 -1.26 -4.90 118.33 106.42 1n1h n VAL 567 Ca 0.39 0.07 -0.07 0.00 -0.01 0.00 0.00 64.34 64.72 1n1h n VAL 567 Cb 1.30 -4.12 0.04 0.00 -0.91 0.00 0.00 33.84 30.15 1n1h n VAL 567 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1n1h h ILE 568 N 0.79 1.24 -1.03 2.52 2.04 -1.91 -3.12 117.51 118.05 1n1h h ILE 568 Ca -0.47 -0.77 0.26 0.00 1.00 0.00 0.00 64.86 64.89 1n1h h ILE 568 Cb 1.31 0.48 -0.11 0.00 -0.74 0.00 0.00 36.82 37.77 1n1h h ILE 568 CO 0.30 0.30 0.64 -0.65 0.00 0.00 0.00 178.15 178.75 1n1h h PRO 569 N 0.96 0.45 -0.35 2.37 0.11 -1.87 -0.69 132.00 132.97 1n1h h PRO 569 Ca 0.22 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.26 1n1h h PRO 569 Cb 0.22 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 1n1h h PRO 569 CO -0.02 0.30 0.02 1.25 -0.21 0.00 0.00 178.00 179.34 1n1h h LEU 570 N 0.46 0.50 -0.36 2.35 5.85 -1.88 -2.25 115.31 119.99 1n1h h LEU 570 Ca 0.62 -0.09 -0.19 0.00 0.84 0.00 0.00 57.88 59.06 1n1h h LEU 570 Cb 1.42 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 1n1h h LEU 570 CO -0.38 0.56 -0.73 1.23 -0.34 0.00 0.00 178.44 178.79 1n1h h GLY 571 N 0.83 0.56 0.94 3.75 0.00 -1.26 -0.96 103.07 106.93 1n1h h GLY 571 Ca 0.11 -0.78 -0.02 0.00 0.00 0.00 0.00 47.33 46.64 1n1h h GLY 571 CO 0.01 0.70 0.16 -2.08 0.00 0.00 0.00 176.54 175.33 1n1h h VAL 572 N 0.35 1.18 0.48 4.60 2.07 -1.25 -1.91 116.25 121.77 1n1h h VAL 572 Ca -0.03 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1n1h h VAL 572 Cb 1.31 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1n1h h VAL 572 CO 0.13 0.19 -0.23 0.22 0.02 0.00 0.00 177.57 177.90 1n1h h TYR 573 N 0.45 -0.60 -0.87 1.57 3.20 -1.34 -2.50 116.97 116.88 1n1h h TYR 573 Ca 0.12 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.04 1n1h h TYR 573 Cb 0.15 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.56 1n1h h TYR 573 CO -0.01 -0.32 0.57 0.00 -1.64 0.00 0.00 178.16 176.76 1n1h h ALA 574 N -0.31 1.55 -0.01 1.82 0.00 -1.15 -2.65 119.26 118.50 1n1h h ALA 574 Ca -0.07 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1n1h h ALA 574 Cb 0.55 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1n1h h ALA 574 CO 0.11 0.32 -0.04 -1.13 0.00 0.00 0.00 179.25 178.51 1n1h n SER 575 N -4.49 1.41 -4.66 0.00 3.41 -0.72 -3.38 113.62 105.19 1n1h n SER 575 Ca 0.13 -1.40 -0.40 0.00 -0.26 0.00 0.00 58.87 56.94 1n1h n SER 575 Cb 0.20 0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.12 1n1h n SER 575 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1n1h s SER 576 N -2.08 6.74 0.53 4.04 0.01 -0.95 -2.08 113.70 119.91 1n1h s SER 576 Ca 0.36 0.90 -0.22 0.00 1.31 0.00 0.00 55.95 58.30 1n1h s SER 576 Cb 0.21 -2.37 -0.06 0.00 0.21 0.00 0.00 66.02 64.01 1n1h s SER 576 CO 0.37 -0.32 1.28 -2.65 0.41 0.00 0.00 173.24 172.33 1n1h n PRO 577 N 5.17 1.62 -0.00 12.44 -0.02 -1.26 -0.01 135.00 152.93 1n1h n PRO 577 Ca 0.00 0.59 0.01 0.00 -2.02 0.00 0.00 63.50 62.09 1n1h n PRO 577 Cb 0.49 -2.47 0.08 0.00 -0.02 0.00 0.00 33.50 31.58 1n1h n PRO 577 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1n1h n PRO 578 N -0.79 1.00 -2.24 0.52 -0.05 -1.26 -4.99 135.00 127.19 1n1h n PRO 578 Ca 0.10 -0.01 -0.32 0.00 -0.05 0.00 0.00 63.50 63.22 1n1h n PRO 578 Cb 0.44 -1.04 -0.02 0.00 -0.05 0.00 0.00 33.50 32.83 1n1h n PRO 578 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 175.50 174.65 1n1h s ASN 579 N -1.08 6.34 0.06 3.54 0.01 0.98 -3.49 114.94 121.29 1n1h s ASN 579 Ca 0.04 1.62 -0.03 0.00 -0.71 0.00 0.00 52.86 53.78 1n1h s ASN 579 Cb 0.02 -2.51 -0.03 0.00 0.41 0.00 0.00 41.25 39.14 1n1h s ASN 579 CO 0.03 -0.79 0.03 -1.10 -1.51 0.00 0.00 177.10 173.76 1n1h s GLN 580 N -4.19 0.65 -0.03 -0.60 -0.21 -0.72 -4.43 119.66 110.13 1n1h s GLN 580 Ca 0.60 -1.10 -0.08 0.00 0.02 0.00 0.00 55.36 54.80 1n1h s GLN 580 Cb -0.12 0.24 0.01 0.00 1.00 0.00 0.00 33.01 34.14 1n1h s GLN 580 CO 0.35 -0.14 0.18 -1.54 -2.12 0.00 0.00 175.29 172.02 1n1h s SER 581 N -2.77 -0.09 -0.22 5.90 1.04 -1.26 -0.07 113.70 116.24 1n1h s SER 581 Ca 0.04 0.05 -0.05 0.00 0.48 0.00 0.00 55.95 56.48 1n1h s SER 581 Cb 0.06 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 66.45 1n1h s SER 581 CO -0.09 -0.28 -0.00 -0.63 0.98 0.00 0.00 173.24 173.22 1n1h s ILE 582 N -0.85 3.81 -0.63 -1.02 -1.09 -0.25 -4.72 121.20 116.45 1n1h s ILE 582 Ca -0.09 -0.35 -0.23 0.00 -2.23 0.00 0.00 60.65 57.75 1n1h s ILE 582 Cb -0.05 -2.74 0.06 0.00 -1.58 0.00 0.00 42.46 38.16 1n1h s ILE 582 CO 0.01 0.41 0.94 0.20 -1.23 0.00 0.00 174.94 175.27 1n1h s ASN 583 N 1.27 6.21 0.04 3.58 0.01 0.18 -1.60 114.94 124.63 1n1h s ASN 583 Ca 0.04 -0.86 -0.09 0.00 -0.71 0.00 0.00 52.86 51.24 1n1h s ASN 583 Cb -0.15 -2.41 -0.05 0.00 0.41 0.00 0.00 41.25 39.05 1n1h s ASN 583 CO 0.01 -1.36 0.34 -0.63 -1.51 0.00 0.00 177.10 173.95 1n1h s ILE 584 N 3.94 5.18 -0.13 0.60 1.01 0.73 -1.17 121.20 131.36 1n1h s ILE 584 Ca 0.23 0.37 -0.17 0.00 0.00 0.00 0.00 60.65 61.08 1n1h s ILE 584 Cb -0.16 -3.62 0.04 0.00 0.01 0.00 0.00 42.46 38.74 1n1h s ILE 584 CO 0.12 0.35 0.46 -0.62 0.00 0.00 0.00 174.94 175.25 1n1h s ASP 585 N -1.67 -0.45 -0.25 3.58 -1.08 -0.75 -0.35 116.67 115.71 1n1h s ASP 585 Ca 0.30 0.76 -0.08 0.00 -0.52 0.00 0.00 52.55 53.01 1n1h s ASP 585 Cb -0.14 0.80 -0.03 0.00 -1.46 0.00 0.00 42.92 42.08 1n1h s ASP 585 CO 0.17 -0.26 0.09 -0.63 0.52 0.00 0.00 175.17 175.06 1n1h s ILE 586 N -0.19 4.52 0.11 4.11 1.01 -1.07 0.20 121.20 129.90 1n1h s ILE 586 Ca -0.04 -0.10 -0.26 0.00 0.00 0.00 0.00 60.65 60.26 1n1h s ILE 586 Cb -0.03 -3.12 -0.07 0.00 0.01 0.00 0.00 42.46 39.25 1n1h s ILE 586 CO 0.02 0.32 0.80 -0.94 0.00 0.00 0.00 174.94 175.14 1n1h s SER 587 N 1.61 7.34 -0.82 3.58 1.04 -0.60 -3.71 113.70 122.13 1n1h s SER 587 Ca 0.06 1.59 -0.05 0.00 0.48 0.00 0.00 55.95 58.04 1n1h s SER 587 Cb -0.15 -2.50 0.01 0.00 0.10 0.00 0.00 66.02 63.47 1n1h s SER 587 CO 0.05 0.10 0.71 0.00 0.98 0.00 0.00 173.24 175.09 1n1h n ALA 588 N 2.19 -0.85 -0.10 5.32 0.00 -1.26 -4.47 120.51 121.35 1n1h n ALA 588 Ca -0.03 0.22 -0.14 0.00 0.00 0.00 0.00 53.44 53.49 1n1h n ALA 588 Cb 0.49 -3.38 -0.10 0.00 0.00 0.00 0.00 19.45 16.47 1n1h n ALA 588 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1h h ASP 590 N -0.44 0.48 1.68 0.00 3.32 -1.92 0.25 116.42 119.79 1n1h h ASP 590 Ca 0.06 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 1n1h h ASP 590 Cb 0.60 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 1n1h h ASP 590 CO -0.54 0.24 -0.01 0.00 -1.72 0.00 0.00 179.24 177.22 1n1h h ALA 591 N 1.63 1.00 0.00 3.45 0.00 -1.68 0.52 119.26 124.18 1n1h h ALA 591 Ca 0.40 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.23 1n1h h ALA 591 Cb 0.81 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1n1h h ALA 591 CO -0.15 0.01 -0.43 0.77 0.00 0.00 0.00 179.25 179.46 1n1h h SER 592 N 0.00 0.00 -2.97 0.00 0.02 0.89 -3.36 113.55 108.14 1n1h h SER 592 Ca -0.00 0.00 -0.71 0.00 -0.84 0.00 0.00 61.79 60.24 1n1h h SER 592 Cb 0.85 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.19 1n1h h SER 592 CO 0.00 0.30 0.22 -0.63 -1.14 0.00 0.00 176.83 175.58 1n1h s ILE 593 N -3.07 4.93 0.36 3.27 -1.09 -0.99 -4.89 121.20 119.72 1n1h s ILE 593 Ca 0.04 -1.31 0.03 0.00 -2.23 0.00 0.00 60.65 57.19 1n1h s ILE 593 Cb 0.07 -4.53 -0.04 0.00 -1.58 0.00 0.00 42.46 36.38 1n1h s ILE 593 CO 0.73 -1.17 0.11 0.42 -1.23 0.00 0.00 174.94 173.80 1n1h s THR 594 N 2.30 0.70 0.09 2.92 -4.23 -1.26 -3.95 115.64 112.21 1n1h s THR 594 Ca 0.15 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.39 1n1h s THR 594 Cb -0.19 -2.51 -0.15 0.00 1.34 0.00 0.00 72.50 70.99 1n1h s THR 594 CO 0.02 0.00 1.68 -0.25 -0.54 0.00 0.00 174.62 175.52 1n1h h TRP 595 N 1.98 -0.46 -1.88 3.99 2.91 -1.86 -2.00 115.95 118.63 1n1h h TRP 595 Ca -0.37 -0.00 0.55 0.00 1.13 0.00 0.00 58.89 60.20 1n1h h TRP 595 Cb 1.26 0.17 -0.09 0.00 -0.51 0.00 0.00 29.16 29.99 1n1h h TRP 595 CO 1.12 -0.28 1.34 -0.25 -1.03 0.00 0.00 178.44 179.34 1n1h n ASP 596 N -5.30 0.03 0.00 2.65 8.00 -1.26 -1.82 116.55 118.84 1n1h n ASP 596 Ca -0.09 1.03 0.00 0.00 0.71 0.00 0.00 54.79 56.43 1n1h n ASP 596 Cb 0.21 -0.51 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 1n1h n ASP 596 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1n1h n PHE 597 N -3.99 0.00 0.00 1.24 7.35 -1.23 -4.68 117.46 116.15 1n1h n PHE 597 Ca 0.43 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.12 1n1h n PHE 597 Cb 1.94 0.18 0.00 0.00 0.35 0.00 0.00 39.48 41.94 1n1h n PHE 597 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1n1h n PHE 598 N -2.45 0.00 -0.24 -5.13 3.72 -1.13 -3.56 117.46 108.67 1n1h n PHE 598 Ca 0.00 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.43 1n1h n PHE 598 Cb 0.00 -0.43 0.15 0.00 -0.94 0.00 0.00 39.48 38.27 1n1h n PHE 598 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1n1h h LEU 599 N 0.00 0.26 -2.21 4.37 3.38 -1.51 0.16 115.31 119.76 1n1h h LEU 599 Ca 0.00 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1n1h h LEU 599 Cb 0.00 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1n1h h LEU 599 CO 0.00 0.12 -0.06 0.77 0.09 0.00 0.00 178.44 179.36 1n1h h SER 600 N 0.44 0.00 0.13 -0.43 4.64 -1.54 -0.14 113.55 116.65 1n1h h SER 600 Ca 0.37 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.33 1n1h h SER 600 Cb 0.52 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.59 1n1h h SER 600 CO -0.36 0.06 -1.98 0.52 -0.87 0.00 0.00 176.83 174.19 1n1h n VAL 601 N -3.51 1.79 -0.09 0.95 0.31 -0.37 -3.41 118.33 114.00 1n1h n VAL 601 Ca -0.02 -0.65 -0.10 0.00 -0.01 0.00 0.00 64.34 63.55 1n1h n VAL 601 Cb 0.18 -1.74 -0.03 0.00 -0.91 0.00 0.00 33.84 31.33 1n1h n VAL 601 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1n1h h ILE 602 N 0.06 1.21 0.02 2.52 2.04 -0.33 -0.19 117.51 122.84 1n1h h ILE 602 Ca -0.42 -0.69 0.03 0.00 1.00 0.00 0.00 64.86 64.78 1n1h h ILE 602 Cb 2.03 1.15 -0.04 0.00 -0.74 0.00 0.00 36.82 39.22 1n1h h ILE 602 CO 0.09 0.22 -0.20 0.24 0.00 0.00 0.00 178.15 178.51 1n1h h MET 603 N 0.27 -0.32 -0.29 2.37 2.86 -1.21 -0.51 114.93 118.12 1n1h h MET 603 Ca 0.09 0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.80 1n1h h MET 603 Cb 0.27 0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.96 1n1h h MET 603 CO -0.00 -0.21 -0.00 0.00 1.06 0.00 0.00 176.91 177.76 1n1h h ALA 604 N 0.56 0.25 -0.24 6.32 0.00 -1.54 -0.12 119.26 124.49 1n1h h ALA 604 Ca 0.05 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1n1h h ALA 604 Cb 0.39 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 1n1h h ALA 604 CO -0.17 -0.41 -0.10 0.00 0.00 0.00 0.00 179.25 178.56 1n1h h ALA 605 N 1.25 0.10 0.63 0.00 0.00 -0.49 -1.60 119.26 119.14 1n1h h ALA 605 Ca 0.14 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 1n1h h ALA 605 Cb 0.18 0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.24 1n1h h ALA 605 CO -0.23 -0.52 -0.30 0.82 0.00 0.00 0.00 179.25 179.02 1n1h h ILE 606 N -0.07 0.35 -1.09 0.00 2.04 -0.80 0.61 117.51 118.55 1n1h h ILE 606 Ca 0.13 -0.11 0.31 0.00 1.00 0.00 0.00 64.86 66.18 1n1h h ILE 606 Cb 0.26 0.40 -0.11 0.00 -0.74 0.00 0.00 36.82 36.63 1n1h h ILE 606 CO -0.29 0.02 0.69 -0.74 0.00 0.00 0.00 178.15 177.83 1n1h h HIS 607 N -0.92 0.69 0.11 1.37 2.76 -0.84 0.05 115.15 118.36 1n1h h HIS 607 Ca -0.09 0.03 -0.35 0.00 -2.20 0.00 0.00 60.37 57.76 1n1h h HIS 607 Cb 0.67 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.42 1n1h h HIS 607 CO -0.02 -0.02 -1.94 0.39 -1.30 0.00 0.00 177.93 175.05 1n1h n GLU 608 N -4.71 0.74 0.05 5.26 -0.58 -0.62 -3.68 120.64 117.11 1n1h n GLU 608 Ca 0.29 0.27 0.11 0.00 -0.42 0.00 0.00 57.16 57.41 1n1h n GLU 608 Cb 0.99 -1.73 0.45 0.00 -0.57 0.00 0.00 31.44 30.59 1n1h n GLU 608 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1n1h n GLY 609 N 1.91 -1.34 0.12 0.62 0.00 0.19 -2.82 105.19 103.87 1n1h n GLY 609 Ca -0.29 -0.03 0.10 0.00 0.00 0.00 0.00 46.02 45.81 1n1h n GLY 609 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1n1h n VAL 610 N -1.84 0.00 0.05 1.61 0.31 -0.06 -2.38 118.33 116.03 1n1h n VAL 610 Ca 0.05 -0.06 -0.14 0.00 -0.01 0.00 0.00 64.34 64.18 1n1h n VAL 610 Cb 0.28 1.03 -0.08 0.00 -0.91 0.00 0.00 33.84 34.16 1n1h n VAL 610 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1n1h h ALA 611 N 3.21 -0.89 -0.04 3.52 0.00 -1.60 -2.75 119.26 120.72 1n1h h ALA 611 Ca 0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1n1h h ALA 611 Cb 0.56 0.88 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1n1h h ALA 611 CO 0.00 -1.02 -0.29 0.66 0.00 0.00 0.00 179.25 178.60 1n1h h SER 612 N -0.58 0.07 1.08 0.00 4.64 -1.84 -2.04 113.55 114.88 1n1h h SER 612 Ca 0.01 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 1n1h h SER 612 Cb 0.62 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1n1h h SER 612 CO -0.30 0.37 -0.93 0.28 -0.87 0.00 0.00 176.83 175.37 1n1h h SER 613 N 0.07 0.00 0.14 4.97 0.02 -1.86 -3.33 113.55 113.56 1n1h h SER 613 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1n1h h SER 613 Cb 0.55 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.09 1n1h h SER 613 CO 0.04 0.11 -1.09 -1.54 -1.14 0.00 0.00 176.83 173.21 1n1h n SER 614 N -2.78 0.73 -4.11 3.07 3.41 -1.04 -4.93 113.62 107.97 1n1h n SER 614 Ca -0.01 -0.62 -0.48 0.00 -0.26 0.00 0.00 58.87 57.50 1n1h n SER 614 Cb 0.60 1.01 -0.04 0.00 -0.26 0.00 0.00 64.21 65.52 1n1h n SER 614 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1h n ILE 615 N -1.70 1.25 -3.79 -1.33 3.06 -0.77 -2.64 119.36 113.44 1n1h n ILE 615 Ca 0.03 -0.31 -0.30 0.00 -2.50 0.00 0.00 62.75 59.66 1n1h n ILE 615 Cb 0.39 0.00 0.02 0.00 0.54 0.00 0.00 39.64 40.59 1n1h n ILE 615 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1n1h n GLY 616 N 1.70 -0.71 3.58 4.50 0.00 -1.26 -4.99 105.19 108.01 1n1h n GLY 616 Ca 0.17 0.34 -0.13 0.00 0.00 0.00 0.00 46.02 46.40 1n1h n GLY 616 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n1h s LYS 617 N -6.24 0.77 0.82 1.61 1.02 -1.08 -5.08 119.74 111.56 1n1h s LYS 617 Ca 0.30 0.42 -0.06 0.00 0.02 0.00 0.00 55.97 56.65 1n1h s LYS 617 Cb -0.11 0.37 0.17 0.00 -0.52 0.00 0.00 37.83 37.74 1n1h s LYS 617 CO 0.87 -0.19 1.12 -0.35 -0.92 0.00 0.00 175.35 175.88 1n1h n PRO 618 N 1.42 -0.55 -3.65 -1.68 -0.04 -1.26 -0.82 135.00 128.41 1n1h n PRO 618 Ca -0.14 -2.48 -0.06 0.00 -0.04 0.00 0.00 63.50 60.78 1n1h n PRO 618 Cb 0.57 -0.92 -0.07 0.00 -0.04 0.00 0.00 33.50 33.03 1n1h n PRO 618 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1n1h s PHE 619 N -3.39 -1.05 -0.94 0.54 5.36 -0.42 -4.69 117.98 113.38 1n1h s PHE 619 Ca 0.70 1.98 -0.02 0.00 -0.96 0.00 0.00 56.93 58.62 1n1h s PHE 619 Cb -0.03 0.59 0.01 0.00 -0.34 0.00 0.00 43.02 43.25 1n1h s PHE 619 CO 0.47 -0.54 0.10 -1.33 -1.46 0.00 0.00 175.22 172.46 1n1h n MET 620 N 4.91 -2.58 0.00 10.12 2.81 -1.26 -1.05 117.12 130.07 1n1h n MET 620 Ca -0.16 0.48 0.00 0.00 -1.81 0.00 0.00 57.70 56.22 1n1h n MET 620 Cb 0.53 -5.09 0.00 0.00 -0.71 0.00 0.00 33.22 27.95 1n1h n MET 620 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n1h n GLY 621 N -0.83 2.41 3.72 3.03 0.00 -1.26 -5.01 105.19 107.25 1n1h n GLY 621 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1n1h n GLY 621 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n1h s VAL 622 N -2.48 3.80 0.53 1.61 1.01 -0.22 -4.71 120.40 119.94 1n1h s VAL 622 Ca 0.00 1.35 -0.04 0.00 0.00 0.00 0.00 61.98 63.29 1n1h s VAL 622 Cb 0.00 -3.86 -0.00 0.00 0.00 0.00 0.00 36.38 32.51 1n1h s VAL 622 CO 0.00 0.13 0.81 -2.16 0.00 0.00 0.00 175.10 173.88 1n1h s PRO 623 N 0.72 3.09 0.81 2.72 0.04 -1.26 -1.30 135.00 139.81 1n1h s PRO 623 Ca 0.58 -0.11 -0.12 0.00 0.04 0.00 0.00 61.00 61.40 1n1h s PRO 623 Cb -0.31 -2.38 0.08 0.00 0.04 0.00 0.00 34.50 31.92 1n1h s PRO 623 CO 0.31 -0.47 1.13 0.00 0.04 0.00 0.00 177.00 178.02 1n1h s ALA 624 N -2.81 2.42 0.00 8.56 0.00 -1.26 -3.81 121.76 124.86 1n1h s ALA 624 Ca 0.51 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.00 1n1h s ALA 624 Cb -0.10 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 20.00 1n1h s ALA 624 CO 0.43 -1.71 0.00 -1.13 0.00 0.00 0.00 175.76 173.35 1n1h n SER 625 N -3.38 0.00 -4.07 0.00 3.41 -0.30 -4.82 113.62 104.46 1n1h n SER 625 Ca 0.07 -0.04 -0.22 0.00 -0.26 0.00 0.00 58.87 58.42 1n1h n SER 625 Cb 0.59 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.38 1n1h n SER 625 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1n1h s ILE 626 N -2.95 1.06 0.16 -1.33 1.01 -1.26 -1.20 121.20 116.69 1n1h s ILE 626 Ca 0.00 -0.54 0.06 0.00 0.00 0.00 0.00 60.65 60.17 1n1h s ILE 626 Cb 0.00 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.51 1n1h s ILE 626 CO 0.00 0.31 -0.12 0.54 0.00 0.00 0.00 174.94 175.67 1n1h s VAL 627 N -0.06 1.37 0.19 2.92 0.11 -0.63 -4.92 120.40 119.39 1n1h s VAL 627 Ca 0.00 -2.05 -0.30 0.00 -2.93 0.00 0.00 61.98 56.70 1n1h s VAL 627 Cb -0.08 -1.86 -0.08 0.00 -1.53 0.00 0.00 36.38 32.83 1n1h s VAL 627 CO 0.00 -0.65 1.12 0.21 -3.33 0.00 0.00 175.10 172.46 1n1h s ASN 628 N -3.10 7.23 -0.11 3.54 3.84 -1.26 -0.26 114.94 124.81 1n1h s ASN 628 Ca 0.17 2.14 0.01 0.00 0.21 0.00 0.00 52.86 55.39 1n1h s ASN 628 Cb 0.00 -2.61 -0.01 0.00 -0.55 0.00 0.00 41.25 38.08 1n1h s ASN 628 CO 0.03 -0.25 -0.15 -0.62 -2.79 0.00 0.00 177.10 173.32 1n1h s ASP 629 N -0.14 3.82 0.00 -4.21 3.68 0.24 -0.96 116.67 119.10 1n1h s ASP 629 Ca 0.50 -0.36 0.15 0.00 2.13 0.00 0.00 52.55 54.97 1n1h s ASP 629 Cb -0.30 -1.47 0.25 0.00 -1.45 0.00 0.00 42.92 39.95 1n1h s ASP 629 CO 0.36 0.19 1.08 -0.62 0.13 0.00 0.00 175.17 176.31 1n1h n GLU 630 N 3.38 0.00 0.00 4.34 1.02 0.33 -2.43 120.64 127.28 1n1h n GLU 630 Ca -0.18 -1.55 0.00 0.00 -0.02 0.00 0.00 57.16 55.41 1n1h n GLU 630 Cb 0.53 -0.11 0.00 0.00 -0.02 0.00 0.00 31.44 31.83 1n1h n GLU 630 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1n1h n SER 631 N 0.29 0.00 -4.72 1.62 7.64 -1.21 -2.76 113.62 114.49 1n1h n SER 631 Ca 0.01 0.86 -0.33 0.00 1.01 0.00 0.00 58.87 60.43 1n1h n SER 631 Cb 0.96 -0.36 0.11 0.00 -1.01 0.00 0.00 64.21 63.91 1n1h n SER 631 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1n1h s VAL 632 N -2.45 2.45 0.09 0.44 1.01 -1.26 -2.06 120.40 118.62 1n1h s VAL 632 Ca 0.00 0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.86 1n1h s VAL 632 Cb 0.00 -2.56 -0.06 0.00 0.00 0.00 0.00 36.38 33.76 1n1h s VAL 632 CO 0.00 -0.15 1.07 -0.69 0.00 0.00 0.00 175.10 175.33 1n1h s VAL 633 N -2.35 4.27 0.00 2.92 1.01 -1.26 -4.05 120.40 120.93 1n1h s VAL 633 Ca 0.69 1.77 0.00 0.00 0.00 0.00 0.00 61.98 64.45 1n1h s VAL 633 Cb -0.25 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.00 1n1h s VAL 633 CO 0.50 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.43 1n1h n GLY 634 N 2.58 2.19 3.37 4.51 0.00 -1.26 -4.93 105.19 111.64 1n1h n GLY 634 Ca 0.05 -0.10 -0.58 0.00 0.00 0.00 0.00 46.02 45.39 1n1h n GLY 634 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1n1h n VAL 635 N 0.00 0.07 -3.68 1.61 0.31 -1.26 -4.91 118.33 110.46 1n1h n VAL 635 Ca 0.00 -0.07 -0.30 0.00 -0.01 0.00 0.00 64.34 63.96 1n1h n VAL 635 Cb 0.00 -0.84 -0.14 0.00 -0.91 0.00 0.00 33.84 31.94 1n1h n VAL 635 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1n1h s ARG 636 N 5.68 0.71 0.25 5.55 3.52 -1.26 -4.42 118.95 128.98 1n1h s ARG 636 Ca 1.15 -1.16 0.01 0.00 -0.13 0.00 0.00 55.73 55.60 1n1h s ARG 636 Cb -1.31 -1.87 -0.00 0.00 -1.56 0.00 0.00 34.95 30.21 1n1h s ARG 636 CO 0.63 -1.03 0.03 0.00 -0.81 0.00 0.00 175.30 174.11 1n1h n ALA 637 N 4.65 0.26 -2.90 6.12 0.00 -1.02 -4.93 120.51 122.69 1n1h n ALA 637 Ca 0.00 -1.18 -0.30 0.00 0.00 0.00 0.00 53.44 51.96 1n1h n ALA 637 Cb 0.40 0.69 -0.04 0.00 0.00 0.00 0.00 19.45 20.51 1n1h n ALA 637 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1h s ALA 638 N -2.51 3.94 -0.07 0.00 0.00 -1.26 0.82 121.76 122.68 1n1h s ALA 638 Ca 0.04 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.12 1n1h s ALA 638 Cb 0.00 -1.77 0.02 0.00 0.00 0.00 0.00 23.12 21.37 1n1h s ALA 638 CO 0.03 0.78 -0.10 0.50 0.00 0.00 0.00 175.76 176.96 1n1h s ARG 639 N -2.59 1.56 -0.40 0.00 3.52 0.64 -4.84 118.95 116.83 1n1h s ARG 639 Ca 0.34 -0.34 -0.29 0.00 -0.13 0.00 0.00 55.73 55.32 1n1h s ARG 639 Cb -0.13 -1.39 0.01 0.00 -1.56 0.00 0.00 34.95 31.89 1n1h s ARG 639 CO 0.27 -0.06 1.40 -2.14 -0.81 0.00 0.00 175.30 173.96 1n1h s PRO 640 N 0.96 3.61 0.12 5.12 0.02 -1.26 -1.61 135.00 141.95 1n1h s PRO 640 Ca -0.09 0.95 0.05 0.00 0.02 0.00 0.00 61.00 61.93 1n1h s PRO 640 Cb -0.15 -4.01 -0.04 0.00 0.02 0.00 0.00 34.50 30.32 1n1h s PRO 640 CO 0.00 -1.53 0.03 0.96 -0.33 0.00 0.00 177.00 176.14 1n1h s ILE 641 N 5.32 4.12 0.66 2.83 -4.36 -0.34 -4.95 121.20 124.48 1n1h s ILE 641 Ca 0.60 -1.05 -0.11 0.00 -0.26 0.00 0.00 60.65 59.83 1n1h s ILE 641 Cb -0.14 -3.01 -0.02 0.00 1.25 0.00 0.00 42.46 40.55 1n1h s ILE 641 CO 0.32 0.04 1.06 -0.94 0.24 0.00 0.00 174.94 175.66 1n1h s SER 642 N -2.57 5.87 0.29 4.36 1.04 -1.26 -1.14 113.70 120.28 1n1h s SER 642 Ca 0.27 1.31 0.03 0.00 0.48 0.00 0.00 55.95 58.04 1n1h s SER 642 Cb -0.11 -2.25 0.64 0.00 0.10 0.00 0.00 66.02 64.40 1n1h s SER 642 CO 0.20 -1.09 1.80 1.23 0.98 0.00 0.00 173.24 176.36 1n1h h GLY 643 N -0.47 1.69 0.94 7.32 0.00 -1.08 0.43 103.07 111.89 1n1h h GLY 643 Ca -0.44 -0.38 0.02 0.00 0.00 0.00 0.00 47.33 46.53 1n1h h GLY 643 CO 0.63 0.04 0.57 1.98 0.00 0.00 0.00 176.54 179.75 1n1h h MET 644 N 0.85 1.09 -0.10 4.80 1.85 -1.84 -1.42 114.93 120.17 1n1h h MET 644 Ca 0.53 -0.07 -0.14 0.00 -0.61 0.00 0.00 59.70 59.42 1n1h h MET 644 Cb 0.69 -0.25 -0.01 0.00 0.43 0.00 0.00 31.60 32.47 1n1h h MET 644 CO -0.33 0.72 -0.54 1.96 -0.40 0.00 0.00 176.91 178.33 1n1h h GLN 645 N 1.13 0.28 -0.19 0.39 4.20 -0.95 -2.66 115.11 117.31 1n1h h GLN 645 Ca 0.33 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.84 1n1h h GLN 645 Cb -0.06 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1n1h h GLN 645 CO -0.09 0.75 -0.01 -0.97 -0.67 0.00 0.00 178.83 177.83 1n1h h ASN 646 N 0.22 0.25 0.33 1.46 -1.24 0.67 0.48 115.58 117.76 1n1h h ASN 646 Ca 0.00 -0.03 -0.02 0.00 0.71 0.00 0.00 56.30 56.96 1n1h h ASN 646 Cb 1.02 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 40.01 1n1h h ASN 646 CO 0.09 0.32 -0.16 0.24 -1.29 0.00 0.00 177.43 176.62 1n1h h MET 647 N 0.27 -0.43 -0.92 6.67 2.86 -0.95 -1.71 114.93 120.72 1n1h h MET 647 Ca 0.06 0.03 0.11 0.00 -2.06 0.00 0.00 59.70 57.84 1n1h h MET 647 Cb 0.21 0.10 -0.08 0.00 0.06 0.00 0.00 31.60 31.89 1n1h h MET 647 CO 0.01 -0.14 0.55 0.82 1.06 0.00 0.00 176.91 179.21 1n1h h ILE 648 N -0.72 0.91 -0.22 -1.22 1.08 -1.40 0.23 117.51 116.16 1n1h h ILE 648 Ca -0.05 -0.31 0.05 0.00 -0.39 0.00 0.00 64.86 64.17 1n1h h ILE 648 Cb 0.50 -0.06 -0.06 0.00 -3.07 0.00 0.00 36.82 34.13 1n1h h ILE 648 CO 0.08 0.16 -0.15 -0.61 -0.69 0.00 0.00 178.15 176.94 1n1h h GLN 649 N 0.89 -0.14 -0.17 2.37 5.75 -0.68 0.43 115.11 123.55 1n1h h GLN 649 Ca 0.45 0.01 -0.18 0.00 -0.15 0.00 0.00 58.65 58.78 1n1h h GLN 649 Cb 0.43 0.03 -0.00 0.00 1.07 0.00 0.00 27.48 29.01 1n1h h GLN 649 CO -0.26 -0.09 -0.63 0.45 -2.65 0.00 0.00 178.83 175.65 1n1h h HIS 650 N -0.15 0.80 -0.64 3.99 3.86 -0.27 -2.99 115.15 119.76 1n1h h HIS 650 Ca 0.13 -0.31 -0.09 0.00 -1.16 0.00 0.00 60.37 58.94 1n1h h HIS 650 Cb 0.34 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.64 1n1h h HIS 650 CO -0.31 1.08 0.04 1.25 0.86 0.00 0.00 177.93 180.85 1n1h h LEU 651 N 0.45 1.07 -1.59 2.43 5.85 -0.23 -2.36 115.31 120.93 1n1h h LEU 651 Ca -0.01 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 1n1h h LEU 651 Cb 1.20 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 1n1h h LEU 651 CO 0.12 1.09 0.08 0.28 -0.34 0.00 0.00 178.44 179.67 1n1h h SER 652 N 1.01 0.31 -0.38 1.25 0.02 -0.14 0.23 113.55 115.85 1n1h h SER 652 Ca 0.19 -0.03 -0.12 0.00 -0.84 0.00 0.00 61.79 60.99 1n1h h SER 652 Cb 0.52 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 1n1h h SER 652 CO 0.02 0.31 -0.24 0.50 -1.14 0.00 0.00 176.83 176.28 1n1h h LYS 653 N 0.35 0.84 -0.20 3.45 3.64 -1.28 -1.34 116.57 122.02 1n1h h LYS 653 Ca 0.09 -0.39 -0.10 0.00 -1.27 0.00 0.00 60.65 58.97 1n1h h LYS 653 Cb 0.11 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1n1h h LYS 653 CO -0.01 1.03 -0.27 1.25 -2.27 0.00 0.00 179.45 179.19 1n1h h LEU 654 N 0.64 0.59 -1.85 5.20 5.85 -0.87 -1.83 115.31 123.05 1n1h h LEU 654 Ca 0.08 -0.50 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 1n1h h LEU 654 Cb 0.81 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 1n1h h LEU 654 CO 0.07 0.98 -0.01 1.88 -0.34 0.00 0.00 178.44 181.01 1n1h h TYR 655 N 0.21 0.08 -0.00 1.25 0.05 -0.56 -0.63 116.97 117.37 1n1h h TYR 655 Ca 0.02 -0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 1n1h h TYR 655 Cb 0.84 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.55 1n1h h TYR 655 CO 0.08 0.09 -0.09 0.87 -1.05 0.00 0.00 178.16 178.07 1n1h h LYS 656 N 0.08 0.07 -0.27 4.88 1.57 -1.09 -3.35 116.57 118.46 1n1h h LYS 656 Ca 0.02 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1n1h h LYS 656 Cb 0.07 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1n1h h LYS 656 CO 0.00 0.81 0.02 -0.09 -0.57 0.00 0.00 179.45 179.62 1n1h h ARG 657 N -0.64 0.47 0.00 3.15 2.43 -1.17 -3.50 114.38 115.13 1n1h h ARG 657 Ca -0.01 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1n1h h ARG 657 Cb 0.84 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1n1h h ARG 657 CO 0.02 0.62 0.00 0.41 -1.51 0.00 0.00 179.97 179.51 1n1h n GLY 658 N -0.37 -0.37 3.39 2.80 0.00 -0.26 -4.91 105.19 105.48 1n1h n GLY 658 Ca -0.03 -2.24 -0.33 0.00 0.00 0.00 0.00 46.02 43.42 1n1h n GLY 658 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1n1h s PHE 659 N -0.16 2.71 -0.80 1.61 0.08 0.22 -4.82 117.98 116.83 1n1h s PHE 659 Ca 0.00 -0.48 -0.19 0.00 0.12 0.00 0.00 56.93 56.38 1n1h s PHE 659 Cb 0.00 -1.72 0.12 0.00 -0.57 0.00 0.00 43.02 40.84 1n1h s PHE 659 CO 0.00 -0.06 0.99 -1.12 -0.10 0.00 0.00 175.22 174.92 1n1h s SER 660 N -0.14 6.45 -0.36 1.36 0.01 -1.26 -0.98 113.70 118.78 1n1h s SER 660 Ca -0.02 -1.72 -0.27 0.00 1.31 0.00 0.00 55.95 55.25 1n1h s SER 660 Cb -0.14 -2.37 0.02 0.00 0.21 0.00 0.00 66.02 63.74 1n1h s SER 660 CO 0.04 -1.13 0.97 -0.47 0.41 0.00 0.00 173.24 173.06 1n1h s TYR 661 N 2.85 3.09 -0.33 2.43 5.04 0.18 -0.32 117.35 130.29 1n1h s TYR 661 Ca 0.25 0.90 -0.22 0.00 -2.44 0.00 0.00 57.07 55.56 1n1h s TYR 661 Cb -0.12 -3.68 0.00 0.00 0.35 0.00 0.00 41.96 38.51 1n1h s TYR 661 CO -0.02 -0.82 0.72 0.50 -1.34 0.00 0.00 175.55 174.59 1n1h s ARG 662 N 3.56 3.85 -0.40 4.97 3.52 0.28 -0.07 118.95 134.65 1n1h s ARG 662 Ca 0.41 0.35 -0.10 0.00 -0.13 0.00 0.00 55.73 56.26 1n1h s ARG 662 Cb -0.12 -3.76 0.06 0.00 -1.56 0.00 0.00 34.95 29.57 1n1h s ARG 662 CO 0.18 -0.70 0.24 0.08 -0.81 0.00 0.00 175.30 174.28 1n1h s VAL 663 N 2.86 4.30 -0.70 7.11 1.01 0.24 -2.92 120.40 132.30 1n1h s VAL 663 Ca 0.29 -1.24 -0.06 0.00 0.00 0.00 0.00 61.98 60.96 1n1h s VAL 663 Cb -0.14 -3.56 0.18 0.00 0.00 0.00 0.00 36.38 32.86 1n1h s VAL 663 CO 0.14 -0.42 0.55 0.20 0.00 0.00 0.00 175.10 175.57 1n1h s ASN 664 N 1.94 5.73 -0.96 3.32 0.01 -1.26 -2.27 114.94 121.44 1n1h s ASN 664 Ca 0.02 -2.83 -0.24 0.00 -0.71 0.00 0.00 52.86 49.11 1n1h s ASN 664 Cb -0.22 -1.97 0.04 0.00 0.41 0.00 0.00 41.25 39.51 1n1h s ASN 664 CO 0.03 -0.43 1.44 -0.62 -1.51 0.00 0.00 177.10 176.01 1n1h s ASP 665 N 1.13 6.38 0.13 -1.22 -1.08 -1.04 -4.86 116.67 116.11 1n1h s ASP 665 Ca 0.17 -1.21 0.14 0.00 -0.52 0.00 0.00 52.55 51.13 1n1h s ASP 665 Cb -0.17 -2.57 0.64 0.00 -1.46 0.00 0.00 42.92 39.37 1n1h s ASP 665 CO -0.05 -1.62 1.42 -1.54 0.52 0.00 0.00 175.17 173.90 1n1h n SER 666 N 9.19 0.28 -0.02 -0.34 3.41 -1.26 -2.32 113.62 122.56 1n1h n SER 666 Ca 0.27 0.60 -0.13 0.00 -0.26 0.00 0.00 58.87 59.36 1n1h n SER 666 Cb 0.50 -0.65 -0.14 0.00 -0.26 0.00 0.00 64.21 63.67 1n1h n SER 666 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1n1h n PHE 667 N -1.84 1.06 -3.52 7.33 3.72 -1.26 -4.70 117.46 118.24 1n1h n PHE 667 Ca 0.01 0.32 -0.42 0.00 -0.05 0.00 0.00 57.45 57.32 1n1h n PHE 667 Cb 0.10 -1.17 -0.07 0.00 -0.94 0.00 0.00 39.48 37.39 1n1h n PHE 667 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1n1h s SER 668 N -6.38 5.84 0.13 4.37 0.01 -0.98 -3.82 113.70 112.86 1n1h s SER 668 Ca -0.11 -2.19 -0.35 0.00 1.31 0.00 0.00 55.95 54.62 1n1h s SER 668 Cb 0.07 -2.03 -0.16 0.00 0.21 0.00 0.00 66.02 64.11 1n1h s SER 668 CO 0.81 -0.63 1.32 -2.65 0.41 0.00 0.00 173.24 172.49 1n1h n PRO 669 N 4.55 1.29 -0.92 12.44 -0.02 -1.26 -1.25 135.00 149.83 1n1h n PRO 669 Ca -0.02 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1n1h n PRO 669 Cb 0.41 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1n1h n PRO 669 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n1h n GLY 670 N 2.45 0.82 3.12 -1.23 0.00 -1.26 -4.75 105.19 104.33 1n1h n GLY 670 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1n1h n GLY 670 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1n1h n ASN 671 N 0.00 5.62 -4.25 1.61 5.03 -0.38 -4.77 115.26 118.11 1n1h n ASN 671 Ca 0.00 -3.16 -0.33 0.00 0.87 0.00 0.00 54.58 51.96 1n1h n ASN 671 Cb 0.00 -1.41 -0.15 0.00 -1.02 0.00 0.00 39.78 37.19 1n1h n ASN 671 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1n1h s ASP 672 N 0.53 3.59 -0.19 6.41 1.01 -1.26 -2.49 116.67 124.27 1n1h s ASP 672 Ca 0.36 -0.49 -0.30 0.00 0.71 0.00 0.00 52.55 52.83 1n1h s ASP 672 Cb 0.02 -1.55 0.15 0.00 1.01 0.00 0.00 42.92 42.55 1n1h s ASP 672 CO 0.02 0.08 1.11 0.72 0.21 0.00 0.00 175.17 177.31 1n1h s PHE 673 N 0.84 -0.26 -0.20 4.23 -0.12 -0.96 -5.03 117.98 116.48 1n1h s PHE 673 Ca -0.05 0.42 -0.08 0.00 -0.05 0.00 0.00 56.93 57.17 1n1h s PHE 673 Cb -0.15 0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 42.66 1n1h s PHE 673 CO -0.01 -0.25 0.08 0.99 -0.05 0.00 0.00 175.22 175.99 1n1h s THR 674 N -1.21 4.88 -0.10 -4.49 2.01 -1.26 -0.59 115.64 114.88 1n1h s THR 674 Ca 0.02 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.04 1n1h s THR 674 Cb -0.01 -3.22 -0.01 0.00 0.01 0.00 0.00 72.50 69.27 1n1h s THR 674 CO -0.02 0.43 -0.16 -2.28 -0.69 0.00 0.00 174.62 171.90 1n1h s HIS 675 N 0.59 2.72 -0.13 4.92 2.46 0.90 -4.94 115.29 121.82 1n1h s HIS 675 Ca 0.04 -0.61 -0.12 0.00 0.47 0.00 0.00 55.06 54.85 1n1h s HIS 675 Cb -0.13 -1.76 -0.05 0.00 -0.13 0.00 0.00 32.58 30.52 1n1h s HIS 675 CO 0.01 -0.16 0.25 1.41 -2.47 0.00 0.00 174.74 173.78 1n1h s MET 676 N 0.08 3.98 0.01 2.88 1.75 -1.26 0.50 119.30 127.24 1n1h s MET 676 Ca -0.07 0.04 -0.00 0.00 -1.25 0.00 0.00 55.69 54.41 1n1h s MET 676 Cb -0.15 -3.33 -0.01 0.00 2.84 0.00 0.00 34.83 34.18 1n1h s MET 676 CO 0.05 0.47 -0.02 -0.08 -0.65 0.00 0.00 175.02 174.79 1n1h s THR 677 N -0.21 0.09 -2.09 10.11 -1.32 -0.15 -4.94 115.64 117.12 1n1h s THR 677 Ca 0.16 -0.71 0.21 0.00 -1.21 0.00 0.00 61.69 60.14 1n1h s THR 677 Cb -0.13 -0.21 0.55 0.00 -1.51 0.00 0.00 72.50 71.19 1n1h s THR 677 CO 0.05 -0.39 1.47 0.35 -2.21 0.00 0.00 174.62 173.89 1n1h n THR 678 N 1.91 0.79 -2.15 5.08 -2.24 -1.26 -0.61 114.28 115.79 1n1h n THR 678 Ca -0.21 -0.83 -0.34 0.00 -2.27 0.00 0.00 64.05 60.39 1n1h n THR 678 Cb 0.56 0.52 0.01 0.00 -2.10 0.00 0.00 70.33 69.32 1n1h n THR 678 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1n1h s THR 679 N -1.21 3.23 0.42 4.28 2.01 -1.26 -4.68 115.64 118.43 1n1h s THR 679 Ca 0.43 0.71 -0.23 0.00 0.31 0.00 0.00 61.69 62.91 1n1h s THR 679 Cb 0.23 -3.26 -0.09 0.00 0.01 0.00 0.00 72.50 69.39 1n1h s THR 679 CO 0.30 -0.21 1.08 0.12 -0.69 0.00 0.00 174.62 175.21 1n1h s PHE 680 N -1.93 3.15 0.22 4.92 5.36 0.17 -4.82 117.98 125.05 1n1h s PHE 680 Ca 0.71 1.61 -0.30 0.00 -0.96 0.00 0.00 56.93 57.99 1n1h s PHE 680 Cb -0.23 -3.18 -0.08 0.00 -0.34 0.00 0.00 43.02 39.19 1n1h s PHE 680 CO 0.30 -0.86 1.07 -2.14 -1.46 0.00 0.00 175.22 172.14 1n1h s PRO 681 N -2.61 4.65 -0.14 10.12 0.02 -1.26 -4.86 135.00 140.91 1n1h s PRO 681 Ca 0.60 1.71 0.06 0.00 0.02 0.00 0.00 61.00 63.38 1n1h s PRO 681 Cb -0.23 -3.25 -0.23 0.00 0.02 0.00 0.00 34.50 30.80 1n1h s PRO 681 CO 0.29 0.18 0.27 0.43 -0.33 0.00 0.00 177.00 177.84 1n1h n SER 682 N 1.90 1.31 -0.16 2.53 7.64 -1.26 -4.06 113.62 121.52 1n1h n SER 682 Ca 0.01 0.16 0.00 0.00 1.01 0.00 0.00 58.87 60.04 1n1h n SER 682 Cb 0.46 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1n1h n SER 682 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n1h n GLY 683 N 1.87 -0.16 3.79 0.23 0.00 -1.04 -4.71 105.19 105.18 1n1h n GLY 683 Ca -0.31 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.34 1n1h n GLY 683 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n1h s SER 684 N -0.97 7.25 0.00 1.61 0.15 -1.26 -4.41 113.70 116.07 1n1h s SER 684 Ca 0.00 1.58 0.09 0.00 0.70 0.00 0.00 55.95 58.32 1n1h s SER 684 Cb 0.00 -2.48 0.42 0.00 -1.71 0.00 0.00 66.02 62.26 1n1h s SER 684 CO 0.00 0.10 1.22 0.35 1.20 0.00 0.00 173.24 176.11 1n1h n THR 685 N 1.11 1.06 -0.00 6.45 -2.24 -1.26 -2.26 114.28 117.14 1n1h n THR 685 Ca -0.03 0.27 -0.20 0.00 -2.27 0.00 0.00 64.05 61.82 1n1h n THR 685 Cb 0.50 -1.11 -0.14 0.00 -2.10 0.00 0.00 70.33 67.47 1n1h n THR 685 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1n1h n ALA 686 N -1.38 0.98 -0.18 6.98 0.00 -1.26 -4.73 120.51 120.91 1n1h n ALA 686 Ca 0.03 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1n1h n ALA 686 Cb 0.09 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 18.85 1n1h n ALA 686 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1n1h n THR 687 N -3.41 0.00 0.15 0.00 -1.04 -0.96 -0.22 114.28 108.79 1n1h n THR 687 Ca -0.30 0.17 -0.16 0.00 -2.04 0.00 0.00 64.05 61.72 1n1h n THR 687 Cb 1.05 -0.26 -0.09 0.00 -1.82 0.00 0.00 70.33 69.20 1n1h n THR 687 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1n1h h SER 688 N 0.00 -1.46 -0.89 8.00 0.87 -1.85 -1.45 113.55 116.77 1n1h h SER 688 Ca 0.00 0.14 0.11 0.00 -1.23 0.00 0.00 61.79 60.82 1n1h h SER 688 Cb 0.00 0.52 -0.07 0.00 -0.44 0.00 0.00 62.40 62.42 1n1h h SER 688 CO 0.00 -0.55 0.57 0.00 -0.53 0.00 0.00 176.83 176.32 1n1h h THR 689 N -0.77 0.93 -0.12 2.23 1.03 -1.79 -1.87 112.91 112.55 1n1h h THR 689 Ca -0.02 -0.28 -0.12 0.00 -0.01 0.00 0.00 66.41 65.98 1n1h h THR 689 Cb 0.74 0.03 -0.01 0.00 -1.07 0.00 0.00 68.15 67.84 1n1h h THR 689 CO -0.22 0.15 -0.46 -0.08 -0.01 0.00 0.00 175.52 174.90 1n1h h GLU 690 N 0.82 0.29 0.02 0.00 4.22 -0.26 -2.20 114.58 117.46 1n1h h GLU 690 Ca 0.42 -0.15 -0.20 0.00 0.08 0.00 0.00 59.36 59.51 1n1h h GLU 690 Cb 0.50 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1n1h h GLU 690 CO -0.19 0.69 -0.92 0.45 -2.18 0.00 0.00 179.01 176.87 1n1h h HIS 691 N 0.23 0.22 -0.55 0.92 3.86 -0.59 -2.73 115.15 116.52 1n1h h HIS 691 Ca 0.01 -0.13 -0.10 0.00 -1.16 0.00 0.00 60.37 58.99 1n1h h HIS 691 Cb 0.90 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.33 1n1h h HIS 691 CO 0.02 0.98 -0.05 1.15 0.86 0.00 0.00 177.93 180.89 1n1h h THR 692 N 0.07 1.26 -0.21 2.45 2.02 -1.14 -2.01 112.91 115.35 1n1h h THR 692 Ca -0.04 -1.17 -0.06 0.00 0.77 0.00 0.00 66.41 65.91 1n1h h THR 692 Cb 1.58 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.87 1n1h h THR 692 CO 0.14 0.42 -0.09 0.00 0.37 0.00 0.00 175.52 176.35 1n1h h ALA 693 N 1.05 0.29 -0.65 6.16 0.00 -1.39 -2.82 119.26 121.91 1n1h h ALA 693 Ca 0.15 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1n1h h ALA 693 Cb 0.58 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1n1h h ALA 693 CO 0.04 0.12 0.10 -0.91 0.00 0.00 0.00 179.25 178.60 1n1h h ASN 694 N 0.14 1.03 -0.07 0.00 2.35 -1.47 -1.43 115.58 116.13 1n1h h ASN 694 Ca 0.05 -0.24 0.01 0.00 -0.55 0.00 0.00 56.30 55.57 1n1h h ASN 694 Cb 0.57 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.64 1n1h h ASN 694 CO 0.03 1.02 -0.21 -1.13 -1.65 0.00 0.00 177.43 175.49 1n1h h ASN 695 N 1.00 -0.67 -0.11 5.81 -0.73 -1.31 -0.11 115.58 119.46 1n1h h ASN 695 Ca 0.20 0.08 -0.02 0.00 1.87 0.00 0.00 56.30 58.43 1n1h h ASN 695 Cb 0.43 0.26 -0.01 0.00 0.27 0.00 0.00 38.32 39.28 1n1h h ASN 695 CO 0.01 -0.18 0.02 0.77 -0.37 0.00 0.00 177.43 177.69 1n1h h SER 696 N -0.21 0.23 -0.11 1.15 4.64 -1.47 -2.15 113.55 115.62 1n1h h SER 696 Ca 0.01 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 1n1h h SER 696 Cb 0.26 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1n1h h SER 696 CO -0.18 0.26 0.00 0.74 -0.87 0.00 0.00 176.83 176.79 1n1h h THR 697 N 0.26 1.25 -0.63 2.95 2.02 -0.83 -1.05 112.91 116.87 1n1h h THR 697 Ca 0.06 -0.79 -0.05 0.00 0.77 0.00 0.00 66.41 66.40 1n1h h THR 697 Cb 0.14 1.55 -0.03 0.00 -1.74 0.00 0.00 68.15 68.07 1n1h h THR 697 CO -0.00 0.23 0.18 0.24 0.37 0.00 0.00 175.52 176.54 1n1h h MET 698 N -0.07 0.96 -0.29 6.66 2.86 -0.73 -1.46 114.93 122.86 1n1h h MET 698 Ca 0.03 -0.19 -0.08 0.00 -2.06 0.00 0.00 59.70 57.40 1n1h h MET 698 Cb 0.35 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.84 1n1h h MET 698 CO 0.01 0.83 -0.14 1.98 1.06 0.00 0.00 176.91 180.65 1n1h h MET 699 N 0.93 0.50 0.10 1.72 -1.53 -1.30 -0.25 114.93 115.11 1n1h h MET 699 Ca 0.20 -0.15 -0.01 0.00 -3.44 0.00 0.00 59.70 56.31 1n1h h MET 699 Cb 0.29 -0.05 0.00 0.00 -0.55 0.00 0.00 31.60 31.29 1n1h h MET 699 CO -0.01 0.64 -0.05 1.49 0.14 0.00 0.00 176.91 179.12 1n1h h GLU 700 N 0.46 -0.13 -0.85 0.39 4.22 -0.78 -1.68 114.58 116.20 1n1h h GLU 700 Ca 0.08 0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.60 1n1h h GLU 700 Cb 0.52 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.74 1n1h h GLU 700 CO 0.03 0.18 0.56 1.15 -2.18 0.00 0.00 179.01 178.75 1n1h h THR 701 N -0.46 1.04 0.34 0.32 2.02 -0.99 0.18 112.91 115.35 1n1h h THR 701 Ca -0.01 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 1n1h h THR 701 Cb 0.38 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 1n1h h THR 701 CO 0.02 0.17 -0.16 0.15 0.37 0.00 0.00 175.52 176.07 1n1h h PHE 702 N 0.93 -0.42 -0.95 3.16 3.57 -0.93 0.29 116.94 122.59 1n1h h PHE 702 Ca 0.37 -0.01 0.21 0.00 3.53 0.00 0.00 57.97 62.07 1n1h h PHE 702 Cb 0.25 0.14 -0.08 0.00 2.79 0.00 0.00 35.95 39.05 1n1h h PHE 702 CO -0.00 -0.26 0.62 -0.07 -2.23 0.00 0.00 178.31 176.36 1n1h h LEU 703 N -0.57 0.48 0.13 0.59 3.38 -1.12 0.93 115.31 119.13 1n1h h LEU 703 Ca -0.05 0.06 -0.35 0.00 0.09 0.00 0.00 57.88 57.63 1n1h h LEU 703 Cb 0.35 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1n1h h LEU 703 CO 0.08 0.17 -1.90 0.74 0.09 0.00 0.00 178.44 177.62 1n1h h THR 704 N 0.47 0.73 0.00 0.22 2.02 -0.69 -3.42 112.91 112.25 1n1h h THR 704 Ca 0.51 -2.43 0.00 0.00 0.77 0.00 0.00 66.41 65.26 1n1h h THR 704 Cb 1.19 2.57 0.00 0.00 -1.74 0.00 0.00 68.15 70.16 1n1h h THR 704 CO -0.23 0.86 0.00 0.52 0.37 0.00 0.00 175.52 177.04 1n1h n VAL 705 N -3.47 0.00 -0.16 3.16 0.31 0.96 -4.76 118.33 114.37 1n1h n VAL 705 Ca -0.28 0.01 -0.10 0.00 -0.01 0.00 0.00 64.34 63.96 1n1h n VAL 705 Cb 1.05 -0.68 -0.07 0.00 -0.91 0.00 0.00 33.84 33.23 1n1h n VAL 705 CO 0.00 0.00 0.00 -0.25 -1.32 0.00 0.00 176.83 175.26 1n1h h TRP 706 N 0.00 -1.30 0.00 3.52 7.01 -1.38 -2.29 115.95 121.51 1n1h h TRP 706 Ca 0.00 0.07 0.00 0.00 2.11 0.00 0.00 58.89 61.07 1n1h h TRP 706 Cb 0.00 0.62 0.00 0.00 -2.10 0.00 0.00 29.16 27.68 1n1h h TRP 706 CO 0.00 -0.34 0.00 0.41 -2.79 0.00 0.00 178.44 175.72 1n1h n GLY 707 N -1.25 -3.17 0.41 2.65 0.00 0.31 -1.20 105.19 102.94 1n1h n GLY 707 Ca -0.02 0.59 0.27 0.00 0.00 0.00 0.00 46.02 46.87 1n1h n GLY 707 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n1h h PRO 708 N 0.00 0.28 0.00 1.61 0.11 -1.70 0.19 132.00 132.48 1n1h h PRO 708 Ca 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1n1h h PRO 708 Cb 0.00 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.05 1n1h h PRO 708 CO 0.00 0.18 0.00 0.93 -0.21 0.00 0.00 178.00 178.90 1n1h h GLU 709 N 0.28 0.00 -0.43 1.05 5.08 -0.57 -3.28 114.58 116.72 1n1h h GLU 709 Ca 0.69 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.05 1n1h h GLU 709 Cb 1.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.13 1n1h h GLU 709 CO -0.40 0.00 0.00 0.72 -1.00 0.00 0.00 179.01 178.33 1n1h n HIS 710 N -2.90 1.33 -3.60 4.33 8.25 0.66 -4.97 115.22 118.31 1n1h n HIS 710 Ca 0.03 -0.75 -0.12 0.00 -0.26 0.00 0.00 57.72 56.62 1n1h n HIS 710 Cb 0.40 -0.33 -0.06 0.00 1.12 0.00 0.00 29.99 31.11 1n1h n HIS 710 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1n1h s THR 711 N -2.44 0.00 -0.85 1.59 -1.32 -1.21 -5.02 115.64 106.39 1n1h s THR 711 Ca 0.46 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 61.02 1n1h s THR 711 Cb 0.34 -1.00 0.17 0.00 -1.51 0.00 0.00 72.50 70.50 1n1h s THR 711 CO 0.15 0.00 1.03 0.47 -2.21 0.00 0.00 174.62 174.06 1n1h n ASP 712 N 1.69 2.32 -4.60 8.08 9.92 -1.26 -4.82 116.55 127.89 1n1h n ASP 712 Ca -0.13 -1.75 -0.42 0.00 -0.53 0.00 0.00 54.79 51.96 1n1h n ASP 712 Cb 0.56 -0.11 -0.03 0.00 -0.64 0.00 0.00 41.12 40.91 1n1h n ASP 712 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1n1h s ASP 713 N -0.89 5.45 0.30 -2.24 -1.08 -1.26 -4.86 116.67 112.10 1n1h s ASP 713 Ca 0.15 1.68 0.05 0.00 -0.52 0.00 0.00 52.55 53.91 1n1h s ASP 713 Cb 0.08 -2.51 0.78 0.00 -1.46 0.00 0.00 42.92 39.81 1n1h s ASP 713 CO 0.12 -2.00 1.69 -0.65 0.52 0.00 0.00 175.17 174.85 1n1h h PRO 714 N 15.01 0.39 -0.05 4.34 0.11 -1.99 -0.89 132.00 148.91 1n1h h PRO 714 Ca -0.38 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.68 1n1h h PRO 714 Cb 1.23 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1n1h h PRO 714 CO 0.99 0.26 -0.07 -0.44 -0.21 0.00 0.00 178.00 178.53 1n1h h ASP 715 N 0.40 0.15 -0.84 -2.05 3.32 -1.99 -1.98 116.42 113.43 1n1h h ASP 715 Ca 0.59 -0.53 0.05 0.00 0.02 0.00 0.00 57.03 57.15 1n1h h ASP 715 Cb 1.14 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 40.60 1n1h h ASP 715 CO -0.54 0.65 0.55 0.58 -1.72 0.00 0.00 179.24 178.76 1n1h h VAL 716 N -0.34 1.10 -0.40 -1.35 2.07 -1.74 0.32 116.25 115.91 1n1h h VAL 716 Ca 0.01 -0.34 -0.10 0.00 0.82 0.00 0.00 66.70 67.08 1n1h h VAL 716 Cb 0.62 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1n1h h VAL 716 CO 0.02 0.18 -0.16 -0.07 0.02 0.00 0.00 177.57 177.55 1n1h h LEU 717 N 0.99 0.75 -0.01 2.57 3.38 -1.15 -1.13 115.31 120.71 1n1h h LEU 717 Ca 0.35 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1n1h h LEU 717 Cb 0.11 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1n1h h LEU 717 CO -0.11 0.92 -0.02 -0.09 0.09 0.00 0.00 178.44 179.22 1n1h h ARG 718 N 0.67 0.04 -0.49 1.13 2.43 -0.36 -0.28 114.38 117.51 1n1h h ARG 718 Ca 0.10 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.32 1n1h h ARG 718 Cb 0.65 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.14 1n1h h ARG 718 CO 0.05 0.58 0.16 1.25 -1.51 0.00 0.00 179.97 180.49 1n1h h LEU 719 N -0.50 0.13 -0.13 3.80 5.85 -0.41 -1.75 115.31 122.30 1n1h h LEU 719 Ca 0.00 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 1n1h h LEU 719 Cb 0.57 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1n1h h LEU 719 CO 0.00 0.10 0.07 -0.03 -0.34 0.00 0.00 178.44 178.25 1n1h h MET 720 N 0.32 0.18 -0.07 1.25 4.05 -1.18 -2.79 114.93 116.69 1n1h h MET 720 Ca 0.24 -0.02 0.02 0.00 -0.28 0.00 0.00 59.70 59.66 1n1h h MET 720 Cb 0.27 -0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.04 1n1h h MET 720 CO -0.26 0.20 0.06 -0.22 0.23 0.00 0.00 176.91 176.91 1n1h h LYS 721 N 0.12 0.00 -0.01 0.39 3.64 -0.54 0.07 116.57 120.23 1n1h h LYS 721 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1n1h h LYS 721 Cb 0.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1n1h h LYS 721 CO -0.01 0.00 0.00 -1.13 -2.27 0.00 0.00 179.45 176.04 1n1h n SER 722 N -4.33 0.51 -4.43 4.20 3.41 -0.70 -4.77 113.62 107.51 1n1h n SER 722 Ca -0.01 -1.22 -0.35 0.00 -0.26 0.00 0.00 58.87 57.03 1n1h n SER 722 Cb 0.16 -0.01 -0.13 0.00 -0.26 0.00 0.00 64.21 63.98 1n1h n SER 722 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1n1h s LEU 723 N -1.93 3.17 0.04 1.04 1.43 0.01 -4.96 118.68 117.48 1n1h s LEU 723 Ca 0.42 -0.23 0.08 0.00 -1.03 0.00 0.00 54.13 53.37 1n1h s LEU 723 Cb 0.21 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.60 1n1h s LEU 723 CO 0.34 0.07 -0.23 -0.89 0.23 0.00 0.00 176.35 175.87 1n1h s THR 724 N 0.99 1.83 -0.58 5.49 2.01 -1.26 -4.94 115.64 119.17 1n1h s THR 724 Ca 0.01 -1.27 0.24 0.00 0.31 0.00 0.00 61.69 60.98 1n1h s THR 724 Cb -0.14 -1.58 0.25 0.00 0.01 0.00 0.00 72.50 71.04 1n1h s THR 724 CO 0.01 0.26 1.72 2.30 -0.69 0.00 0.00 174.62 178.22 1n1h n ILE 725 N 1.82 0.76 0.82 1.82 -5.35 -1.26 -0.56 119.36 117.41 1n1h n ILE 725 Ca -0.17 0.11 0.12 0.00 -0.27 0.00 0.00 62.75 62.54 1n1h n ILE 725 Cb 0.53 -1.00 0.31 0.00 -1.74 0.00 0.00 39.64 37.73 1n1h n ILE 725 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1n1h n GLN 726 N -2.18 0.13 0.00 6.28 3.00 -1.26 -3.30 117.38 120.05 1n1h n GLN 726 Ca 0.03 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 1n1h n GLN 726 Cb 0.27 -1.59 0.00 0.00 0.00 0.00 0.00 30.24 28.92 1n1h n GLN 726 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1n1h n ARG 727 N -1.78 0.85 0.00 -1.09 1.74 -1.01 -4.71 116.66 110.65 1n1h n ARG 727 Ca 0.05 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.19 1n1h n ARG 727 Cb 0.38 -0.75 0.04 0.00 -1.02 0.00 0.00 32.46 31.11 1n1h n ARG 727 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1n1h n ASN 728 N -1.67 1.86 -3.84 0.55 3.02 0.28 -4.93 115.26 110.52 1n1h n ASN 728 Ca 0.00 -1.43 -0.30 0.00 -0.03 0.00 0.00 54.58 52.83 1n1h n ASN 728 Cb 0.25 0.15 -0.16 0.00 -0.61 0.00 0.00 39.78 39.41 1n1h n ASN 728 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1n1h s TYR 729 N -1.25 1.97 -0.10 3.10 5.04 -1.18 -0.95 117.35 123.98 1n1h s TYR 729 Ca 0.14 -1.61 -0.07 0.00 -2.44 0.00 0.00 57.07 53.08 1n1h s TYR 729 Cb 0.11 -1.57 -0.04 0.00 0.35 0.00 0.00 41.96 40.80 1n1h s TYR 729 CO 0.21 -0.77 0.17 0.08 -1.34 0.00 0.00 175.55 173.90 1n1h s VAL 730 N 1.54 5.46 0.04 3.14 1.01 -0.99 -4.22 120.40 126.38 1n1h s VAL 730 Ca 0.01 0.24 -0.25 0.00 0.00 0.00 0.00 61.98 61.98 1n1h s VAL 730 Cb -0.18 -3.44 0.06 0.00 0.00 0.00 0.00 36.38 32.82 1n1h s VAL 730 CO -0.12 0.59 0.58 0.00 0.00 0.00 0.00 175.10 176.15 1n1h s GLN 732 N -2.38 0.15 6.98 0.00 0.74 -0.73 -2.78 119.66 121.64 1n1h s GLN 732 Ca -0.06 0.68 0.00 0.00 0.05 0.00 0.00 55.36 56.03 1n1h s GLN 732 Cb -0.01 -0.18 0.00 0.00 1.10 0.00 0.00 33.01 33.93 1n1h s GLN 732 CO -0.01 -0.34 0.00 0.41 -0.55 0.00 0.00 175.29 174.81 1n1h n GLY 733 N 5.35 2.18 1.23 2.59 0.00 -1.26 -1.77 105.19 113.51 1n1h n GLY 733 Ca -0.06 -0.38 0.09 0.00 0.00 0.00 0.00 46.02 45.68 1n1h n GLY 733 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n1h n ASP 734 N 5.52 3.58 -4.75 1.61 5.75 -1.26 -3.43 116.55 123.57 1n1h n ASP 734 Ca 0.00 -2.14 -0.36 0.00 -0.01 0.00 0.00 54.79 52.28 1n1h n ASP 734 Cb 0.00 -0.46 -0.07 0.00 -1.03 0.00 0.00 41.12 39.56 1n1h n ASP 734 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1n1h s ASP 735 N -0.93 6.35 0.01 -1.12 1.11 -0.73 -2.60 116.67 118.75 1n1h s ASP 735 Ca 0.42 0.40 0.03 0.00 0.18 0.00 0.00 52.55 53.58 1n1h s ASP 735 Cb 0.24 -2.13 -0.01 0.00 1.07 0.00 0.00 42.92 42.08 1n1h s ASP 735 CO 0.25 0.18 -0.10 -0.83 1.18 0.00 0.00 175.17 175.85 1n1h s GLY 736 N 0.19 0.52 -0.28 0.21 0.00 0.53 -1.78 107.32 106.71 1n1h s GLY 736 Ca 0.13 -0.54 0.01 0.00 0.00 0.00 0.00 44.72 44.32 1n1h s GLY 736 CO 0.02 -0.51 0.01 -2.27 0.00 0.00 0.00 173.10 170.35 1n1h s LEU 737 N -0.65 3.00 -0.46 0.66 2.96 -0.11 -0.19 118.68 123.89 1n1h s LEU 737 Ca 0.01 -1.52 -0.22 0.00 -0.22 0.00 0.00 54.13 52.17 1n1h s LEU 737 Cb -0.05 -1.20 0.03 0.00 0.50 0.00 0.00 46.19 45.46 1n1h s LEU 737 CO 0.00 -0.32 0.75 -0.32 -1.32 0.00 0.00 176.35 175.15 1n1h s MET 738 N 1.34 3.36 -0.44 1.98 -2.45 -0.63 -2.35 119.30 120.10 1n1h s MET 738 Ca 0.02 -0.21 -0.16 0.00 -1.25 0.00 0.00 55.69 54.09 1n1h s MET 738 Cb -0.18 -3.96 0.04 0.00 1.25 0.00 0.00 34.83 31.98 1n1h s MET 738 CO -0.11 -1.12 0.37 0.42 1.05 0.00 0.00 175.02 175.62 1n1h s ILE 739 N 3.19 5.22 -0.55 10.11 1.01 -0.12 -1.09 121.20 138.97 1n1h s ILE 739 Ca 0.28 -0.79 -0.19 0.00 0.00 0.00 0.00 60.65 59.94 1n1h s ILE 739 Cb -0.13 -4.04 0.07 0.00 0.01 0.00 0.00 42.46 38.38 1n1h s ILE 739 CO 0.21 -0.45 0.68 -0.63 0.00 0.00 0.00 174.94 174.75 1n1h s ILE 740 N 1.75 4.81 0.57 2.92 1.09 0.90 -4.73 121.20 128.51 1n1h s ILE 740 Ca 0.06 -0.65 -0.21 0.00 -1.10 0.00 0.00 60.65 58.75 1n1h s ILE 740 Cb -0.21 -4.40 -0.04 0.00 -1.06 0.00 0.00 42.46 36.75 1n1h s ILE 740 CO 0.09 -0.97 1.35 -1.81 -0.10 0.00 0.00 174.94 173.50 1n1h s ASP 741 N 3.09 5.10 0.64 3.58 -0.00 -1.26 -1.75 116.67 126.07 1n1h s ASP 741 Ca 0.15 2.74 0.01 0.00 -0.00 0.00 0.00 52.55 55.45 1n1h s ASP 741 Cb -0.21 -2.63 0.08 0.00 -0.00 0.00 0.00 42.92 40.16 1n1h s ASP 741 CO 0.10 -1.69 0.89 -0.83 -0.00 0.00 0.00 175.17 173.64 1n1h s GLY 742 N -1.04 1.79 0.00 0.21 0.00 -1.23 -4.76 107.32 102.28 1n1h s GLY 742 Ca 0.74 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.89 1n1h s GLY 742 CO 0.46 -1.14 0.00 2.41 0.00 0.00 0.00 173.10 174.83 1n1h n THR 743 N -2.59 0.00 0.06 0.90 -1.04 0.02 -4.92 114.28 106.70 1n1h n THR 743 Ca 0.12 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.09 1n1h n THR 743 Cb 0.60 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 69.03 1n1h n THR 743 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1n1h h THR 744 N 0.59 1.06 0.00 12.58 2.02 -2.00 -3.08 112.91 124.08 1n1h h THR 744 Ca 0.00 -2.67 0.00 0.00 0.77 0.00 0.00 66.41 64.51 1n1h h THR 744 Cb 0.00 2.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.89 1n1h h THR 744 CO 0.00 0.61 0.00 0.00 0.37 0.00 0.00 175.52 176.50 1n1h n ALA 745 N -2.37 2.16 0.00 6.16 0.00 -1.26 -4.98 120.51 120.22 1n1h n ALA 745 Ca -0.05 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1n1h n ALA 745 Cb 0.89 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1n1h n ALA 745 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1h n GLY 746 N 0.27 -0.73 3.91 0.00 0.00 -1.17 -5.02 105.19 102.45 1n1h n GLY 746 Ca 0.13 -2.04 -0.27 0.00 0.00 0.00 0.00 46.02 43.84 1n1h n GLY 746 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n1h s LYS 747 N 0.00 3.36 0.36 1.61 -2.85 -1.26 -0.80 119.74 120.16 1n1h s LYS 747 Ca 0.00 0.18 -0.28 0.00 -1.00 0.00 0.00 55.97 54.87 1n1h s LYS 747 Cb 0.00 -2.32 -0.10 0.00 -2.06 0.00 0.00 37.83 33.35 1n1h s LYS 747 CO 0.00 -0.38 1.31 0.08 0.10 0.00 0.00 175.35 176.46 1n1h s VAL 748 N -2.85 2.66 0.04 1.79 1.01 -1.26 -4.91 120.40 116.88 1n1h s VAL 748 Ca 0.50 0.64 -0.37 0.00 0.00 0.00 0.00 61.98 62.75 1n1h s VAL 748 Cb -0.10 -3.40 -0.16 0.00 0.00 0.00 0.00 36.38 32.72 1n1h s VAL 748 CO 0.46 0.13 1.47 -3.20 0.00 0.00 0.00 175.10 173.95 1n1h n ASN 749 N 0.55 2.09 -0.29 3.32 5.15 -1.26 -4.89 115.26 119.93 1n1h n ASN 749 Ca 0.01 1.10 0.03 0.00 -0.60 0.00 0.00 54.58 55.12 1n1h n ASN 749 Cb 0.42 -1.23 0.23 0.00 -0.53 0.00 0.00 39.78 38.67 1n1h n ASN 749 CO 0.00 0.00 0.00 -1.28 1.40 0.00 0.00 177.26 177.38 1n1h h SER 750 N 5.39 0.92 0.11 1.20 0.87 -1.91 -2.36 113.55 117.77 1n1h h SER 750 Ca -0.47 -0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 59.96 1n1h h SER 750 Cb 1.32 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 63.06 1n1h h SER 750 CO 0.83 0.61 -0.43 -0.08 -0.53 0.00 0.00 176.83 177.24 1n1h h GLU 751 N 1.06 0.40 -0.21 2.24 4.81 -1.92 -0.21 114.58 120.75 1n1h h GLU 751 Ca 0.36 -0.20 -0.17 0.00 -0.13 0.00 0.00 59.36 59.22 1n1h h GLU 751 Cb 0.10 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 1n1h h GLU 751 CO -0.12 0.76 -0.57 1.15 -0.73 0.00 0.00 179.01 179.50 1n1h h THR 752 N 0.33 1.31 -0.20 0.32 2.02 -1.85 -1.54 112.91 113.30 1n1h h THR 752 Ca 0.03 -1.80 -0.03 0.00 0.77 0.00 0.00 66.41 65.38 1n1h h THR 752 Cb 0.89 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 69.05 1n1h h THR 752 CO 0.07 0.57 0.03 0.40 0.37 0.00 0.00 175.52 176.96 1n1h h ILE 753 N 0.50 1.23 -0.77 3.11 2.04 -1.25 -2.25 117.51 120.11 1n1h h ILE 753 Ca 0.01 -0.76 0.12 0.00 1.00 0.00 0.00 64.86 65.23 1n1h h ILE 753 Cb 1.14 1.34 -0.08 0.00 -0.74 0.00 0.00 36.82 38.47 1n1h h ILE 753 CO 0.11 0.23 0.37 1.56 0.00 0.00 0.00 178.15 180.43 1n1h h GLN 754 N 0.13 0.56 -0.25 2.37 1.08 -0.86 -0.85 115.11 117.28 1n1h h GLN 754 Ca 0.06 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1n1h h GLN 754 Cb 0.32 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.62 1n1h h GLN 754 CO 0.00 0.37 0.14 -0.91 -0.95 0.00 0.00 178.83 177.49 1n1h h ASN 755 N 0.57 0.31 0.04 1.46 2.35 -1.10 -2.84 115.58 116.37 1n1h h ASN 755 Ca 0.40 -0.07 0.03 0.00 -0.55 0.00 0.00 56.30 56.11 1n1h h ASN 755 Cb 0.53 -0.08 -0.05 0.00 0.05 0.00 0.00 38.32 38.77 1n1h h ASN 755 CO -0.33 0.29 -0.37 -0.78 -1.65 0.00 0.00 177.43 174.60 1n1h h ASP 756 N 0.30 -1.09 -0.45 5.81 1.82 -0.64 -2.70 116.42 119.47 1n1h h ASP 756 Ca 0.09 0.13 0.09 0.00 -0.39 0.00 0.00 57.03 56.95 1n1h h ASP 756 Cb 0.05 0.43 -0.09 0.00 0.68 0.00 0.00 39.33 40.39 1n1h h ASP 756 CO -0.02 -0.43 -0.15 -0.07 -1.61 0.00 0.00 179.24 176.96 1n1h h LEU 757 N -0.55 -0.55 -2.01 2.28 3.38 -1.13 -0.25 115.31 116.50 1n1h h LEU 757 Ca 0.05 0.15 0.13 0.00 0.09 0.00 0.00 57.88 58.29 1n1h h LEU 757 Cb 0.61 0.33 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 1n1h h LEU 757 CO -0.27 -0.19 0.32 -0.33 0.09 0.00 0.00 178.44 178.07 1n1h h GLU 758 N -0.05 0.00 -0.12 1.13 5.08 -1.24 0.17 114.58 119.55 1n1h h GLU 758 Ca 0.22 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.38 1n1h h GLU 758 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1n1h h GLU 758 CO -0.49 0.00 -0.72 -0.07 -1.00 0.00 0.00 179.01 176.72 1n1h h LEU 759 N 0.00 0.65 -0.55 1.33 3.38 -0.81 -2.23 115.31 117.09 1n1h h LEU 759 Ca 0.21 -0.42 -0.05 0.00 0.09 0.00 0.00 57.88 57.71 1n1h h LEU 759 Cb 0.86 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1n1h h LEU 759 CO -0.00 1.18 0.14 0.40 0.09 0.00 0.00 178.44 180.25 1n1h h ILE 760 N 0.38 1.24 0.30 1.22 2.04 -0.32 0.32 117.51 122.70 1n1h h ILE 760 Ca -0.03 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 64.96 1n1h h ILE 760 Cb 1.31 0.76 -0.00 0.00 -0.74 0.00 0.00 36.82 38.15 1n1h h ILE 760 CO 0.13 0.32 -0.17 -1.28 0.00 0.00 0.00 178.15 177.15 1n1h h SER 761 N 0.77 -0.43 -0.69 1.72 0.87 -1.15 -2.12 113.55 112.52 1n1h h SER 761 Ca 0.17 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.74 1n1h h SER 761 Cb 0.33 0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.38 1n1h h SER 761 CO 0.00 -0.28 0.39 0.11 -0.53 0.00 0.00 176.83 176.52 1n1h h LYS 762 N -0.45 0.97 -0.90 2.24 1.57 -1.22 -2.67 116.57 116.11 1n1h h LYS 762 Ca -0.03 -0.10 0.04 0.00 -1.87 0.00 0.00 60.65 58.69 1n1h h LYS 762 Cb 0.37 -0.20 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 1n1h h LYS 762 CO 0.04 0.70 0.58 -0.92 -0.57 0.00 0.00 179.45 179.28 1n1h h TYR 763 N 0.98 1.08 -0.41 -1.35 3.20 -0.04 -3.06 116.97 117.36 1n1h h TYR 763 Ca 0.25 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 62.05 1n1h h TYR 763 Cb 0.01 -0.36 -0.02 0.00 1.54 0.00 0.00 36.73 37.91 1n1h h TYR 763 CO 0.01 0.61 -0.14 0.78 -1.64 0.00 0.00 178.16 177.77 1n1h h GLY 764 N 1.10 0.83 0.91 1.82 0.00 -1.03 -2.85 103.07 103.86 1n1h h GLY 764 Ca 0.37 -0.64 0.15 0.00 0.00 0.00 0.00 47.33 47.20 1n1h h GLY 764 CO -0.13 0.59 0.40 0.83 0.00 0.00 0.00 176.54 178.23 1n1h h GLU 765 N 0.68 0.00 -0.03 4.80 5.08 -1.51 -0.38 114.58 123.22 1n1h h GLU 765 Ca 0.11 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1n1h h GLU 765 Cb 0.63 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 1n1h h GLU 765 CO 0.04 0.00 -0.05 0.93 -1.00 0.00 0.00 179.01 178.93 1n1h h GLU 766 N 0.00 0.04 0.00 2.33 5.08 -1.59 -1.85 114.58 118.59 1n1h h GLU 766 Ca 0.24 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1n1h h GLU 766 Cb 1.04 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.24 1n1h h GLU 766 CO -0.00 0.10 -0.32 1.97 -1.00 0.00 0.00 179.01 179.76 1n1h n PHE 767 N -4.45 0.00 -2.44 4.33 1.16 -0.29 -2.05 117.46 113.72 1n1h n PHE 767 Ca -0.02 -0.92 -0.05 0.00 -1.87 0.00 0.00 57.45 54.59 1n1h n PHE 767 Cb 0.15 -0.16 0.01 0.00 -1.61 0.00 0.00 39.48 37.87 1n1h n PHE 767 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1n1h n GLY 768 N -0.93 0.42 3.09 4.97 0.00 -0.91 -4.80 105.19 107.03 1n1h n GLY 768 Ca 0.13 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 1n1h n GLY 768 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1n1h s TRP 769 N -2.69 2.68 -0.64 1.61 0.52 -0.42 -4.57 118.94 115.43 1n1h s TRP 769 Ca 0.07 -1.63 -0.19 0.00 0.02 0.00 0.00 56.10 54.37 1n1h s TRP 769 Cb -0.03 -1.84 0.11 0.00 -1.15 0.00 0.00 33.47 30.56 1n1h s TRP 769 CO 0.09 -0.78 0.78 0.21 0.02 0.00 0.00 176.95 177.27 1n1h s LYS 770 N 1.32 3.13 0.10 4.98 2.20 -1.26 -3.51 119.74 126.69 1n1h s LYS 770 Ca 0.03 -1.34 -0.30 0.00 -0.36 0.00 0.00 55.97 54.00 1n1h s LYS 770 Cb -0.14 -4.32 -0.06 0.00 -1.51 0.00 0.00 37.83 31.79 1n1h s LYS 770 CO -0.11 -1.60 1.21 0.71 -0.36 0.00 0.00 175.35 175.20 1n1h s TYR 771 N 2.79 3.43 -0.85 4.03 2.02 -1.26 -1.56 117.35 125.94 1n1h s TYR 771 Ca 0.15 1.31 -0.09 0.00 -0.37 0.00 0.00 57.07 58.07 1n1h s TYR 771 Cb -0.21 -3.44 0.22 0.00 -0.40 0.00 0.00 41.96 38.13 1n1h s TYR 771 CO 0.05 -1.34 0.76 0.34 -1.57 0.00 0.00 175.55 173.79 1n1h s ASP 772 N 0.81 6.40 -0.07 2.29 -1.08 0.53 -4.92 116.67 120.63 1n1h s ASP 772 Ca 0.58 -3.07 -0.18 0.00 -0.52 0.00 0.00 52.55 49.36 1n1h s ASP 772 Cb -0.31 -2.08 -0.05 0.00 -1.46 0.00 0.00 42.92 39.02 1n1h s ASP 772 CO 0.31 -0.41 0.48 -0.63 0.52 0.00 0.00 175.17 175.44 1n1h s ILE 773 N -0.41 5.10 -0.12 4.11 1.01 -1.26 -1.81 121.20 127.82 1n1h s ILE 773 Ca 0.22 0.97 0.01 0.00 0.00 0.00 0.00 60.65 61.84 1n1h s ILE 773 Cb -0.12 -3.81 0.02 0.00 0.01 0.00 0.00 42.46 38.56 1n1h s ILE 773 CO -0.08 0.40 -0.12 0.00 0.00 0.00 0.00 174.94 175.14 1n1h s ALA 774 N 0.07 1.62 -0.44 9.38 0.00 -0.31 -4.98 121.76 127.09 1n1h s ALA 774 Ca 0.26 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.52 1n1h s ALA 774 Cb -0.16 -0.92 0.13 0.00 0.00 0.00 0.00 23.12 22.17 1n1h s ALA 774 CO 0.12 -0.27 0.23 -0.47 0.00 0.00 0.00 175.76 175.36 1n1h s TYR 775 N 1.36 2.09 -0.03 0.00 5.04 -1.26 -0.65 117.35 123.91 1n1h s TYR 775 Ca 0.00 -2.46 0.04 0.00 -2.44 0.00 0.00 57.07 52.22 1n1h s TYR 775 Cb -0.13 -1.98 0.06 0.00 0.35 0.00 0.00 41.96 40.26 1n1h s TYR 775 CO -0.07 -0.79 0.89 -0.40 -1.34 0.00 0.00 175.55 173.85 1n1h n ASP 776 N 3.60 1.08 0.00 4.32 5.68 -1.26 -4.31 116.55 125.65 1n1h n ASP 776 Ca 0.08 -1.95 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 1n1h n ASP 776 Cb 0.35 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 1n1h n ASP 776 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n1h n GLY 777 N -0.45 0.90 3.62 6.12 0.00 -1.26 -4.70 105.19 109.41 1n1h n GLY 777 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1n1h n GLY 777 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n1h s THR 778 N -3.42 3.41 -0.19 2.61 2.01 -1.26 -4.65 115.64 114.15 1n1h s THR 778 Ca 0.00 -1.71 -0.02 0.00 0.31 0.00 0.00 61.69 60.27 1n1h s THR 778 Cb 0.00 -2.75 -0.01 0.00 0.01 0.00 0.00 72.50 69.76 1n1h s THR 778 CO 0.00 -0.22 -0.09 0.00 -0.69 0.00 0.00 174.62 173.63 1n1h s ALA 779 N -1.96 2.70 -0.18 7.40 0.00 -0.57 -4.74 121.76 124.42 1n1h s ALA 779 Ca 0.28 -1.10 -0.03 0.00 0.00 0.00 0.00 51.96 51.11 1n1h s ALA 779 Cb -0.08 -1.50 0.06 0.00 0.00 0.00 0.00 23.12 21.60 1n1h s ALA 779 CO 0.18 -0.23 0.05 -2.00 0.00 0.00 0.00 175.76 173.75 1n1h s GLU 780 N 1.14 0.51 -0.03 0.00 2.12 -1.26 0.23 118.70 121.41 1n1h s GLU 780 Ca 0.01 -0.30 -0.00 0.00 0.36 0.00 0.00 54.97 55.04 1n1h s GLU 780 Cb -0.14 -1.96 0.03 0.00 0.26 0.00 0.00 34.13 32.32 1n1h s GLU 780 CO -0.02 -0.62 0.02 -0.47 -0.54 0.00 0.00 175.26 173.63 1n1h s TYR 781 N 1.93 0.24 -1.46 5.30 5.04 -1.00 -4.81 117.35 122.58 1n1h s TYR 781 Ca 0.00 0.07 -0.12 0.00 -2.44 0.00 0.00 57.07 54.58 1n1h s TYR 781 Cb -0.16 -0.43 0.05 0.00 0.35 0.00 0.00 41.96 41.76 1n1h s TYR 781 CO -0.08 -0.16 1.04 1.28 -1.34 0.00 0.00 175.55 176.29 1n1h n LEU 782 N 4.53 -2.85 -2.30 6.97 4.77 -1.26 -1.80 117.00 125.06 1n1h n LEU 782 Ca -0.19 -0.65 -0.19 0.00 -0.03 0.00 0.00 56.01 54.94 1n1h n LEU 782 Cb 0.50 -2.75 0.00 0.00 -2.33 0.00 0.00 43.42 38.84 1n1h n LEU 782 CO 0.17 0.52 -0.19 0.29 -1.33 0.00 0.00 177.39 176.86 1n1h n LYS 783 N -4.76 -2.19 -4.65 3.23 4.76 -1.26 -5.00 118.16 108.29 1n1h n LYS 783 Ca 0.02 0.90 -0.33 0.00 -2.87 0.00 0.00 58.31 56.03 1n1h n LYS 783 Cb 0.54 -5.48 -0.14 0.00 -1.84 0.00 0.00 35.03 28.11 1n1h n LYS 783 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1n1h s LEU 784 N -5.60 2.82 -0.16 -0.35 2.01 -0.74 -4.94 118.68 111.72 1n1h s LEU 784 Ca 0.06 -0.30 -0.04 0.00 0.01 0.00 0.00 54.13 53.86 1n1h s LEU 784 Cb -0.03 -1.65 -0.03 0.00 0.01 0.00 0.00 46.19 44.49 1n1h s LEU 784 CO 0.08 0.15 -0.02 -0.31 1.01 0.00 0.00 176.35 177.26 1n1h s TYR 785 N 0.43 3.06 0.11 0.29 2.02 -1.26 -2.37 117.35 119.64 1n1h s TYR 785 Ca -0.09 -0.25 0.06 0.00 -0.37 0.00 0.00 57.07 56.43 1n1h s TYR 785 Cb -0.15 -1.98 -0.04 0.00 -0.40 0.00 0.00 41.96 39.39 1n1h s TYR 785 CO 0.04 -0.02 -0.15 -0.06 -1.57 0.00 0.00 175.55 173.80 1n1h s PHE 786 N 0.40 1.43 -0.30 2.71 0.08 0.14 0.34 117.98 122.78 1n1h s PHE 786 Ca -0.03 -0.51 -0.12 0.00 0.12 0.00 0.00 56.93 56.39 1n1h s PHE 786 Cb -0.14 -0.76 0.12 0.00 -0.57 0.00 0.00 43.02 41.67 1n1h s PHE 786 CO 0.02 0.14 0.72 -1.50 -0.10 0.00 0.00 175.22 174.51 1n1h s ILE 787 N -1.81 -0.67 -1.40 0.64 2.07 -0.17 -1.51 121.20 118.35 1n1h s ILE 787 Ca 0.06 0.00 -0.05 0.00 -1.41 0.00 0.00 60.65 59.25 1n1h s ILE 787 Cb -0.07 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.55 1n1h s ILE 787 CO 0.03 0.00 0.44 0.49 -1.91 0.00 0.00 174.94 173.99 1n1h n PHE 788 N 5.05 -1.76 -0.32 3.50 3.01 -0.89 -0.04 117.46 126.01 1n1h n PHE 788 Ca -0.14 0.39 0.00 0.00 1.01 0.00 0.00 57.45 58.72 1n1h n PHE 788 Cb 0.52 -3.64 0.00 0.00 -0.01 0.00 0.00 39.48 36.35 1n1h n PHE 788 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1n1h n GLY 789 N -1.26 1.65 3.66 1.37 0.00 -1.20 -4.12 105.19 105.30 1n1h n GLY 789 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 1n1h n GLY 789 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1h s ARG 791 N 1.07 4.59 -0.42 0.00 3.52 -0.35 -1.00 118.95 126.37 1n1h s ARG 791 Ca 0.08 1.37 -0.08 0.00 -0.13 0.00 0.00 55.73 56.97 1n1h s ARG 791 Cb -0.14 -3.43 0.09 0.00 -1.56 0.00 0.00 34.95 29.92 1n1h s ARG 791 CO 0.05 0.07 0.26 0.42 -0.81 0.00 0.00 175.30 175.28 1n1h s ILE 792 N 0.59 4.00 0.42 4.11 -1.09 0.15 -1.46 121.20 127.92 1n1h s ILE 792 Ca 0.48 -1.60 -0.26 0.00 -2.23 0.00 0.00 60.65 57.04 1n1h s ILE 792 Cb -0.22 -3.53 -0.09 0.00 -1.58 0.00 0.00 42.46 37.05 1n1h s ILE 792 CO 0.28 -0.58 1.35 -2.84 -1.23 0.00 0.00 174.94 171.92 1n1h s PRO 793 N 1.35 3.90 -0.57 2.79 0.02 -1.26 -4.16 135.00 137.07 1n1h s PRO 793 Ca 0.04 2.27 -0.07 0.00 0.02 0.00 0.00 61.00 63.26 1n1h s PRO 793 Cb -0.24 -2.75 0.15 0.00 0.02 0.00 0.00 34.50 31.68 1n1h s PRO 793 CO 0.00 -0.59 0.42 1.21 -0.33 0.00 0.00 177.00 177.71 1n1h s ASN 794 N -0.62 5.64 0.35 2.53 3.84 -1.26 -4.80 114.94 120.63 1n1h s ASN 794 Ca 0.58 -2.37 0.09 0.00 0.21 0.00 0.00 52.86 51.36 1n1h s ASN 794 Cb -0.40 -1.96 0.67 0.00 -0.55 0.00 0.00 41.25 39.00 1n1h s ASN 794 CO 0.52 -0.55 1.84 -0.07 -2.79 0.00 0.00 177.10 176.06 1n1h h LEU 795 N 7.81 0.23 -2.33 3.21 4.07 -1.88 -2.97 115.31 123.45 1n1h h LEU 795 Ca -0.09 -0.06 0.03 0.00 0.08 0.00 0.00 57.88 57.84 1n1h h LEU 795 Cb 1.02 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.70 1n1h h LEU 795 CO 0.77 0.47 0.17 0.77 -1.08 0.00 0.00 178.44 179.55 1n1h h SER 796 N 0.22 0.00 0.12 -0.43 4.64 -1.72 -0.05 113.55 116.33 1n1h h SER 796 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1n1h h SER 796 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1n1h h SER 796 CO 0.04 0.00 -0.02 0.54 -0.87 0.00 0.00 176.83 176.51 1n1h n ARG 797 N -3.58 1.03 -3.10 4.77 1.74 -1.12 -4.14 116.66 112.25 1n1h n ARG 797 Ca 0.00 -0.25 -0.24 0.00 -0.77 0.00 0.00 57.85 56.59 1n1h n ARG 797 Cb 0.27 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.17 1n1h n ARG 797 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1n1h n HIS 798 N -0.77 2.60 -1.59 -1.55 8.25 -0.03 -4.97 115.22 117.16 1n1h n HIS 798 Ca 0.20 -3.94 -0.51 0.00 -0.26 0.00 0.00 57.72 53.21 1n1h n HIS 798 Cb 0.21 -0.47 -0.05 0.00 1.12 0.00 0.00 29.99 30.79 1n1h n HIS 798 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1n1h n PRO 799 N 0.19 1.22 0.16 -0.41 -0.02 -1.26 -4.86 135.00 130.02 1n1h n PRO 799 Ca 0.28 0.44 0.02 0.00 -2.02 0.00 0.00 63.50 62.23 1n1h n PRO 799 Cb 0.48 -2.06 0.21 0.00 -0.02 0.00 0.00 33.50 32.11 1n1h n PRO 799 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1n1h h ILE 800 N 3.20 1.08 0.00 4.25 2.04 -1.93 -3.29 117.51 122.87 1n1h h ILE 800 Ca -0.47 -1.93 0.00 0.00 1.00 0.00 0.00 64.86 63.46 1n1h h ILE 800 Cb 1.33 2.14 0.00 0.00 -0.74 0.00 0.00 36.82 39.55 1n1h h ILE 800 CO 0.77 0.50 -1.17 1.33 0.00 0.00 0.00 178.15 179.57 1n1h n VAL 801 N -3.53 0.00 -1.67 1.67 0.24 -1.26 -4.91 118.33 108.88 1n1h n VAL 801 Ca -0.00 -0.26 -0.32 0.00 -2.04 0.00 0.00 64.34 61.73 1n1h n VAL 801 Cb 0.61 0.52 0.05 0.00 -1.47 0.00 0.00 33.84 33.54 1n1h n VAL 801 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1n1h s GLY 802 N -2.90 1.86 -0.28 7.63 0.00 -1.24 0.13 107.32 112.53 1n1h s GLY 802 Ca -0.01 0.27 -0.18 0.00 0.00 0.00 0.00 44.72 44.79 1n1h s GLY 802 CO 0.49 0.59 0.81 1.25 0.00 0.00 0.00 173.10 176.24 1n1h s LYS 803 N -4.61 0.62 0.15 2.90 2.20 0.16 -4.24 119.74 116.92 1n1h s LYS 803 Ca 0.61 0.97 -0.30 0.00 -0.36 0.00 0.00 55.97 56.89 1n1h s LYS 803 Cb -0.16 0.18 -0.08 0.00 -1.51 0.00 0.00 37.83 36.26 1n1h s LYS 803 CO 0.48 -0.11 1.24 -2.00 -0.36 0.00 0.00 175.35 174.60 1n1h s GLU 804 N 1.20 4.44 -0.34 4.03 2.12 -1.26 -3.57 118.70 125.32 1n1h s GLU 804 Ca -0.07 1.91 0.00 0.00 0.36 0.00 0.00 54.97 57.17 1n1h s GLU 804 Cb -0.05 -3.25 0.14 0.00 0.26 0.00 0.00 34.13 31.23 1n1h s GLU 804 CO -0.14 -0.19 0.27 1.03 -0.54 0.00 0.00 175.26 175.69 1n1h s ARG 805 N 0.20 0.47 -0.10 4.30 0.52 -1.26 -5.02 118.95 118.06 1n1h s ARG 805 Ca 0.56 -0.82 -0.14 0.00 -0.52 0.00 0.00 55.73 54.81 1n1h s ARG 805 Cb -0.33 -0.96 -0.12 0.00 0.52 0.00 0.00 34.95 34.06 1n1h s ARG 805 CO 0.35 -1.14 0.47 0.00 0.02 0.00 0.00 175.30 175.00 1n1h h ALA 806 N 7.50 -0.09 -2.33 2.13 0.00 -1.94 -3.47 119.26 121.05 1n1h h ALA 806 Ca -0.02 -0.21 -0.50 0.00 0.00 0.00 0.00 54.91 54.18 1n1h h ALA 806 Cb 1.02 0.03 0.14 0.00 0.00 0.00 0.00 17.79 18.98 1n1h h ALA 806 CO 0.29 -0.10 0.29 0.54 0.00 0.00 0.00 179.25 180.26 1n1h s ASN 807 N -5.69 3.99 0.42 0.00 2.20 -1.26 -4.97 114.94 109.63 1n1h s ASN 807 Ca -0.09 1.60 0.22 0.00 -0.94 0.00 0.00 52.86 53.65 1n1h s ASN 807 Cb -0.01 -2.30 0.39 0.00 -2.00 0.00 0.00 41.25 37.33 1n1h s ASN 807 CO 0.33 -2.33 1.61 0.28 -2.94 0.00 0.00 177.10 174.06 1n1h h SER 808 N -1.33 0.00 -2.36 3.54 0.02 -2.01 -3.47 113.55 107.94 1n1h h SER 808 Ca -0.47 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 59.88 1n1h h SER 808 Cb 1.26 0.00 0.17 0.00 0.14 0.00 0.00 62.40 63.97 1n1h h SER 808 CO 0.54 0.11 -0.74 -1.54 -1.14 0.00 0.00 176.83 174.05 1n1h n SER 809 N -3.13 -2.21 -4.83 3.07 3.41 -1.26 -4.94 113.62 103.73 1n1h n SER 809 Ca 0.03 0.74 -0.31 0.00 -0.26 0.00 0.00 58.87 59.08 1n1h n SER 809 Cb 0.55 -1.01 0.06 0.00 -0.26 0.00 0.00 64.21 63.55 1n1h n SER 809 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n1h s ALA 810 N -1.78 2.65 0.79 7.33 0.00 -1.26 -5.03 121.76 124.46 1n1h s ALA 810 Ca 0.62 -0.09 -0.11 0.00 0.00 0.00 0.00 51.96 52.38 1n1h s ALA 810 Cb -0.51 -3.12 0.07 0.00 0.00 0.00 0.00 23.12 19.56 1n1h s ALA 810 CO 0.60 -1.28 1.12 -1.83 0.00 0.00 0.00 175.76 174.37 1n1h s GLU 811 N -5.14 1.99 0.47 0.00 -1.05 -1.26 -4.98 118.70 108.73 1n1h s GLU 811 Ca 0.58 1.35 -0.23 0.00 -0.15 0.00 0.00 54.97 56.52 1n1h s GLU 811 Cb -0.13 -1.85 -0.07 0.00 -0.44 0.00 0.00 34.13 31.64 1n1h s GLU 811 CO 0.54 -1.87 1.22 -1.21 0.95 0.00 0.00 175.26 174.89 1n1h s GLU 812 N -4.65 3.63 0.79 -4.83 2.02 -1.26 -4.96 118.70 109.45 1n1h s GLU 812 Ca 0.64 1.91 -0.15 0.00 0.02 0.00 0.00 54.97 57.39 1n1h s GLU 812 Cb -0.20 -2.40 -0.03 0.00 0.10 0.00 0.00 34.13 31.60 1n1h s GLU 812 CO 0.54 -0.69 0.40 -2.30 0.02 0.00 0.00 175.26 173.23 1n1h n PRO 813 N -0.56 0.13 0.00 0.39 -0.02 -1.26 -4.73 135.00 128.95 1n1h n PRO 813 Ca 0.08 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1n1h n PRO 813 Cb 0.47 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1n1h n PRO 813 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 1n1h n TRP 814 N -2.66 0.00 -0.06 6.00 -0.00 -1.26 -1.93 117.44 117.52 1n1h n TRP 814 Ca 0.08 0.00 0.02 0.00 -0.00 0.00 0.00 57.50 57.61 1n1h n TRP 814 Cb 0.51 0.00 0.05 0.00 -0.00 0.00 0.00 31.31 31.87 1n1h n TRP 814 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 1n1h n PRO 815 N -0.38 -0.02 -0.35 5.87 -0.02 -1.26 0.14 135.00 138.98 1n1h n PRO 815 Ca 0.00 0.28 0.29 0.00 -2.02 0.00 0.00 63.50 62.04 1n1h n PRO 815 Cb 0.00 -0.43 0.54 0.00 -0.02 0.00 0.00 33.50 33.59 1n1h n PRO 815 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1n1h h ALA 816 N 0.37 2.16 0.00 3.55 0.00 -1.30 0.14 119.26 124.18 1n1h h ALA 816 Ca 0.10 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1n1h h ALA 816 Cb 0.20 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1n1h h ALA 816 CO -0.18 -0.83 -0.08 0.97 0.00 0.00 0.00 179.25 179.14 1n1h h ILE 817 N 0.19 0.45 -0.39 0.00 6.09 -0.51 -2.66 117.51 120.69 1n1h h ILE 817 Ca 0.78 -0.40 -0.09 0.00 -1.37 0.00 0.00 64.86 63.78 1n1h h ILE 817 Cb 2.00 1.27 -0.02 0.00 0.47 0.00 0.00 36.82 40.54 1n1h h ILE 817 CO -0.61 0.08 -0.12 -0.07 -3.07 0.00 0.00 178.15 174.35 1n1h h LEU 818 N 0.00 0.68 -0.73 2.19 3.38 -0.90 -0.42 115.31 119.51 1n1h h LEU 818 Ca -0.00 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.68 1n1h h LEU 818 Cb 0.27 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1n1h h LEU 818 CO 0.01 0.83 -0.07 0.44 0.09 0.00 0.00 178.44 179.74 1n1h h ASP 819 N 0.63 0.89 -0.36 -0.43 3.32 -1.61 -1.59 116.42 117.27 1n1h h ASP 819 Ca 0.11 -0.26 -0.08 0.00 0.02 0.00 0.00 57.03 56.82 1n1h h ASP 819 Cb 0.57 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 1n1h h ASP 819 CO 0.04 0.98 -0.05 1.56 -1.72 0.00 0.00 179.24 180.05 1n1h h GLN 820 N 0.82 0.77 -0.31 3.56 4.20 -1.45 -1.44 115.11 121.27 1n1h h GLN 820 Ca 0.14 -0.23 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 1n1h h GLN 820 Cb 0.58 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1n1h h GLN 820 CO 0.04 0.81 -0.05 0.82 -0.67 0.00 0.00 178.83 179.78 1n1h h ILE 821 N 0.71 1.27 -0.94 2.54 1.08 -0.79 -2.33 117.51 119.05 1n1h h ILE 821 Ca 0.13 -1.06 -0.00 0.00 -0.39 0.00 0.00 64.86 63.54 1n1h h ILE 821 Cb 0.51 1.34 -0.05 0.00 -3.07 0.00 0.00 36.82 35.56 1n1h h ILE 821 CO 0.03 0.34 0.57 0.24 -0.69 0.00 0.00 178.15 178.64 1n1h h MET 822 N 0.35 1.27 -0.27 2.37 2.86 -1.07 -1.00 114.93 119.44 1n1h h MET 822 Ca 0.08 -0.11 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1n1h h MET 822 Cb 0.52 -0.27 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 1n1h h MET 822 CO 0.03 0.88 0.04 0.78 1.06 0.00 0.00 176.91 179.70 1n1h h GLY 823 N 1.30 0.42 1.05 8.32 0.00 -1.12 -1.29 103.07 111.75 1n1h h GLY 823 Ca 0.34 -0.21 -0.05 0.00 0.00 0.00 0.00 47.33 47.40 1n1h h GLY 823 CO -0.06 0.20 0.27 -2.08 0.00 0.00 0.00 176.54 174.87 1n1h h VAL 824 N 0.39 1.26 0.45 4.60 2.07 -0.64 -1.81 116.25 122.57 1n1h h VAL 824 Ca 0.09 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.73 1n1h h VAL 824 Cb 0.19 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1n1h h VAL 824 CO -0.00 0.34 -0.22 0.15 0.02 0.00 0.00 177.57 177.87 1n1h h PHE 825 N 1.12 -0.56 -0.61 1.57 3.57 -0.69 -2.50 116.94 118.83 1n1h h PHE 825 Ca 0.25 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.78 1n1h h PHE 825 Cb 0.26 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1n1h h PHE 825 CO 0.02 -0.30 0.40 0.74 -2.23 0.00 0.00 178.31 176.94 1n1h h PHE 826 N -0.69 0.65 -0.33 0.41 0.04 -1.28 0.03 116.94 115.77 1n1h h PHE 826 Ca -0.06 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.73 1n1h h PHE 826 Cb 0.51 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 38.42 1n1h h PHE 826 CO -0.03 0.37 0.21 -0.91 -0.60 0.00 0.00 178.31 177.35 1n1h h ASN 827 N 0.67 0.36 0.01 2.17 2.35 -1.20 0.59 115.58 120.53 1n1h h ASN 827 Ca 0.25 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1n1h h ASN 827 Cb 0.17 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.45 1n1h h ASN 827 CO -0.07 0.26 -0.01 1.23 -1.65 0.00 0.00 177.43 177.19 1n1h h GLY 828 N 0.43 0.00 0.09 2.83 0.00 -0.56 0.61 103.07 106.47 1n1h h GLY 828 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.45 1n1h h GLY 828 CO -0.03 0.00 -0.02 -2.08 0.00 0.00 0.00 176.54 174.41 1n1h h VAL 829 N 0.00 1.10 0.00 4.60 2.07 -0.43 -1.27 116.25 122.32 1n1h h VAL 829 Ca -0.00 -1.69 -0.01 0.00 0.82 0.00 0.00 66.70 65.82 1n1h h VAL 829 Cb 0.01 2.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1n1h h VAL 829 CO 0.00 0.35 -0.05 0.45 0.02 0.00 0.00 177.57 178.35 1n1h h HIS 830 N -0.95 0.00 -0.01 1.57 -0.00 -0.29 -1.76 115.15 113.70 1n1h h HIS 830 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1n1h h HIS 830 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.03 1n1h h HIS 830 CO 0.16 0.05 -0.11 -0.25 -0.00 0.00 0.00 177.93 177.78 1n1h n ASP 831 N -3.62 1.41 -1.06 2.45 8.00 0.21 -4.98 116.55 118.95 1n1h n ASP 831 Ca -0.02 -1.30 -0.08 0.00 0.71 0.00 0.00 54.79 54.09 1n1h n ASP 831 Cb 0.15 0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 1n1h n ASP 831 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n1h n GLY 832 N 1.25 0.08 3.64 0.44 0.00 -0.66 -4.86 105.19 105.07 1n1h n GLY 832 Ca 0.16 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1n1h n GLY 832 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1h s LEU 833 N -2.55 2.00 -0.10 0.99 1.43 -0.51 -4.54 118.68 115.40 1n1h s LEU 833 Ca 0.04 1.69 -0.29 0.00 -1.03 0.00 0.00 54.13 54.53 1n1h s LEU 833 Cb -0.02 -3.95 -0.06 0.00 0.03 0.00 0.00 46.19 42.19 1n1h s LEU 833 CO 0.04 -3.22 1.97 -1.10 0.23 0.00 0.00 176.35 174.28 1n1h s GLN 834 N -4.72 3.73 0.15 1.70 -1.52 -0.44 -4.89 119.66 113.67 1n1h s GLN 834 Ca 0.66 2.21 -0.27 0.00 -1.95 0.00 0.00 55.36 56.01 1n1h s GLN 834 Cb -0.21 -4.20 -0.00 0.00 -0.22 0.00 0.00 33.01 28.37 1n1h s GLN 834 CO 0.59 -1.41 1.58 0.11 -0.25 0.00 0.00 175.29 175.92 1n1h h TRP 835 N 12.09 -1.17 -0.36 0.91 5.08 -1.88 -0.21 115.95 130.42 1n1h h TRP 835 Ca -0.43 0.06 0.02 0.00 1.08 0.00 0.00 58.89 59.62 1n1h h TRP 835 Cb 1.22 0.56 -0.02 0.00 -3.00 0.00 0.00 29.16 27.91 1n1h h TRP 835 CO 0.94 -0.44 0.21 1.96 -1.28 0.00 0.00 178.44 179.83 1n1h h GLN 836 N -0.35 0.41 -0.73 0.12 4.20 -1.97 -0.60 115.11 116.20 1n1h h GLN 836 Ca 0.13 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 1n1h h GLN 836 Cb 0.58 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 1n1h h GLN 836 CO -0.52 0.27 0.35 0.00 -0.67 0.00 0.00 178.83 178.26 1n1h h ARG 837 N 0.42 1.03 -0.16 1.46 2.47 -1.81 -0.93 114.38 116.86 1n1h h ARG 837 Ca 0.14 -0.14 -0.08 0.00 -1.26 0.00 0.00 59.98 58.63 1n1h h ARG 837 Cb 0.01 -0.19 -0.00 0.00 -1.65 0.00 0.00 29.97 28.13 1n1h h ARG 837 CO -0.07 0.80 -0.23 2.35 0.56 0.00 0.00 179.97 183.38 1n1h h TRP 838 N 1.03 0.55 -0.57 3.04 -0.00 -0.77 -2.28 115.95 116.94 1n1h h TRP 838 Ca 0.25 -0.18 -0.03 0.00 -0.00 0.00 0.00 58.89 58.93 1n1h h TRP 838 Cb 0.11 -0.11 -0.03 0.00 -0.00 0.00 0.00 29.16 29.13 1n1h h TRP 838 CO 0.01 0.86 0.24 0.82 -0.00 0.00 0.00 178.44 180.37 1n1h h ILE 839 N 0.08 1.22 -0.38 2.65 2.04 -0.92 -1.07 117.51 121.13 1n1h h ILE 839 Ca 0.02 -0.66 -0.03 0.00 1.00 0.00 0.00 64.86 65.18 1n1h h ILE 839 Cb 0.79 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1n1h h ILE 839 CO 0.05 0.26 0.12 -0.09 0.00 0.00 0.00 178.15 178.49 1n1h h ARG 840 N 0.79 0.59 -0.69 2.37 2.43 -1.20 -1.97 114.38 116.70 1n1h h ARG 840 Ca 0.19 -0.13 -0.05 0.00 -0.81 0.00 0.00 59.98 59.18 1n1h h ARG 840 Cb 0.17 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 1n1h h ARG 840 CO -0.02 0.61 0.24 -0.92 -1.51 0.00 0.00 179.97 178.37 1n1h h TYR 841 N 0.47 1.06 -0.34 2.20 3.20 -1.26 -2.16 116.97 120.14 1n1h h TYR 841 Ca 0.12 -0.09 -0.04 0.00 3.14 0.00 0.00 58.73 61.86 1n1h h TYR 841 Cb 0.26 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 1n1h h TYR 841 CO 0.01 0.83 0.02 0.77 -1.64 0.00 0.00 178.16 178.16 1n1h h SER 842 N 1.01 0.49 0.16 -2.11 0.02 -0.98 0.33 113.55 112.47 1n1h h SER 842 Ca 0.23 -0.08 -0.12 0.00 -0.84 0.00 0.00 61.79 60.98 1n1h h SER 842 Cb 0.25 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1n1h h SER 842 CO -0.01 0.54 -0.43 -0.50 -1.14 0.00 0.00 176.83 175.29 1n1h h TRP 843 N 0.51 0.40 0.15 3.45 4.06 -0.87 0.18 115.95 123.82 1n1h h TRP 843 Ca 0.11 -0.11 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 1n1h h TRP 843 Cb 0.30 -0.09 0.00 0.00 -1.00 0.00 0.00 29.16 28.37 1n1h h TRP 843 CO 0.01 0.71 -0.07 0.00 -3.56 0.00 0.00 178.44 175.53 1n1h h ALA 844 N 1.28 -0.20 -0.57 1.49 0.00 -0.63 -1.33 119.26 119.31 1n1h h ALA 844 Ca 0.02 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.78 1n1h h ALA 844 Cb 0.87 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 1n1h h ALA 844 CO 0.07 -0.40 0.30 1.25 0.00 0.00 0.00 179.25 180.47 1n1h h LEU 845 N -0.61 0.44 0.51 0.00 6.46 -0.23 -1.12 115.31 120.76 1n1h h LEU 845 Ca -0.02 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.74 1n1h h LEU 845 Cb 0.46 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.34 1n1h h LEU 845 CO 0.03 0.30 -0.24 0.00 -0.62 0.00 0.00 178.44 177.91 1n1h n ALA 848 N -2.44 1.74 -0.49 0.00 0.00 -0.44 -2.63 120.51 116.25 1n1h n ALA 848 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1n1h n ALA 848 Cb 0.64 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1n1h n ALA 848 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1n1h n PHE 849 N -1.22 0.00 1.23 0.00 3.72 0.92 -4.81 117.46 117.29 1n1h n PHE 849 Ca 0.06 -0.09 0.14 0.00 -0.05 0.00 0.00 57.45 57.51 1n1h n PHE 849 Cb 0.08 -0.01 0.69 0.00 -0.94 0.00 0.00 39.48 39.29 1n1h n PHE 849 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1n1h n SER 850 N -0.09 0.02 -4.19 4.37 3.41 -0.64 -4.81 113.62 111.69 1n1h n SER 850 Ca 0.00 0.13 -0.29 0.00 -0.26 0.00 0.00 58.87 58.45 1n1h n SER 850 Cb 0.21 -0.37 -0.16 0.00 -0.26 0.00 0.00 64.21 63.63 1n1h n SER 850 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1n1h s ARG 851 N -2.77 2.20 0.01 4.33 3.52 -1.26 -1.85 118.95 123.14 1n1h s ARG 851 Ca 0.22 -0.74 0.01 0.00 -0.13 0.00 0.00 55.73 55.08 1n1h s ARG 851 Cb 0.20 -1.86 -0.01 0.00 -1.56 0.00 0.00 34.95 31.72 1n1h s ARG 851 CO 0.50 0.29 -0.04 -1.14 -0.81 0.00 0.00 175.30 174.09 1n1h s GLN 852 N 0.01 0.30 0.06 5.12 2.00 -0.21 -4.98 119.66 121.96 1n1h s GLN 852 Ca -0.05 -0.31 -0.30 0.00 -2.00 0.00 0.00 55.36 52.70 1n1h s GLN 852 Cb -0.13 -0.18 -0.05 0.00 0.80 0.00 0.00 33.01 33.45 1n1h s GLN 852 CO 0.03 0.04 1.03 0.50 -0.50 0.00 0.00 175.29 176.39 1n1h s ARG 853 N -0.58 4.58 0.08 1.67 3.52 -1.26 -0.51 118.95 126.45 1n1h s ARG 853 Ca -0.04 1.53 0.08 0.00 -0.13 0.00 0.00 55.73 57.17 1n1h s ARG 853 Cb -0.04 -3.39 -0.04 0.00 -1.56 0.00 0.00 34.95 29.92 1n1h s ARG 853 CO -0.00 0.00 -0.19 0.95 -0.81 0.00 0.00 175.30 175.25 1n1h s THR 854 N 0.58 2.74 -0.01 4.11 -4.23 -1.13 -4.91 115.64 112.80 1n1h s THR 854 Ca 0.51 -1.37 0.07 0.00 -1.18 0.00 0.00 61.69 59.73 1n1h s THR 854 Cb -0.24 -2.20 -0.02 0.00 1.34 0.00 0.00 72.50 71.38 1n1h s THR 854 CO 0.30 0.22 -0.23 -0.04 -0.54 0.00 0.00 174.62 174.33 1n1h s MET 855 N -1.76 1.77 0.00 3.99 -1.94 -1.26 -2.68 119.30 117.41 1n1h s MET 855 Ca 0.16 -0.84 0.00 0.00 -1.71 0.00 0.00 55.69 53.30 1n1h s MET 855 Cb -0.10 -1.75 0.00 0.00 2.01 0.00 0.00 34.83 34.99 1n1h s MET 855 CO 0.07 0.47 0.43 -0.89 -0.01 0.00 0.00 175.02 175.09 1n1h n ILE 856 N 2.39 0.00 0.00 2.53 2.08 -1.25 -4.94 119.36 120.17 1n1h n ILE 856 Ca -0.16 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.15 1n1h n ILE 856 Cb 0.52 1.02 0.00 0.00 -0.75 0.00 0.00 39.64 40.44 1n1h n ILE 856 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1n1h n GLY 857 N 0.00 0.77 2.97 7.39 0.00 -1.26 -4.59 105.19 110.47 1n1h n GLY 857 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1n1h n GLY 857 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1n1h n GLU 858 N 0.00 -0.30 -2.34 1.61 2.13 -1.26 -4.90 120.64 115.59 1n1h n GLU 858 Ca 0.00 0.07 -0.41 0.00 0.66 0.00 0.00 57.16 57.48 1n1h n GLU 858 Cb 0.00 -3.44 0.01 0.00 0.27 0.00 0.00 31.44 28.28 1n1h n GLU 858 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1n1h n SER 859 N -0.15 7.20 -4.55 4.31 7.64 -1.26 -4.96 113.62 121.84 1n1h n SER 859 Ca 0.00 -3.31 -0.35 0.00 1.01 0.00 0.00 58.87 56.21 1n1h n SER 859 Cb 0.07 -1.32 -0.04 0.00 -1.01 0.00 0.00 64.21 61.92 1n1h n SER 859 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1n1h s VAL 860 N -1.94 3.40 0.00 0.44 1.01 -1.26 -3.82 120.40 118.24 1n1h s VAL 860 Ca 0.45 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.46 1n1h s VAL 860 Cb 0.16 -4.02 0.00 0.00 0.00 0.00 0.00 36.38 32.52 1n1h s VAL 860 CO -0.06 -0.98 0.00 0.61 0.00 0.00 0.00 175.10 174.67 1n1h n GLY 861 N 6.04 5.31 3.18 4.51 0.00 -1.09 -4.98 105.19 118.16 1n1h n GLY 861 Ca 0.26 -1.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.17 1n1h n GLY 861 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n1h s TYR 862 N 1.61 -0.41 -0.18 1.61 2.02 -1.26 -2.83 117.35 117.91 1n1h s TYR 862 Ca 0.00 0.94 -0.18 0.00 -0.37 0.00 0.00 57.07 57.46 1n1h s TYR 862 Cb 0.00 0.14 -0.04 0.00 -0.40 0.00 0.00 41.96 41.66 1n1h s TYR 862 CO 0.00 -0.23 0.47 -0.51 -1.57 0.00 0.00 175.55 173.71 1n1h s LEU 863 N 0.77 4.18 -0.05 -1.29 1.43 0.33 -4.95 118.68 119.11 1n1h s LEU 863 Ca -0.05 0.67 -0.00 0.00 -1.03 0.00 0.00 54.13 53.72 1n1h s LEU 863 Cb -0.06 -2.65 0.03 0.00 0.03 0.00 0.00 46.19 43.54 1n1h s LEU 863 CO -0.05 -0.10 -0.01 -1.58 0.23 0.00 0.00 176.35 174.84 1n1h s GLN 864 N 1.26 0.57 -0.12 1.70 2.00 -1.26 -1.05 119.66 122.76 1n1h s GLN 864 Ca 0.23 0.04 -0.17 0.00 -2.00 0.00 0.00 55.36 53.46 1n1h s GLN 864 Cb -0.15 -0.78 -0.04 0.00 0.80 0.00 0.00 33.01 32.84 1n1h s GLN 864 CO 0.09 -0.19 0.44 0.71 -0.50 0.00 0.00 175.29 175.85 1n1h s TYR 865 N 1.38 3.51 0.74 1.67 2.02 -0.77 -5.04 117.35 120.87 1n1h s TYR 865 Ca -0.04 0.84 -0.12 0.00 -0.37 0.00 0.00 57.07 57.38 1n1h s TYR 865 Cb -0.13 -2.51 0.04 0.00 -0.40 0.00 0.00 41.96 38.97 1n1h s TYR 865 CO -0.02 0.20 1.11 -2.14 -1.57 0.00 0.00 175.55 173.12 1n1h s PRO 866 N 0.54 2.32 0.51 -1.71 0.02 -1.26 -4.87 135.00 130.55 1n1h s PRO 866 Ca 0.24 1.31 0.21 0.00 0.02 0.00 0.00 61.00 62.79 1n1h s PRO 866 Cb -0.15 -1.90 1.31 0.00 0.02 0.00 0.00 34.50 33.78 1n1h s PRO 866 CO 0.09 -1.61 2.03 0.00 -0.33 0.00 0.00 177.00 177.18 1n1h h MET 867 N -0.76 0.07 0.00 5.54 -0.00 -1.91 -1.26 114.93 116.61 1n1h h MET 867 Ca -0.45 -0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.25 1n1h h MET 867 Cb 1.24 -0.01 -0.00 0.00 -0.00 0.00 0.00 31.60 32.83 1n1h h MET 867 CO 0.51 0.04 -0.00 -1.49 -0.00 0.00 0.00 176.91 175.97 1n1h h TRP 868 N 0.07 0.00 -0.29 -0.10 4.06 -1.89 -2.38 115.95 115.42 1n1h h TRP 868 Ca 0.20 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.08 1n1h h TRP 868 Cb 0.72 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.86 1n1h h TRP 868 CO -0.00 0.00 -0.14 0.77 -3.56 0.00 0.00 178.44 175.51 1n1h h SER 869 N 0.00 0.49 0.22 -3.49 0.02 -1.34 -1.88 113.55 107.56 1n1h h SER 869 Ca -0.00 -0.13 -0.14 0.00 -0.84 0.00 0.00 61.79 60.68 1n1h h SER 869 Cb 0.00 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 1n1h h SER 869 CO 0.00 0.66 -0.53 -0.26 -1.14 0.00 0.00 176.83 175.56 1n1h h PHE 870 N 0.46 0.43 -0.23 3.45 0.04 -1.57 -1.54 116.94 117.98 1n1h h PHE 870 Ca 0.08 -0.15 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 1n1h h PHE 870 Cb 0.52 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 1n1h h PHE 870 CO 0.02 0.80 0.11 0.28 -0.60 0.00 0.00 178.31 178.92 1n1h h VAL 871 N 0.27 1.14 -0.90 -0.55 2.07 -1.40 -1.25 116.25 115.63 1n1h h VAL 871 Ca 0.01 -0.41 0.13 0.00 0.82 0.00 0.00 66.70 67.24 1n1h h VAL 871 Cb 1.03 0.99 -0.09 0.00 -1.52 0.00 0.00 31.29 31.70 1n1h h VAL 871 CO 0.09 0.14 0.52 0.22 0.02 0.00 0.00 177.57 178.56 1n1h h TYR 872 N 0.24 0.93 0.00 1.57 3.20 -1.01 0.45 116.97 122.35 1n1h h TYR 872 Ca 0.08 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1n1h h TYR 872 Cb 0.12 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.11 1n1h h TYR 872 CO -0.02 0.32 0.00 0.91 -1.64 0.00 0.00 178.16 177.73 1n1h n TRP 873 N -4.75 0.82 0.00 -3.82 8.01 -0.61 -0.91 117.44 116.18 1n1h n TRP 873 Ca 0.17 0.31 0.00 0.00 -1.31 0.00 0.00 57.50 56.67 1n1h n TRP 873 Cb 0.38 -1.00 0.00 0.00 -2.01 0.00 0.00 31.31 28.68 1n1h n TRP 873 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1n1h n GLY 874 N 0.22 1.38 3.66 6.99 0.00 0.15 -4.83 105.19 112.76 1n1h n GLY 874 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1n1h n GLY 874 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1n1h s LEU 875 N 0.00 4.25 0.45 0.99 2.96 -0.71 -4.81 118.68 121.80 1n1h s LEU 875 Ca 0.00 1.94 -0.22 0.00 -0.22 0.00 0.00 54.13 55.62 1n1h s LEU 875 Cb 0.00 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 43.07 1n1h s LEU 875 CO 0.00 -0.81 1.09 -2.16 -1.32 0.00 0.00 176.35 173.14 1n1h s PRO 876 N 3.55 3.89 0.40 0.98 0.04 -1.26 -4.04 135.00 138.56 1n1h s PRO 876 Ca 0.63 1.56 -0.24 0.00 0.04 0.00 0.00 61.00 62.98 1n1h s PRO 876 Cb -0.27 -2.35 -0.09 0.00 0.04 0.00 0.00 34.50 31.83 1n1h s PRO 876 CO 0.21 -0.39 1.10 -0.51 0.04 0.00 0.00 177.00 177.45 1n1h s LEU 877 N -3.05 4.16 -0.07 -3.56 1.43 -1.26 -4.96 118.68 111.36 1n1h s LEU 877 Ca 0.63 2.16 -0.07 0.00 -1.03 0.00 0.00 54.13 55.82 1n1h s LEU 877 Cb -0.23 -4.12 -0.28 0.00 0.03 0.00 0.00 46.19 41.59 1n1h s LEU 877 CO 0.28 -0.58 0.57 0.58 0.23 0.00 0.00 176.35 177.43 1n1h h VAL 878 N 2.23 0.83 -0.88 -1.59 2.07 -1.93 -3.39 116.25 113.58 1n1h h VAL 878 Ca -0.48 -2.49 0.19 0.00 0.82 0.00 0.00 66.70 64.74 1n1h h VAL 878 Cb 1.22 2.64 -0.28 0.00 -1.52 0.00 0.00 31.29 33.36 1n1h h VAL 878 CO 0.62 0.85 0.47 -0.75 0.02 0.00 0.00 177.57 178.78 1n1h s LYS 879 N -2.58 0.18 0.12 1.57 2.20 -1.26 -0.29 119.74 119.68 1n1h s LYS 879 Ca -0.17 0.39 -0.07 0.00 -0.36 0.00 0.00 55.97 55.75 1n1h s LYS 879 Cb 0.06 0.16 -0.01 0.00 -1.51 0.00 0.00 37.83 36.53 1n1h s LYS 879 CO 0.82 -0.05 0.20 0.00 -0.36 0.00 0.00 175.35 175.95 1n1h s ALA 880 N 1.79 0.02 -0.89 3.13 0.00 -1.26 -0.26 121.76 124.28 1n1h s ALA 880 Ca -0.04 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1n1h s ALA 880 Cb -0.03 0.64 0.00 0.00 0.00 0.00 0.00 23.12 23.73 1n1h s ALA 880 CO -0.15 -0.55 0.00 1.19 0.00 0.00 0.00 175.76 176.25 1n1h n PHE 881 N -0.11 -1.03 -0.75 0.00 3.72 -1.26 -0.73 117.46 117.30 1n1h n PHE 881 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1n1h n PHE 881 Cb 0.63 -2.20 0.00 0.00 -0.94 0.00 0.00 39.48 36.97 1n1h n PHE 881 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1n1h n GLY 882 N -0.43 0.58 3.77 1.37 0.00 -1.26 -4.57 105.19 104.65 1n1h n GLY 882 Ca -0.10 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.22 1n1h n GLY 882 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n1h s SER 883 N -2.36 2.28 0.67 1.61 1.04 0.09 -5.03 113.70 112.01 1n1h s SER 883 Ca 0.00 0.53 -0.11 0.00 0.48 0.00 0.00 55.95 56.85 1n1h s SER 883 Cb 0.00 -0.74 -0.01 0.00 0.10 0.00 0.00 66.02 65.38 1n1h s SER 883 CO 0.00 -3.27 1.07 -1.81 0.98 0.00 0.00 173.24 170.21 1n1h s ASP 884 N -4.35 5.73 0.48 7.02 1.01 -1.26 -4.72 116.67 120.58 1n1h s ASP 884 Ca 0.71 1.23 -0.16 0.00 0.71 0.00 0.00 52.55 55.04 1n1h s ASP 884 Cb -0.08 -2.12 -0.08 0.00 1.01 0.00 0.00 42.92 41.65 1n1h s ASP 884 CO 0.54 -1.17 0.93 -2.16 0.21 0.00 0.00 175.17 173.53 1n1h s PRO 885 N -5.29 3.95 -1.50 8.23 0.04 -1.26 -4.23 135.00 134.93 1n1h s PRO 885 Ca 0.57 0.87 -0.11 0.00 0.04 0.00 0.00 61.00 62.37 1n1h s PRO 885 Cb -0.11 -2.20 0.07 0.00 0.04 0.00 0.00 34.50 32.30 1n1h s PRO 885 CO 0.52 -0.19 0.89 0.91 0.04 0.00 0.00 177.00 179.18 1n1h n TRP 886 N -1.40 -2.16 0.37 0.56 7.02 0.61 -4.88 117.44 117.55 1n1h n TRP 886 Ca 0.06 0.88 0.12 0.00 -1.02 0.00 0.00 57.50 57.53 1n1h n TRP 886 Cb 0.54 -3.98 0.09 0.00 -2.42 0.00 0.00 31.31 25.54 1n1h n TRP 886 CO 0.00 0.00 0.00 -0.84 -2.02 0.00 0.00 177.69 174.83 1n1h h ILE 887 N -2.00 0.00 -3.32 -0.99 3.07 -1.76 -3.44 117.51 109.07 1n1h h ILE 887 Ca -0.59 -0.71 -0.60 0.00 1.55 0.00 0.00 64.86 64.52 1n1h h ILE 887 Cb 1.37 1.24 -0.11 0.00 -0.27 0.00 0.00 36.82 39.05 1n1h h ILE 887 CO 0.66 0.00 -0.39 -0.36 -1.05 0.00 0.00 178.15 177.00 1n1h s PHE 888 N -3.25 3.43 0.42 0.16 0.08 -1.26 -0.23 117.98 117.32 1n1h s PHE 888 Ca 0.03 0.47 -0.07 0.00 0.12 0.00 0.00 56.93 57.48 1n1h s PHE 888 Cb 0.12 -2.28 -0.05 0.00 -0.57 0.00 0.00 43.02 40.24 1n1h s PHE 888 CO 0.76 0.23 0.74 0.45 -0.10 0.00 0.00 175.22 177.29 1n1h s SER 889 N 0.51 6.39 0.00 1.36 0.15 0.22 -4.76 113.70 117.57 1n1h s SER 889 Ca 0.13 0.96 0.26 0.00 0.70 0.00 0.00 55.95 58.00 1n1h s SER 889 Cb -0.12 -2.25 1.57 0.00 -1.71 0.00 0.00 66.02 63.51 1n1h s SER 889 CO 0.02 -0.44 1.93 -2.67 1.20 0.00 0.00 173.24 173.28 1n1h n TRP 890 N -1.67 0.00 0.45 3.44 2.14 -1.26 -2.36 117.44 118.18 1n1h n TRP 890 Ca 0.01 0.00 0.05 0.00 2.07 0.00 0.00 57.50 59.63 1n1h n TRP 890 Cb 0.55 -0.01 0.19 0.00 -0.81 0.00 0.00 31.31 31.23 1n1h n TRP 890 CO 0.00 0.00 0.00 0.66 2.07 0.00 0.00 177.69 180.42 1n1h n TYR 891 N -1.01 0.76 -1.89 -2.67 4.01 -1.26 -4.91 117.16 110.19 1n1h n TYR 891 Ca 0.20 -0.31 -0.41 0.00 -0.16 0.00 0.00 57.90 57.21 1n1h n TYR 891 Cb 0.09 -0.13 -0.02 0.00 -0.31 0.00 0.00 39.34 38.98 1n1h n TYR 891 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 1n1h s MET 892 N -1.66 4.19 1.36 -0.72 -2.45 -0.99 -4.45 119.30 114.57 1n1h s MET 892 Ca 0.27 2.44 -0.21 0.00 -1.25 0.00 0.00 55.69 56.95 1n1h s MET 892 Cb 0.17 -3.07 0.33 0.00 1.25 0.00 0.00 34.83 33.51 1n1h s MET 892 CO 0.14 -0.53 0.78 -2.30 1.05 0.00 0.00 175.02 174.16 1n1h n PRO 893 N 2.30 -4.08 -3.78 4.11 -0.02 -1.26 -4.94 135.00 127.32 1n1h n PRO 893 Ca 0.08 -1.21 -0.22 0.00 -2.02 0.00 0.00 63.50 60.13 1n1h n PRO 893 Cb 0.39 -1.87 -0.04 0.00 -0.02 0.00 0.00 33.50 31.95 1n1h n PRO 893 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1n1h s THR 894 N -2.14 2.82 0.00 3.45 -1.32 -1.26 -4.16 115.64 113.02 1n1h s THR 894 Ca 0.62 -1.45 0.00 0.00 -1.21 0.00 0.00 61.69 59.64 1n1h s THR 894 Cb -0.13 -3.03 0.00 0.00 -1.51 0.00 0.00 72.50 67.83 1n1h s THR 894 CO 0.54 -0.06 0.00 0.61 -2.21 0.00 0.00 174.62 173.50 1n1h n GLY 895 N -1.41 0.90 0.28 6.08 0.00 -0.09 -2.07 105.19 108.88 1n1h n GLY 895 Ca 0.01 -0.62 0.06 0.00 0.00 0.00 0.00 46.02 45.47 1n1h n GLY 895 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1n1h h ASP 896 N 3.14 0.13 -0.75 1.61 3.32 -1.96 0.02 116.42 121.93 1n1h h ASP 896 Ca 0.00 0.14 0.03 0.00 0.02 0.00 0.00 57.03 57.21 1n1h h ASP 896 Cb 0.00 0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 1n1h h ASP 896 CO 0.00 0.01 0.50 0.25 -1.72 0.00 0.00 179.24 178.28 1n1h h LEU 897 N 0.34 0.81 -0.39 1.55 5.85 -1.93 -0.05 115.31 121.49 1n1h h LEU 897 Ca 0.43 -0.01 -0.19 0.00 0.84 0.00 0.00 57.88 58.95 1n1h h LEU 897 Cb 0.72 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 1n1h h LEU 897 CO -0.48 0.57 -0.72 1.23 -0.34 0.00 0.00 178.44 178.70 1n1h h GLY 898 N 0.95 0.50 0.96 3.75 0.00 -0.49 -2.53 103.07 106.22 1n1h h GLY 898 Ca 0.29 -0.70 -0.06 0.00 0.00 0.00 0.00 47.33 46.86 1n1h h GLY 898 CO -0.08 0.62 0.05 -0.33 0.00 0.00 0.00 176.54 176.81 1n1h h MET 899 N 0.32 0.75 -0.58 4.80 2.86 -0.20 -2.62 114.93 120.26 1n1h h MET 899 Ca -0.03 -0.21 0.01 0.00 -2.06 0.00 0.00 59.70 57.41 1n1h h MET 899 Cb 1.30 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.84 1n1h h MET 899 CO 0.13 0.79 0.38 -0.92 1.06 0.00 0.00 176.91 178.34 1n1h h TYR 900 N 0.61 0.71 0.70 -0.22 3.20 -1.04 -2.31 116.97 118.63 1n1h h TYR 900 Ca 0.13 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 1n1h h TYR 900 Cb 0.41 -0.24 0.01 0.00 1.54 0.00 0.00 36.73 38.45 1n1h h TYR 900 CO 0.03 0.44 -0.34 0.77 -1.64 0.00 0.00 178.16 177.42 1n1h h SER 901 N 0.76 -0.80 -0.19 -2.11 0.02 -1.25 0.10 113.55 110.09 1n1h h SER 901 Ca 0.22 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.09 1n1h h SER 901 Cb -0.06 0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 1n1h h SER 901 CO -0.06 -0.53 -0.14 4.11 -1.14 0.00 0.00 176.83 179.08 1n1h h TRP 902 N -1.02 0.63 -0.52 3.45 5.08 -1.51 -1.91 115.95 120.16 1n1h h TRP 902 Ca -0.10 -0.11 -0.09 0.00 1.08 0.00 0.00 58.89 59.68 1n1h h TRP 902 Cb 0.74 -0.17 -0.02 0.00 -3.00 0.00 0.00 29.16 26.72 1n1h h TRP 902 CO -0.01 0.70 -0.02 0.82 -1.28 0.00 0.00 178.44 178.64 1n1h h ILE 903 N 0.53 1.26 -0.48 0.12 2.04 -1.37 -2.82 117.51 116.78 1n1h h ILE 903 Ca 0.09 -1.10 -0.08 0.00 1.00 0.00 0.00 64.86 64.78 1n1h h ILE 903 Cb 0.55 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1n1h h ILE 903 CO 0.03 0.39 -0.03 0.28 0.00 0.00 0.00 178.15 178.82 1n1h h SER 904 N 0.83 0.78 0.54 1.72 0.02 -0.43 -0.36 113.55 116.65 1n1h h SER 904 Ca 0.15 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1n1h h SER 904 Cb 0.52 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1n1h h SER 904 CO 0.03 0.87 0.00 -0.07 -1.14 0.00 0.00 176.83 176.51 1n1h h LEU 905 N 0.75 0.00 -3.76 5.07 3.38 -1.11 -3.20 115.31 116.44 1n1h h LEU 905 Ca 0.14 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.91 1n1h h LEU 905 Cb 0.50 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 40.87 1n1h h LEU 905 CO 0.03 0.00 -1.01 2.30 0.09 0.00 0.00 178.44 179.84 1n1h n ILE 906 N -2.50 0.40 0.07 1.22 -5.35 -1.02 -4.94 119.36 107.23 1n1h n ILE 906 Ca 0.00 -1.56 -0.13 0.00 -0.27 0.00 0.00 62.75 60.79 1n1h n ILE 906 Cb 0.18 1.07 -0.08 0.00 -1.74 0.00 0.00 39.64 39.07 1n1h n ILE 906 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 1n1h h ARG 907 N 1.46 -0.57 -0.47 6.28 2.43 -1.07 0.19 114.38 122.63 1n1h h ARG 907 Ca -0.22 0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1n1h h ARG 907 Cb 1.67 0.13 -0.08 0.00 -0.42 0.00 0.00 29.97 31.26 1n1h h ARG 907 CO 0.10 -0.38 -0.04 -1.35 -1.51 0.00 0.00 179.97 176.79 1n1h h PRO 908 N -0.59 0.07 -0.39 0.20 0.11 -1.88 -0.55 132.00 128.96 1n1h h PRO 908 Ca 0.00 -0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.19 1n1h h PRO 908 Cb 0.61 -0.02 -0.08 0.00 0.11 0.00 0.00 31.00 31.62 1n1h h PRO 908 CO -0.27 0.05 -0.19 1.25 -0.21 0.00 0.00 178.00 178.63 1n1h h LEU 909 N 0.07 -0.65 0.36 2.35 7.12 -1.80 0.12 115.31 122.88 1n1h h LEU 909 Ca 0.23 0.15 -0.02 0.00 0.13 0.00 0.00 57.88 58.38 1n1h h LEU 909 Cb 0.35 0.35 0.00 0.00 -0.53 0.00 0.00 40.66 40.84 1n1h h LEU 909 CO -0.42 -0.22 -0.17 0.24 -0.13 0.00 0.00 178.44 177.73 1n1h h MET 910 N -0.12 -0.47 -0.28 1.25 2.86 -0.01 -0.38 114.93 117.79 1n1h h MET 910 Ca 0.19 0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.93 1n1h h MET 910 Cb 0.42 0.11 -0.07 0.00 0.06 0.00 0.00 31.60 32.12 1n1h h MET 910 CO -0.47 -0.31 -0.16 1.15 1.06 0.00 0.00 176.91 178.18 1n1h h THR 911 N -0.48 0.53 -0.24 2.22 2.02 -0.68 0.24 112.91 116.52 1n1h h THR 911 Ca -0.05 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.14 1n1h h THR 911 Cb 0.37 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 1n1h h THR 911 CO 0.08 0.00 0.12 -0.09 0.37 0.00 0.00 175.52 176.00 1n1h h ARG 912 N -0.13 0.25 -0.22 6.66 2.43 -0.66 -2.14 114.38 120.57 1n1h h ARG 912 Ca 0.15 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1n1h h ARG 912 Cb 0.35 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.83 1n1h h ARG 912 CO -0.36 0.16 0.08 2.35 -1.51 0.00 0.00 179.97 180.70 1n1h h TRP 913 N 0.26 0.15 -0.01 2.20 7.01 -0.34 -1.12 115.95 124.10 1n1h h TRP 913 Ca 0.10 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.13 1n1h h TRP 913 Cb 0.02 -0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 27.00 1n1h h TRP 913 CO -0.09 0.08 -0.19 0.52 -2.79 0.00 0.00 178.44 175.97 1n1h h MET 914 N 0.19 -0.29 -0.48 2.65 2.86 -0.31 -2.60 114.93 116.95 1n1h h MET 914 Ca 0.09 0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.81 1n1h h MET 914 Cb 0.05 0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 1n1h h MET 914 CO -0.09 -0.19 0.21 0.28 1.06 0.00 0.00 176.91 178.18 1n1h h VAL 915 N -0.30 0.89 0.00 -2.22 2.07 -1.26 -0.42 116.25 115.00 1n1h h VAL 915 Ca 0.06 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1n1h h VAL 915 Cb 0.38 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1n1h h VAL 915 CO -0.18 0.07 0.00 0.00 0.02 0.00 0.00 177.57 177.48 1n1h n ALA 916 N -2.37 1.24 -1.50 1.67 0.00 -0.44 -2.21 120.51 116.90 1n1h n ALA 916 Ca 0.04 -0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.52 1n1h n ALA 916 Cb 0.16 -1.07 0.20 0.00 0.00 0.00 0.00 19.45 18.74 1n1h n ALA 916 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1n1h n ASN 917 N -1.46 1.91 0.00 0.00 4.13 -0.24 -4.97 115.26 114.63 1n1h n ASN 917 Ca 0.01 -3.77 0.00 0.00 1.68 0.00 0.00 54.58 52.50 1n1h n ASN 917 Cb 0.05 -0.53 0.00 0.00 -1.54 0.00 0.00 39.78 37.76 1n1h n ASN 917 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1n1h n GLY 918 N -1.15 2.84 2.70 7.41 0.00 -0.94 -4.94 105.19 111.11 1n1h n GLY 918 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1n1h n GLY 918 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1n1h n TYR 919 N -2.00 3.45 -4.26 1.61 4.01 -0.75 -4.89 117.16 114.33 1n1h n TYR 919 Ca 0.00 -2.99 -0.26 0.00 -0.16 0.00 0.00 57.90 54.50 1n1h n TYR 919 Cb 0.00 -2.55 -0.08 0.00 -0.31 0.00 0.00 39.34 36.39 1n1h n TYR 919 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1n1h s VAL 920 N 3.12 3.46 0.23 -0.72 1.01 -1.26 -0.13 120.40 126.10 1n1h s VAL 920 Ca 0.49 -1.64 -0.15 0.00 0.00 0.00 0.00 61.98 60.67 1n1h s VAL 920 Cb 0.14 -2.76 0.01 0.00 0.00 0.00 0.00 36.38 33.77 1n1h s VAL 920 CO -0.09 -0.18 0.51 0.28 0.00 0.00 0.00 175.10 175.62 1n1h s THR 921 N -1.88 0.02 -0.19 3.92 -1.32 -1.08 -4.51 115.64 110.60 1n1h s THR 921 Ca 0.28 -1.12 0.22 0.00 -1.21 0.00 0.00 61.69 59.85 1n1h s THR 921 Cb -0.08 -1.92 -0.08 0.00 -1.51 0.00 0.00 72.50 68.91 1n1h s THR 921 CO 0.18 -0.07 0.91 0.47 -2.21 0.00 0.00 174.62 173.90 1n1h n ASP 922 N -0.36 0.68 -4.67 8.08 8.00 -1.26 -4.76 116.55 122.26 1n1h n ASP 922 Ca -0.05 0.27 -0.42 0.00 0.71 0.00 0.00 54.79 55.29 1n1h n ASP 922 Cb 0.62 0.72 -0.03 0.00 -0.02 0.00 0.00 41.12 42.41 1n1h n ASP 922 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1n1h s ARG 923 N -3.35 4.31 -0.37 -1.24 0.52 -1.26 -5.00 118.95 112.56 1n1h s ARG 923 Ca -0.02 1.28 -0.26 0.00 -0.52 0.00 0.00 55.73 56.20 1n1h s ARG 923 Cb 0.10 -3.60 0.02 0.00 0.52 0.00 0.00 34.95 31.99 1n1h s ARG 923 CO 0.81 -0.47 0.94 0.00 0.02 0.00 0.00 175.30 176.60 1n1h s SER 925 N 1.89 7.03 0.37 0.00 0.15 0.67 -4.87 113.70 118.93 1n1h s SER 925 Ca 0.39 2.10 0.08 0.00 0.70 0.00 0.00 55.95 59.22 1n1h s SER 925 Cb -0.12 -2.60 0.71 0.00 -1.71 0.00 0.00 66.02 62.30 1n1h s SER 925 CO 0.19 -0.30 1.89 0.74 1.20 0.00 0.00 173.24 176.96 1n1h h THR 926 N 2.60 1.19 0.00 6.45 2.02 -1.96 -1.62 112.91 121.59 1n1h h THR 926 Ca -0.47 -0.81 -0.43 0.00 0.77 0.00 0.00 66.41 65.47 1n1h h THR 926 Cb 1.21 1.14 -0.07 0.00 -1.74 0.00 0.00 68.15 68.69 1n1h h THR 926 CO 0.64 0.26 -2.49 0.52 0.37 0.00 0.00 175.52 174.82 1n1h n VAL 927 N -4.27 1.52 -0.73 3.16 0.31 -1.26 -4.70 118.33 112.36 1n1h n VAL 927 Ca -0.00 -0.45 0.08 0.00 -0.01 0.00 0.00 64.34 63.96 1n1h n VAL 927 Cb 0.27 -1.71 0.27 0.00 -0.91 0.00 0.00 33.84 31.76 1n1h n VAL 927 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1n1h n PHE 928 N -3.87 1.07 -0.55 3.52 3.72 -1.25 -4.92 117.46 115.17 1n1h n PHE 928 Ca -0.51 -0.73 0.00 0.00 -0.05 0.00 0.00 57.45 56.16 1n1h n PHE 928 Cb 0.92 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 39.20 1n1h n PHE 928 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1n1h n GLY 929 N 0.15 3.37 2.05 1.37 0.00 -0.61 -2.24 105.19 109.28 1n1h n GLY 929 Ca 0.21 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1n1h n GLY 929 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1n1h n ASN 930 N 3.91 6.58 -4.82 1.61 4.13 -1.26 0.24 115.26 125.66 1n1h n ASN 930 Ca 0.00 -3.34 -0.36 0.00 1.68 0.00 0.00 54.58 52.55 1n1h n ASN 930 Cb 0.00 -0.99 -0.07 0.00 -1.54 0.00 0.00 39.78 37.18 1n1h n ASN 930 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1n1h s ALA 931 N -2.63 3.69 -1.47 5.41 0.00 -0.95 -2.62 121.76 123.20 1n1h s ALA 931 Ca 0.45 -0.69 -0.08 0.00 0.00 0.00 0.00 51.96 51.63 1n1h s ALA 931 Cb 0.35 -1.82 0.02 0.00 0.00 0.00 0.00 23.12 21.68 1n1h s ALA 931 CO 0.00 0.61 2.61 -3.47 0.00 0.00 0.00 175.76 175.51 1n1h n ASP 932 N 2.04 7.94 -0.17 0.00 -0.08 0.81 -4.74 116.55 122.36 1n1h n ASP 932 Ca -0.20 -2.86 0.15 0.00 -1.51 0.00 0.00 54.79 50.37 1n1h n ASP 932 Cb 0.55 -1.48 0.50 0.00 2.34 0.00 0.00 41.12 43.02 1n1h n ASP 932 CO 0.00 0.00 0.00 0.10 0.12 0.00 0.00 177.20 177.42 1n1h h TYR 933 N 4.94 0.50 -0.41 -0.67 -0.00 -1.93 -1.16 116.97 118.24 1n1h h TYR 933 Ca 0.76 0.01 -0.02 0.00 0.00 0.00 0.00 58.73 59.48 1n1h h TYR 933 Cb 0.33 -0.16 -0.02 0.00 0.00 0.00 0.00 36.73 36.88 1n1h h TYR 933 CO 1.70 0.20 0.19 0.00 -0.00 0.00 0.00 178.16 180.25 1n1h h ARG 934 N 0.43 0.60 -0.07 0.10 3.08 -1.92 0.85 114.38 117.46 1n1h h ARG 934 Ca 0.37 -0.10 -0.16 0.00 0.07 0.00 0.00 59.98 60.16 1n1h h ARG 934 Cb 0.82 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 1n1h h ARG 934 CO -0.12 0.54 -0.67 -0.09 -1.07 0.00 0.00 179.97 178.56 1n1h h ARG 935 N 0.53 0.31 0.19 0.04 2.43 -1.74 -3.19 114.38 112.94 1n1h h ARG 935 Ca 0.14 -0.23 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1n1h h ARG 935 Cb 0.14 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1n1h h ARG 935 CO -0.02 0.86 -0.09 0.00 -1.51 0.00 0.00 179.97 179.21 1n1h h PHE 937 N -0.61 0.00 0.21 0.00 0.04 -0.92 -0.69 116.94 114.97 1n1h h PHE 937 Ca -0.03 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.40 1n1h h PHE 937 Cb 0.45 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.62 1n1h h PHE 937 CO 0.03 0.00 -1.66 -0.91 -0.60 0.00 0.00 178.31 175.17 1n1h h ASN 938 N 0.00 0.70 0.33 2.17 2.35 -1.55 0.11 115.58 119.70 1n1h h ASN 938 Ca 0.00 -0.93 -0.13 0.00 -0.55 0.00 0.00 56.30 54.69 1n1h h ASN 938 Cb 0.15 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1n1h h ASN 938 CO 0.00 1.77 -0.52 -0.33 -1.65 0.00 0.00 177.43 176.69 1n1h h GLU 939 N 0.12 0.21 -0.00 0.81 5.08 -1.09 -2.58 114.58 117.13 1n1h h GLU 939 Ca -0.32 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1n1h h GLU 939 Cb 2.13 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.39 1n1h h GLU 939 CO 0.21 0.69 -0.17 1.28 -1.00 0.00 0.00 179.01 180.02 1n1h n LEU 940 N -3.93 0.47 -0.81 1.33 4.77 -0.32 -4.90 117.00 113.61 1n1h n LEU 940 Ca -0.02 0.05 -0.09 0.00 -0.03 0.00 0.00 56.01 55.92 1n1h n LEU 940 Cb 0.56 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 1n1h n LEU 940 CO 0.43 0.09 -0.10 0.29 -1.33 0.00 0.00 177.39 176.78 1n1h n LYS 941 N -1.09 -0.66 -0.06 3.23 4.76 -0.97 -4.53 118.16 118.83 1n1h n LYS 941 Ca 0.12 0.69 -0.16 0.00 -2.87 0.00 0.00 58.31 56.09 1n1h n LYS 941 Cb 0.30 -4.61 -0.06 0.00 -1.84 0.00 0.00 35.03 28.83 1n1h n LYS 941 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1n1h h LEU 942 N 0.00 0.90 -0.20 -0.35 6.46 -1.08 0.23 115.31 121.27 1n1h h LEU 942 Ca -0.19 -0.56 -0.07 0.00 -0.12 0.00 0.00 57.88 56.94 1n1h h LEU 942 Cb 0.78 -0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 40.45 1n1h h LEU 942 CO 0.26 1.30 -0.13 1.88 -0.62 0.00 0.00 178.44 181.14 1n1h h TYR 943 N 0.54 0.52 0.32 1.25 0.05 -1.59 -1.65 116.97 116.42 1n1h h TYR 943 Ca -0.01 -0.14 -0.00 0.00 0.05 0.00 0.00 58.73 58.63 1n1h h TYR 943 Cb 1.18 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 38.79 1n1h h TYR 943 CO 0.08 0.76 -0.28 1.96 -1.05 0.00 0.00 178.16 179.63 1n1h h GLN 944 N 0.13 -0.59 -0.96 4.88 7.50 -1.77 -1.46 115.11 122.84 1n1h h GLN 944 Ca 0.04 0.04 0.11 0.00 0.50 0.00 0.00 58.65 59.34 1n1h h GLN 944 Cb 0.64 0.13 -0.08 0.00 0.05 0.00 0.00 27.48 28.22 1n1h h GLN 944 CO 0.04 -0.40 0.60 0.78 -1.50 0.00 0.00 178.83 178.35 1n1h h GLY 945 N -0.62 1.55 0.86 3.46 0.00 -0.56 0.95 103.07 108.73 1n1h h GLY 945 Ca -0.02 -0.41 0.03 0.00 0.00 0.00 0.00 47.33 46.93 1n1h h GLY 945 CO -0.04 0.17 0.34 -1.82 0.00 0.00 0.00 176.54 175.19 1n1h h TYR 946 N 0.97 0.63 0.09 5.60 3.20 -0.76 -1.51 116.97 125.19 1n1h h TYR 946 Ca 0.47 0.02 -0.27 0.00 3.14 0.00 0.00 58.73 62.09 1n1h h TYR 946 Cb 0.43 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 1n1h h TYR 946 CO -0.02 0.36 -1.29 1.88 -1.64 0.00 0.00 178.16 177.45 1n1h h TYR 947 N 0.66 0.35 -0.00 -3.82 0.05 -0.74 -3.26 116.97 110.21 1n1h h TYR 947 Ca 0.23 -0.25 -0.06 0.00 0.05 0.00 0.00 58.73 58.70 1n1h h TYR 947 Cb 0.03 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.75 1n1h h TYR 947 CO -0.06 1.23 -0.28 0.52 -1.05 0.00 0.00 178.16 178.52 1n1h h MET 948 N 0.05 0.00 -0.24 4.88 2.86 -0.70 -2.14 114.93 119.65 1n1h h MET 948 Ca -0.14 -0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.44 1n1h h MET 948 Cb 1.94 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.59 1n1h h MET 948 CO 0.17 0.28 -0.10 0.00 1.06 0.00 0.00 176.91 178.32 1n1h h ALA 949 N 1.72 1.40 -0.19 6.32 0.00 -1.32 -2.73 119.26 124.47 1n1h h ALA 949 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1n1h h ALA 949 Cb 0.49 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1n1h h ALA 949 CO 0.04 0.41 0.00 1.04 0.00 0.00 0.00 179.25 180.74 1n1h n GLN 950 N -4.25 1.45 -3.99 0.00 6.02 -0.81 -4.88 117.38 110.92 1n1h n GLN 950 Ca 0.00 -0.69 -0.32 0.00 -0.01 0.00 0.00 57.00 55.98 1n1h n GLN 950 Cb 0.28 -1.16 -0.06 0.00 1.02 0.00 0.00 30.24 30.32 1n1h n GLN 950 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1n1h s LEU 951 N -0.99 4.14 0.18 1.08 1.43 -1.03 -5.05 118.68 118.43 1n1h s LEU 951 Ca 0.13 0.22 -0.33 0.00 -1.03 0.00 0.00 54.13 53.12 1n1h s LEU 951 Cb 0.07 -2.56 -0.15 0.00 0.03 0.00 0.00 46.19 43.57 1n1h s LEU 951 CO 0.09 0.23 1.18 -2.65 0.23 0.00 0.00 176.35 175.43 1n1h n PRO 952 N 0.81 1.23 -0.95 1.29 -0.02 -1.26 -4.89 135.00 131.21 1n1h n PRO 952 Ca -0.10 0.44 -0.05 0.00 -2.02 0.00 0.00 63.50 61.77 1n1h n PRO 952 Cb 0.52 -1.95 0.28 0.00 -0.02 0.00 0.00 33.50 32.34 1n1h n PRO 952 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1n1h n ARG 953 N 1.76 3.35 -3.60 -0.52 1.74 -1.26 -4.92 116.66 113.21 1n1h n ARG 953 Ca 0.15 -3.07 -0.16 0.00 -0.77 0.00 0.00 57.85 53.99 1n1h n ARG 953 Cb 0.25 -2.13 -0.07 0.00 -1.02 0.00 0.00 32.46 29.49 1n1h n ARG 953 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1n1h s ASN 954 N -1.33 -0.53 0.33 0.55 4.22 -1.26 -3.04 114.94 113.89 1n1h s ASN 954 Ca 0.53 0.58 -0.27 0.00 -2.14 0.00 0.00 52.86 51.56 1n1h s ASN 954 Cb 0.43 0.53 -0.13 0.00 1.28 0.00 0.00 41.25 43.37 1n1h s ASN 954 CO 0.11 -0.53 1.15 -2.65 -2.04 0.00 0.00 177.10 173.14 1n1h n PRO 955 N 1.16 1.73 -3.95 3.55 -0.02 -1.26 -5.00 135.00 131.21 1n1h n PRO 955 Ca -0.19 0.61 -0.37 0.00 -2.02 0.00 0.00 63.50 61.53 1n1h n PRO 955 Cb 0.57 -2.11 -0.07 0.00 -0.02 0.00 0.00 33.50 31.87 1n1h n PRO 955 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1n1h s LYS 956 N -1.79 3.43 0.00 -0.52 -2.85 -1.26 -4.98 119.74 111.77 1n1h s LYS 956 Ca 0.58 -0.18 0.22 0.00 -1.00 0.00 0.00 55.97 55.59 1n1h s LYS 956 Cb -0.61 -3.15 -0.24 0.00 -2.06 0.00 0.00 37.83 31.77 1n1h s LYS 956 CO 0.61 0.73 0.69 1.63 0.10 0.00 0.00 175.35 179.10 1n1h n LYS 957 N 2.13 0.45 -1.36 1.78 4.01 -1.26 -4.89 118.16 119.01 1n1h n LYS 957 Ca -0.19 -0.11 -0.36 0.00 -0.51 0.00 0.00 58.31 57.14 1n1h n LYS 957 Cb 0.55 -1.54 0.08 0.00 -0.51 0.00 0.00 35.03 33.60 1n1h n LYS 957 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1n1h n SER 958 N -2.07 0.27 0.00 4.39 3.41 -1.26 -2.66 113.62 115.70 1n1h n SER 958 Ca -0.01 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.27 1n1h n SER 958 Cb 0.49 -1.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 1n1h n SER 958 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n1h n GLY 959 N 1.18 0.80 3.77 5.00 0.00 -1.26 -5.04 105.19 109.65 1n1h n GLY 959 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1n1h n GLY 959 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n1h s ARG 960 N -0.60 4.09 -0.02 1.61 0.52 -1.09 -4.90 118.95 118.58 1n1h s ARG 960 Ca 0.00 1.71 -0.30 0.00 -0.52 0.00 0.00 55.73 56.62 1n1h s ARG 960 Cb 0.00 -2.63 -0.09 0.00 0.52 0.00 0.00 34.95 32.76 1n1h s ARG 960 CO 0.00 -0.25 2.02 0.00 0.02 0.00 0.00 175.30 177.09 1n1h n ALA 961 N 0.02 1.57 -3.99 2.13 0.00 -1.26 -4.94 120.51 114.04 1n1h n ALA 961 Ca 0.05 0.14 -0.31 0.00 0.00 0.00 0.00 53.44 53.31 1n1h n ALA 961 Cb 0.48 -2.71 -0.16 0.00 0.00 0.00 0.00 19.45 17.06 1n1h n ALA 961 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1h s ALA 962 N 5.12 2.12 -0.45 0.00 0.00 -1.26 -4.64 121.76 122.65 1n1h s ALA 962 Ca 0.91 -1.39 -0.27 0.00 0.00 0.00 0.00 51.96 51.22 1n1h s ALA 962 Cb -0.44 -1.40 -0.07 0.00 0.00 0.00 0.00 23.12 21.21 1n1h s ALA 962 CO 0.42 -1.03 2.39 -1.13 0.00 0.00 0.00 175.76 176.40 1n1h n SER 963 N 4.62 2.46 -0.07 0.00 3.41 -1.26 -4.82 113.62 117.96 1n1h n SER 963 Ca -0.14 -0.37 0.01 0.00 -0.26 0.00 0.00 58.87 58.12 1n1h n SER 963 Cb 0.45 -1.57 0.03 0.00 -0.26 0.00 0.00 64.21 62.86 1n1h n SER 963 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1n1h n ARG 964 N 8.95 -0.02 -0.08 4.33 0.00 -1.26 -1.00 116.66 127.58 1n1h n ARG 964 Ca 0.36 0.30 -0.09 0.00 -0.00 0.00 0.00 57.85 58.42 1n1h n ARG 964 Cb 0.52 -0.45 -0.02 0.00 0.00 0.00 0.00 32.46 32.51 1n1h n ARG 964 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 1n1h h GLU 965 N 0.00 0.37 0.00 -0.14 4.81 -1.99 0.58 114.58 118.21 1n1h h GLU 965 Ca 0.10 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.19 1n1h h GLU 965 Cb 0.16 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1n1h h GLU 965 CO -0.20 0.25 -0.56 -0.24 -0.73 0.00 0.00 179.01 177.53 1n1h h VAL 966 N 0.38 1.09 -0.41 0.32 3.04 -1.45 -1.88 116.25 117.35 1n1h h VAL 966 Ca 0.10 -2.18 -0.05 0.00 -1.01 0.00 0.00 66.70 63.56 1n1h h VAL 966 Cb -0.04 2.29 -0.02 0.00 -2.01 0.00 0.00 31.29 31.51 1n1h h VAL 966 CO -0.02 0.55 0.04 -0.09 -1.01 0.00 0.00 177.57 177.04 1n1h h ARG 967 N 0.00 0.64 0.04 4.17 1.12 -0.91 -1.41 114.38 118.03 1n1h h ARG 967 Ca -0.01 -0.14 -0.25 0.00 -1.11 0.00 0.00 59.98 58.48 1n1h h ARG 967 Cb 1.25 -0.09 -0.03 0.00 -0.01 0.00 0.00 29.97 31.09 1n1h h ARG 967 CO 0.07 0.63 -1.28 0.93 -3.11 0.00 0.00 179.97 177.21 1n1h h GLU 968 N 0.61 0.08 -0.40 0.20 5.08 -0.64 -2.98 114.58 116.53 1n1h h GLU 968 Ca 0.13 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1n1h h GLU 968 Cb 0.32 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1n1h h GLU 968 CO 0.01 0.94 0.20 1.96 -1.00 0.00 0.00 179.01 181.12 1n1h h GLN 969 N 0.02 0.58 0.93 2.33 4.20 -1.04 -1.77 115.11 120.36 1n1h h GLN 969 Ca -0.13 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.45 1n1h h GLN 969 Cb 1.89 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 29.58 1n1h h GLN 969 CO 0.13 0.50 -0.45 0.35 -0.67 0.00 0.00 178.83 178.70 1n1h h PHE 970 N 0.51 -1.16 -0.01 2.96 3.57 -1.35 -1.08 116.94 120.38 1n1h h PHE 970 Ca 0.14 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1n1h h PHE 970 Cb 0.11 0.38 -0.00 0.00 2.79 0.00 0.00 35.95 39.24 1n1h h PHE 970 CO -0.01 -0.72 0.02 1.79 -2.23 0.00 0.00 178.31 177.16 1n1h h THR 971 N -1.33 0.14 -0.00 4.41 1.35 -1.56 -0.35 112.91 115.57 1n1h h THR 971 Ca -0.13 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.73 1n1h h THR 971 Cb 0.96 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 1n1h h THR 971 CO 0.21 0.00 -0.02 -0.61 -0.25 0.00 0.00 175.52 174.85 1n1h h GLN 972 N 0.00 0.02 -0.54 4.72 5.75 -1.04 -0.97 115.11 123.05 1n1h h GLN 972 Ca 0.00 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.52 1n1h h GLN 972 Cb 0.04 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.56 1n1h h GLN 972 CO -0.00 0.68 0.31 0.00 -2.65 0.00 0.00 178.83 177.17 1n1h h ALA 973 N 0.34 0.69 -0.39 3.38 0.00 0.02 0.29 119.26 123.60 1n1h h ALA 973 Ca -0.00 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1n1h h ALA 973 Cb 0.68 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1n1h h ALA 973 CO 0.00 0.00 0.13 -0.07 0.00 0.00 0.00 179.25 179.32 1n1h h LEU 974 N 0.61 0.14 -0.14 0.00 3.38 -1.11 -0.27 115.31 117.91 1n1h h LEU 974 Ca 0.22 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.27 1n1h h LEU 974 Cb 0.06 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1n1h h LEU 974 CO -0.12 0.12 -0.05 -1.28 0.09 0.00 0.00 178.44 177.20 1n1h h SER 975 N 0.29 -0.17 -0.98 -0.43 0.87 0.14 -2.12 113.55 111.15 1n1h h SER 975 Ca 0.18 0.05 0.07 0.00 -1.23 0.00 0.00 61.79 60.86 1n1h h SER 975 Cb 0.16 0.10 -0.07 0.00 -0.44 0.00 0.00 62.40 62.15 1n1h h SER 975 CO -0.18 -0.06 0.63 0.44 -0.53 0.00 0.00 176.83 177.12 1n1h h ASP 976 N -0.02 0.99 0.18 6.23 3.32 0.20 0.97 116.42 128.29 1n1h h ASP 976 Ca 0.07 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 1n1h h ASP 976 Cb 0.13 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1n1h h ASP 976 CO -0.16 0.62 -0.12 0.22 -1.72 0.00 0.00 179.24 178.08 1n1h h TYR 977 N 1.12 -0.31 -0.32 4.55 3.20 -0.63 -1.71 116.97 122.88 1n1h h TYR 977 Ca 0.43 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 62.20 1n1h h TYR 977 Cb 0.21 0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 1n1h h TYR 977 CO -0.01 -0.19 -0.18 1.25 -1.64 0.00 0.00 178.16 177.39 1n1h h LEU 978 N -0.30 0.71 -4.10 2.82 5.85 -0.82 -3.24 115.31 116.23 1n1h h LEU 978 Ca -0.01 -0.42 -0.51 0.00 0.84 0.00 0.00 57.88 57.78 1n1h h LEU 978 Cb 0.26 -0.20 -0.20 0.00 0.37 0.00 0.00 40.66 40.89 1n1h h LEU 978 CO 0.01 0.98 0.59 0.23 -0.34 0.00 0.00 178.44 179.91 1n1h n MET 979 N -4.34 2.29 0.52 1.25 2.81 0.33 -4.61 117.12 115.38 1n1h n MET 979 Ca -0.03 -2.42 -0.21 0.00 -1.81 0.00 0.00 57.70 53.24 1n1h n MET 979 Cb 0.41 -2.00 -0.10 0.00 -0.71 0.00 0.00 33.22 30.81 1n1h n MET 979 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1n1h h GLN 980 N 2.25 -1.28 -6.29 0.03 4.20 -1.34 -3.41 115.11 109.27 1n1h h GLN 980 Ca 0.42 0.09 -0.57 0.00 0.06 0.00 0.00 58.65 58.66 1n1h h GLN 980 Cb 0.72 0.29 -0.04 0.00 0.30 0.00 0.00 27.48 28.75 1n1h h GLN 980 CO 1.06 -0.85 0.99 1.21 -0.67 0.00 0.00 178.83 180.57 1n1h s ASN 981 N -4.03 6.68 0.45 1.46 3.84 -1.26 -4.93 114.94 117.15 1n1h s ASN 981 Ca -0.20 1.44 0.20 0.00 0.21 0.00 0.00 52.86 54.51 1n1h s ASN 981 Cb 0.02 -2.54 1.17 0.00 -0.55 0.00 0.00 41.25 39.35 1n1h s ASN 981 CO 0.59 -1.04 1.90 -0.65 -2.79 0.00 0.00 177.10 175.12 1n1h h PRO 982 N 9.34 0.29 -0.99 0.43 0.11 -1.99 -2.07 132.00 137.11 1n1h h PRO 982 Ca -0.28 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.82 1n1h h PRO 982 Cb 1.11 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.11 1n1h h PRO 982 CO 1.01 0.19 0.66 1.49 -0.21 0.00 0.00 178.00 181.14 1n1h h GLU 983 N 0.30 1.30 0.22 1.05 4.81 -1.96 -1.14 114.58 119.16 1n1h h GLU 983 Ca 0.39 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.54 1n1h h GLU 983 Cb 1.10 -0.29 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1n1h h GLU 983 CO -0.11 0.86 -0.11 1.25 -0.73 0.00 0.00 179.01 180.18 1n1h h LEU 984 N 1.34 -0.25 -0.41 1.64 6.46 -1.74 -1.17 115.31 121.18 1n1h h LEU 984 Ca 0.37 -0.17 0.08 0.00 -0.12 0.00 0.00 57.88 58.04 1n1h h LEU 984 Cb -0.14 0.06 -0.08 0.00 -0.73 0.00 0.00 40.66 39.78 1n1h h LEU 984 CO -0.08 0.03 -0.07 0.50 -0.62 0.00 0.00 178.44 178.20 1n1h h LYS 985 N -0.54 0.03 -0.96 1.25 3.64 -1.51 0.18 116.57 118.67 1n1h h LYS 985 Ca -0.03 -0.00 0.15 0.00 -1.27 0.00 0.00 60.65 59.50 1n1h h LYS 985 Cb 0.40 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.13 1n1h h LYS 985 CO 0.05 0.02 0.61 1.03 -2.27 0.00 0.00 179.45 178.89 1n1h h SER 986 N 0.03 0.77 -0.60 4.20 0.87 -1.09 0.33 113.55 118.07 1n1h h SER 986 Ca 0.20 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.80 1n1h h SER 986 Cb 0.30 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.14 1n1h h SER 986 CO -0.40 0.37 0.29 0.03 -0.53 0.00 0.00 176.83 176.59 1n1h h ARG 987 N 0.81 0.86 -0.26 2.24 3.08 0.63 -2.41 114.38 119.31 1n1h h ARG 987 Ca 0.50 -0.12 -0.14 0.00 0.07 0.00 0.00 59.98 60.28 1n1h h ARG 987 Cb 0.70 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 1n1h h ARG 987 CO -0.26 0.69 -0.41 0.28 -1.07 0.00 0.00 179.97 179.19 1n1h h VAL 988 N 0.81 1.30 -0.24 2.04 2.07 -0.09 -2.41 116.25 119.73 1n1h h VAL 988 Ca 0.21 -1.59 -0.05 0.00 0.82 0.00 0.00 66.70 66.09 1n1h h VAL 988 Cb 0.11 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1n1h h VAL 988 CO -0.03 0.50 -0.07 -0.07 0.02 0.00 0.00 177.57 177.93 1n1h h LEU 989 N 0.52 0.35 0.20 2.57 3.38 -0.93 -0.61 115.31 120.78 1n1h h LEU 989 Ca 0.04 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1n1h h LEU 989 Cb 0.93 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1n1h h LEU 989 CO 0.08 0.47 -0.10 -0.09 0.09 0.00 0.00 178.44 178.89 1n1h h ARG 990 N 0.35 -0.26 -0.90 1.13 1.12 -1.25 -2.66 114.38 111.91 1n1h h ARG 990 Ca 0.07 0.02 0.23 0.00 -1.11 0.00 0.00 59.98 59.19 1n1h h ARG 990 Cb 0.36 0.06 -0.13 0.00 -0.01 0.00 0.00 29.97 30.25 1n1h h ARG 990 CO 0.02 0.07 0.40 0.78 -3.11 0.00 0.00 179.97 178.13 1n1h h GLY 991 N -0.63 1.56 0.00 2.80 0.00 -0.95 -1.08 103.07 104.77 1n1h h GLY 991 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1n1h h GLY 991 CO 0.05 -0.28 0.00 0.54 0.00 0.00 0.00 176.54 176.85 1n1h n ARG 992 N -5.05 0.00 -0.07 4.80 1.74 -0.28 0.30 116.66 118.11 1n1h n ARG 992 Ca 0.23 0.34 0.25 0.00 -0.77 0.00 0.00 57.85 57.90 1n1h n ARG 992 Cb 0.67 -1.32 0.67 0.00 -1.02 0.00 0.00 32.46 31.47 1n1h n ARG 992 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1n1h h SER 993 N 0.00 0.00 -0.09 0.55 4.64 -1.35 1.15 113.55 118.45 1n1h h SER 993 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1n1h h SER 993 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1n1h h SER 993 CO 0.00 0.00 -0.48 -0.33 -0.87 0.00 0.00 176.83 175.15 1n1h h GLU 994 N 0.00 0.49 -0.47 4.77 4.39 -0.99 -3.24 114.58 119.54 1n1h h GLU 994 Ca 0.34 -0.40 0.06 0.00 0.34 0.00 0.00 59.36 59.70 1n1h h GLU 994 Cb 1.77 0.08 -0.05 0.00 -0.10 0.00 0.00 28.75 30.45 1n1h h GLU 994 CO -0.00 1.04 0.18 2.35 -1.16 0.00 0.00 179.01 181.41 1n1h h TRP 995 N 0.07 0.32 0.00 4.33 2.91 0.60 -1.49 115.95 122.69 1n1h h TRP 995 Ca -0.03 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.01 1n1h h TRP 995 Cb 1.13 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.70 1n1h h TRP 995 CO 0.12 0.12 0.13 0.93 -1.03 0.00 0.00 178.44 178.71 1n1h h GLU 996 N 0.37 0.00 0.00 2.65 4.39 -1.34 0.11 114.58 120.75 1n1h h GLU 996 Ca 0.22 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.54 1n1h h GLU 996 Cb 0.20 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.79 1n1h h GLU 996 CO -0.21 0.00 -2.41 1.63 -1.16 0.00 0.00 179.01 176.86 1n1h n LYS 997 N -2.95 0.68 -0.00 2.33 5.02 -0.62 -4.67 118.16 117.93 1n1h n LYS 997 Ca -0.03 0.05 0.01 0.00 -2.02 0.00 0.00 58.31 56.33 1n1h n LYS 997 Cb 0.19 -1.53 -0.02 0.00 -0.02 0.00 0.00 35.03 33.65 1n1h n LYS 997 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1n1h n TYR 998 N -2.94 0.00 -0.01 2.13 4.02 -0.84 -4.93 117.16 114.60 1n1h n TYR 998 Ca -0.37 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.51 1n1h n TYR 998 Cb 1.10 -0.08 -0.01 0.00 -0.02 0.00 0.00 39.34 40.33 1n1h n TYR 998 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1n1h n GLY 999 N 2.44 -0.04 3.63 2.72 0.00 0.18 -4.62 105.19 109.51 1n1h n GLY 999 Ca -0.01 -0.02 -0.51 0.00 0.00 0.00 0.00 46.02 45.49 1n1h n GLY 999 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1h n ALA 1000N -2.28 -0.16 0.00 4.61 0.00 -0.06 -1.23 120.51 121.39 1n1h n ALA 1000Ca -0.02 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1n1h n ALA 1000Cb 0.53 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.80 1n1h n ALA 1000CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1h n GLY 1001N 2.98 3.10 0.07 0.00 0.00 -1.26 -4.87 105.19 105.21 1n1h n GLY 1001Ca 0.19 -0.94 -0.13 0.00 0.00 0.00 0.00 46.02 45.15 1n1h n GLY 1001CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1n1h h ILE 1002N 0.00 1.09 -3.33 -0.61 2.04 -1.53 -3.45 117.51 111.72 1n1h h ILE 1002Ca 0.00 -0.43 -0.38 0.00 1.00 0.00 0.00 64.86 65.06 1n1h h ILE 1002Cb 0.00 1.38 -0.14 0.00 -0.74 0.00 0.00 36.82 37.31 1n1h h ILE 1002CO 0.00 0.11 -0.66 0.27 0.00 0.00 0.00 178.15 177.87 1n1h s ILE 1003N -5.43 1.02 0.00 -0.67 -4.36 -1.25 -4.46 121.20 106.05 1n1h s ILE 1003Ca -0.14 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.22 1n1h s ILE 1003Cb 0.04 -2.35 0.00 0.00 1.25 0.00 0.00 42.46 41.40 1n1h s ILE 1003CO 0.66 -0.32 0.91 1.41 0.24 0.00 0.00 174.94 177.83 1n1h n HIS 1004N -0.42 0.00 -1.22 1.37 8.25 -1.25 -4.71 115.22 117.24 1n1h n HIS 1004Ca -0.05 -0.41 -0.01 0.00 -0.26 0.00 0.00 57.72 56.99 1n1h n HIS 1004Cb 0.64 -0.04 0.23 0.00 1.12 0.00 0.00 29.99 31.94 1n1h n HIS 1004CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1n1h n ASN 1005N -0.41 3.38 -4.37 0.41 3.02 -1.26 -4.81 115.26 111.23 1n1h n ASN 1005Ca 0.00 -3.42 -0.53 0.00 -0.03 0.00 0.00 54.58 50.60 1n1h n ASN 1005Cb 0.24 -0.63 -0.10 0.00 -0.61 0.00 0.00 39.78 38.67 1n1h n ASN 1005CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1n1h n PRO 1006N -0.79 0.45 -2.20 3.52 -0.02 -1.26 -4.87 135.00 129.83 1n1h n PRO 1006Ca 0.32 0.11 -0.38 0.00 -2.02 0.00 0.00 63.50 61.53 1n1h n PRO 1006Cb 1.08 -1.94 -0.01 0.00 -0.02 0.00 0.00 33.50 32.61 1n1h n PRO 1006CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1n1h s PRO 1007N 6.56 3.89 -0.11 0.52 0.02 -1.26 -5.02 135.00 139.60 1n1h s PRO 1007Ca 1.17 1.91 -0.17 0.00 0.02 0.00 0.00 61.00 63.94 1n1h s PRO 1007Cb -1.17 -2.59 0.04 0.00 0.02 0.00 0.00 34.50 30.80 1n1h s PRO 1007CO 0.56 -0.48 0.43 0.45 -0.33 0.00 0.00 177.00 177.63 1n1h s SER 1008N -1.10 -0.40 0.61 2.53 0.15 -1.26 -4.56 113.70 109.66 1n1h s SER 1008Ca 0.60 0.64 0.37 0.00 0.70 0.00 0.00 55.95 58.26 1n1h s SER 1008Cb -0.32 0.70 2.00 0.00 -1.71 0.00 0.00 66.02 66.68 1n1h s SER 1008CO 0.40 -0.28 2.25 -0.07 1.20 0.00 0.00 173.24 176.74 1n1h h LEU 1009N 4.77 0.00 -0.09 3.45 3.38 -1.39 0.24 115.31 125.67 1n1h h LEU 1009Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1n1h h LEU 1009Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1n1h h LEU 1009CO 0.29 0.02 0.00 0.49 0.09 0.00 0.00 178.44 179.33 1n1h n PHE 1010N -3.33 0.12 0.05 1.13 3.72 -1.26 -2.76 117.46 115.13 1n1h n PHE 1010Ca -0.02 0.05 -0.23 0.00 -0.05 0.00 0.00 57.45 57.20 1n1h n PHE 1010Cb 0.14 -0.57 -0.15 0.00 -0.94 0.00 0.00 39.48 37.96 1n1h n PHE 1010CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1n1h h ASP 1011N 0.00 0.56 -0.82 4.37 3.32 -1.34 -3.39 116.42 119.11 1n1h h ASP 1011Ca 0.00 -0.94 0.16 0.00 0.02 0.00 0.00 57.03 56.27 1n1h h ASP 1011Cb 0.30 -0.18 -0.15 0.00 0.22 0.00 0.00 39.33 39.51 1n1h h ASP 1011CO 0.00 1.80 -0.22 0.52 -1.72 0.00 0.00 179.24 179.62 1n1h n VAL 1012N -3.59 -0.35 -0.25 -1.35 0.31 -1.11 0.15 118.33 112.13 1n1h n VAL 1012Ca -0.27 1.87 0.08 0.00 -0.01 0.00 0.00 64.34 66.02 1n1h n VAL 1012Cb 1.06 -2.58 0.33 0.00 -0.91 0.00 0.00 33.84 31.73 1n1h n VAL 1012CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1n1h h PRO 1013N 0.00 0.79 -0.22 5.55 0.11 -1.76 0.22 132.00 136.69 1n1h h PRO 1013Ca 0.38 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 66.25 1n1h h PRO 1013Cb 0.59 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.52 1n1h h PRO 1013CO -0.84 0.52 -0.61 0.45 -0.21 0.00 0.00 178.00 177.31 1n1h h HIS 1014N 0.81 0.97 -0.24 0.65 3.86 0.12 -2.13 115.15 119.18 1n1h h HIS 1014Ca 0.39 -0.37 -0.13 0.00 -1.16 0.00 0.00 60.37 59.10 1n1h h HIS 1014Cb 0.42 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.71 1n1h h HIS 1014CO -0.00 1.17 -0.41 0.87 0.86 0.00 0.00 177.93 180.43 1n1h h LYS 1015N 0.56 0.58 -0.72 2.45 1.57 -0.39 -2.47 116.57 118.15 1n1h h LYS 1015Ca -0.01 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.42 1n1h h LYS 1015Cb 1.21 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 1n1h h LYS 1015CO 0.13 0.88 0.21 -1.49 -0.57 0.00 0.00 179.45 178.60 1n1h h TRP 1016N 0.47 1.18 -0.18 -1.35 6.55 -0.50 -0.78 115.95 121.34 1n1h h TRP 1016Ca 0.04 -0.13 -0.02 0.00 0.95 0.00 0.00 58.89 59.74 1n1h h TRP 1016Cb 0.91 -0.34 -0.01 0.00 -0.86 0.00 0.00 29.16 28.87 1n1h h TRP 1016CO 0.04 0.94 0.05 -0.92 -1.05 0.00 0.00 178.44 177.50 1n1h h TYR 1017N 1.07 0.30 -0.91 0.49 5.03 -1.26 -1.50 116.97 120.20 1n1h h TYR 1017Ca 0.23 -0.03 0.05 0.00 2.58 0.00 0.00 58.73 61.55 1n1h h TYR 1017Cb 0.33 -0.09 -0.06 0.00 1.55 0.00 0.00 36.73 38.47 1n1h h TYR 1017CO 0.03 0.40 0.58 1.96 -1.32 0.00 0.00 178.16 179.81 1n1h h GLN 1018N 0.11 1.07 -0.63 1.82 4.20 -1.29 0.54 115.11 120.93 1n1h h GLN 1018Ca 0.06 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 1n1h h GLN 1018Cb 0.25 -0.24 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1n1h h GLN 1018CO -0.00 0.71 0.25 0.78 -0.67 0.00 0.00 178.83 179.89 1n1h h GLY 1019N 1.10 1.01 1.77 3.46 0.00 -0.86 0.12 103.07 109.67 1n1h h GLY 1019Ca 0.37 -0.55 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 1n1h h GLY 1019CO -0.14 0.52 -0.26 0.00 0.00 0.00 0.00 176.54 176.66 1n1h h ALA 1020N 1.10 1.28 0.57 3.60 0.00 -0.56 -2.67 119.26 122.58 1n1h h ALA 1020Ca 0.21 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1n1h h ALA 1020Cb 0.21 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1n1h h ALA 1020CO -0.02 0.48 -0.27 1.96 0.00 0.00 0.00 179.25 181.40 1n1h h GLN 1021N 0.25 -0.73 0.00 0.00 4.20 -0.10 -1.96 115.11 116.76 1n1h h GLN 1021Ca 0.04 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1n1h h GLN 1021Cb 0.60 0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.54 1n1h h GLN 1021CO 0.04 -0.49 0.05 0.39 -0.67 0.00 0.00 178.83 178.15 1n1h n GLU 1022N -4.81 0.00 0.15 1.46 -0.58 0.34 -0.85 120.64 116.35 1n1h n GLU 1022Ca -0.09 0.40 0.12 0.00 -0.42 0.00 0.00 57.16 57.17 1n1h n GLU 1022Cb 0.30 -1.55 0.16 0.00 -0.57 0.00 0.00 31.44 29.78 1n1h n GLU 1022CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n1h h ALA 1023N 1.78 0.82 -2.31 0.62 0.00 -1.39 -3.47 119.26 115.31 1n1h h ALA 1023Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1n1h h ALA 1023Cb 0.10 0.00 0.05 0.00 0.00 0.00 0.00 17.79 17.95 1n1h h ALA 1023CO 0.00 0.00 0.38 0.00 0.00 0.00 0.00 179.25 179.63 1n1h s ALA 1024N -3.23 2.82 0.20 0.00 0.00 -0.03 -4.94 121.76 116.58 1n1h s ALA 1024Ca 0.06 0.32 -0.31 0.00 0.00 0.00 0.00 51.96 52.03 1n1h s ALA 1024Cb 0.08 -3.20 -0.10 0.00 0.00 0.00 0.00 23.12 19.90 1n1h s ALA 1024CO 0.70 -0.68 1.52 0.42 0.00 0.00 0.00 175.76 177.71 1n1h s ILE 1025N -2.53 2.65 0.68 0.00 1.01 -1.26 -4.99 121.20 116.76 1n1h s ILE 1025Ca 0.62 0.49 -0.11 0.00 0.00 0.00 0.00 60.65 61.66 1n1h s ILE 1025Cb -0.14 -3.31 0.01 0.00 0.01 0.00 0.00 42.46 39.02 1n1h s ILE 1025CO 0.37 0.05 1.07 0.00 0.00 0.00 0.00 174.94 176.42 1n1h s ALA 1026N 0.71 2.96 0.30 9.38 0.00 -1.26 -5.08 121.76 128.76 1n1h s ALA 1026Ca 0.66 -0.36 0.06 0.00 0.00 0.00 0.00 51.96 52.31 1n1h s ALA 1026Cb -0.43 -2.98 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 1n1h s ALA 1026CO 0.36 -1.05 0.43 0.95 0.00 0.00 0.00 175.76 176.44 1n1h s THR 1027N -3.30 4.55 0.47 0.00 -4.23 -1.26 -4.99 115.64 106.88 1n1h s THR 1027Ca 0.57 -0.99 0.26 0.00 -1.18 0.00 0.00 61.69 60.35 1n1h s THR 1027Cb -0.11 -3.59 0.29 0.00 1.34 0.00 0.00 72.50 70.44 1n1h s THR 1027CO 0.51 -0.23 2.11 -0.09 -0.54 0.00 0.00 174.62 176.39 1n1h h ARG 1028N 1.00 0.00 0.05 3.99 2.43 -1.99 -1.49 114.38 118.37 1n1h h ARG 1028Ca -0.48 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1n1h h ARG 1028Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1n1h h ARG 1028CO 0.56 0.10 -0.02 0.93 -1.51 0.00 0.00 179.97 180.02 1n1h h GLU 1029N 0.00 -0.06 0.00 0.20 3.07 -1.99 -1.15 114.58 114.65 1n1h h GLU 1029Ca -0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1n1h h GLU 1029Cb 0.24 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1n1h h GLU 1029CO 0.01 0.37 -0.01 0.93 -1.40 0.00 0.00 179.01 178.91 1n1h h GLU 1030N -0.51 0.00 -0.03 2.33 5.08 -1.76 0.18 114.58 119.87 1n1h h GLU 1030Ca -0.01 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.10 1n1h h GLU 1030Cb 0.46 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.73 1n1h h GLU 1030CO 0.01 0.01 -0.99 1.25 -1.00 0.00 0.00 179.01 178.29 1n1h h LEU 1031N 0.00 0.90 -0.93 1.33 5.85 -1.00 -2.60 115.31 118.86 1n1h h LEU 1031Ca -0.00 -0.70 -0.09 0.00 0.84 0.00 0.00 57.88 57.93 1n1h h LEU 1031Cb 0.02 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 1n1h h LEU 1031CO 0.00 1.50 -0.22 0.00 -0.34 0.00 0.00 178.44 179.38 1n1h h ALA 1032N 0.45 1.09 -0.62 1.25 0.00 0.19 -2.50 119.26 119.12 1n1h h ALA 1032Ca -0.11 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 1n1h h ALA 1032Cb 1.64 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.27 1n1h h ALA 1032CO 0.20 0.56 0.18 0.93 0.00 0.00 0.00 179.25 181.11 1n1h h GLU 1033N 0.47 0.97 -0.67 0.00 5.08 -1.00 -1.60 114.58 117.84 1n1h h GLU 1033Ca 0.07 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 1n1h h GLU 1033Cb 0.64 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1n1h h GLU 1033CO 0.05 0.87 0.16 1.98 -1.00 0.00 0.00 179.01 181.07 1n1h h MET 1034N 0.90 1.06 0.55 2.33 4.05 -1.19 -2.30 114.93 120.33 1n1h h MET 1034Ca 0.20 -0.24 -0.03 0.00 -0.28 0.00 0.00 59.70 59.35 1n1h h MET 1034Cb 0.32 -0.14 0.01 0.00 -0.80 0.00 0.00 31.60 30.98 1n1h h MET 1034CO -0.00 0.94 -0.27 -0.44 0.23 0.00 0.00 176.91 177.37 1n1h h ASP 1035N 1.01 -0.63 -0.96 1.39 3.32 -1.20 -2.59 116.42 116.76 1n1h h ASP 1035Ca 0.21 -0.03 0.31 0.00 0.02 0.00 0.00 57.03 57.54 1n1h h ASP 1035Cb 0.35 0.16 -0.16 0.00 0.22 0.00 0.00 39.33 39.91 1n1h h ASP 1035CO 0.00 -0.36 0.39 -0.08 -1.72 0.00 0.00 179.24 177.48 1n1h h GLU 1036N -0.88 0.18 0.02 3.56 4.57 -1.18 0.29 114.58 121.14 1n1h h GLU 1036Ca -0.08 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1n1h h GLU 1036Cb 0.62 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1n1h h GLU 1036CO 0.12 0.12 -0.01 1.15 -1.18 0.00 0.00 179.01 179.21 1n1h h THR 1037N 0.19 1.00 -0.25 0.32 2.02 -1.17 0.33 112.91 115.35 1n1h h THR 1037Ca 0.68 -0.06 -0.07 0.00 0.77 0.00 0.00 66.41 67.74 1n1h h THR 1037Cb 1.56 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.99 1n1h h THR 1037CO -0.69 0.01 -0.16 -0.07 0.37 0.00 0.00 175.52 174.98 1n1h h LEU 1038N -0.05 0.42 0.00 2.58 3.38 -0.29 -2.35 115.31 119.00 1n1h h LEU 1038Ca -0.00 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1n1h h LEU 1038Cb 0.04 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1n1h h LEU 1038CO 0.00 0.60 -0.07 -0.03 0.09 0.00 0.00 178.44 179.03 1n1h h MET 1039N 0.40 0.00 0.21 1.13 4.05 -0.19 -2.83 114.93 117.70 1n1h h MET 1039Ca 0.07 0.00 -0.30 0.00 -0.28 0.00 0.00 59.70 59.19 1n1h h MET 1039Cb 0.51 0.00 0.03 0.00 -0.80 0.00 0.00 31.60 31.34 1n1h h MET 1039CO 0.03 0.02 -1.30 -0.09 0.23 0.00 0.00 176.91 175.80 1n1h h ARG 1040N 0.00 0.51 0.00 0.39 2.43 -0.06 -2.82 114.38 114.83 1n1h h ARG 1040Ca -0.00 -0.83 -0.03 0.00 -0.81 0.00 0.00 59.98 58.30 1n1h h ARG 1040Cb 1.01 0.30 -0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1n1h h ARG 1040CO 0.00 1.39 -0.16 0.00 -1.51 0.00 0.00 179.97 179.69 1n1h h ALA 1041N 0.16 1.24 0.02 2.80 0.00 -1.45 -0.92 119.26 121.12 1n1h h ALA 1041Ca -0.22 -0.15 -0.21 0.00 0.00 0.00 0.00 54.91 54.34 1n1h h ALA 1041Cb 2.01 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.77 1n1h h ALA 1041CO 0.25 0.20 -0.92 -0.09 0.00 0.00 0.00 179.25 178.68 1n1h h ARG 1042N 0.00 0.17 0.06 0.00 2.43 -1.46 -3.32 114.38 112.27 1n1h h ARG 1042Ca -0.00 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 58.96 1n1h h ARG 1042Cb 0.44 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1n1h h ARG 1042CO 0.02 0.98 -0.03 0.00 -1.51 0.00 0.00 179.97 179.43 1n1h h ARG 1043N 0.09 -0.08 -6.23 0.20 3.08 -1.14 -3.46 114.38 106.83 1n1h h ARG 1043Ca -0.05 0.01 -0.59 0.00 0.07 0.00 0.00 59.98 59.41 1n1h h ARG 1043Cb 1.58 0.02 0.17 0.00 0.08 0.00 0.00 29.97 31.82 1n1h h ARG 1043CO 0.14 0.51 -0.78 1.58 -1.07 0.00 0.00 179.97 180.35 1n1h n HIS 1044N -4.78 -1.80 -4.34 3.04 -0.00 -0.41 -5.00 115.22 101.93 1n1h n HIS 1044Ca -0.08 0.46 -0.29 0.00 0.46 0.00 0.00 57.72 58.28 1n1h n HIS 1044Cb 0.31 -1.82 -0.12 0.00 -0.12 0.00 0.00 29.99 28.24 1n1h n HIS 1044CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 1n1h s SER 1045N -1.07 3.69 0.39 0.26 1.04 -1.26 -4.88 113.70 111.86 1n1h s SER 1045Ca 0.62 -0.65 0.06 0.00 0.48 0.00 0.00 55.95 56.46 1n1h s SER 1045Cb -0.49 -0.43 -0.07 0.00 0.10 0.00 0.00 66.02 65.13 1n1h s SER 1045CO 0.60 0.17 0.03 -0.31 0.98 0.00 0.00 173.24 174.71 1n1h s TYR 1046N -1.21 2.33 0.00 5.02 2.02 -1.26 -5.05 117.35 119.19 1n1h s TYR 1046Ca 0.18 -0.77 0.00 0.00 -0.37 0.00 0.00 57.07 56.10 1n1h s TYR 1046Cb -0.10 -1.61 0.00 0.00 -0.40 0.00 0.00 41.96 39.85 1n1h s TYR 1046CO 0.09 0.30 0.51 -1.13 -1.57 0.00 0.00 175.55 173.75 1n1h n SER 1047N -0.89 0.97 -3.52 2.29 3.41 -1.26 -4.87 113.62 109.75 1n1h n SER 1047Ca -0.04 -1.18 -0.01 0.00 -0.26 0.00 0.00 58.87 57.38 1n1h n SER 1047Cb 0.67 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.63 1n1h n SER 1047CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1n1h s SER 1048N -0.18 -0.01 0.00 4.04 1.04 -1.26 -4.93 113.70 112.40 1n1h s SER 1048Ca 0.00 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1n1h s SER 1048Cb 0.00 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1n1h s SER 1048CO 0.00 -0.77 0.00 0.49 0.98 0.00 0.00 173.24 173.94 1n1h n PHE 1049N -0.73 0.00 -1.23 5.02 3.72 -1.26 -5.06 117.46 117.92 1n1h n PHE 1049Ca -0.02 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.07 1n1h n PHE 1049Cb 0.59 0.00 0.10 0.00 -0.94 0.00 0.00 39.48 39.23 1n1h n PHE 1049CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1n1h s SER 1050N -1.00 4.33 0.26 4.37 1.04 -1.26 -4.84 113.70 116.59 1n1h s SER 1050Ca 0.00 1.80 -0.05 0.00 0.48 0.00 0.00 55.95 58.18 1n1h s SER 1050Cb 0.00 -2.48 0.30 0.00 0.10 0.00 0.00 66.02 63.93 1n1h s SER 1050CO 0.00 -2.14 1.86 0.11 0.98 0.00 0.00 173.24 174.05 1n1h h LYS 1051N -1.21 1.12 -0.33 4.02 1.57 -1.99 -2.19 116.57 117.56 1n1h h LYS 1051Ca -0.44 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.16 1n1h h LYS 1051Cb 1.24 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1n1h h LYS 1051CO 0.51 0.85 0.10 -0.07 -0.57 0.00 0.00 179.45 180.27 1n1h h LEU 1052N 1.12 0.49 -0.74 2.94 4.07 -1.97 -2.84 115.31 118.37 1n1h h LEU 1052Ca 0.28 -0.21 -0.09 0.00 0.08 0.00 0.00 57.88 57.94 1n1h h LEU 1052Cb 0.08 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 1n1h h LEU 1052CO -0.04 0.57 0.01 0.25 -1.08 0.00 0.00 178.44 178.15 1n1h h LEU 1053N 0.38 0.94 -2.08 1.67 5.85 -1.90 -1.74 115.31 118.44 1n1h h LEU 1053Ca 0.11 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 1n1h h LEU 1053Cb 0.26 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.04 1n1h h LEU 1053CO -0.00 0.99 -0.08 -0.33 -0.34 0.00 0.00 178.44 178.68 1n1h h GLU 1054N 0.89 0.00 0.05 1.25 4.39 -1.34 -1.91 114.58 117.91 1n1h h GLU 1054Ca 0.17 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.73 1n1h h GLU 1054Cb 0.51 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1n1h h GLU 1054CO 0.03 0.08 -0.55 0.00 -1.16 0.00 0.00 179.01 177.41 1n1h h ALA 1055N 1.92 0.00 -0.70 3.43 0.00 -1.15 -3.30 119.26 119.46 1n1h h ALA 1055Ca -0.00 -0.59 0.03 0.00 0.00 0.00 0.00 54.91 54.36 1n1h h ALA 1055Cb 0.21 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1n1h h ALA 1055CO 0.01 0.28 0.46 1.88 0.00 0.00 0.00 179.25 181.88 1n1h h TYR 1056N -0.35 0.82 0.00 0.00 0.05 -0.72 -2.14 116.97 114.62 1n1h h TYR 1056Ca -0.08 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.72 1n1h h TYR 1056Cb 1.34 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 38.80 1n1h h TYR 1056CO 0.18 0.48 0.00 -0.07 -1.05 0.00 0.00 178.16 177.70 1n1h h LEU 1057N 0.85 0.00 -0.96 3.88 3.38 -1.44 -1.25 115.31 119.77 1n1h h LEU 1057Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1n1h h LEU 1057Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1n1h h LEU 1057CO -0.08 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.38 1n1h h LEU 1058N 0.00 0.00 -9.05 1.67 3.38 -1.49 -3.43 115.31 106.39 1n1h h LEU 1058Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1n1h h LEU 1058Cb 0.11 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.74 1n1h h LEU 1058CO 0.00 0.00 -0.10 -0.69 0.09 0.00 0.00 178.44 177.74 1n1h s VAL 1059N -3.45 5.13 0.06 1.22 1.01 -0.47 -1.41 120.40 122.48 1n1h s VAL 1059Ca 0.03 0.81 0.06 0.00 0.00 0.00 0.00 61.98 62.88 1n1h s VAL 1059Cb 0.09 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1n1h s VAL 1059CO 0.48 0.16 -0.10 -0.54 0.00 0.00 0.00 175.10 175.11 1n1h s LYS 1060N 1.85 2.27 0.40 2.72 3.01 0.23 -4.97 119.74 125.26 1n1h s LYS 1060Ca 0.20 -0.91 0.03 0.00 -1.01 0.00 0.00 55.97 54.28 1n1h s LYS 1060Cb -0.15 -2.36 -0.04 0.00 -1.01 0.00 0.00 37.83 34.27 1n1h s LYS 1060CO 0.09 0.54 0.08 -1.58 0.51 0.00 0.00 175.35 174.99 1n1h s TRP 1061N -1.10 1.91 -0.18 3.18 0.52 -1.26 -0.87 118.94 121.13 1n1h s TRP 1061Ca 0.19 -1.08 -0.02 0.00 0.02 0.00 0.00 56.10 55.21 1n1h s TRP 1061Cb -0.11 -1.32 0.05 0.00 -1.15 0.00 0.00 33.47 30.94 1n1h s TRP 1061CO 0.11 -0.05 -0.00 1.03 0.02 0.00 0.00 176.95 178.05 1n1h s ARG 1062N -3.80 0.99 0.11 4.98 0.52 0.55 -4.68 118.95 117.62 1n1h s ARG 1062Ca 0.25 -0.49 -0.30 0.00 -0.52 0.00 0.00 55.73 54.66 1n1h s ARG 1062Cb 0.05 -2.07 -0.06 0.00 0.52 0.00 0.00 34.95 33.39 1n1h s ARG 1062CO 0.13 -0.56 1.12 1.41 0.02 0.00 0.00 175.30 177.42 1n1h s MET 1063N 1.74 4.53 0.00 3.54 1.75 -1.26 -0.18 119.30 129.42 1n1h s MET 1063Ca -0.01 1.69 0.00 0.00 -1.25 0.00 0.00 55.69 56.12 1n1h s MET 1063Cb -0.17 -3.33 0.00 0.00 2.84 0.00 0.00 34.83 34.17 1n1h s MET 1063CO -0.07 -0.06 0.00 0.00 -0.65 0.00 0.00 175.02 174.24 1n1h s GLU 1065N 3.61 3.34 0.46 0.00 8.01 -1.26 -4.45 118.70 128.41 1n1h s GLU 1065Ca 0.00 2.29 -0.24 0.00 0.01 0.00 0.00 54.97 57.03 1n1h s GLU 1065Cb 0.00 -2.40 -0.07 0.00 -4.31 0.00 0.00 34.13 27.35 1n1h s GLU 1065CO 0.00 -1.05 1.25 0.00 0.01 0.00 0.00 175.26 175.47 1n1h s ALA 1066N -1.27 3.04 0.92 5.21 0.00 -1.26 -1.68 121.76 126.71 1n1h s ALA 1066Ca 0.68 1.11 -0.11 0.00 0.00 0.00 0.00 51.96 53.63 1n1h s ALA 1066Cb -0.41 -3.45 0.14 0.00 0.00 0.00 0.00 23.12 19.40 1n1h s ALA 1066CO 0.51 -0.85 1.09 1.03 0.00 0.00 0.00 175.76 177.54 1n1h s ARG 1067N -2.57 1.07 0.31 0.00 0.52 -0.29 -4.84 118.95 113.15 1n1h s ARG 1067Ca 0.63 0.90 -0.06 0.00 -0.52 0.00 0.00 55.73 56.68 1n1h s ARG 1067Cb -0.34 -1.78 -0.05 0.00 0.52 0.00 0.00 34.95 33.29 1n1h s ARG 1067CO 0.42 -2.39 0.59 -1.21 0.02 0.00 0.00 175.30 172.73 1n1h s GLU 1068N -4.87 3.66 0.25 3.54 0.41 -1.26 -4.95 118.70 115.49 1n1h s GLU 1068Ca 0.64 0.09 -0.31 0.00 -0.41 0.00 0.00 54.97 54.98 1n1h s GLU 1068Cb -0.19 -2.60 -0.12 0.00 -1.78 0.00 0.00 34.13 29.44 1n1h s GLU 1068CO 0.58 0.17 1.61 -2.30 -0.49 0.00 0.00 175.26 174.83 1n1h n PRO 1069N -1.01 2.61 0.04 0.39 -0.02 -1.26 -4.71 135.00 131.03 1n1h n PRO 1069Ca -0.01 0.93 0.12 0.00 -2.02 0.00 0.00 63.50 62.52 1n1h n PRO 1069Cb 0.54 -2.72 0.08 0.00 -0.02 0.00 0.00 33.50 31.38 1n1h n PRO 1069CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1n1h n SER 1070N 2.79 0.65 -3.81 2.55 7.64 0.17 -4.91 113.62 118.70 1n1h n SER 1070Ca 0.12 -0.04 -0.11 0.00 1.01 0.00 0.00 58.87 59.85 1n1h n SER 1070Cb 0.35 0.54 -0.08 0.00 -1.01 0.00 0.00 64.21 64.01 1n1h n SER 1070CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1n1h s VAL 1071N -3.20 0.10 0.20 0.44 -7.23 -1.23 -5.00 120.40 104.49 1n1h s VAL 1071Ca 0.04 -0.83 -0.32 0.00 -1.81 0.00 0.00 61.98 59.05 1n1h s VAL 1071Cb 0.14 -0.95 -0.13 0.00 0.56 0.00 0.00 36.38 36.00 1n1h s VAL 1071CO 0.77 -0.46 1.61 -0.67 -0.31 0.00 0.00 175.10 176.04 1n1h n ASP 1072N 0.59 3.47 0.00 4.85 -0.08 -1.26 -4.87 116.55 119.25 1n1h n ASP 1072Ca -0.18 1.09 0.09 0.00 -1.51 0.00 0.00 54.79 54.28 1n1h n ASP 1072Cb 0.59 -1.50 0.46 0.00 2.34 0.00 0.00 41.12 43.01 1n1h n ASP 1072CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1n1h n LEU 1073N 3.29 0.00 -0.12 -2.67 4.32 -1.26 -1.91 117.00 118.66 1n1h n LEU 1073Ca 0.15 0.29 0.11 0.00 -0.02 0.00 0.00 56.01 56.54 1n1h n LEU 1073Cb 0.32 -0.29 0.08 0.00 -1.62 0.00 0.00 43.42 41.91 1n1h n LEU 1073CO 0.64 -0.11 0.26 0.54 -1.22 0.00 0.00 177.39 177.50 1n1h n ARG 1074N -1.29 0.32 -2.63 3.23 1.74 -1.26 -4.93 116.66 111.84 1n1h n ARG 1074Ca 0.09 -0.24 -0.43 0.00 -0.77 0.00 0.00 57.85 56.50 1n1h n ARG 1074Cb 0.15 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.07 1n1h n ARG 1074CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1n1h s LEU 1075N -2.84 3.72 -0.07 0.55 2.96 -0.80 -4.76 118.68 117.43 1n1h s LEU 1075Ca 0.13 0.57 -0.30 0.00 -0.22 0.00 0.00 54.13 54.31 1n1h s LEU 1075Cb 0.17 -3.52 -0.04 0.00 0.50 0.00 0.00 46.19 43.30 1n1h s LEU 1075CO 0.72 -1.16 1.37 -2.84 -1.32 0.00 0.00 176.35 173.12 1n1h s PRO 1076N 4.23 4.26 -0.07 0.98 0.02 -1.26 -4.86 135.00 138.30 1n1h s PRO 1076Ca 0.47 1.85 0.04 0.00 0.02 0.00 0.00 61.00 63.38 1n1h s PRO 1076Cb -0.08 -3.71 -0.07 0.00 0.02 0.00 0.00 34.50 30.66 1n1h s PRO 1076CO 0.28 -0.64 -0.01 1.28 -0.33 0.00 0.00 177.00 177.57 1n1h n LEU 1077N 6.06 1.03 -3.30 -5.54 7.99 -1.26 -4.18 117.00 117.79 1n1h n LEU 1077Ca 0.14 -0.02 -0.05 0.00 -0.01 0.00 0.00 56.01 56.07 1n1h n LEU 1077Cb 0.44 0.01 -0.06 0.00 -0.11 0.00 0.00 43.42 43.70 1n1h n LEU 1077CO 0.58 0.32 0.01 0.00 -1.51 0.00 0.00 177.39 176.79 1n1h n ALA 1079N 5.38 -0.20 0.00 0.00 0.00 -0.53 -0.07 120.51 125.10 1n1h n ALA 1079Ca -0.03 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1n1h n ALA 1079Cb 0.50 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1n1h n ALA 1079CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n1h n GLY 1080N 2.89 1.81 3.33 0.00 0.00 -1.26 -4.55 105.19 107.41 1n1h n GLY 1080Ca 0.18 -0.17 -0.46 0.00 0.00 0.00 0.00 46.02 45.58 1n1h n GLY 1080CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n1h s ILE 1081N -1.66 5.75 0.32 -0.61 -1.09 0.90 -4.62 121.20 120.19 1n1h s ILE 1081Ca 0.00 -2.83 0.04 0.00 -2.23 0.00 0.00 60.65 55.63 1n1h s ILE 1081Cb 0.00 -4.52 -0.02 0.00 -1.58 0.00 0.00 42.46 36.34 1n1h s ILE 1081CO 0.00 -1.09 0.31 1.51 -1.23 0.00 0.00 174.94 174.44 1n1h s ASP 1082N 1.84 1.31 0.00 3.58 1.47 -1.26 -4.59 116.67 119.01 1n1h s ASP 1082Ca 0.23 -1.65 0.00 0.00 1.18 0.00 0.00 52.55 52.31 1n1h s ASP 1082Cb -0.10 0.56 0.00 0.00 -0.34 0.00 0.00 42.92 43.04 1n1h s ASP 1082CO -0.09 -1.09 0.49 -2.65 0.68 0.00 0.00 175.17 172.52 1n1h n PRO 1083N -0.57 0.00 0.02 2.11 -0.02 -1.26 0.42 135.00 135.70 1n1h n PRO 1083Ca 0.05 0.11 0.11 0.00 -2.02 0.00 0.00 63.50 61.76 1n1h n PRO 1083Cb 0.63 -1.56 0.08 0.00 -0.02 0.00 0.00 33.50 32.62 1n1h n PRO 1083CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1n1h n LEU 1084N -0.99 0.64 -3.07 2.45 4.77 -1.26 -4.32 117.00 115.21 1n1h n LEU 1084Ca 0.00 -0.05 -0.26 0.00 -0.03 0.00 0.00 56.01 55.67 1n1h n LEU 1084Cb 0.06 -0.13 -0.05 0.00 -2.33 0.00 0.00 43.42 40.97 1n1h n LEU 1084CO 0.00 0.08 0.10 -3.20 -1.33 0.00 0.00 177.39 173.04 1n1h n ASN 1085N -1.81 4.01 -0.24 -1.43 2.85 0.17 -5.01 115.26 113.80 1n1h n ASN 1085Ca 0.03 -3.57 -0.06 0.00 -0.11 0.00 0.00 54.58 50.87 1n1h n ASN 1085Cb 0.40 -0.59 -0.06 0.00 1.24 0.00 0.00 39.78 40.77 1n1h n ASN 1085CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1n1h n SER 1086N 0.08 -0.59 -0.01 1.20 3.41 -1.26 -1.97 113.62 114.48 1n1h n SER 1086Ca 0.30 1.02 -0.12 0.00 -0.26 0.00 0.00 58.87 59.81 1n1h n SER 1086Cb 0.41 -0.14 -0.08 0.00 -0.26 0.00 0.00 64.21 64.14 1n1h n SER 1086CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1n1h h ASP 1087N 0.00 0.08 -0.47 4.04 3.58 -1.93 0.11 116.42 121.82 1n1h h ASP 1087Ca 0.09 -0.31 0.05 0.00 0.42 0.00 0.00 57.03 57.28 1n1h h ASP 1087Cb 0.23 -0.02 -0.05 0.00 1.72 0.00 0.00 39.33 41.21 1n1h h ASP 1087CO -0.53 0.36 0.20 -0.65 -2.88 0.00 0.00 179.24 175.74 1n1h h PRO 1088N -0.22 0.38 0.59 0.28 0.11 -1.90 -1.62 132.00 129.62 1n1h h PRO 1088Ca 0.01 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.08 1n1h h PRO 1088Cb 0.33 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.35 1n1h h PRO 1088CO 0.00 0.25 -0.35 0.35 -0.21 0.00 0.00 178.00 178.04 1n1h h PHE 1089N 0.39 -0.93 -0.70 0.65 3.57 -1.30 -1.21 116.94 117.41 1n1h h PHE 1089Ca 0.22 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.79 1n1h h PHE 1089Cb 0.18 0.33 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 1n1h h PHE 1089CO -0.13 -0.54 0.46 -0.07 -2.23 0.00 0.00 178.31 175.80 1n1h h LEU 1090N -0.89 0.57 -0.36 0.59 3.38 -0.67 -0.35 115.31 117.59 1n1h h LEU 1090Ca -0.07 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1n1h h LEU 1090Cb 0.72 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1n1h h LEU 1090CO 0.08 0.36 -0.13 0.11 0.09 0.00 0.00 178.44 178.94 1n1h h LYS 1091N 0.64 0.72 -0.31 1.13 1.79 -1.10 -0.83 116.57 118.62 1n1h h LYS 1091Ca 0.31 -0.30 0.02 0.00 -2.18 0.00 0.00 60.65 58.51 1n1h h LYS 1091Cb 0.39 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.98 1n1h h LYS 1091CO -0.11 0.89 0.14 1.98 -1.08 0.00 0.00 179.45 181.28 1n1h h MET 1092N 0.50 0.28 -0.20 3.15 4.05 0.09 0.29 114.93 123.10 1n1h h MET 1092Ca 0.08 -0.02 -0.08 0.00 -0.28 0.00 0.00 59.70 59.40 1n1h h MET 1092Cb 0.66 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 31.39 1n1h h MET 1092CO 0.04 0.19 -0.20 0.28 0.23 0.00 0.00 176.91 177.45 1n1h h VAL 1093N 0.29 1.33 0.08 -5.77 2.07 -1.06 -1.25 116.25 111.94 1n1h h VAL 1093Ca 0.13 -1.37 -0.18 0.00 0.82 0.00 0.00 66.70 66.11 1n1h h VAL 1093Cb 0.06 1.76 0.02 0.00 -1.52 0.00 0.00 31.29 31.61 1n1h h VAL 1093CO -0.10 0.42 -0.74 0.77 0.02 0.00 0.00 177.57 177.93 1n1h h SER 1094N 0.17 0.51 0.15 0.57 4.64 -1.12 0.52 113.55 118.99 1n1h h SER 1094Ca 0.03 -0.87 -0.28 0.00 -0.47 0.00 0.00 61.79 60.21 1n1h h SER 1094Cb 0.75 -0.16 0.02 0.00 -0.31 0.00 0.00 62.40 62.70 1n1h h SER 1094CO 0.05 1.33 -1.13 0.58 -0.87 0.00 0.00 176.83 176.78 1n1h h VAL 1095N -0.23 1.31 0.00 0.95 2.07 -1.07 -3.39 116.25 115.89 1n1h h VAL 1095Ca -0.12 -2.42 0.00 0.00 0.82 0.00 0.00 66.70 64.99 1n1h h VAL 1095Cb 1.52 2.56 0.00 0.00 -1.52 0.00 0.00 31.29 33.84 1n1h h VAL 1095CO 0.14 0.74 0.00 0.61 0.02 0.00 0.00 177.57 179.08 1n1h n GLY 1096N 1.22 1.56 3.85 2.17 0.00 -0.47 -4.33 105.19 109.20 1n1h n GLY 1096Ca -0.11 -1.73 -0.32 0.00 0.00 0.00 0.00 46.02 43.86 1n1h n GLY 1096CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n1h s PRO 1097N -3.67 3.92 -0.64 1.61 0.04 -1.26 -1.20 135.00 133.79 1n1h s PRO 1097Ca 0.00 0.75 -0.27 0.00 0.04 0.00 0.00 61.00 61.52 1n1h s PRO 1097Cb 0.00 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.27 1n1h s PRO 1097CO 0.00 -0.10 1.49 1.41 0.04 0.00 0.00 177.00 179.84 1n1h s MET 1098N -3.76 3.07 -0.02 4.56 -2.45 0.79 -4.07 119.30 117.42 1n1h s MET 1098Ca 0.56 0.25 0.11 0.00 -1.25 0.00 0.00 55.69 55.36 1n1h s MET 1098Cb -0.10 -4.22 0.35 0.00 1.25 0.00 0.00 34.83 32.11 1n1h s MET 1098CO 0.28 -2.24 1.26 1.28 1.05 0.00 0.00 175.02 176.65 1n1h n LEU 1099N 10.41 2.22 -4.32 4.11 4.77 -1.26 -4.55 117.00 128.39 1n1h n LEU 1099Ca 0.11 -1.11 -0.24 0.00 -0.03 0.00 0.00 56.01 54.74 1n1h n LEU 1099Cb 0.50 -0.30 -0.12 0.00 -2.33 0.00 0.00 43.42 41.17 1n1h n LEU 1099CO 0.71 0.50 -0.52 -1.58 -1.33 0.00 0.00 177.39 175.18 1n1h s GLN 1100N -1.54 1.22 0.00 3.23 0.74 -1.26 -1.23 119.66 120.82 1n1h s GLN 1100Ca 0.26 -1.27 -0.30 0.00 0.05 0.00 0.00 55.36 54.10 1n1h s GLN 1100Cb 0.14 -1.46 -0.07 0.00 1.10 0.00 0.00 33.01 32.72 1n1h s GLN 1100CO 0.16 0.33 1.74 0.45 -0.55 0.00 0.00 175.29 177.42 1n1h s SER 1101N -2.16 6.59 0.53 6.67 0.15 -0.76 -4.87 113.70 119.84 1n1h s SER 1101Ca 0.11 2.41 0.18 0.00 0.70 0.00 0.00 55.95 59.35 1n1h s SER 1101Cb -0.09 -2.54 1.35 0.00 -1.71 0.00 0.00 66.02 63.03 1n1h s SER 1101CO 0.05 -0.95 2.15 0.71 1.20 0.00 0.00 173.24 176.41 1n1h h THR 1102N 5.40 0.92 -0.23 6.45 1.35 -1.93 0.13 112.91 125.00 1n1h h THR 1102Ca -0.43 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.38 1n1h h THR 1102Cb 1.20 0.98 -0.01 0.00 -1.73 0.00 0.00 68.15 68.59 1n1h h THR 1102CO 0.94 0.00 -0.05 -0.09 -0.25 0.00 0.00 175.52 176.08 1n1h h ARG 1103N 0.00 0.44 -0.59 4.72 9.65 -1.89 -1.63 114.38 125.08 1n1h h ARG 1103Ca 0.02 -0.16 -0.10 0.00 -1.10 0.00 0.00 59.98 58.63 1n1h h ARG 1103Cb 0.07 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.60 1n1h h ARG 1103CO -0.00 0.67 -0.02 0.87 2.80 0.00 0.00 179.97 184.28 1n1h h LYS 1104N 0.18 1.06 0.98 0.20 1.79 -1.62 -2.50 116.57 116.65 1n1h h LYS 1104Ca 0.06 -0.34 -0.05 0.00 -2.18 0.00 0.00 60.65 58.14 1n1h h LYS 1104Cb 0.50 -0.09 0.01 0.00 -1.58 0.00 0.00 32.23 31.07 1n1h h LYS 1104CO 0.02 1.04 -0.47 -0.92 -1.08 0.00 0.00 179.45 178.05 1n1h h TYR 1105N 0.96 -1.21 0.00 -1.35 3.20 -0.65 -3.05 116.97 114.86 1n1h h TYR 1105Ca 0.17 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1n1h h TYR 1105Cb 0.58 0.40 -0.00 0.00 1.54 0.00 0.00 36.73 39.25 1n1h h TYR 1105CO 0.04 -0.76 -0.03 0.74 -1.64 0.00 0.00 178.16 176.51 1n1h h PHE 1106N -1.31 0.00 0.00 -3.82 0.04 -1.36 0.26 116.94 110.75 1n1h h PHE 1106Ca -0.13 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.64 1n1h h PHE 1106Cb 1.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.15 1n1h h PHE 1106CO 0.01 0.03 0.00 0.00 -0.60 0.00 0.00 178.31 177.75 1n1h h ALA 1107N 1.97 1.00 -0.27 2.45 0.00 -1.33 -1.40 119.26 121.68 1n1h h ALA 1107Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1n1h h ALA 1107Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1n1h h ALA 1107CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.29 1n1h n GLN 1108N -2.62 1.82 -0.44 0.00 1.13 0.08 -3.99 117.38 113.36 1n1h n GLN 1108Ca 0.00 -1.25 0.07 0.00 -1.94 0.00 0.00 57.00 53.88 1n1h n GLN 1108Cb 0.20 -1.35 0.23 0.00 0.11 0.00 0.00 30.24 29.43 1n1h n GLN 1108CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1n1h n THR 1109N 0.49 2.27 -4.01 5.09 -2.24 -0.53 -5.00 114.28 110.34 1n1h n THR 1109Ca 0.15 -2.11 -0.11 0.00 -2.27 0.00 0.00 64.05 59.71 1n1h n THR 1109Cb 0.33 -0.27 -0.12 0.00 -2.10 0.00 0.00 70.33 68.18 1n1h n THR 1109CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1n1h s LEU 1110N -2.92 2.22 0.19 3.22 1.43 -1.26 -4.62 118.68 116.94 1n1h s LEU 1110Ca 0.41 -0.46 0.17 0.00 -1.03 0.00 0.00 54.13 53.21 1n1h s LEU 1110Cb 0.34 -0.03 -0.02 0.00 0.03 0.00 0.00 46.19 46.51 1n1h s LEU 1110CO 0.06 -0.22 1.16 -0.26 0.23 0.00 0.00 176.35 177.32 1n1h h PHE 1111N 4.77 0.00 -3.68 0.29 0.04 -1.93 -3.45 116.94 112.98 1n1h h PHE 1111Ca -0.33 0.00 -0.41 0.00 2.80 0.00 0.00 57.97 60.03 1n1h h PHE 1111Cb 1.21 0.00 -0.32 0.00 2.20 0.00 0.00 35.95 39.04 1n1h h PHE 1111CO 0.62 0.47 -0.78 -1.64 -0.60 0.00 0.00 178.31 176.39 1n1h s MET 1112N -2.99 0.86 -0.06 1.51 -1.94 -1.26 -5.07 119.30 110.35 1n1h s MET 1112Ca 0.01 -0.22 -0.07 0.00 -1.71 0.00 0.00 55.69 53.70 1n1h s MET 1112Cb 0.08 -0.82 -0.04 0.00 2.01 0.00 0.00 34.83 36.06 1n1h s MET 1112CO 0.77 0.04 0.30 0.00 -0.01 0.00 0.00 175.02 176.13 1n1h h ALA 1113N 6.64 -0.26 -2.15 3.03 0.00 -1.95 -3.48 119.26 121.08 1n1h h ALA 1113Ca -0.34 -0.05 -0.60 0.00 0.00 0.00 0.00 54.91 53.91 1n1h h ALA 1113Cb 1.17 0.10 -0.13 0.00 0.00 0.00 0.00 17.79 18.92 1n1h h ALA 1113CO 0.48 -0.25 -0.72 0.15 0.00 0.00 0.00 179.25 178.91 1n1h s LYS 1114N -2.34 1.80 0.31 0.00 1.02 -1.26 -4.91 119.74 114.35 1n1h s LYS 1114Ca -0.04 -1.75 -0.06 0.00 0.02 0.00 0.00 55.97 54.14 1n1h s LYS 1114Cb 0.00 -1.82 -0.00 0.00 -0.52 0.00 0.00 37.83 35.50 1n1h s LYS 1114CO 0.11 0.29 0.46 -0.08 -0.92 0.00 0.00 175.35 175.21 1n1h s THR 1115N -2.50 0.00 0.23 2.17 -1.32 -1.26 -5.05 115.64 107.90 1n1h s THR 1115Ca 0.31 -1.56 -0.32 0.00 -1.21 0.00 0.00 61.69 58.91 1n1h s THR 1115Cb -0.04 -2.52 -0.12 0.00 -1.51 0.00 0.00 72.50 68.31 1n1h s THR 1115CO 0.16 0.00 1.63 0.52 -2.21 0.00 0.00 174.62 174.72 1n1h n VAL 1116N -0.49 0.39 -1.65 5.08 0.31 -1.26 -4.85 118.33 115.86 1n1h n VAL 1116Ca -0.00 -0.10 -0.46 0.00 -0.01 0.00 0.00 64.34 63.77 1n1h n VAL 1116Cb 0.62 -1.85 -0.04 0.00 -0.91 0.00 0.00 33.84 31.66 1n1h n VAL 1116CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1n1h n SER 1117N 3.17 2.54 0.00 4.52 2.88 -1.26 -1.65 113.62 123.81 1n1h n SER 1117Ca 0.14 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.80 1n1h n SER 1117Cb 0.34 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.43 1n1h n SER 1117CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1n1h n GLY 1118N 2.54 2.51 3.94 0.46 0.00 -1.26 -4.99 105.19 108.40 1n1h n GLY 1118Ca 0.14 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 45.10 1n1h n GLY 1118CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1h s LEU 1119N 0.00 4.05 -0.27 0.99 1.43 -0.66 -4.94 118.68 119.29 1n1h s LEU 1119Ca 0.00 0.43 -0.06 0.00 -1.03 0.00 0.00 54.13 53.47 1n1h s LEU 1119Cb 0.00 -3.28 0.00 0.00 0.03 0.00 0.00 46.19 42.94 1n1h s LEU 1119CO 0.00 -0.26 0.05 -0.62 0.23 0.00 0.00 176.35 175.76 1n1h s ASP 1120N -3.93 4.96 0.34 2.29 -1.08 -1.26 -4.87 116.67 113.12 1n1h s ASP 1120Ca 0.40 -0.58 0.09 0.00 -0.52 0.00 0.00 52.55 51.93 1n1h s ASP 1120Cb -0.10 -1.85 0.83 0.00 -1.46 0.00 0.00 42.92 40.34 1n1h s ASP 1120CO 0.35 -0.13 1.82 0.58 0.52 0.00 0.00 175.17 178.30 1n1h h VAL 1121N 5.80 0.74 0.00 1.11 2.07 -1.93 0.58 116.25 124.63 1n1h h VAL 1121Ca -0.34 -0.23 -0.08 0.00 0.82 0.00 0.00 66.70 66.86 1n1h h VAL 1121Cb 1.14 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1n1h h VAL 1121CO 0.60 0.12 -0.40 0.78 0.02 0.00 0.00 177.57 178.69 1n1h h ASN 1122N 0.68 0.00 0.10 0.57 2.35 -1.93 -1.54 115.58 115.81 1n1h h ASN 1122Ca 0.52 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.26 1n1h h ASN 1122Cb 0.90 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.28 1n1h h ASN 1122CO -0.28 0.40 -0.05 0.00 -1.65 0.00 0.00 177.43 175.85 1n1h h ALA 1123N 1.60 -0.13 -0.74 -0.83 0.00 -0.42 -2.19 119.26 116.56 1n1h h ALA 1123Ca -0.00 -0.25 0.09 0.00 0.00 0.00 0.00 54.91 54.75 1n1h h ALA 1123Cb 1.06 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.83 1n1h h ALA 1123CO 0.05 -0.30 0.39 0.82 0.00 0.00 0.00 179.25 180.22 1n1h h ILE 1124N -0.69 0.88 -0.49 0.00 2.04 -0.57 -0.07 117.51 118.62 1n1h h ILE 1124Ca -0.01 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1n1h h ILE 1124Cb 0.54 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.74 1n1h h ILE 1124CO 0.02 0.12 0.25 -0.78 0.00 0.00 0.00 178.15 177.77 1n1h h ASP 1125N 0.67 0.60 -0.12 1.72 3.58 -1.25 -2.57 116.42 119.05 1n1h h ASP 1125Ca 0.36 -0.04 -0.19 0.00 0.42 0.00 0.00 57.03 57.58 1n1h h ASP 1125Cb 0.35 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.25 1n1h h ASP 1125CO -0.25 0.49 -0.63 -1.28 -2.88 0.00 0.00 179.24 174.69 1n1h h SER 1126N 0.68 0.84 -0.36 2.28 0.87 -0.38 -2.72 113.55 114.75 1n1h h SER 1126Ca 0.17 -0.48 -0.04 0.00 -1.23 0.00 0.00 61.79 60.21 1n1h h SER 1126Cb 0.04 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.74 1n1h h SER 1126CO -0.03 1.26 0.08 0.00 -0.53 0.00 0.00 176.83 177.61 1n1h h ALA 1127N 0.75 0.47 -0.39 6.23 0.00 -1.00 0.22 119.26 125.54 1n1h h ALA 1127Ca -0.01 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1n1h h ALA 1127Cb 1.22 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1n1h h ALA 1127CO 0.13 0.15 0.10 -0.07 0.00 0.00 0.00 179.25 179.56 1n1h h LEU 1128N 0.42 0.58 -0.54 0.00 3.38 -1.51 0.30 115.31 117.94 1n1h h LEU 1128Ca 0.11 -0.22 -0.16 0.00 0.09 0.00 0.00 57.88 57.70 1n1h h LEU 1128Cb 0.32 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1n1h h LEU 1128CO 0.00 0.65 -0.56 -0.07 0.09 0.00 0.00 178.44 178.56 1n1h h LEU 1129N 0.48 0.57 -0.28 1.67 3.38 -1.44 -2.36 115.31 117.33 1n1h h LEU 1129Ca 0.12 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 1n1h h LEU 1129Cb 0.29 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1n1h h LEU 1129CO -0.00 1.01 0.05 0.03 0.09 0.00 0.00 178.44 179.62 1n1h h ARG 1130N 0.39 0.46 -0.85 1.13 3.08 -0.32 0.22 114.38 118.49 1n1h h ARG 1130Ca 0.01 -0.12 0.07 0.00 0.07 0.00 0.00 59.98 60.01 1n1h h ARG 1130Cb 1.09 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 31.02 1n1h h ARG 1130CO 0.10 0.56 0.52 -0.07 -1.07 0.00 0.00 179.97 180.01 1n1h h LEU 1131N 0.28 0.80 -0.65 3.04 3.38 -0.90 0.27 115.31 121.53 1n1h h LEU 1131Ca 0.09 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1n1h h LEU 1131Cb 0.32 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1n1h h LEU 1131CO 0.00 0.49 0.13 -0.09 0.09 0.00 0.00 178.44 179.07 1n1h h ARG 1132N 0.92 1.06 -0.01 1.13 2.43 -1.04 0.35 114.38 119.22 1n1h h ARG 1132Ca 0.38 -0.27 -0.12 0.00 -0.81 0.00 0.00 59.98 59.17 1n1h h ARG 1132Cb 0.23 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1n1h h ARG 1132CO -0.20 0.96 -0.55 1.15 -1.51 0.00 0.00 179.97 179.83 1n1h h THR 1133N 0.98 1.39 -0.14 0.20 2.02 0.08 -2.19 112.91 115.25 1n1h h THR 1133Ca 0.20 -1.88 0.00 0.00 0.77 0.00 0.00 66.41 65.50 1n1h h THR 1133Cb 0.40 2.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1n1h h THR 1133CO 0.01 0.54 0.00 0.18 0.37 0.00 0.00 175.52 176.62 1n1h n LEU 1134N -3.89 1.29 -0.63 2.58 4.77 0.83 -4.86 117.00 117.08 1n1h n LEU 1134Ca -0.01 -0.65 -0.08 0.00 -0.03 0.00 0.00 56.01 55.24 1n1h n LEU 1134Cb 0.56 -0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 41.33 1n1h n LEU 1134CO 0.42 0.25 -0.08 0.61 -1.33 0.00 0.00 177.39 177.26 1n1h n GLY 1135N 0.48 0.98 3.69 -0.72 0.00 -0.82 -4.99 105.19 103.80 1n1h n GLY 1135Ca 0.05 -0.38 -0.31 0.00 0.00 0.00 0.00 46.02 45.38 1n1h n GLY 1135CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n1h s ALA 1136N -2.17 1.60 0.29 4.61 0.00 0.12 -4.99 121.76 121.23 1n1h s ALA 1136Ca 0.00 0.59 -0.14 0.00 0.00 0.00 0.00 51.96 52.40 1n1h s ALA 1136Cb 0.00 -3.44 -0.09 0.00 0.00 0.00 0.00 23.12 19.60 1n1h s ALA 1136CO 0.00 -2.60 0.70 0.34 0.00 0.00 0.00 175.76 174.19 1n1h s ASP 1137N -2.69 6.77 0.19 0.00 2.15 -1.26 -4.73 116.67 117.10 1n1h s ASP 1137Ca 0.67 1.22 -0.25 0.00 0.43 0.00 0.00 52.55 54.62 1n1h s ASP 1137Cb -0.23 -2.35 0.06 0.00 -0.30 0.00 0.00 42.92 40.11 1n1h s ASP 1137CO 0.57 -0.16 1.55 0.50 -0.17 0.00 0.00 175.17 177.46 1n1h h LYS 1138N 2.43 -0.05 -1.46 4.34 3.64 -1.94 0.80 116.57 124.33 1n1h h LYS 1138Ca -0.48 0.00 0.48 0.00 -1.27 0.00 0.00 60.65 59.38 1n1h h LYS 1138Cb 1.18 0.01 -0.12 0.00 -0.41 0.00 0.00 32.23 32.88 1n1h h LYS 1138CO 0.66 -0.03 0.97 0.87 -2.27 0.00 0.00 179.45 179.64 1n1h h LYS 1139N -0.05 0.03 -0.39 1.90 1.57 -1.97 1.21 116.57 118.87 1n1h h LYS 1139Ca 0.23 -0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.94 1n1h h LYS 1139Cb 0.51 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1n1h h LYS 1139CO -0.90 0.02 -0.03 0.00 -0.57 0.00 0.00 179.45 177.97 1n1h h ALA 1140N 1.50 0.53 -0.50 3.86 0.00 0.38 -0.45 119.26 124.58 1n1h h ALA 1140Ca 0.87 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 55.42 1n1h h ALA 1140Cb 2.90 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 20.53 1n1h h ALA 1140CO -0.37 0.33 -0.02 -0.07 0.00 0.00 0.00 179.25 179.12 1n1h h LEU 1141N 0.53 0.89 -1.46 0.00 4.07 0.15 -1.92 115.31 117.57 1n1h h LEU 1141Ca 0.11 -0.32 0.08 0.00 0.08 0.00 0.00 57.88 57.83 1n1h h LEU 1141Cb 0.52 -0.24 -0.04 0.00 1.08 0.00 0.00 40.66 41.97 1n1h h LEU 1141CO 0.03 1.00 0.45 0.74 -1.08 0.00 0.00 178.44 179.57 1n1h h THR 1142N 0.77 0.97 -0.59 0.22 2.02 -0.81 -1.57 112.91 113.91 1n1h h THR 1142Ca 0.14 -0.22 -0.11 0.00 0.77 0.00 0.00 66.41 67.00 1n1h h THR 1142Cb 0.55 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 1n1h h THR 1142CO 0.03 0.11 -0.05 0.00 0.37 0.00 0.00 175.52 175.99 1n1h h ALA 1143N 1.64 0.80 -0.11 6.16 0.00 -0.31 -2.64 119.26 124.81 1n1h h ALA 1143Ca 0.31 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1n1h h ALA 1143Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1n1h h ALA 1143CO -0.10 0.68 0.06 0.37 0.00 0.00 0.00 179.25 180.25 1n1h h GLN 1144N 0.96 0.15 -0.64 0.00 5.75 -0.84 -1.99 115.11 118.50 1n1h h GLN 1144Ca 0.16 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.67 1n1h h GLN 1144Cb 0.62 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.10 1n1h h GLN 1144CO 0.04 0.20 0.42 -0.07 -2.65 0.00 0.00 178.83 176.78 1n1h h LEU 1145N 0.06 0.65 -0.71 -2.39 3.38 -1.39 -1.07 115.31 113.84 1n1h h LEU 1145Ca 0.04 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 1n1h h LEU 1145Cb 0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1n1h h LEU 1145CO -0.01 0.45 -0.48 -0.07 0.09 0.00 0.00 178.44 178.43 1n1h h LEU 1146N 0.76 0.43 -0.41 1.67 3.38 -1.23 -1.47 115.31 118.44 1n1h h LEU 1146Ca 0.25 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1n1h h LEU 1146Cb 0.07 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1n1h h LEU 1146CO -0.07 0.85 0.00 0.23 0.09 0.00 0.00 178.44 179.54 1n1h n MET 1147N -3.98 0.15 -0.30 1.13 2.81 -0.45 -2.38 117.12 114.10 1n1h n MET 1147Ca -0.02 0.33 0.07 0.00 -1.81 0.00 0.00 57.70 56.27 1n1h n MET 1147Cb 0.55 -1.76 0.21 0.00 -0.71 0.00 0.00 33.22 31.51 1n1h n MET 1147CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 1n1h n VAL 1148N -2.04 1.44 0.00 2.03 0.24 -0.95 -0.96 118.33 118.09 1n1h n VAL 1148Ca 0.03 -1.26 0.00 0.00 -2.04 0.00 0.00 64.34 61.07 1n1h n VAL 1148Cb 0.25 0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.88 1n1h n VAL 1148CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1n1h n GLY 1149N 0.34 0.84 3.79 7.63 0.00 -1.00 -4.86 105.19 111.93 1n1h n GLY 1149Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1n1h n GLY 1149CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1n1h s LEU 1150N 0.00 3.81 0.19 0.99 1.02 -0.59 -4.66 118.68 119.45 1n1h s LEU 1150Ca 0.00 2.03 -0.29 0.00 0.02 0.00 0.00 54.13 55.89 1n1h s LEU 1150Cb 0.00 -4.56 -0.08 0.00 0.02 0.00 0.00 46.19 41.57 1n1h s LEU 1150CO 0.00 -0.95 0.91 -1.58 0.02 0.00 0.00 176.35 174.76 1n1h s GLN 1151N -3.24 4.76 0.29 1.70 -0.44 -1.26 -4.47 119.66 117.00 1n1h s GLN 1151Ca 0.69 1.41 -0.01 0.00 -2.50 0.00 0.00 55.36 54.95 1n1h s GLN 1151Cb -0.19 -3.30 0.65 0.00 -1.64 0.00 0.00 33.01 28.53 1n1h s GLN 1151CO 0.23 0.45 1.58 0.93 0.50 0.00 0.00 175.29 178.97 1n1h h GLU 1152N 4.58 0.02 -0.12 1.67 5.08 -1.97 0.27 114.58 124.11 1n1h h GLU 1152Ca -0.45 -0.00 0.05 0.00 -1.00 0.00 0.00 59.36 57.96 1n1h h GLU 1152Cb 1.20 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.39 1n1h h GLU 1152CO 0.69 0.02 -0.25 0.77 -1.00 0.00 0.00 179.01 179.23 1n1h h SER 1153N 0.02 -0.77 -0.36 1.42 0.02 -1.99 0.51 113.55 112.41 1n1h h SER 1153Ca 0.55 0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 61.59 1n1h h SER 1153Cb 1.06 0.34 -0.02 0.00 0.14 0.00 0.00 62.40 63.93 1n1h h SER 1153CO -0.90 -0.30 0.11 -0.33 -1.14 0.00 0.00 176.83 174.27 1n1h h GLU 1154N -0.32 0.56 -0.03 3.45 5.08 -1.35 -1.44 114.58 120.52 1n1h h GLU 1154Ca 0.10 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1n1h h GLU 1154Cb 0.47 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1n1h h GLU 1154CO -0.31 0.58 -0.21 0.00 -1.00 0.00 0.00 179.01 178.08 1n1h h ALA 1155N 0.95 -0.24 -0.35 3.43 0.00 0.03 0.18 119.26 123.27 1n1h h ALA 1155Ca 0.12 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1n1h h ALA 1155Cb 0.26 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1n1h h ALA 1155CO -0.00 -0.69 0.01 0.22 0.00 0.00 0.00 179.25 178.78 1n1h h ASP 1156N -0.31 0.50 0.21 0.00 3.58 0.05 0.96 116.42 121.40 1n1h h ASP 1156Ca 0.07 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.42 1n1h h ASP 1156Cb 0.41 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.33 1n1h h ASP 1156CO -0.21 0.56 -0.10 0.00 -2.88 0.00 0.00 179.24 176.61 1n1h h ALA 1157N 1.51 -0.28 -0.64 -0.78 0.00 -0.70 -1.33 119.26 117.03 1n1h h ALA 1157Ca 0.11 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1n1h h ALA 1157Cb 0.32 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1n1h h ALA 1157CO 0.01 -0.41 0.28 1.25 0.00 0.00 0.00 179.25 180.38 1n1h h LEU 1158N -0.77 0.86 -0.46 0.00 5.85 -0.58 0.11 115.31 120.32 1n1h h LEU 1158Ca -0.03 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.57 1n1h h LEU 1158Cb 0.51 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1n1h h LEU 1158CO 0.05 0.78 0.24 0.00 -0.34 0.00 0.00 178.44 179.16 1n1h h ALA 1159N 1.12 0.58 -0.30 1.25 0.00 -0.86 0.51 119.26 121.56 1n1h h ALA 1159Ca 0.22 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1n1h h ALA 1159Cb 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1n1h h ALA 1159CO -0.02 -0.11 -0.13 0.78 0.00 0.00 0.00 179.25 179.77 1n1h h GLY 1160N 0.47 0.55 0.62 0.00 0.00 -0.81 -1.58 103.07 102.32 1n1h h GLY 1160Ca 0.20 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.14 1n1h h GLY 1160CO -0.13 0.36 -0.00 1.70 0.00 0.00 0.00 176.54 178.47 1n1h h LYS 1161N 0.47 -0.00 -0.66 4.80 3.64 0.23 -3.15 116.57 121.89 1n1h h LYS 1161Ca 0.08 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.57 1n1h h LYS 1161Cb 0.51 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.25 1n1h h LYS 1161CO 0.03 0.38 0.25 0.82 -2.27 0.00 0.00 179.45 178.66 1n1h h ILE 1162N -0.38 0.74 -0.89 2.00 2.04 0.18 -2.29 117.51 118.90 1n1h h ILE 1162Ca -0.00 -0.14 0.15 0.00 1.00 0.00 0.00 64.86 65.87 1n1h h ILE 1162Cb 0.38 0.28 -0.07 0.00 -0.74 0.00 0.00 36.82 36.67 1n1h h ILE 1162CO 0.00 0.08 0.58 0.24 0.00 0.00 0.00 178.15 179.04 1n1h h MET 1163N 0.42 0.64 -0.03 2.37 2.86 -1.25 -2.74 114.93 117.20 1n1h h MET 1163Ca 0.34 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.94 1n1h h MET 1163Cb 0.45 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1n1h h MET 1163CO -0.34 0.42 0.00 1.28 1.06 0.00 0.00 176.91 179.34 1n1h n LEU 1164N -4.56 2.87 -4.81 1.22 4.77 -0.90 -5.01 117.00 110.59 1n1h n LEU 1164Ca 0.18 -1.01 -0.33 0.00 -0.03 0.00 0.00 56.01 54.82 1n1h n LEU 1164Cb 0.50 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1n1h n LEU 1164CO 0.29 0.49 0.71 -1.58 -1.33 0.00 0.00 177.39 175.97 1n1h s GLN 1165N -1.86 3.45 -0.54 3.23 0.74 -0.99 -5.00 119.66 118.69 1n1h s GLN 1165Ca 0.26 1.16 -0.15 0.00 0.05 0.00 0.00 55.36 56.68 1n1h s GLN 1165Cb 0.19 -2.05 0.13 0.00 1.10 0.00 0.00 33.01 32.38 1n1h s GLN 1165CO 0.28 -0.70 0.49 -0.51 -0.55 0.00 0.00 175.29 174.30 1n1h s ASP 1166N -2.84 6.15 0.10 6.67 1.01 -1.26 -5.05 116.67 121.45 1n1h s ASP 1166Ca 0.63 -1.83 -0.30 0.00 0.71 0.00 0.00 52.55 51.75 1n1h s ASP 1166Cb -0.15 -2.19 -0.06 0.00 1.01 0.00 0.00 42.92 41.54 1n1h s ASP 1166CO 0.36 -0.83 1.01 -0.69 0.21 0.00 0.00 175.17 175.23 1n1h s VAL 1167N 1.53 4.41 0.69 -1.27 1.01 -1.26 -5.03 120.40 120.48 1n1h s VAL 1167Ca 0.04 1.92 -0.13 0.00 0.00 0.00 0.00 61.98 63.81 1n1h s VAL 1167Cb -0.29 -4.23 0.01 0.00 0.00 0.00 0.00 36.38 31.87 1n1h s VAL 1167CO 0.02 0.26 1.09 0.21 0.00 0.00 0.00 175.10 176.68 1n1h s ASN 1168N 0.28 5.05 0.15 3.32 3.04 -1.26 -4.73 114.94 120.79 1n1h s ASN 1168Ca 0.50 1.87 -0.31 0.00 0.04 0.00 0.00 52.86 54.95 1n1h s ASN 1168Cb -0.25 -2.53 -0.08 0.00 -1.54 0.00 0.00 41.25 36.85 1n1h s ASN 1168CO 0.30 -1.67 1.54 0.74 -3.04 0.00 0.00 177.10 174.97 1n1h h THR 1169N -0.37 0.00 -0.73 -5.21 2.02 -1.95 0.70 112.91 107.36 1n1h h THR 1169Ca -0.45 0.00 0.06 0.00 0.77 0.00 0.00 66.41 66.79 1n1h h THR 1169Cb 1.23 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.58 1n1h h THR 1169CO 0.54 0.00 0.42 0.58 0.37 0.00 0.00 175.52 177.43 1n1h h VAL 1170N -0.12 0.98 -0.22 3.16 2.07 -1.93 -0.06 116.25 120.13 1n1h h VAL 1170Ca 0.13 -0.26 -0.19 0.00 0.82 0.00 0.00 66.70 67.20 1n1h h VAL 1170Cb 0.46 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1n1h h VAL 1170CO -0.83 0.14 -0.61 -0.61 0.02 0.00 0.00 177.57 175.67 1n1h h GLN 1171N 0.76 0.80 -0.11 1.57 4.15 -1.60 -3.24 115.11 117.44 1n1h h GLN 1171Ca 0.33 -0.57 -0.11 0.00 0.77 0.00 0.00 58.65 59.07 1n1h h GLN 1171Cb 0.20 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 1n1h h GLN 1171CO -0.19 1.19 -0.41 1.25 -1.93 0.00 0.00 178.83 178.75 1n1h h LEU 1172N 0.55 0.27 0.00 -2.39 5.85 -0.61 -2.99 115.31 116.00 1n1h h LEU 1172Ca -0.01 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1n1h h LEU 1172Cb 1.23 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1n1h h LEU 1172CO 0.13 0.65 0.00 0.00 -0.34 0.00 0.00 178.44 178.88 1n1h n ALA 1173N -2.47 1.50 0.31 1.25 0.00 -0.06 -2.29 120.51 118.73 1n1h n ALA 1173Ca -0.01 -0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.53 1n1h n ALA 1173Cb 0.48 -1.13 0.45 0.00 0.00 0.00 0.00 19.45 19.25 1n1h n ALA 1173CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n1h h ARG 1174N 0.00 0.00 0.00 0.00 3.08 -1.66 -1.69 114.38 114.11 1n1h h ARG 1174Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1n1h h ARG 1174Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1n1h h ARG 1174CO 0.00 0.00 0.00 -0.39 -1.07 0.00 0.00 179.97 178.51 1n1h h VAL 1175N 0.00 0.00 0.00 2.04 -1.51 -1.69 0.10 116.25 115.19 1n1h h VAL 1175Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 1n1h h VAL 1175Cb 0.69 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 30.66 1n1h h VAL 1175CO 0.00 0.00 -0.06 0.55 -1.23 0.00 0.00 177.57 176.83 1n1h n VAL 1176N -2.62 1.46 -2.09 7.19 3.14 -1.15 -4.86 118.33 119.41 1n1h n VAL 1176Ca -0.01 -1.73 -0.16 0.00 -2.96 0.00 0.00 64.34 59.48 1n1h n VAL 1176Cb 0.09 -0.00 -0.02 0.00 -1.06 0.00 0.00 33.84 32.85 1n1h n VAL 1176CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1n1h n ASN 1177N -1.08 -4.81 -4.74 6.55 3.02 0.02 -5.01 115.26 109.21 1n1h n ASN 1177Ca 0.11 0.09 -0.39 0.00 -0.03 0.00 0.00 54.58 54.36 1n1h n ASN 1177Cb 0.59 -3.88 -0.05 0.00 -0.61 0.00 0.00 39.78 35.83 1n1h n ASN 1177CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1n1h s LEU 1178N -4.35 4.36 0.03 3.41 1.43 -0.65 -4.98 118.68 117.93 1n1h s LEU 1178Ca 0.00 1.12 0.05 0.00 -1.03 0.00 0.00 54.13 54.26 1n1h s LEU 1178Cb 0.00 -2.94 -0.02 0.00 0.03 0.00 0.00 46.19 43.26 1n1h s LEU 1178CO 0.00 0.02 -0.15 0.00 0.23 0.00 0.00 176.35 176.45 1n1h s ALA 1179N 0.24 1.21 0.10 4.21 0.00 -1.26 -4.09 121.76 122.17 1n1h s ALA 1179Ca 0.32 -0.78 -0.31 0.00 0.00 0.00 0.00 51.96 51.19 1n1h s ALA 1179Cb -0.18 -0.22 -0.10 0.00 0.00 0.00 0.00 23.12 22.62 1n1h s ALA 1179CO 0.16 0.25 1.88 0.08 0.00 0.00 0.00 175.76 178.14 1n1h s VAL 1180N -0.71 2.67 0.37 0.00 1.01 -1.26 -4.90 120.40 117.59 1n1h s VAL 1180Ca 0.03 0.02 -0.28 0.00 0.00 0.00 0.00 61.98 61.75 1n1h s VAL 1180Cb -0.07 -3.01 -0.11 0.00 0.00 0.00 0.00 36.38 33.18 1n1h s VAL 1180CO 0.01 -0.00 1.42 -2.65 0.00 0.00 0.00 175.10 173.88 1n1h n PRO 1181N 6.31 2.47 -0.35 2.72 -0.02 -1.26 -4.88 135.00 139.99 1n1h n PRO 1181Ca 0.19 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.53 1n1h n PRO 1181Cb 0.39 -2.56 0.16 0.00 -0.02 0.00 0.00 33.50 31.47 1n1h n PRO 1181CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1n1h h ASP 1182N 2.76 1.07 0.03 2.55 5.19 -2.00 -1.21 116.42 124.81 1n1h h ASP 1182Ca -0.49 -0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 55.90 1n1h h ASP 1182Cb 1.26 -0.25 -0.00 0.00 0.18 0.00 0.00 39.33 40.52 1n1h h ASP 1182CO 0.63 0.74 -0.01 0.71 -3.12 0.00 0.00 179.24 178.20 1n1h h THR 1183N 1.24 0.33 0.00 0.35 1.35 -1.95 -2.11 112.91 112.12 1n1h h THR 1183Ca 0.38 -0.03 -0.08 0.00 -0.55 0.00 0.00 66.41 66.13 1n1h h THR 1183Cb -0.03 1.02 -0.01 0.00 -1.73 0.00 0.00 68.15 67.40 1n1h h THR 1183CO -0.11 0.01 -0.52 -0.50 -0.25 0.00 0.00 175.52 174.15 1n1h h TRP 1184N 0.00 0.00 -1.04 4.73 4.06 -1.57 -3.39 115.95 118.74 1n1h h TRP 1184Ca -0.00 0.00 0.30 0.00 2.06 0.00 0.00 58.89 61.25 1n1h h TRP 1184Cb 0.02 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.14 1n1h h TRP 1184CO 0.00 0.35 1.18 0.52 -3.56 0.00 0.00 178.44 176.93 1n1h h MET 1185N 0.00 0.00 -0.01 0.49 2.86 -1.35 0.54 114.93 117.45 1n1h h MET 1185Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1n1h h MET 1185Cb 1.29 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.95 1n1h h MET 1185CO 0.04 0.00 -0.20 -1.13 1.06 0.00 0.00 176.91 176.68 1n1h n SER 1186N -3.31 1.38 -4.72 1.22 3.41 -1.26 -4.71 113.62 105.62 1n1h n SER 1186Ca 0.23 -1.19 -0.22 0.00 -0.26 0.00 0.00 58.87 57.43 1n1h n SER 1186Cb 1.50 0.13 -0.06 0.00 -0.26 0.00 0.00 64.21 65.52 1n1h n SER 1186CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1n1h s LEU 1187N -2.34 3.46 -1.42 1.04 1.43 0.19 -0.15 118.68 120.90 1n1h s LEU 1187Ca 0.28 -0.48 -0.14 0.00 -1.03 0.00 0.00 54.13 52.76 1n1h s LEU 1187Cb 0.20 -1.99 0.06 0.00 0.03 0.00 0.00 46.19 44.49 1n1h s LEU 1187CO 0.46 -0.02 2.12 -0.67 0.23 0.00 0.00 176.35 178.48 1n1h n ASP 1188N -1.02 4.16 0.24 2.29 2.03 -0.34 -4.12 116.55 119.78 1n1h n ASP 1188Ca -0.07 -2.88 0.10 0.00 0.52 0.00 0.00 54.79 52.46 1n1h n ASP 1188Cb 0.58 -1.65 0.58 0.00 -0.72 0.00 0.00 41.12 39.92 1n1h n ASP 1188CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 1n1h h PHE 1189N 6.17 0.00 -0.54 -0.67 -5.15 -1.88 -2.82 116.94 112.04 1n1h h PHE 1189Ca 0.53 0.00 -0.09 0.00 -0.20 0.00 0.00 57.97 58.21 1n1h h PHE 1189Cb 0.67 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.82 1n1h h PHE 1189CO 1.43 0.20 -0.03 0.22 -2.00 0.00 0.00 178.31 178.12 1n1h h ASP 1190N 0.00 0.93 -0.31 -0.68 3.58 -1.98 -1.07 116.42 116.89 1n1h h ASP 1190Ca -0.00 -0.26 -0.13 0.00 0.42 0.00 0.00 57.03 57.06 1n1h h ASP 1190Cb 0.51 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 41.30 1n1h h ASP 1190CO 0.03 1.00 -0.31 0.28 -2.88 0.00 0.00 179.24 177.36 1n1h h SER 1191N 0.87 0.80 -0.02 2.28 0.02 -1.88 -2.14 113.55 113.46 1n1h h SER 1191Ca 0.15 -0.47 0.02 0.00 -0.84 0.00 0.00 61.79 60.65 1n1h h SER 1191Cb 0.55 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 1n1h h SER 1191CO 0.03 1.11 -0.09 -0.03 -1.14 0.00 0.00 176.83 176.71 1n1h h MET 1192N 0.50 -0.14 -0.13 3.45 1.85 -1.33 0.40 114.93 119.54 1n1h h MET 1192Ca 0.05 0.01 0.03 0.00 -0.61 0.00 0.00 59.70 59.18 1n1h h MET 1192Cb 0.88 0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.91 1n1h h MET 1192CO 0.08 -0.09 -0.07 0.74 -0.40 0.00 0.00 176.91 177.17 1n1h h PHE 1193N -0.14 -0.16 -0.32 1.39 0.04 -1.18 -1.70 116.94 114.87 1n1h h PHE 1193Ca 0.04 0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.72 1n1h h PHE 1193Cb 0.20 0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.43 1n1h h PHE 1193CO -0.16 -0.11 -0.22 0.87 -0.60 0.00 0.00 178.31 178.09 1n1h h LYS 1194N -0.06 0.71 -0.01 1.51 1.57 -0.98 -3.39 116.57 115.92 1n1h h LYS 1194Ca 0.07 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1n1h h LYS 1194Cb 0.17 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1n1h h LYS 1194CO -0.17 0.94 -0.04 0.72 -0.57 0.00 0.00 179.45 180.33 1n1h n HIS 1195N -4.30 0.00 -1.84 -1.35 8.25 0.14 -4.77 115.22 111.34 1n1h n HIS 1195Ca -0.03 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.47 1n1h n HIS 1195Cb 0.43 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.61 1n1h n HIS 1195CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1n1h n HIS 1196N 0.03 0.00 -3.56 4.41 8.25 -0.64 -4.86 115.22 118.85 1n1h n HIS 1196Ca 0.03 -0.57 -0.28 0.00 -0.26 0.00 0.00 57.72 56.64 1n1h n HIS 1196Cb 0.13 -0.13 -0.11 0.00 1.12 0.00 0.00 29.99 31.00 1n1h n HIS 1196CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1n1h s VAL 1197N -1.15 1.13 -0.03 1.59 1.01 -1.22 -3.20 120.40 118.52 1n1h s VAL 1197Ca 0.21 -3.07 -0.30 0.00 0.00 0.00 0.00 61.98 58.82 1n1h s VAL 1197Cb 0.21 -1.76 -0.05 0.00 0.00 0.00 0.00 36.38 34.78 1n1h s VAL 1197CO -0.04 -1.14 1.50 -0.54 0.00 0.00 0.00 175.10 174.88 1n1h s LYS 1198N -0.31 4.23 0.00 2.72 3.01 -0.90 -4.89 119.74 123.60 1n1h s LYS 1198Ca 0.29 2.05 0.26 0.00 -1.01 0.00 0.00 55.97 57.56 1n1h s LYS 1198Cb -0.01 -3.75 0.75 0.00 -1.01 0.00 0.00 37.83 33.81 1n1h s LYS 1198CO -0.17 -0.71 1.56 1.28 0.51 0.00 0.00 175.35 177.83 1n1h n LEU 1199N 6.18 1.14 -4.56 3.17 4.77 -1.26 -0.33 117.00 126.10 1n1h n LEU 1199Ca 0.15 -0.32 -0.40 0.00 -0.03 0.00 0.00 56.01 55.41 1n1h n LEU 1199Cb 0.43 -0.10 -0.09 0.00 -2.33 0.00 0.00 43.42 41.33 1n1h n LEU 1199CO 0.60 0.21 0.05 -0.22 -1.33 0.00 0.00 177.39 176.70 1n1h s LEU 1200N -2.44 4.33 0.28 2.23 0.20 -1.26 -4.69 118.68 117.33 1n1h s LEU 1200Ca 0.26 -0.10 -0.28 0.00 0.69 0.00 0.00 54.13 54.70 1n1h s LEU 1200Cb 0.19 -2.37 -0.15 0.00 -0.43 0.00 0.00 46.19 43.44 1n1h s LEU 1200CO 0.50 -0.31 0.86 -2.65 -0.29 0.00 0.00 176.35 174.47 1n1h n PRO 1201N 5.39 0.99 -0.15 0.98 -0.02 -1.23 -4.53 135.00 136.43 1n1h n PRO 1201Ca -0.09 0.35 0.21 0.00 -2.02 0.00 0.00 63.50 61.95 1n1h n PRO 1201Cb 0.50 -1.63 0.61 0.00 -0.02 0.00 0.00 33.50 32.95 1n1h n PRO 1201CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1n1h h LYS 1202N 1.66 0.20 -0.84 -0.52 3.64 -1.88 -0.39 116.57 118.44 1n1h h LYS 1202Ca -0.37 -0.01 -0.36 0.00 -1.27 0.00 0.00 60.65 58.64 1n1h h LYS 1202Cb 1.37 -0.05 -0.21 0.00 -0.41 0.00 0.00 32.23 32.93 1n1h h LYS 1202CO 0.59 0.13 0.44 -0.40 -2.27 0.00 0.00 179.45 177.94 1n1h n ASP 1203N -4.41 4.18 0.00 4.20 3.85 -1.26 -5.05 116.55 118.05 1n1h n ASP 1203Ca 0.16 -3.44 0.00 0.00 -0.71 0.00 0.00 54.79 50.80 1n1h n ASP 1203Cb 0.71 -0.78 0.00 0.00 -1.35 0.00 0.00 41.12 39.70 1n1h n ASP 1203CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1n1h n GLY 1204N -0.70 0.69 3.75 6.12 0.00 -0.16 -5.01 105.19 109.89 1n1h n GLY 1204Ca 0.50 -2.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 1n1h n GLY 1204CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n1h s ARG 1205N -1.27 4.20 0.21 1.61 0.52 -1.26 -3.88 118.95 119.07 1n1h s ARG 1205Ca 0.00 2.43 0.10 0.00 -0.52 0.00 0.00 55.73 57.74 1n1h s ARG 1205Cb 0.00 -3.05 -0.04 0.00 0.52 0.00 0.00 34.95 32.37 1n1h s ARG 1205CO 0.00 -0.48 -0.15 -1.01 0.02 0.00 0.00 175.30 173.68 1n1h s HIS 1206N -0.31 2.48 0.05 -0.53 3.76 -1.26 -5.04 115.29 114.44 1n1h s HIS 1206Ca 0.58 -0.28 -0.21 0.00 -0.15 0.00 0.00 55.06 55.00 1n1h s HIS 1206Cb -0.44 -1.19 -0.13 0.00 1.11 0.00 0.00 32.58 31.93 1n1h s HIS 1206CO 0.49 0.55 1.44 -0.07 -0.85 0.00 0.00 174.74 176.30 1n1h h LEU 1207N 2.81 0.28 -1.32 0.89 3.38 -1.97 -2.94 115.31 116.44 1n1h h LEU 1207Ca -0.45 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.10 1n1h h LEU 1207Cb 1.22 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1n1h h LEU 1207CO 0.54 0.58 -0.06 0.78 0.09 0.00 0.00 178.44 180.37 1n1h h ASN 1208N -0.02 0.36 1.86 -0.43 2.35 -1.96 -3.13 115.58 114.62 1n1h h ASN 1208Ca 0.04 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1n1h h ASN 1208Cb 0.45 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.73 1n1h h ASN 1208CO 0.01 0.47 0.00 0.71 -1.65 0.00 0.00 177.43 176.97 1n1h h THR 1209N 0.37 0.00 -3.99 2.81 1.35 -1.86 -2.18 112.91 109.42 1n1h h THR 1209Ca 0.08 -0.88 -0.54 0.00 -0.55 0.00 0.00 66.41 64.53 1n1h h THR 1209Cb 0.34 1.88 0.11 0.00 -1.73 0.00 0.00 68.15 68.74 1n1h h THR 1209CO 0.02 0.00 0.64 -1.81 -0.25 0.00 0.00 175.52 174.11 1n1h s ASP 1210N -5.84 5.91 -0.31 5.36 1.01 -1.11 -4.90 116.67 116.78 1n1h s ASP 1210Ca 0.08 2.75 -0.10 0.00 0.71 0.00 0.00 52.55 55.98 1n1h s ASP 1210Cb 0.07 -2.64 -0.02 0.00 1.01 0.00 0.00 42.92 41.34 1n1h s ASP 1210CO 0.65 -1.13 0.17 -0.63 0.21 0.00 0.00 175.17 174.44 1n1h s ILE 1211N -1.27 4.84 0.40 0.77 -1.09 -1.26 -4.23 121.20 119.35 1n1h s ILE 1211Ca 0.62 -0.29 -0.24 0.00 -2.23 0.00 0.00 60.65 58.51 1n1h s ILE 1211Cb -0.40 -3.44 -0.12 0.00 -1.58 0.00 0.00 42.46 36.92 1n1h s ILE 1211CO 0.50 0.08 0.86 -2.65 -1.23 0.00 0.00 174.94 172.51 1n1h n PRO 1212N 5.02 1.07 -0.14 2.79 -0.02 -1.26 -4.89 135.00 137.56 1n1h n PRO 1212Ca -0.14 0.38 -0.04 0.00 -2.02 0.00 0.00 63.50 61.68 1n1h n PRO 1212Cb 0.50 -1.82 -0.04 0.00 -0.02 0.00 0.00 33.50 32.11 1n1h n PRO 1212CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1n1h h PRO 1213N 1.35 -0.03 0.00 0.52 0.11 -2.03 -0.85 132.00 131.07 1n1h h PRO 1213Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1n1h h PRO 1213Cb 1.36 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.48 1n1h h PRO 1213CO 0.56 -0.02 0.00 0.54 -0.21 0.00 0.00 178.00 178.87 1n1h n ARG 1214N -3.84 0.41 -1.70 1.05 1.74 -1.26 -3.74 116.66 109.32 1n1h n ARG 1214Ca 0.00 0.06 -0.33 0.00 -0.77 0.00 0.00 57.85 56.82 1n1h n ARG 1214Cb 0.11 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.10 1n1h n ARG 1214CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1n1h n MET 1215N -1.20 2.99 0.10 5.56 2.81 -0.32 -4.68 117.12 122.38 1n1h n MET 1215Ca 0.12 -3.65 0.02 0.00 -1.81 0.00 0.00 57.70 52.37 1n1h n MET 1215Cb 0.14 -2.28 0.36 0.00 -0.71 0.00 0.00 33.22 30.73 1n1h n MET 1215CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1n1h h GLY 1216N 2.27 0.30 1.29 3.03 0.00 -1.66 -2.21 103.07 106.09 1n1h h GLY 1216Ca 0.52 -0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.69 1n1h h GLY 1216CO 1.30 0.18 0.33 0.11 0.00 0.00 0.00 176.54 178.46 1n1h h TRP 1217N 0.27 0.00 -0.93 5.60 5.08 -1.93 -1.26 115.95 122.77 1n1h h TRP 1217Ca 0.05 0.00 0.05 0.00 1.08 0.00 0.00 58.89 60.08 1n1h h TRP 1217Cb 0.39 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.49 1n1h h TRP 1217CO 0.01 0.00 0.60 -0.07 -1.28 0.00 0.00 178.44 177.69 1n1h h LEU 1218N 0.00 0.96 -1.84 0.11 3.38 -1.79 -2.66 115.31 113.47 1n1h h LEU 1218Ca 0.05 0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.21 1n1h h LEU 1218Cb 0.71 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 1n1h h LEU 1218CO -0.00 0.63 0.49 0.03 0.09 0.00 0.00 178.44 179.68 1n1h h ARG 1219N 1.11 0.14 -0.11 1.13 3.08 -1.44 0.14 114.38 118.44 1n1h h ARG 1219Ca 0.39 -0.01 -0.20 0.00 0.07 0.00 0.00 59.98 60.23 1n1h h ARG 1219Cb 0.12 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.14 1n1h h ARG 1219CO -0.16 0.10 -0.72 0.00 -1.07 0.00 0.00 179.97 178.11 1n1h h ALA 1220N 1.66 0.23 -0.40 0.04 0.00 -1.66 -1.80 119.26 117.33 1n1h h ALA 1220Ca 0.34 -0.58 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 1n1h h ALA 1220Cb 1.14 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1n1h h ALA 1220CO -0.05 0.57 -0.28 0.82 0.00 0.00 0.00 179.25 180.30 1n1h h ILE 1221N 0.35 1.27 -0.26 0.00 2.04 -1.29 -2.75 117.51 116.88 1n1h h ILE 1221Ca -0.06 -1.44 -0.07 0.00 1.00 0.00 0.00 64.86 64.29 1n1h h ILE 1221Cb 1.37 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 1n1h h ILE 1221CO 0.15 0.48 -0.15 -0.07 0.00 0.00 0.00 178.15 178.56 1n1h h LEU 1222N 0.74 0.43 -0.48 1.44 3.38 -0.74 -3.01 115.31 117.07 1n1h h LEU 1222Ca 0.09 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1n1h h LEU 1222Cb 0.84 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 1n1h h LEU 1222CO 0.07 0.61 0.20 0.03 0.09 0.00 0.00 178.44 179.45 1n1h h ARG 1223N 0.41 0.71 -0.78 1.13 3.08 -1.02 -2.39 114.38 115.52 1n1h h ARG 1223Ca 0.07 -0.13 0.06 0.00 0.07 0.00 0.00 59.98 60.06 1n1h h ARG 1223Cb 0.51 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.39 1n1h h ARG 1223CO 0.03 0.63 0.47 0.74 -1.07 0.00 0.00 179.97 180.77 1n1h h PHE 1224N 0.63 0.86 -0.62 3.04 -1.00 -1.42 -1.82 116.94 116.62 1n1h h PHE 1224Ca 0.16 0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.93 1n1h h PHE 1224Cb 0.18 -0.27 -0.03 0.00 3.61 0.00 0.00 35.95 39.44 1n1h h PHE 1224CO 0.00 0.43 0.23 -0.07 -1.61 0.00 0.00 178.31 177.29 1n1h h LEU 1225N 0.86 0.84 -0.19 1.54 3.38 -1.36 0.71 115.31 121.09 1n1h h LEU 1225Ca 0.34 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 1n1h h LEU 1225Cb 0.17 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1n1h h LEU 1225CO -0.17 0.77 -0.19 1.23 0.09 0.00 0.00 178.44 180.16 1n1h h GLY 1226N 1.00 0.50 1.32 0.83 0.00 -0.96 -2.94 103.07 102.82 1n1h h GLY 1226Ca 0.21 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 46.97 1n1h h GLY 1226CO -0.02 0.46 0.12 0.00 0.00 0.00 0.00 176.54 177.10 1n1h h ALA 1227N 0.63 1.17 -0.49 3.60 0.00 -1.18 -1.99 119.26 121.02 1n1h h ALA 1227Ca 0.03 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.78 1n1h h ALA 1227Cb 0.73 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 1n1h h ALA 1227CO 0.05 0.56 0.19 0.78 0.00 0.00 0.00 179.25 180.82 1n1h h GLY 1228N 0.98 0.65 1.25 0.00 0.00 -0.78 0.20 103.07 105.37 1n1h h GLY 1228Ca 0.18 -0.11 -0.14 0.00 0.00 0.00 0.00 47.33 47.26 1n1h h GLY 1228CO 0.00 0.03 -0.31 -0.33 0.00 0.00 0.00 176.54 175.93 1n1h h MET 1229N 0.37 0.84 0.15 4.80 2.86 -1.30 -2.30 114.93 120.36 1n1h h MET 1229Ca 0.23 -0.39 -0.01 0.00 -2.06 0.00 0.00 59.70 57.47 1n1h h MET 1229Cb 0.22 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.87 1n1h h MET 1229CO -0.22 1.03 -0.07 0.28 1.06 0.00 0.00 176.91 178.99 1n1h h VAL 1230N 0.71 0.93 0.00 -2.22 2.07 -0.61 -2.49 116.25 114.64 1n1h h VAL 1230Ca 0.08 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 1n1h h VAL 1230Cb 0.86 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.79 1n1h h VAL 1230CO 0.08 0.09 -0.14 0.24 0.02 0.00 0.00 177.57 177.85 1n1h h MET 1231N -0.38 0.00 0.00 1.57 2.86 -0.66 -2.77 114.93 115.55 1n1h h MET 1231Ca -0.02 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.46 1n1h h MET 1231Cb 0.30 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1n1h h MET 1231CO 0.03 0.14 -0.76 1.15 1.06 0.00 0.00 176.91 178.54 1n1h h THR 1232N 0.00 1.32 -2.94 2.22 2.02 -1.28 -3.38 112.91 110.87 1n1h h THR 1232Ca -0.00 -2.83 -0.56 0.00 0.77 0.00 0.00 66.41 63.79 1n1h h THR 1232Cb 0.41 2.63 -0.03 0.00 -1.74 0.00 0.00 68.15 69.42 1n1h h THR 1232CO 0.02 0.74 0.85 0.00 0.37 0.00 0.00 175.52 177.50 1n1h s ALA 1233N -2.86 3.60 0.51 6.16 0.00 -0.95 0.71 121.76 128.95 1n1h s ALA 1233Ca 0.02 0.58 -0.22 0.00 0.00 0.00 0.00 51.96 52.33 1n1h s ALA 1233Cb 0.09 -3.60 -0.06 0.00 0.00 0.00 0.00 23.12 19.55 1n1h s ALA 1233CO 0.78 -1.05 1.28 2.41 0.00 0.00 0.00 175.76 179.19 1n1h n THR 1234N 5.10 3.41 0.00 0.00 -1.04 0.68 -4.70 114.28 117.72 1n1h n THR 1234Ca 0.13 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.64 1n1h n THR 1234Cb 0.45 -1.57 0.00 0.00 -1.82 0.00 0.00 70.33 67.39 1n1h n THR 1234CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1n1h n GLY 1235N 0.84 -0.36 3.80 3.41 0.00 -1.26 -5.00 105.19 106.61 1n1h n GLY 1235Ca 0.10 -1.96 -0.35 0.00 0.00 0.00 0.00 46.02 43.80 1n1h n GLY 1235CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1n1h s VAL 1236N 0.00 3.97 0.36 1.61 -7.23 -1.26 -4.11 120.40 113.73 1n1h s VAL 1236Ca 0.00 1.36 -0.28 0.00 -1.81 0.00 0.00 61.98 61.25 1n1h s VAL 1236Cb 0.00 -3.62 -0.10 0.00 0.56 0.00 0.00 36.38 33.22 1n1h s VAL 1236CO 0.00 -0.14 1.33 0.00 -0.31 0.00 0.00 175.10 175.97 1n1h s ALA 1237N -1.89 3.45 0.32 1.32 0.00 -1.26 -4.88 121.76 118.82 1n1h s ALA 1237Ca 0.61 1.29 0.10 0.00 0.00 0.00 0.00 51.96 53.96 1n1h s ALA 1237Cb -0.16 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.40 1n1h s ALA 1237CO 0.21 -0.74 -0.10 0.08 0.00 0.00 0.00 175.76 175.22 1n1h s VAL 1238N -1.17 2.44 -0.25 0.00 1.01 -1.26 -1.13 120.40 120.03 1n1h s VAL 1238Ca 0.51 -2.20 -0.20 0.00 0.00 0.00 0.00 61.98 60.10 1n1h s VAL 1238Cb -0.40 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.36 1n1h s VAL 1238CO 0.53 -0.26 0.60 -1.81 0.00 0.00 0.00 175.10 174.16 1n1h s ASP 1239N -3.61 6.55 -0.13 3.32 1.01 -0.68 -4.80 116.67 118.33 1n1h s ASP 1239Ca 0.32 0.67 -0.09 0.00 0.71 0.00 0.00 52.55 54.16 1n1h s ASP 1239Cb -0.00 -2.32 -0.05 0.00 1.01 0.00 0.00 42.92 41.56 1n1h s ASP 1239CO 0.17 -0.35 0.19 -0.51 0.21 0.00 0.00 175.17 174.88 1n1h s ILE 1240N 2.45 5.41 -0.10 0.77 2.07 -1.20 -0.60 121.20 130.00 1n1h s ILE 1240Ca 0.25 0.32 0.03 0.00 -1.41 0.00 0.00 60.65 59.84 1n1h s ILE 1240Cb -0.16 -3.48 -0.01 0.00 0.13 0.00 0.00 42.46 38.94 1n1h s ILE 1240CO 0.09 0.54 -0.19 -0.31 -1.91 0.00 0.00 174.94 173.16 1n1h s TYR 1241N -0.53 2.64 -0.01 3.50 2.02 0.74 -2.12 117.35 123.59 1n1h s TYR 1241Ca 0.14 -0.77 -0.32 0.00 -0.37 0.00 0.00 57.07 55.76 1n1h s TYR 1241Cb -0.12 -1.73 -0.11 0.00 -0.40 0.00 0.00 41.96 39.60 1n1h s TYR 1241CO 0.04 -0.26 1.91 -0.11 -1.57 0.00 0.00 175.55 175.56 1n1h n LEU 1242N 3.32 3.81 -0.13 -1.29 7.94 0.55 -0.33 117.00 130.87 1n1h n LEU 1242Ca -0.18 0.95 -0.25 0.00 -1.11 0.00 0.00 56.01 55.42 1n1h n LEU 1242Cb 0.53 -1.46 -0.10 0.00 0.53 0.00 0.00 43.42 42.92 1n1h n LEU 1242CO 0.28 0.07 -1.36 1.21 -1.11 0.00 0.00 177.39 176.49 1n1h n GLU 1243N 6.87 0.56 -3.52 1.96 4.07 -0.33 -3.51 120.64 126.74 1n1h n GLU 1243Ca 0.21 0.21 -0.16 0.00 -0.06 0.00 0.00 57.16 57.36 1n1h n GLU 1243Cb 0.35 -1.43 -0.05 0.00 -0.06 0.00 0.00 31.44 30.24 1n1h n GLU 1243CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 1n1h s ASP 1244N -7.03 -0.59 -0.18 4.31 3.68 -0.04 -4.89 116.67 111.92 1n1h s ASP 1244Ca -0.35 0.57 -0.00 0.00 2.13 0.00 0.00 52.55 54.90 1n1h s ASP 1244Cb 0.12 0.50 0.05 0.00 -1.45 0.00 0.00 42.92 42.14 1n1h s ASP 1244CO 0.48 -0.60 -0.05 -0.63 0.13 0.00 0.00 175.17 174.50 1n1h s ILE 1245N -1.49 1.16 0.01 4.11 1.01 -1.26 0.77 121.20 125.51 1n1h s ILE 1245Ca -0.08 -0.73 -0.02 0.00 0.00 0.00 0.00 60.65 59.82 1n1h s ILE 1245Cb -0.00 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 41.10 1n1h s ILE 1245CO 0.06 0.07 1.04 -0.74 0.00 0.00 0.00 174.94 175.37 1n1h h HIS 1246N 8.10 -0.12 -0.22 3.97 -0.00 -1.60 -1.93 115.15 123.35 1n1h h HIS 1246Ca -0.23 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.15 1n1h h HIS 1246Cb 1.11 0.06 0.00 0.00 -0.00 0.00 0.00 27.41 28.57 1n1h h HIS 1246CO 0.45 -0.03 0.00 0.41 -0.00 0.00 0.00 177.93 178.76 1n1h n GLY 1247N -1.02 0.01 0.00 5.26 0.00 -1.26 -5.01 105.19 103.17 1n1h n GLY 1247Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1n1h n GLY 1247CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n1h n GLY 1248N 0.85 0.07 0.25 -0.02 0.00 -0.73 -4.06 105.19 101.56 1n1h n GLY 1248Ca 0.07 -1.77 -0.05 0.00 0.00 0.00 0.00 46.02 44.28 1n1h n GLY 1248CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1n1h h GLY 1249N 0.00 0.65 0.94 -0.02 0.00 -1.56 -2.17 103.07 100.90 1n1h h GLY 1249Ca 0.00 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 1n1h h GLY 1249CO 0.00 0.47 0.14 -0.09 0.00 0.00 0.00 176.54 177.06 1n1h h ARG 1250N 0.54 0.40 -0.68 4.80 2.43 -1.84 -0.19 114.38 119.84 1n1h h ARG 1250Ca 0.08 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1n1h h ARG 1250Cb 0.64 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1n1h h ARG 1250CO 0.05 0.37 0.37 0.77 -1.51 0.00 0.00 179.97 180.02 1n1h h SER 1251N 0.32 0.85 -0.53 -3.80 0.02 -1.67 -2.50 113.55 106.25 1n1h h SER 1251Ca 0.10 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1n1h h SER 1251Cb 0.10 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 1n1h h SER 1251CO -0.01 0.70 0.33 0.25 -1.14 0.00 0.00 176.83 176.96 1n1h h LEU 1252N 0.93 0.62 -0.46 5.07 5.85 -1.07 -1.32 115.31 124.93 1n1h h LEU 1252Ca 0.24 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.94 1n1h h LEU 1252Cb 0.04 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 1n1h h LEU 1252CO -0.04 0.47 0.29 1.23 -0.34 0.00 0.00 178.44 180.05 1n1h h GLY 1253N 0.71 0.64 1.09 3.75 0.00 -0.74 0.36 103.07 108.88 1n1h h GLY 1253Ca 0.19 -0.22 -0.05 0.00 0.00 0.00 0.00 47.33 47.24 1n1h h GLY 1253CO -0.04 0.21 0.26 1.46 0.00 0.00 0.00 176.54 178.44 1n1h h GLN 1254N 0.59 1.14 -0.45 4.80 1.08 -1.27 0.70 115.11 121.70 1n1h h GLN 1254Ca 0.17 -0.22 0.03 0.00 -1.45 0.00 0.00 58.65 57.18 1n1h h GLN 1254Cb -0.04 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.18 1n1h h GLN 1254CO -0.05 0.95 0.25 -0.09 -0.95 0.00 0.00 178.83 178.93 1n1h h ARG 1255N 1.10 0.48 -0.53 1.46 2.43 -0.53 0.71 114.38 119.50 1n1h h ARG 1255Ca 0.25 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.29 1n1h h ARG 1255Cb 0.26 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 1n1h h ARG 1255CO -0.01 0.32 -0.06 0.74 -1.51 0.00 0.00 179.97 179.44 1n1h h PHE 1256N 0.49 1.09 -0.32 2.20 0.04 -0.48 -2.81 116.94 117.15 1n1h h PHE 1256Ca 0.19 -0.21 -0.00 0.00 2.80 0.00 0.00 57.97 60.74 1n1h h PHE 1256Cb 0.06 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.92 1n1h h PHE 1256CO -0.08 1.01 0.18 0.52 -0.60 0.00 0.00 178.31 179.33 1n1h h MET 1257N 0.86 0.43 -0.13 1.51 2.86 -0.18 -0.63 114.93 119.65 1n1h h MET 1257Ca 0.14 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1n1h h MET 1257Cb 0.62 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.18 1n1h h MET 1257CO 0.04 0.32 0.02 1.15 1.06 0.00 0.00 176.91 179.50 1n1h h THR 1258N 0.44 1.22 -0.14 2.22 2.02 -0.64 -1.41 112.91 116.62 1n1h h THR 1258Ca 0.12 -0.68 0.04 0.00 0.77 0.00 0.00 66.41 66.65 1n1h h THR 1258Cb 0.01 1.43 -0.04 0.00 -1.74 0.00 0.00 68.15 67.81 1n1h h THR 1258CO -0.02 0.20 -0.10 -0.25 0.37 0.00 0.00 175.52 175.72 1n1h h TRP 1259N -0.01 -0.25 -0.15 3.16 7.01 -1.16 -2.63 115.95 121.92 1n1h h TRP 1259Ca 0.04 0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.08 1n1h h TRP 1259Cb 0.29 0.13 -0.05 0.00 -2.10 0.00 0.00 29.16 27.43 1n1h h TRP 1259CO 0.02 -0.15 -0.41 0.52 -2.79 0.00 0.00 178.44 175.62 1n1h h MET 1260N -0.11 -0.39 0.00 2.65 2.86 -0.89 -1.04 114.93 118.02 1n1h h MET 1260Ca 0.09 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1n1h h MET 1260Cb 0.24 0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.98 1n1h h MET 1260CO -0.21 -0.26 0.00 2.89 1.06 0.00 0.00 176.91 180.39 1n1h n ARG 1261N -4.71 0.15 0.00 1.72 1.85 -0.55 -1.84 116.66 113.29 1n1h n ARG 1261Ca -0.04 0.16 0.08 0.00 -1.00 0.00 0.00 57.85 57.05 1n1h n ARG 1261Cb 0.28 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.16 1n1h n ARG 1261CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1n1h n GLN 1262N -1.22 1.70 -1.68 2.89 6.02 -0.44 -4.44 117.38 120.21 1n1h n GLN 1262Ca 0.05 -0.57 -0.46 0.00 -0.01 0.00 0.00 57.00 56.01 1n1h n GLN 1262Cb 0.06 -1.27 -0.04 0.00 1.02 0.00 0.00 30.24 30.00 1n1h n GLN 1262CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1n1h n GLU 1263N -0.50 2.39 -2.40 -1.09 -0.58 -0.77 -3.51 120.64 114.18 1n1h n GLU 1263Ca 0.06 0.87 -0.05 0.00 -0.42 0.00 0.00 57.16 57.62 1n1h n GLU 1263Cb 0.32 -2.73 0.01 0.00 -0.57 0.00 0.00 31.44 28.46 1n1h n GLU 1263CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1n1h n GLY 1264N 4.21 -1.09 0.00 0.62 0.00 -1.26 -3.97 105.19 103.70 1n1h n GLY 1264Ca 0.20 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.96 1n1h n GLY 1264CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86