#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rtr s ASN 3 N 0.00 6.24 -0.50 8.00 2.47 -1.26 -4.96 114.94 124.92 1rtr s ASN 3 Ca 0.00 -0.21 0.03 0.00 0.42 0.00 0.00 52.86 53.10 1rtr s ASN 3 Cb 0.00 -2.56 0.15 0.00 -1.45 0.00 0.00 41.25 37.39 1rtr s ASN 3 CO 0.00 -1.73 0.31 -0.76 -3.72 0.00 0.00 177.10 171.20 1rtr s LEU 4 N 5.57 3.15 0.31 3.21 1.43 -1.26 -5.11 118.68 125.98 1rtr s LEU 4 Ca 0.39 -3.00 -0.29 0.00 -1.03 0.00 0.00 54.13 50.20 1rtr s LEU 4 Cb -0.08 -1.15 -0.12 0.00 0.03 0.00 0.00 46.19 44.87 1rtr s LEU 4 CO 0.19 -0.21 1.46 -2.65 0.23 0.00 0.00 176.35 175.37 1rtr n PRO 5 N 3.06 2.43 -0.13 1.29 -0.02 -1.26 -4.87 135.00 135.50 1rtr n PRO 5 Ca 0.14 0.86 -0.05 0.00 -2.02 0.00 0.00 63.50 62.42 1rtr n PRO 5 Cb 0.36 -2.56 0.01 0.00 -0.02 0.00 0.00 33.50 31.29 1rtr n PRO 5 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1rtr h MET 6 N 3.71 -0.13 0.00 -0.52 2.86 -2.00 -1.99 114.93 116.86 1rtr h MET 6 Ca -0.47 0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.18 1rtr h MET 6 Cb 1.25 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.94 1rtr h MET 6 CO 0.71 -0.09 -0.00 -2.95 1.06 0.00 0.00 176.91 175.64 1rtr h ASN 7 N -0.14 0.00 0.05 1.22 -1.07 -1.99 -1.74 115.58 111.92 1rtr h ASN 7 Ca 0.20 0.00 -0.23 0.00 0.07 0.00 0.00 56.30 56.34 1rtr h ASN 7 Cb 0.45 0.00 0.02 0.00 -2.07 0.00 0.00 38.32 36.72 1rtr h ASN 7 CO -0.51 0.00 -0.93 0.50 0.07 0.00 0.00 177.43 176.56 1rtr h LYS 8 N 0.00 0.53 -0.05 4.14 1.63 -1.74 -2.21 116.57 118.86 1rtr h LYS 8 Ca -0.00 -0.65 -0.01 0.00 -0.85 0.00 0.00 60.65 59.15 1rtr h LYS 8 Cb 0.00 0.20 -0.00 0.00 -0.60 0.00 0.00 32.23 31.83 1rtr h LYS 8 CO 0.00 1.26 0.01 1.25 -3.45 0.00 0.00 179.45 178.52 1rtr h LEU 9 N 0.10 0.08 -0.98 5.20 5.85 -1.20 -0.99 115.31 123.36 1rtr h LEU 9 Ca -0.13 -0.24 0.14 0.00 0.84 0.00 0.00 57.88 58.49 1rtr h LEU 9 Cb 1.63 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 42.55 1rtr h LEU 9 CO 0.18 0.29 0.60 0.40 -0.34 0.00 0.00 178.44 179.57 1rtr h ILE 10 N -0.14 0.84 -0.26 4.05 2.04 -1.41 0.71 117.51 123.34 1rtr h ILE 10 Ca 0.02 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 1rtr h ILE 10 Cb 0.25 -0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.19 1rtr h ILE 10 CO 0.00 0.16 0.05 0.44 0.00 0.00 0.00 178.15 178.80 1rtr h ASP 11 N 0.89 0.41 -0.38 1.72 5.19 -1.12 -0.03 116.42 123.10 1rtr h ASP 11 Ca 0.51 -0.25 -0.01 0.00 -0.62 0.00 0.00 57.03 56.67 1rtr h ASP 11 Cb 0.62 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 40.00 1rtr h ASP 11 CO -0.31 0.56 0.21 -0.08 -3.12 0.00 0.00 179.24 176.49 1rtr h GLU 12 N 0.25 0.53 -0.53 3.56 4.81 -0.69 -1.99 114.58 120.51 1rtr h GLU 12 Ca 0.08 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1rtr h GLU 12 Cb 0.31 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1rtr h GLU 12 CO 0.00 0.44 0.34 0.28 -0.73 0.00 0.00 179.01 179.34 1rtr h VAL 13 N 0.48 1.14 -0.00 0.32 2.07 -0.72 -0.90 116.25 118.65 1rtr h VAL 13 Ca 0.13 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 1rtr h VAL 13 Cb 0.06 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1rtr h VAL 13 CO -0.02 0.14 -0.11 0.78 0.02 0.00 0.00 177.57 178.38 1rtr h ASN 14 N 0.72 0.00 0.07 0.57 2.35 -0.88 -1.92 115.58 116.50 1rtr h ASN 14 Ca 0.19 -0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.66 1rtr h ASN 14 Cb -0.06 -0.00 0.03 0.00 0.05 0.00 0.00 38.32 38.33 1rtr h ASN 14 CO -0.04 0.11 -1.15 0.78 -1.65 0.00 0.00 177.43 175.48 1rtr h ASN 15 N 0.00 0.90 -0.46 5.81 2.35 -0.56 -2.68 115.58 120.94 1rtr h ASN 15 Ca -0.00 -0.77 -0.05 0.00 -0.55 0.00 0.00 56.30 54.93 1rtr h ASN 15 Cb 0.19 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1rtr h ASN 15 CO 0.01 1.57 0.12 -0.33 -1.65 0.00 0.00 177.43 177.16 1rtr h GLU 16 N 0.34 0.80 -0.09 0.81 4.39 -1.04 -3.02 114.58 116.77 1rtr h GLU 16 Ca -0.16 -0.16 -0.17 0.00 0.34 0.00 0.00 59.36 59.20 1rtr h GLU 16 Cb 1.81 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 30.33 1rtr h GLU 16 CO 0.22 0.73 -0.69 -0.07 -1.16 0.00 0.00 179.01 178.04 1rtr h LEU 17 N 0.77 0.45 -1.57 1.33 3.38 -1.38 -2.49 115.31 115.81 1rtr h LEU 17 Ca 0.17 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1rtr h LEU 17 Cb 0.29 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1rtr h LEU 17 CO -0.00 1.00 -0.03 0.77 0.09 0.00 0.00 178.44 180.27 1rtr h SER 18 N 0.27 0.00 -0.09 -0.43 4.64 -1.35 -2.69 113.55 113.90 1rtr h SER 18 Ca -0.02 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 1rtr h SER 18 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 1rtr h SER 18 CO 0.12 0.03 -0.07 1.33 -0.87 0.00 0.00 176.83 177.37 1rtr n VAL 19 N -3.15 2.07 0.13 0.95 0.24 -1.17 -4.76 118.33 112.64 1rtr n VAL 19 Ca 0.00 -2.35 0.03 0.00 -2.04 0.00 0.00 64.34 59.98 1rtr n VAL 19 Cb 0.30 -0.25 0.02 0.00 -1.47 0.00 0.00 33.84 32.44 1rtr n VAL 19 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1rtr h ALA 20 N 0.62 0.69 -3.23 2.33 0.00 -1.09 -3.43 119.26 115.15 1rtr h ALA 20 Ca 0.02 -0.46 -0.62 0.00 0.00 0.00 0.00 54.91 53.85 1rtr h ALA 20 Cb 1.15 -0.04 -0.35 0.00 0.00 0.00 0.00 17.79 18.56 1rtr h ALA 20 CO 0.08 0.61 -0.85 0.42 0.00 0.00 0.00 179.25 179.51 1rtr s ILE 21 N -2.98 1.71 0.26 0.00 1.01 -1.26 -5.09 121.20 114.85 1rtr s ILE 21 Ca 0.03 -0.76 -0.09 0.00 0.00 0.00 0.00 60.65 59.83 1rtr s ILE 21 Cb 0.08 -1.54 -0.07 0.00 0.01 0.00 0.00 42.46 40.93 1rtr s ILE 21 CO 0.75 0.48 0.58 0.20 0.00 0.00 0.00 174.94 176.95 1rtr s ASN 22 N 0.98 6.58 0.48 3.58 0.01 -1.26 -5.05 114.94 120.26 1rtr s ASN 22 Ca -0.05 0.91 -0.24 0.00 -0.71 0.00 0.00 52.86 52.77 1rtr s ASN 22 Cb -0.15 -2.22 -0.08 0.00 0.41 0.00 0.00 41.25 39.21 1rtr s ASN 22 CO -0.03 -0.14 1.28 0.29 -1.51 0.00 0.00 177.10 176.99 1rtr n LYS 23 N -0.45 1.77 -4.32 -0.60 5.02 -1.26 -4.96 118.16 113.35 1rtr n LYS 23 Ca 0.00 0.64 -0.26 0.00 -2.02 0.00 0.00 58.31 56.68 1rtr n LYS 23 Cb 0.53 -2.43 -0.09 0.00 -0.02 0.00 0.00 35.03 33.01 1rtr n LYS 23 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1rtr s SER 24 N -0.71 4.17 0.36 4.39 0.15 -1.26 -5.02 113.70 115.77 1rtr s SER 24 Ca 0.66 -0.67 0.25 0.00 0.70 0.00 0.00 55.95 56.88 1rtr s SER 24 Cb -0.47 -0.66 1.31 0.00 -1.71 0.00 0.00 66.02 64.50 1rtr s SER 24 CO 0.54 0.07 1.76 1.62 1.20 0.00 0.00 173.24 178.44 1rtr h VAL 25 N 2.53 0.00 0.00 4.45 3.04 -2.02 -3.12 116.25 121.13 1rtr h VAL 25 Ca -0.45 -0.03 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 1rtr h VAL 25 Cb 1.22 0.61 0.00 0.00 -2.01 0.00 0.00 31.29 31.12 1rtr h VAL 25 CO 0.56 0.00 -0.21 0.23 -1.01 0.00 0.00 177.57 177.13 1rtr n MET 26 N -2.37 0.06 -3.31 4.17 2.81 -1.26 -4.96 117.12 112.26 1rtr n MET 26 Ca -0.01 0.04 -0.15 0.00 -1.81 0.00 0.00 57.70 55.76 1rtr n MET 26 Cb 0.06 -1.56 0.04 0.00 -0.71 0.00 0.00 33.22 31.06 1rtr n MET 26 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1rtr n ASP 27 N -1.66 -6.62 -2.58 7.83 -0.08 -1.18 -5.03 116.55 107.22 1rtr n ASP 27 Ca 0.06 -0.62 -0.12 0.00 -1.51 0.00 0.00 54.79 52.60 1rtr n ASP 27 Cb 0.36 -4.74 -0.03 0.00 2.34 0.00 0.00 41.12 39.05 1rtr n ASP 27 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1rtr n THR 28 N -3.02 0.00 0.71 5.18 -2.24 -1.26 -5.05 114.28 108.59 1rtr n THR 28 Ca -0.07 -1.09 0.11 0.00 -2.27 0.00 0.00 64.05 60.73 1rtr n THR 28 Cb 0.59 0.39 0.28 0.00 -2.10 0.00 0.00 70.33 69.48 1rtr n THR 28 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rtr n GLN 29 N -0.42 2.13 0.06 -0.78 6.02 -1.26 -4.54 117.38 118.59 1rtr n GLN 29 Ca -0.03 -1.71 -0.11 0.00 -0.01 0.00 0.00 57.00 55.14 1rtr n GLN 29 Cb 0.28 -1.44 -0.04 0.00 1.02 0.00 0.00 30.24 30.05 1rtr n GLN 29 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1rtr h LEU 30 N 3.27 -0.54 -0.84 1.08 6.46 -1.96 0.15 115.31 122.94 1rtr h LEU 30 Ca 0.00 0.08 -0.12 0.00 -0.12 0.00 0.00 57.88 57.72 1rtr h LEU 30 Cb 0.73 0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.87 1rtr h LEU 30 CO 0.00 -0.25 -0.42 -0.33 -0.62 0.00 0.00 178.44 176.82 1rtr h GLU 31 N -0.30 0.34 -0.19 1.25 3.07 -1.93 0.36 114.58 117.18 1rtr h GLU 31 Ca 0.06 -0.17 -0.04 0.00 -0.50 0.00 0.00 59.36 58.71 1rtr h GLU 31 Cb 0.37 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.28 1rtr h GLU 31 CO -0.17 0.71 -0.02 1.49 -1.40 0.00 0.00 179.01 179.62 1rtr h GLU 32 N 0.28 0.35 -0.53 2.33 4.81 -1.74 -1.26 114.58 118.83 1rtr h GLU 32 Ca 0.02 -0.12 -0.04 0.00 -0.13 0.00 0.00 59.36 59.09 1rtr h GLU 32 Cb 0.86 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.19 1rtr h GLU 32 CO 0.07 0.58 0.17 1.03 -0.73 0.00 0.00 179.01 180.13 1rtr h SER 33 N 0.10 0.76 -0.25 1.04 0.87 -0.40 0.16 113.55 115.82 1rtr h SER 33 Ca 0.05 -0.20 0.04 0.00 -1.23 0.00 0.00 61.79 60.46 1rtr h SER 33 Cb 0.43 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.15 1rtr h SER 33 CO 0.01 0.75 -0.02 0.24 -0.53 0.00 0.00 176.83 177.29 1rtr h MET 34 N 0.72 0.05 -0.06 2.24 2.86 -0.87 -2.78 114.93 117.09 1rtr h MET 34 Ca 0.17 -0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.64 1rtr h MET 34 Cb 0.26 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1rtr h MET 34 CO -0.01 0.04 -0.71 -0.07 1.06 0.00 0.00 176.91 177.22 1rtr h LEU 35 N 0.05 0.34 0.04 1.22 3.38 -0.99 -2.09 115.31 117.26 1rtr h LEU 35 Ca 0.12 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.90 1rtr h LEU 35 Cb 0.16 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1rtr h LEU 35 CO -0.21 0.94 -0.38 0.22 0.09 0.00 0.00 178.44 179.09 1rtr h TYR 36 N 0.20 -1.06 -0.48 1.13 3.20 -0.48 -0.07 116.97 119.41 1rtr h TYR 36 Ca -0.02 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1rtr h TYR 36 Cb 1.26 0.46 -0.02 0.00 1.54 0.00 0.00 36.73 39.97 1rtr h TYR 36 CO 0.03 -0.47 0.01 0.77 -1.64 0.00 0.00 178.16 176.86 1rtr h SER 37 N -0.56 0.76 0.49 -2.11 0.02 -1.47 -2.78 113.55 107.90 1rtr h SER 37 Ca 0.04 -0.18 -0.06 0.00 -0.84 0.00 0.00 61.79 60.75 1rtr h SER 37 Cb 0.63 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 1rtr h SER 37 CO -0.27 0.82 -0.31 0.25 -1.14 0.00 0.00 176.83 176.18 1rtr h LEU 38 N 0.74 0.00 -1.50 5.07 5.85 -1.01 -2.64 115.31 121.83 1rtr h LEU 38 Ca 0.15 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1rtr h LEU 38 Cb 0.44 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1rtr h LEU 38 CO 0.02 0.31 0.00 0.59 -0.34 0.00 0.00 178.44 179.02 1rtr n ASN 39 N -3.84 2.32 0.23 1.25 5.03 -0.07 -4.34 115.26 115.83 1rtr n ASN 39 Ca -0.01 -1.77 0.18 0.00 0.87 0.00 0.00 54.58 53.84 1rtr n ASN 39 Cb 0.39 -0.01 0.84 0.00 -1.02 0.00 0.00 39.78 39.98 1rtr n ASN 39 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1rtr h ALA 40 N 4.53 1.67 -2.07 5.41 0.00 -1.19 -3.47 119.26 124.13 1rtr h ALA 40 Ca 0.00 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.11 1rtr h ALA 40 Cb 0.77 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.46 1rtr h ALA 40 CO 0.00 -0.38 -0.71 0.41 0.00 0.00 0.00 179.25 178.57 1rtr n GLY 41 N -1.34 -2.91 0.00 0.00 0.00 -1.26 -5.08 105.19 94.60 1rtr n GLY 41 Ca 0.02 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.82 1rtr n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rtr n GLY 42 N -3.44 -0.73 0.18 -0.02 0.00 -1.26 -4.98 105.19 94.93 1rtr n GLY 42 Ca -0.05 -0.38 0.06 0.00 0.00 0.00 0.00 46.02 45.65 1rtr n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rtr h LYS 43 N 0.00 0.00 -6.49 1.61 1.57 -2.03 -3.47 116.57 107.76 1rtr h LYS 43 Ca 0.00 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.27 1rtr h LYS 43 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.20 1rtr h LYS 43 CO 0.00 0.35 -0.79 0.54 -0.57 0.00 0.00 179.45 178.98 1rtr n ARG 44 N -3.30 -4.55 0.15 3.15 5.12 -1.26 -4.87 116.66 111.10 1rtr n ARG 44 Ca 0.01 0.50 0.00 0.00 -1.93 0.00 0.00 57.85 56.44 1rtr n ARG 44 Cb 0.59 -5.33 0.28 0.00 -1.16 0.00 0.00 32.46 26.83 1rtr n ARG 44 CO 0.00 0.00 0.00 0.97 -1.93 0.00 0.00 177.63 176.67 1rtr h ILE 45 N -1.84 1.32 0.36 0.55 6.09 -1.98 -2.31 117.51 119.70 1rtr h ILE 45 Ca -0.58 -1.55 -0.02 0.00 -1.37 0.00 0.00 64.86 61.34 1rtr h ILE 45 Cb 1.38 1.80 0.00 0.00 0.47 0.00 0.00 36.82 40.48 1rtr h ILE 45 CO 0.72 0.45 -0.17 0.03 -3.07 0.00 0.00 178.15 176.11 1rtr h ARG 46 N 0.05 -0.46 -0.71 2.19 3.08 -1.98 0.36 114.38 116.92 1rtr h ARG 46 Ca 0.00 0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.10 1rtr h ARG 46 Cb 0.81 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.93 1rtr h ARG 46 CO 0.06 -0.14 0.46 -1.00 -1.07 0.00 0.00 179.97 178.28 1rtr h PRO 47 N -0.87 0.91 -0.19 0.04 0.13 -1.78 -1.72 132.00 128.52 1rtr h PRO 47 Ca -0.05 -0.05 0.02 0.00 -0.87 0.00 0.00 66.00 65.04 1rtr h PRO 47 Cb 0.53 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.44 1rtr h PRO 47 CO 0.08 0.60 0.07 0.28 -0.23 0.00 0.00 178.00 178.80 1rtr h VAL 48 N 0.94 0.96 -0.45 1.56 2.07 -1.41 -0.98 116.25 118.94 1rtr h VAL 48 Ca 0.27 -0.05 0.09 0.00 0.82 0.00 0.00 66.70 67.82 1rtr h VAL 48 Cb -0.08 0.78 -0.08 0.00 -1.52 0.00 0.00 31.29 30.39 1rtr h VAL 48 CO -0.07 0.03 -0.06 0.25 0.02 0.00 0.00 177.57 177.74 1rtr h LEU 49 N 0.16 -0.30 -0.26 2.57 5.85 -0.08 0.78 115.31 124.03 1rtr h LEU 49 Ca 0.08 0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.97 1rtr h LEU 49 Cb 0.05 0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1rtr h LEU 49 CO -0.08 -0.11 -0.04 0.25 -0.34 0.00 0.00 178.44 178.12 1rtr h LEU 50 N 0.05 -0.19 0.06 2.25 6.46 -0.52 -1.87 115.31 121.55 1rtr h LEU 50 Ca 0.22 0.07 -0.00 0.00 -0.12 0.00 0.00 57.88 58.05 1rtr h LEU 50 Cb 0.33 0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.40 1rtr h LEU 50 CO -0.42 -0.06 -0.03 -0.07 -0.62 0.00 0.00 178.44 177.24 1rtr h LEU 51 N 0.03 -0.06 -0.76 2.25 3.38 -0.65 -2.45 115.31 117.04 1rtr h LEU 51 Ca 0.12 -0.34 0.14 0.00 0.09 0.00 0.00 57.88 57.89 1rtr h LEU 51 Cb 0.18 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 40.85 1rtr h LEU 51 CO -0.25 0.32 0.31 -0.07 0.09 0.00 0.00 178.44 178.84 1rtr h LEU 52 N -0.45 0.30 -0.71 1.67 3.38 -0.80 -1.12 115.31 117.57 1rtr h LEU 52 Ca -0.01 0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 1rtr h LEU 52 Cb 0.40 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1rtr h LEU 52 CO 0.01 0.12 -0.64 0.71 0.09 0.00 0.00 178.44 178.73 1rtr h THR 53 N 0.46 1.44 -0.47 0.22 1.35 -1.29 0.79 112.91 115.41 1rtr h THR 53 Ca 0.42 -2.19 0.02 0.00 -0.55 0.00 0.00 66.41 64.10 1rtr h THR 53 Cb 0.62 2.19 -0.03 0.00 -1.73 0.00 0.00 68.15 69.20 1rtr h THR 53 CO -0.40 0.62 0.28 -0.07 -0.25 0.00 0.00 175.52 175.71 1rtr h LEU 54 N 0.00 0.47 -0.34 3.87 3.38 -0.78 -1.50 115.31 120.41 1rtr h LEU 54 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1rtr h LEU 54 Cb 1.13 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1rtr h LEU 54 CO 0.08 0.33 0.09 -0.78 0.09 0.00 0.00 178.44 178.26 1rtr h ASP 55 N 0.57 0.50 -0.38 -0.43 3.58 -0.90 -1.68 116.42 117.68 1rtr h ASP 55 Ca 0.18 -0.22 0.11 0.00 0.42 0.00 0.00 57.03 57.53 1rtr h ASP 55 Cb -0.00 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 1rtr h ASP 55 CO -0.08 0.59 0.46 0.28 -2.88 0.00 0.00 179.24 177.61 1rtr h SER 56 N 0.39 0.00 -0.59 2.28 0.02 -0.63 -1.47 113.55 113.55 1rtr h SER 56 Ca 0.11 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.96 1rtr h SER 56 Cb 0.27 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.76 1rtr h SER 56 CO -0.00 0.00 0.11 0.18 -1.14 0.00 0.00 176.83 175.98 1rtr n LEU 57 N -3.59 5.61 -3.62 5.07 4.77 -0.58 -3.61 117.00 121.05 1rtr n LEU 57 Ca 0.07 -3.09 -0.24 0.00 -0.03 0.00 0.00 56.01 52.72 1rtr n LEU 57 Cb 0.62 -0.69 0.07 0.00 -2.33 0.00 0.00 43.42 41.09 1rtr n LEU 57 CO 0.25 0.73 0.21 0.59 -1.33 0.00 0.00 177.39 177.84 1rtr n ASN 58 N 0.10 -5.54 -4.11 -1.43 3.02 -0.55 -4.99 115.26 101.77 1rtr n ASN 58 Ca 0.33 -0.58 -0.22 0.00 -0.03 0.00 0.00 54.58 54.08 1rtr n ASN 58 Cb 1.24 -4.90 -0.15 0.00 -0.61 0.00 0.00 39.78 35.36 1rtr n ASN 58 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1rtr s THR 59 N -3.33 1.07 -0.30 3.41 2.01 -0.78 -5.04 115.64 112.68 1rtr s THR 59 Ca 0.51 -0.65 -0.37 0.00 0.31 0.00 0.00 61.69 61.49 1rtr s THR 59 Cb -0.23 -0.90 -0.13 0.00 0.01 0.00 0.00 72.50 71.24 1rtr s THR 59 CO 0.74 0.25 2.00 1.21 -0.69 0.00 0.00 174.62 178.13 1rtr n GLU 60 N 2.60 1.18 0.26 4.92 0.00 -1.26 -3.64 120.64 124.70 1rtr n GLU 60 Ca -0.15 0.38 0.13 0.00 0.00 0.00 0.00 57.16 57.52 1rtr n GLU 60 Cb 0.55 -2.31 0.71 0.00 0.00 0.00 0.00 31.44 30.40 1rtr n GLU 60 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.13 177.23 1rtr h TYR 61 N 10.06 0.00 0.00 4.31 -0.00 -1.87 -2.51 116.97 126.96 1rtr h TYR 61 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.38 1rtr h TYR 61 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.05 1rtr h TYR 61 CO 0.89 0.12 0.00 0.93 -0.00 0.00 0.00 178.16 180.10 1rtr h GLU 62 N 0.00 0.00 0.00 0.10 4.39 -1.95 -1.72 114.58 115.40 1rtr h GLU 62 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1rtr h GLU 62 Cb 0.37 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1rtr h GLU 62 CO 0.02 0.00 0.00 -0.07 -1.16 0.00 0.00 179.01 177.80 1rtr h LEU 63 N 0.00 0.00 -2.42 1.33 3.38 -1.83 -2.70 115.31 113.07 1rtr h LEU 63 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rtr h LEU 63 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1rtr h LEU 63 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1rtr n GLY 64 N -0.58 1.78 0.27 0.83 0.00 -0.65 -4.67 105.19 102.18 1rtr n GLY 64 Ca -0.01 -0.39 -0.06 0.00 0.00 0.00 0.00 46.02 45.55 1rtr n GLY 64 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1rtr h MET 65 N 2.29 0.92 -0.29 1.61 -1.53 -1.54 0.22 114.93 116.61 1rtr h MET 65 Ca 0.00 -0.10 -0.03 0.00 -3.44 0.00 0.00 59.70 56.13 1rtr h MET 65 Cb 0.68 -0.18 -0.01 0.00 -0.55 0.00 0.00 31.60 31.53 1rtr h MET 65 CO 0.00 0.69 0.07 0.87 0.14 0.00 0.00 176.91 178.67 1rtr h LYS 66 N 0.90 0.47 -0.67 0.39 1.79 -1.83 -1.22 116.57 116.40 1rtr h LYS 66 Ca 0.23 -0.12 0.04 0.00 -2.18 0.00 0.00 60.65 58.63 1rtr h LYS 66 Cb 0.03 -0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 30.57 1rtr h LYS 66 CO -0.04 0.56 0.40 0.77 -1.08 0.00 0.00 179.45 180.05 1rtr h SER 67 N 0.30 0.63 -0.57 0.86 0.02 -1.77 0.12 113.55 113.13 1rtr h SER 67 Ca 0.09 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1rtr h SER 67 Cb 0.30 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 1rtr h SER 67 CO 0.00 0.42 0.37 0.00 -1.14 0.00 0.00 176.83 176.48 1rtr h ALA 68 N 1.31 0.73 -0.38 3.77 0.00 -0.39 0.86 119.26 125.16 1rtr h ALA 68 Ca 0.28 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 1rtr h ALA 68 Cb 0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1rtr h ALA 68 CO -0.14 0.18 -0.02 0.82 0.00 0.00 0.00 179.25 180.09 1rtr h ILE 69 N 0.77 1.26 -0.56 0.00 2.04 -0.69 -0.97 117.51 119.37 1rtr h ILE 69 Ca 0.21 -1.03 0.10 0.00 1.00 0.00 0.00 64.86 65.13 1rtr h ILE 69 Cb -0.06 1.17 -0.08 0.00 -0.74 0.00 0.00 36.82 37.12 1rtr h ILE 69 CO -0.04 0.35 0.14 0.00 0.00 0.00 0.00 178.15 178.60 1rtr h ALA 70 N 0.87 0.67 -0.52 1.87 0.00 -0.56 -0.24 119.26 121.35 1rtr h ALA 70 Ca 0.11 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.15 1rtr h ALA 70 Cb 0.50 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1rtr h ALA 70 CO 0.02 -0.28 0.31 1.25 0.00 0.00 0.00 179.25 180.56 1rtr h LEU 71 N 0.29 0.51 -0.86 0.00 5.85 -0.33 -0.38 115.31 120.39 1rtr h LEU 71 Ca 0.29 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.90 1rtr h LEU 71 Cb 0.39 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1rtr h LEU 71 CO -0.35 0.36 -0.42 -0.08 -0.34 0.00 0.00 178.44 177.61 1rtr h GLU 72 N 0.62 0.31 -0.79 1.25 4.57 -0.69 -1.43 114.58 118.42 1rtr h GLU 72 Ca 0.21 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 58.23 1rtr h GLU 72 Cb 0.02 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.57 1rtr h GLU 72 CO -0.10 0.69 0.47 0.52 -1.18 0.00 0.00 179.01 179.41 1rtr h MET 73 N 0.26 1.08 -0.65 1.92 2.86 -0.59 -0.55 114.93 119.27 1rtr h MET 73 Ca 0.02 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 1rtr h MET 73 Cb 0.86 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 32.26 1rtr h MET 73 CO 0.07 0.77 0.24 0.82 1.06 0.00 0.00 176.91 179.87 1rtr h ILE 74 N 1.09 1.24 -0.35 -1.22 1.08 -0.65 -1.81 117.51 116.90 1rtr h ILE 74 Ca 0.28 -0.79 -0.03 0.00 -0.39 0.00 0.00 64.86 63.93 1rtr h ILE 74 Cb -0.03 0.54 -0.01 0.00 -3.07 0.00 0.00 36.82 34.24 1rtr h ILE 74 CO -0.05 0.31 0.10 -0.74 -0.69 0.00 0.00 178.15 177.08 1rtr h HIS 75 N 0.93 0.56 -0.05 1.37 2.76 -0.96 -2.92 115.15 116.85 1rtr h HIS 75 Ca 0.21 -0.06 -0.15 0.00 -2.20 0.00 0.00 60.37 58.18 1rtr h HIS 75 Cb 0.24 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 1rtr h HIS 75 CO 0.02 0.56 -0.63 0.00 -1.30 0.00 0.00 177.93 176.58 1rtr h THR 76 N 0.40 1.41 -0.95 6.26 1.03 -1.03 -2.70 112.91 117.33 1rtr h THR 76 Ca 0.11 -2.06 -0.00 0.00 -0.01 0.00 0.00 66.41 64.45 1rtr h THR 76 Cb 0.27 2.07 -0.05 0.00 -1.07 0.00 0.00 68.15 69.37 1rtr h THR 76 CO -0.00 0.60 0.57 0.10 -0.01 0.00 0.00 175.52 176.79 1rtr h TYR 77 N 0.14 1.25 -0.16 0.00 -0.00 -1.28 -0.38 116.97 116.54 1rtr h TYR 77 Ca -0.01 -0.00 -0.12 0.00 -0.00 0.00 0.00 58.73 58.59 1rtr h TYR 77 Cb 1.14 -0.41 -0.01 0.00 -0.00 0.00 0.00 36.73 37.45 1rtr h TYR 77 CO 0.02 0.83 -0.44 0.66 -0.00 0.00 0.00 178.16 179.23 1rtr h SER 78 N 1.31 0.42 -0.78 0.10 4.64 -1.42 -0.71 113.55 117.11 1rtr h SER 78 Ca 0.34 -0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.45 1rtr h SER 78 Cb -0.06 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 61.88 1rtr h SER 78 CO -0.06 0.80 0.41 -0.07 -0.87 0.00 0.00 176.83 177.05 1rtr h LEU 79 N 0.32 0.99 -0.22 5.97 4.07 -1.14 0.64 115.31 125.94 1rtr h LEU 79 Ca 0.02 -0.11 -0.01 0.00 0.08 0.00 0.00 57.88 57.87 1rtr h LEU 79 Cb 0.90 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.38 1rtr h LEU 79 CO 0.08 0.81 0.11 0.40 -1.08 0.00 0.00 178.44 178.75 1rtr h ILE 80 N 1.09 1.14 -0.37 1.22 2.04 -0.54 -2.43 117.51 119.65 1rtr h ILE 80 Ca 0.27 -0.40 -0.14 0.00 1.00 0.00 0.00 64.86 65.59 1rtr h ILE 80 Cb 0.05 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1rtr h ILE 80 CO -0.04 0.14 -0.33 0.45 0.00 0.00 0.00 178.15 178.36 1rtr h HIS 81 N 0.22 0.99 -0.48 1.37 3.86 -0.95 -3.22 115.15 116.95 1rtr h HIS 81 Ca 0.08 -0.27 0.04 0.00 -1.16 0.00 0.00 60.37 59.06 1rtr h HIS 81 Cb 0.12 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.33 1rtr h HIS 81 CO -0.02 1.05 0.23 -0.44 0.86 0.00 0.00 177.93 179.61 1rtr h ASP 82 N 0.70 0.33 0.58 2.45 3.32 0.49 -2.64 116.42 121.65 1rtr h ASP 82 Ca 0.07 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1rtr h ASP 82 Cb 0.89 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1rtr h ASP 82 CO 0.08 0.23 0.00 0.47 -1.72 0.00 0.00 179.24 178.30 1rtr n ASP 83 N -4.91 0.49 -4.70 6.45 10.43 -0.93 -0.99 116.55 122.39 1rtr n ASP 83 Ca 0.04 0.63 -0.41 0.00 2.57 0.00 0.00 54.79 57.62 1rtr n ASP 83 Cb 0.13 -0.73 0.01 0.00 1.84 0.00 0.00 41.12 42.37 1rtr n ASP 83 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1rtr n LEU 84 N -2.06 3.88 -0.38 0.64 4.77 -1.00 -1.41 117.00 121.45 1rtr n LEU 84 Ca 0.02 1.12 0.30 0.00 -0.03 0.00 0.00 56.01 57.42 1rtr n LEU 84 Cb 0.19 -1.49 0.60 0.00 -2.33 0.00 0.00 43.42 40.38 1rtr n LEU 84 CO 0.17 -0.66 1.24 -0.65 -1.33 0.00 0.00 177.39 176.16 1rtr h PRO 85 N 2.14 0.22 0.00 3.23 0.11 -1.90 0.45 132.00 136.24 1rtr h PRO 85 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1rtr h PRO 85 Cb 1.29 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1rtr h PRO 85 CO 0.60 0.14 0.00 0.00 -0.21 0.00 0.00 178.00 178.54 1rtr n ALA 86 N -2.54 1.96 -2.28 -0.75 0.00 -1.26 -4.35 120.51 111.30 1rtr n ALA 86 Ca 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1rtr n ALA 86 Cb 1.15 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 19.24 1rtr n ALA 86 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1rtr n MET 87 N -1.71 0.00 0.25 0.00 2.81 0.15 -4.95 117.12 113.67 1rtr n MET 87 Ca 0.05 0.00 0.15 0.00 -1.81 0.00 0.00 57.70 56.09 1rtr n MET 87 Cb 0.27 0.00 0.50 0.00 -0.71 0.00 0.00 33.22 33.27 1rtr n MET 87 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1rtr h ASP 88 N 0.00 0.00 -5.93 7.83 3.45 -0.99 -3.48 116.42 117.30 1rtr h ASP 88 Ca 0.00 0.00 -0.38 0.00 0.43 0.00 0.00 57.03 57.08 1rtr h ASP 88 Cb 0.00 0.00 0.10 0.00 -0.56 0.00 0.00 39.33 38.87 1rtr h ASP 88 CO 0.00 0.00 -0.83 -3.20 -1.57 0.00 0.00 179.24 173.64 1rtr n ASN 89 N -3.07 -2.26 -4.71 6.45 4.05 -0.79 -4.99 115.26 109.95 1rtr n ASN 89 Ca 0.02 -0.78 -0.38 0.00 0.45 0.00 0.00 54.58 53.89 1rtr n ASN 89 Cb 0.39 -4.37 -0.06 0.00 1.23 0.00 0.00 39.78 36.96 1rtr n ASN 89 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 177.26 172.40 1rtr s ASP 90 N -4.19 6.64 0.11 1.20 -0.00 -0.50 -4.90 116.67 115.03 1rtr s ASP 90 Ca 0.09 0.77 0.23 0.00 -0.00 0.00 0.00 52.55 53.63 1rtr s ASP 90 Cb -0.02 -2.28 0.13 0.00 -0.00 0.00 0.00 42.92 40.75 1rtr s ASP 90 CO 0.79 -0.02 1.12 0.47 -0.00 0.00 0.00 175.17 177.53 1rtr n ASP 91 N 3.85 0.68 -3.96 0.27 10.43 -1.26 -4.71 116.55 121.85 1rtr n ASP 91 Ca -0.07 0.05 -0.14 0.00 2.57 0.00 0.00 54.79 57.20 1rtr n ASP 91 Cb 0.51 0.52 -0.14 0.00 1.84 0.00 0.00 41.12 43.86 1rtr n ASP 91 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 1rtr s TYR 92 N -3.24 0.37 -0.09 1.24 1.51 -1.26 -2.10 117.35 113.78 1rtr s TYR 92 Ca 0.03 -0.17 -0.03 0.00 -1.01 0.00 0.00 57.07 55.89 1rtr s TYR 92 Cb 0.13 -0.24 0.05 0.00 -0.11 0.00 0.00 41.96 41.79 1rtr s TYR 92 CO 0.77 -0.03 0.17 0.50 -1.11 0.00 0.00 175.55 175.85 1rtr s ARG 93 N -0.44 0.06 -0.87 -0.62 3.52 -0.31 -4.87 118.95 115.42 1rtr s ARG 93 Ca -0.02 0.56 -0.08 0.00 -0.13 0.00 0.00 55.73 56.06 1rtr s ARG 93 Cb -0.03 -0.23 0.01 0.00 -1.56 0.00 0.00 34.95 33.13 1rtr s ARG 93 CO -0.00 -0.29 0.15 2.89 -0.81 0.00 0.00 175.30 177.25 1rtr n ARG 94 N 5.18 -0.80 0.00 5.12 1.85 -1.26 -2.06 116.66 124.68 1rtr n ARG 94 Ca -0.08 -0.03 0.00 0.00 -1.00 0.00 0.00 57.85 56.74 1rtr n ARG 94 Cb 0.50 -1.78 0.00 0.00 -1.05 0.00 0.00 32.46 30.13 1rtr n ARG 94 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rtr n GLY 95 N -1.85 2.68 3.88 2.89 0.00 -1.26 -5.02 105.19 106.51 1rtr n GLY 95 Ca -0.15 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 1rtr n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rtr s LYS 96 N 0.00 3.74 0.56 1.61 -0.14 -0.87 -5.07 119.74 119.57 1rtr s LYS 96 Ca 0.00 0.18 -0.21 0.00 -1.36 0.00 0.00 55.97 54.58 1rtr s LYS 96 Cb 0.00 -2.66 -0.04 0.00 -1.68 0.00 0.00 37.83 33.45 1rtr s LYS 96 CO 0.00 0.30 1.36 -0.51 -0.76 0.00 0.00 175.35 175.74 1rtr s LEU 97 N -2.99 3.82 0.55 3.17 1.43 -1.26 -1.16 118.68 122.24 1rtr s LEU 97 Ca 0.46 2.78 -0.17 0.00 -1.03 0.00 0.00 54.13 56.17 1rtr s LEU 97 Cb -0.11 -4.30 -0.06 0.00 0.03 0.00 0.00 46.19 41.74 1rtr s LEU 97 CO 0.24 -1.64 1.02 0.42 0.23 0.00 0.00 176.35 176.61 1rtr s THR 98 N -1.30 4.14 0.19 5.49 -4.23 -0.89 -4.76 115.64 114.28 1rtr s THR 98 Ca 0.73 1.05 -0.24 0.00 -1.18 0.00 0.00 61.69 62.05 1rtr s THR 98 Cb -0.41 -3.54 0.07 0.00 1.34 0.00 0.00 72.50 69.96 1rtr s THR 98 CO 0.48 -0.56 1.52 -3.20 -0.54 0.00 0.00 174.62 172.31 1rtr n ASN 99 N -1.71 -0.85 0.24 3.99 2.85 -1.26 -0.65 115.26 117.86 1rtr n ASN 99 Ca 0.08 1.73 0.17 0.00 -0.11 0.00 0.00 54.58 56.44 1rtr n ASN 99 Cb 0.53 -0.30 0.80 0.00 1.24 0.00 0.00 39.78 42.05 1rtr n ASN 99 CO 0.00 0.00 0.00 1.12 -2.11 0.00 0.00 177.26 176.27 1rtr h HIS 100 N 0.00 0.00 0.00 1.20 2.07 -1.91 0.41 115.15 116.92 1rtr h HIS 100 Ca 0.24 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.76 1rtr h HIS 100 Cb 0.49 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.47 1rtr h HIS 100 CO -0.94 0.00 -0.73 0.87 -3.07 0.00 0.00 177.93 174.06 1rtr h LYS 101 N 0.00 0.00 0.09 5.12 1.79 -1.18 -1.49 116.57 120.90 1rtr h LYS 101 Ca 0.00 0.00 -0.36 0.00 -2.18 0.00 0.00 60.65 58.11 1rtr h LYS 101 Cb 0.20 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 1rtr h LYS 101 CO 0.00 0.00 -2.06 0.28 -1.08 0.00 0.00 179.45 176.59 1rtr n VAL 102 N -2.69 1.69 0.21 0.50 0.31 -0.63 -4.69 118.33 113.04 1rtr n VAL 102 Ca 0.01 -0.58 0.02 0.00 -0.01 0.00 0.00 64.34 63.79 1rtr n VAL 102 Cb 0.53 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 1rtr n VAL 102 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1rtr n TYR 103 N -3.54 0.00 0.00 3.52 4.02 0.04 -5.11 117.16 116.09 1rtr n TYR 103 Ca -0.36 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.53 1rtr n TYR 103 Cb 1.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.32 1rtr n TYR 103 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1rtr n GLY 104 N 0.58 0.26 0.12 2.72 0.00 -0.56 -4.44 105.19 103.86 1rtr n GLY 104 Ca 0.02 -1.68 -0.08 0.00 0.00 0.00 0.00 46.02 44.28 1rtr n GLY 104 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1rtr h GLU 105 N 0.00 0.18 -0.64 1.61 5.08 -1.92 -2.47 114.58 116.43 1rtr h GLU 105 Ca 0.00 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 1rtr h GLU 105 Cb 0.00 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 1rtr h GLU 105 CO 0.00 0.12 0.05 0.11 -1.00 0.00 0.00 179.01 178.29 1rtr h TRP 106 N 0.19 1.17 -0.28 4.33 5.08 -1.94 -0.58 115.95 123.91 1rtr h TRP 106 Ca 0.11 -0.18 -0.01 0.00 1.08 0.00 0.00 58.89 59.88 1rtr h TRP 106 Cb 0.08 -0.31 -0.01 0.00 -3.00 0.00 0.00 29.16 25.91 1rtr h TRP 106 CO -0.13 1.01 0.14 1.15 -1.28 0.00 0.00 178.44 179.32 1rtr h THR 107 N 1.00 1.15 -0.48 0.12 2.02 -1.77 -2.15 112.91 112.80 1rtr h THR 107 Ca 0.19 -0.42 0.01 0.00 0.77 0.00 0.00 66.41 66.96 1rtr h THR 107 Cb 0.51 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 1rtr h THR 107 CO 0.02 0.15 0.31 0.00 0.37 0.00 0.00 175.52 176.37 1rtr h ALA 108 N 1.00 0.61 -0.49 6.16 0.00 -1.07 0.28 119.26 125.75 1rtr h ALA 108 Ca 0.10 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.05 1rtr h ALA 108 Cb 0.11 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1rtr h ALA 108 CO -0.01 0.03 0.15 0.82 0.00 0.00 0.00 179.25 180.23 1rtr h ILE 109 N 0.62 0.80 -0.22 0.00 2.04 -1.00 -1.96 117.51 117.78 1rtr h ILE 109 Ca 0.18 -0.10 -0.12 0.00 1.00 0.00 0.00 64.86 65.82 1rtr h ILE 109 Cb -0.04 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 1rtr h ILE 109 CO -0.06 0.06 -0.37 -0.07 0.00 0.00 0.00 178.15 177.71 1rtr h LEU 110 N 0.30 0.51 -0.85 1.44 3.38 -0.66 -1.65 115.31 117.79 1rtr h LEU 110 Ca 0.24 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1rtr h LEU 110 Cb 0.27 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1rtr h LEU 110 CO -0.27 0.84 0.49 0.00 0.09 0.00 0.00 178.44 179.59 1rtr h ALA 111 N 1.19 1.09 0.19 1.53 0.00 -0.04 0.06 119.26 123.28 1rtr h ALA 111 Ca 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1rtr h ALA 111 Cb 0.83 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1rtr h ALA 111 CO 0.07 0.57 -0.09 0.78 0.00 0.00 0.00 179.25 180.58 1rtr h GLY 112 N 1.18 -0.26 0.54 0.00 0.00 -1.06 -0.70 103.07 102.77 1rtr h GLY 112 Ca 0.30 0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.81 1rtr h GLY 112 CO -0.05 -0.10 0.39 -0.55 0.00 0.00 0.00 176.54 176.23 1rtr h ASP 113 N -0.32 0.54 -0.35 0.19 3.45 -1.10 -0.62 116.42 118.22 1rtr h ASP 113 Ca -0.03 0.05 -0.03 0.00 0.43 0.00 0.00 57.03 57.45 1rtr h ASP 113 Cb 0.25 -0.05 -0.01 0.00 -0.56 0.00 0.00 39.33 38.95 1rtr h ASP 113 CO 0.04 0.32 0.08 0.00 -1.57 0.00 0.00 179.24 178.12 1rtr h ALA 114 N 1.41 0.46 -0.41 3.45 0.00 -0.86 -1.43 119.26 121.88 1rtr h ALA 114 Ca 0.35 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1rtr h ALA 114 Cb 0.32 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1rtr h ALA 114 CO -0.24 0.12 0.21 -0.07 0.00 0.00 0.00 179.25 179.27 1rtr h LEU 115 N 0.41 0.53 -0.45 0.00 3.38 -0.77 0.23 115.31 118.63 1rtr h LEU 115 Ca 0.11 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.06 1rtr h LEU 115 Cb 0.30 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.82 1rtr h LEU 115 CO 0.00 0.49 -0.20 0.25 0.09 0.00 0.00 178.44 179.07 1rtr h LEU 116 N 0.53 -0.69 -0.39 1.67 6.46 -0.97 -2.07 115.31 119.85 1rtr h LEU 116 Ca 0.14 0.16 -0.05 0.00 -0.12 0.00 0.00 57.88 58.02 1rtr h LEU 116 Cb 0.09 0.38 -0.02 0.00 -0.73 0.00 0.00 40.66 40.39 1rtr h LEU 116 CO -0.02 -0.23 0.06 0.74 -0.62 0.00 0.00 178.44 178.37 1rtr h THR 117 N -0.10 1.24 -0.32 1.05 2.02 -0.63 -2.97 112.91 113.19 1rtr h THR 117 Ca 0.22 -0.88 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 1rtr h THR 117 Cb 0.44 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 1rtr h THR 117 CO -0.52 0.30 0.14 0.50 0.37 0.00 0.00 175.52 176.31 1rtr h LYS 118 N 0.49 0.44 -0.66 6.66 1.63 -0.31 -2.08 116.57 122.75 1rtr h LYS 118 Ca 0.12 -0.05 0.05 0.00 -0.85 0.00 0.00 60.65 59.92 1rtr h LYS 118 Cb 0.38 -0.09 -0.05 0.00 -0.60 0.00 0.00 32.23 31.87 1rtr h LYS 118 CO 0.01 0.36 0.38 0.00 -3.45 0.00 0.00 179.45 176.75 1rtr h ALA 119 N 1.71 0.87 -0.02 5.00 0.00 -1.21 0.33 119.26 125.94 1rtr h ALA 119 Ca 0.11 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 1rtr h ALA 119 Cb 0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1rtr h ALA 119 CO -0.01 0.08 -0.66 0.74 0.00 0.00 0.00 179.25 179.40 1rtr h PHE 120 N 0.71 0.14 -0.23 0.00 -1.00 -1.47 -2.61 116.94 112.48 1rtr h PHE 120 Ca 0.29 -0.06 -0.01 0.00 2.81 0.00 0.00 57.97 61.00 1rtr h PHE 120 Cb 0.13 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.66 1rtr h PHE 120 CO -0.07 0.73 0.12 1.49 -1.61 0.00 0.00 178.31 178.97 1rtr h GLU 121 N 0.07 0.32 -0.33 1.51 4.81 -0.68 -1.82 114.58 118.47 1rtr h GLU 121 Ca -0.01 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1rtr h GLU 121 Cb 1.17 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 1rtr h GLU 121 CO 0.09 0.31 0.10 1.25 -0.73 0.00 0.00 179.01 180.04 1rtr h LEU 122 N 0.25 0.09 -0.42 1.64 5.85 -0.18 -1.18 115.31 121.35 1rtr h LEU 122 Ca 0.08 0.04 -0.17 0.00 0.84 0.00 0.00 57.88 58.67 1rtr h LEU 122 Cb 0.09 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.16 1rtr h LEU 122 CO -0.01 0.08 -0.50 0.40 -0.34 0.00 0.00 178.44 178.07 1rtr h ILE 123 N 0.23 1.29 -0.74 4.05 2.04 -1.49 -2.84 117.51 120.05 1rtr h ILE 123 Ca 0.15 -1.70 0.15 0.00 1.00 0.00 0.00 64.86 64.46 1rtr h ILE 123 Cb 0.14 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.78 1rtr h ILE 123 CO -0.17 0.55 0.50 0.28 0.00 0.00 0.00 178.15 179.30 1rtr h SER 124 N 0.60 0.37 0.01 1.72 0.02 -1.00 -3.03 113.55 112.24 1rtr h SER 124 Ca 0.02 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1rtr h SER 124 Cb 1.08 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.56 1rtr h SER 124 CO 0.11 0.19 -0.18 -1.54 -1.14 0.00 0.00 176.83 174.27 1rtr n SER 125 N -4.47 2.17 -4.58 3.07 3.41 -0.47 -4.92 113.62 107.82 1rtr n SER 125 Ca 0.14 -1.61 -0.42 0.00 -0.26 0.00 0.00 58.87 56.72 1rtr n SER 125 Cb 0.53 0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 64.61 1rtr n SER 125 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1rtr s ASP 126 N -2.21 6.13 0.00 4.04 3.68 -1.15 -4.88 116.67 122.29 1rtr s ASP 126 Ca 0.26 0.56 0.28 0.00 2.13 0.00 0.00 52.55 55.78 1rtr s ASP 126 Cb 0.20 -2.54 1.11 0.00 -1.45 0.00 0.00 42.92 40.24 1rtr s ASP 126 CO 0.42 -1.65 1.79 -0.90 0.13 0.00 0.00 175.17 174.96 1rtr n ASP 127 N 9.55 0.57 0.07 -0.34 3.85 -1.26 -3.14 116.55 125.85 1rtr n ASP 127 Ca 0.15 -0.60 0.11 0.00 -0.71 0.00 0.00 54.79 53.75 1rtr n ASP 127 Cb 0.49 -0.04 0.45 0.00 -1.35 0.00 0.00 41.12 40.67 1rtr n ASP 127 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1rtr n ARG 128 N -0.92 0.13 -4.83 0.11 5.12 -1.26 -4.79 116.66 110.21 1rtr n ARG 128 Ca 0.14 0.25 -0.31 0.00 -1.93 0.00 0.00 57.85 56.00 1rtr n ARG 128 Cb 0.29 -1.70 -0.14 0.00 -1.16 0.00 0.00 32.46 29.76 1rtr n ARG 128 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1rtr s LEU 129 N -3.87 2.47 0.89 0.55 1.43 -1.19 -5.03 118.68 113.95 1rtr s LEU 129 Ca 0.08 -0.42 -0.11 0.00 -1.03 0.00 0.00 54.13 52.65 1rtr s LEU 129 Cb 0.12 -1.46 0.13 0.00 0.03 0.00 0.00 46.19 45.01 1rtr s LEU 129 CO 0.44 0.28 1.11 0.42 0.23 0.00 0.00 176.35 178.83 1rtr s THR 130 N -0.83 2.51 0.39 5.49 -4.23 -1.26 -4.82 115.64 112.89 1rtr s THR 130 Ca 0.13 0.16 0.06 0.00 -1.18 0.00 0.00 61.69 60.87 1rtr s THR 130 Cb -0.10 -2.38 0.24 0.00 1.34 0.00 0.00 72.50 71.60 1rtr s THR 130 CO 0.03 -0.22 2.02 0.44 -0.54 0.00 0.00 174.62 176.35 1rtr h ASP 131 N -1.69 0.48 -0.69 3.99 3.32 -1.98 -2.34 116.42 117.50 1rtr h ASP 131 Ca -0.46 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 56.49 1rtr h ASP 131 Cb 1.27 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.67 1rtr h ASP 131 CO 0.47 0.39 0.15 1.05 -1.72 0.00 0.00 179.24 179.58 1rtr h GLU 132 N 0.55 1.13 0.02 3.56 4.11 -2.00 -2.16 114.58 119.78 1rtr h GLU 132 Ca 0.14 -0.28 -0.23 0.00 0.07 0.00 0.00 59.36 59.06 1rtr h GLU 132 Cb 0.02 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1rtr h GLU 132 CO -0.02 1.00 -0.98 -0.39 0.07 0.00 0.00 179.01 178.69 1rtr h VAL 133 N 1.06 1.43 -0.59 -1.06 -1.51 -1.88 -2.74 116.25 110.95 1rtr h VAL 133 Ca 0.22 -2.56 0.08 0.00 -1.23 0.00 0.00 66.70 63.21 1rtr h VAL 133 Cb 0.40 2.50 -0.07 0.00 -2.13 0.00 0.00 31.29 31.99 1rtr h VAL 133 CO 0.01 0.76 0.24 0.11 -1.23 0.00 0.00 177.57 177.45 1rtr h LYS 134 N 0.19 0.42 -0.79 5.19 1.57 -1.29 0.11 116.57 121.97 1rtr h LYS 134 Ca -0.08 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.63 1rtr h LYS 134 Cb 1.62 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 33.80 1rtr h LYS 134 CO 0.16 0.28 0.33 0.82 -0.57 0.00 0.00 179.45 180.47 1rtr h ILE 135 N 0.43 1.26 -0.31 1.86 1.08 -1.36 0.25 117.51 120.72 1rtr h ILE 135 Ca 0.29 -0.80 -0.01 0.00 -0.39 0.00 0.00 64.86 63.96 1rtr h ILE 135 Cb 0.33 0.30 -0.01 0.00 -3.07 0.00 0.00 36.82 34.36 1rtr h ILE 135 CO -0.27 0.33 0.17 0.11 -0.69 0.00 0.00 178.15 177.80 1rtr h LYS 136 N 1.15 0.43 -0.17 2.37 1.57 -0.97 0.24 116.57 121.20 1rtr h LYS 136 Ca 0.27 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.97 1rtr h LYS 136 Cb 0.20 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1rtr h LYS 136 CO -0.02 0.36 -0.00 0.28 -0.57 0.00 0.00 179.45 179.50 1rtr h VAL 137 N 0.38 1.26 -0.50 0.50 2.07 -0.58 -2.22 116.25 117.16 1rtr h VAL 137 Ca 0.11 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 1rtr h VAL 137 Cb 0.06 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1rtr h VAL 137 CO -0.02 0.25 0.27 0.25 0.02 0.00 0.00 177.57 178.35 1rtr h LEU 138 N 0.04 0.62 -0.54 2.57 5.85 -0.40 0.15 115.31 123.60 1rtr h LEU 138 Ca 0.05 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 1rtr h LEU 138 Cb 0.38 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 1rtr h LEU 138 CO 0.01 0.53 0.22 -0.61 -0.34 0.00 0.00 178.44 178.24 1rtr h GLN 139 N 0.66 0.81 -0.59 1.25 4.15 -0.53 -2.36 115.11 118.50 1rtr h GLN 139 Ca 0.17 -0.15 -0.06 0.00 0.77 0.00 0.00 58.65 59.39 1rtr h GLN 139 Cb 0.05 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.58 1rtr h GLN 139 CO -0.03 0.70 0.15 -0.09 -1.93 0.00 0.00 178.83 177.63 1rtr h ARG 140 N 0.73 0.94 -0.82 1.69 2.43 -1.09 -2.50 114.38 115.77 1rtr h ARG 140 Ca 0.18 -0.23 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1rtr h ARG 140 Cb 0.20 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 1rtr h ARG 140 CO -0.01 0.87 0.45 1.25 -1.51 0.00 0.00 179.97 181.01 1rtr h LEU 141 N 0.85 1.02 -0.21 3.80 5.85 -0.49 -0.94 115.31 125.19 1rtr h LEU 141 Ca 0.18 -0.08 -0.22 0.00 0.84 0.00 0.00 57.88 58.60 1rtr h LEU 141 Cb 0.35 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1rtr h LEU 141 CO 0.00 0.81 -0.88 0.77 -0.34 0.00 0.00 178.44 178.80 1rtr h SER 142 N 1.14 0.63 -0.39 1.25 4.64 -1.31 -1.63 113.55 117.89 1rtr h SER 142 Ca 0.29 -0.47 -0.06 0.00 -0.47 0.00 0.00 61.79 61.09 1rtr h SER 142 Cb 0.02 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 1rtr h SER 142 CO -0.05 1.25 0.02 0.40 -0.87 0.00 0.00 176.83 177.59 1rtr h ILE 143 N 0.31 1.25 0.00 0.95 2.04 -1.37 -1.81 117.51 118.88 1rtr h ILE 143 Ca -0.07 -0.95 -0.03 0.00 1.00 0.00 0.00 64.86 64.81 1rtr h ILE 143 Cb 1.50 1.11 -0.00 0.00 -0.74 0.00 0.00 36.82 38.69 1rtr h ILE 143 CO 0.16 0.32 -0.16 0.00 0.00 0.00 0.00 178.15 178.47 1rtr h ALA 144 N 0.89 1.17 0.00 1.87 0.00 -1.09 -3.23 119.26 118.87 1rtr h ALA 144 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rtr h ALA 144 Cb 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1rtr h ALA 144 CO 0.02 0.19 -1.68 0.43 0.00 0.00 0.00 179.25 178.21 1rtr n SER 145 N -3.53 0.39 -1.20 0.00 7.64 -0.62 -0.54 113.62 115.76 1rtr n SER 145 Ca -0.01 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.59 1rtr n SER 145 Cb 0.31 1.69 0.00 0.00 -1.01 0.00 0.00 64.21 65.20 1rtr n SER 145 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rtr n GLY 146 N 1.35 1.30 0.25 0.23 0.00 -0.69 -2.64 105.19 104.99 1rtr n GLY 146 Ca -0.02 -1.60 0.15 0.00 0.00 0.00 0.00 46.02 44.56 1rtr n GLY 146 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1rtr h HIS 147 N 0.00 0.00 -0.61 1.61 2.07 -1.85 -1.88 115.15 114.48 1rtr h HIS 147 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1rtr h HIS 147 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1rtr h HIS 147 CO 0.00 0.00 0.00 1.33 -3.07 0.00 0.00 177.93 176.19 1rtr n VAL 148 N -3.07 1.24 0.00 6.12 0.24 -1.26 -3.36 118.33 118.23 1rtr n VAL 148 Ca 0.02 -1.08 0.00 0.00 -2.04 0.00 0.00 64.34 61.24 1rtr n VAL 148 Cb 0.39 0.39 0.00 0.00 -1.47 0.00 0.00 33.84 33.15 1rtr n VAL 148 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rtr n GLY 149 N 1.20 4.14 0.32 7.63 0.00 -0.80 -4.91 105.19 112.77 1rtr n GLY 149 Ca 0.22 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 1rtr n GLY 149 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1rtr h MET 150 N 0.00 -0.33 -0.19 1.61 -1.53 -0.72 -0.03 114.93 113.74 1rtr h MET 150 Ca 0.00 0.02 -0.17 0.00 -3.44 0.00 0.00 59.70 56.11 1rtr h MET 150 Cb 0.00 0.07 -0.00 0.00 -0.55 0.00 0.00 31.60 31.12 1rtr h MET 150 CO 0.00 -0.22 -0.59 -0.39 0.14 0.00 0.00 176.91 175.85 1rtr h VAL 151 N -0.34 1.32 -0.97 -5.77 -1.51 -1.13 -1.79 116.25 106.06 1rtr h VAL 151 Ca 0.11 -1.84 0.03 0.00 -1.23 0.00 0.00 66.70 63.77 1rtr h VAL 151 Cb 0.52 1.81 -0.05 0.00 -2.13 0.00 0.00 31.29 31.43 1rtr h VAL 151 CO -0.38 0.58 0.64 1.23 -1.23 0.00 0.00 177.57 178.41 1rtr h GLY 152 N 0.99 1.39 1.05 5.19 0.00 -1.27 -0.37 103.07 110.04 1rtr h GLY 152 Ca -0.00 -0.49 0.02 0.00 0.00 0.00 0.00 47.33 46.85 1rtr h GLY 152 CO 0.11 0.45 0.62 -1.33 0.00 0.00 0.00 176.54 176.39 1rtr h GLY 153 N 1.26 1.32 1.09 4.60 0.00 -0.58 -1.70 103.07 109.06 1rtr h GLY 153 Ca 0.37 -0.48 -0.11 0.00 0.00 0.00 0.00 47.33 47.11 1rtr h GLY 153 CO -0.10 0.46 -0.11 1.46 0.00 0.00 0.00 176.54 178.25 1rtr h GLN 154 N 1.24 1.02 0.05 4.80 1.08 -0.45 -1.48 115.11 121.37 1rtr h GLN 154 Ca 0.35 -0.38 0.02 0.00 -1.45 0.00 0.00 58.65 57.19 1rtr h GLN 154 Cb -0.10 -0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.21 1rtr h GLN 154 CO -0.09 1.07 -0.46 0.52 -0.95 0.00 0.00 178.83 178.92 1rtr h MET 155 N 0.90 -0.62 -0.47 1.46 2.86 -0.69 0.41 114.93 118.77 1rtr h MET 155 Ca 0.14 0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.90 1rtr h MET 155 Cb 0.68 0.14 -0.07 0.00 0.06 0.00 0.00 31.60 32.41 1rtr h MET 155 CO 0.05 -0.41 0.07 1.25 1.06 0.00 0.00 176.91 178.93 1rtr h LEU 156 N -0.64 -0.04 0.03 1.22 6.46 -1.25 0.13 115.31 121.22 1rtr h LEU 156 Ca 0.03 0.09 0.01 0.00 -0.12 0.00 0.00 57.88 57.89 1rtr h LEU 156 Cb 0.69 0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.74 1rtr h LEU 156 CO -0.30 0.01 -0.08 -0.78 -0.62 0.00 0.00 178.44 176.67 1rtr h ASP 157 N 0.20 -0.23 -0.77 1.25 -0.00 -0.92 -2.26 116.42 113.70 1rtr h ASP 157 Ca 0.23 0.03 -0.02 0.00 -0.00 0.00 0.00 57.03 57.28 1rtr h ASP 157 Cb 0.31 0.09 -0.04 0.00 -0.00 0.00 0.00 39.33 39.70 1rtr h ASP 157 CO -0.32 -0.12 0.42 0.24 -0.00 0.00 0.00 179.24 179.45 1rtr h MET 158 N -0.16 1.07 0.00 0.28 2.86 -0.36 -1.77 114.93 116.86 1rtr h MET 158 Ca 0.02 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.53 1rtr h MET 158 Cb 0.18 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 1rtr h MET 158 CO -0.06 0.80 -0.02 0.37 1.06 0.00 0.00 176.91 179.06 1rtr h GLN 159 N 1.07 0.00 -0.19 1.72 4.15 -0.58 -2.68 115.11 118.60 1rtr h GLN 159 Ca 0.27 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.69 1rtr h GLN 159 Cb 0.04 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.73 1rtr h GLN 159 CO -0.04 0.02 0.00 0.43 -1.93 0.00 0.00 178.83 177.31 1rtr n SER 160 N -3.41 2.70 -4.71 -0.69 7.64 -0.71 -5.01 113.62 109.43 1rtr n SER 160 Ca -0.03 -1.79 -0.43 0.00 1.01 0.00 0.00 58.87 57.64 1rtr n SER 160 Cb 0.12 -0.12 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1rtr n SER 160 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1rtr n GLU 161 N 0.93 2.44 -3.54 1.43 2.13 -0.93 -3.16 120.64 119.93 1rtr n GLU 161 Ca 0.12 0.87 -0.22 0.00 0.66 0.00 0.00 57.16 58.59 1rtr n GLU 161 Cb 0.44 -2.61 0.05 0.00 0.27 0.00 0.00 31.44 29.59 1rtr n GLU 161 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1rtr n GLY 162 N 2.42 -0.76 3.62 8.31 0.00 -1.26 -5.02 105.19 112.50 1rtr n GLY 162 Ca 0.11 0.36 -0.10 0.00 0.00 0.00 0.00 46.02 46.39 1rtr n GLY 162 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1rtr s GLN 163 N -5.45 0.55 -0.25 1.61 -2.07 -1.19 -5.12 119.66 107.74 1rtr s GLN 163 Ca 0.27 0.46 -0.31 0.00 -1.82 0.00 0.00 55.36 53.96 1rtr s GLN 163 Cb -0.07 0.26 -0.08 0.00 -1.09 0.00 0.00 33.01 32.04 1rtr s GLN 163 CO 0.80 -0.11 2.18 -0.35 -1.32 0.00 0.00 175.29 176.49 1rtr n PRO 164 N 1.73 1.66 -4.27 9.60 -0.04 -1.26 -4.52 135.00 137.90 1rtr n PRO 164 Ca -0.12 0.47 -0.33 0.00 -0.04 0.00 0.00 63.50 63.49 1rtr n PRO 164 Cb 0.56 -2.90 -0.09 0.00 -0.04 0.00 0.00 33.50 31.04 1rtr n PRO 164 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rtr s ILE 165 N 7.56 4.20 1.00 0.52 1.10 -1.26 -4.94 121.20 129.38 1rtr s ILE 165 Ca 1.03 -0.57 -0.14 0.00 -0.51 0.00 0.00 60.65 60.45 1rtr s ILE 165 Cb -0.56 -2.87 0.19 0.00 0.15 0.00 0.00 42.46 39.37 1rtr s ILE 165 CO 0.42 0.38 1.15 1.51 -2.11 0.00 0.00 174.94 176.29 1rtr s ASP 166 N -1.54 2.71 0.22 4.50 1.47 -1.26 -4.01 116.67 118.75 1rtr s ASP 166 Ca 0.19 0.80 -0.05 0.00 1.18 0.00 0.00 52.55 54.68 1rtr s ASP 166 Cb -0.12 -1.23 0.19 0.00 -0.34 0.00 0.00 42.92 41.42 1rtr s ASP 166 CO 0.10 -3.03 1.65 0.25 0.68 0.00 0.00 175.17 174.82 1rtr h LEU 167 N -1.83 0.82 -0.42 2.11 6.46 -1.99 -2.23 115.31 118.23 1rtr h LEU 167 Ca -0.49 -0.28 -0.13 0.00 -0.12 0.00 0.00 57.88 56.87 1rtr h LEU 167 Cb 1.31 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 41.00 1rtr h LEU 167 CO 0.51 0.98 -0.60 1.05 -0.62 0.00 0.00 178.44 179.77 1rtr h GLU 168 N 0.72 0.00 -0.30 1.25 4.11 -1.99 -2.08 114.58 116.30 1rtr h GLU 168 Ca 0.11 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.49 1rtr h GLU 168 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1rtr h GLU 168 CO 0.05 0.60 -0.01 1.15 0.07 0.00 0.00 179.01 180.87 1rtr h THR 169 N 0.00 1.26 -0.37 -1.06 2.02 -1.92 -1.59 112.91 111.25 1rtr h THR 169 Ca -0.01 -0.97 -0.01 0.00 0.77 0.00 0.00 66.41 66.19 1rtr h THR 169 Cb 1.28 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 1rtr h THR 169 CO 0.08 0.31 0.17 0.25 0.37 0.00 0.00 175.52 176.70 1rtr h LEU 170 N 0.32 0.46 -0.01 2.58 5.85 -1.22 -0.72 115.31 122.56 1rtr h LEU 170 Ca 0.08 -0.04 -0.25 0.00 0.84 0.00 0.00 57.88 58.52 1rtr h LEU 170 Cb 0.46 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 1rtr h LEU 170 CO 0.02 0.40 -1.10 -0.33 -0.34 0.00 0.00 178.44 177.08 1rtr h GLU 171 N 0.52 0.26 -0.46 1.25 5.08 -1.31 -2.34 114.58 117.57 1rtr h GLU 171 Ca 0.13 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1rtr h GLU 171 Cb 0.07 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 1rtr h GLU 171 CO -0.02 1.14 0.31 1.98 -1.00 0.00 0.00 179.01 181.41 1rtr h MET 172 N 0.10 0.61 -0.25 2.33 4.05 -0.73 0.12 114.93 121.16 1rtr h MET 172 Ca -0.10 -0.04 0.04 0.00 -0.28 0.00 0.00 59.70 59.32 1rtr h MET 172 Cb 1.80 -0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 32.43 1rtr h MET 172 CO 0.18 0.41 0.02 0.82 0.23 0.00 0.00 176.91 178.57 1rtr h ILE 173 N 0.63 0.85 -0.45 1.77 2.04 -1.09 -2.59 117.51 118.68 1rtr h ILE 173 Ca 0.17 -0.04 -0.10 0.00 1.00 0.00 0.00 64.86 65.90 1rtr h ILE 173 Cb -0.07 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1rtr h ILE 173 CO -0.04 0.02 -0.10 0.45 0.00 0.00 0.00 178.15 178.49 1rtr h HIS 174 N 0.11 0.96 -1.00 1.37 3.86 -1.11 0.28 115.15 119.62 1rtr h HIS 174 Ca 0.11 -0.20 0.09 0.00 -1.16 0.00 0.00 60.37 59.22 1rtr h HIS 174 Cb 0.13 -0.24 -0.08 0.00 1.06 0.00 0.00 27.41 28.29 1rtr h HIS 174 CO -0.18 0.95 0.64 -0.22 0.86 0.00 0.00 177.93 179.98 1rtr h LYS 175 N 0.70 1.05 0.00 2.45 3.64 -0.68 0.12 116.57 123.84 1rtr h LYS 175 Ca 0.12 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.29 1rtr h LYS 175 Cb 0.63 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1rtr h LYS 175 CO 0.04 0.69 -1.16 0.25 -2.27 0.00 0.00 179.45 177.01 1rtr n THR 176 N -4.56 1.49 -0.22 1.00 -2.24 -0.99 -1.44 114.28 107.32 1rtr n THR 176 Ca 0.17 0.03 0.01 0.00 -2.27 0.00 0.00 64.05 61.99 1rtr n THR 176 Cb 0.27 -2.20 0.13 0.00 -2.10 0.00 0.00 70.33 66.43 1rtr n THR 176 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1rtr h LYS 177 N -1.00 0.45 0.00 -0.78 3.64 -0.55 -3.08 116.57 115.25 1rtr h LYS 177 Ca -0.22 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.05 1rtr h LYS 177 Cb 1.02 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.72 1rtr h LYS 177 CO -0.13 0.30 -1.30 2.41 -2.27 0.00 0.00 179.45 178.45 1rtr n THR 178 N -4.96 0.31 0.04 1.00 -1.04 -0.95 -4.68 114.28 104.00 1rtr n THR 178 Ca 0.10 -0.12 -0.04 0.00 -2.04 0.00 0.00 64.05 61.95 1rtr n THR 178 Cb 0.29 -0.71 0.18 0.00 -1.82 0.00 0.00 70.33 68.27 1rtr n THR 178 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1rtr h GLY 179 N 0.45 0.45 1.03 3.41 0.00 -0.61 -3.21 103.07 104.59 1rtr h GLY 179 Ca -0.12 -0.41 -0.06 0.00 0.00 0.00 0.00 47.33 46.74 1rtr h GLY 179 CO -0.02 0.38 0.15 0.00 0.00 0.00 0.00 176.54 177.05 1rtr h ALA 180 N 1.27 0.82 -0.42 3.60 0.00 -1.34 -1.22 119.26 121.97 1rtr h ALA 180 Ca 0.04 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1rtr h ALA 180 Cb 0.79 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1rtr h ALA 180 CO 0.06 0.53 0.09 -0.07 0.00 0.00 0.00 179.25 179.86 1rtr h LEU 181 N 0.91 0.65 -0.74 0.00 3.38 -1.78 -0.46 115.31 117.27 1rtr h LEU 181 Ca 0.19 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1rtr h LEU 181 Cb 0.36 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1rtr h LEU 181 CO 0.00 0.73 0.37 -0.07 0.09 0.00 0.00 178.44 179.55 1rtr h LEU 182 N 0.54 0.97 -0.91 1.67 3.38 -1.53 -0.70 115.31 118.73 1rtr h LEU 182 Ca 0.13 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1rtr h LEU 182 Cb 0.34 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1rtr h LEU 182 CO 0.00 0.82 -0.13 0.74 0.09 0.00 0.00 178.44 179.97 1rtr h THR 183 N 1.04 1.25 -0.79 0.22 2.02 -1.09 -2.01 112.91 113.56 1rtr h THR 183 Ca 0.26 -1.14 0.06 0.00 0.77 0.00 0.00 66.41 66.36 1rtr h THR 183 Cb 0.11 1.11 -0.06 0.00 -1.74 0.00 0.00 68.15 67.57 1rtr h THR 183 CO -0.03 0.38 0.48 0.15 0.37 0.00 0.00 175.52 176.86 1rtr h PHE 184 N 0.59 0.89 -0.30 3.16 3.57 -0.04 -0.65 116.94 124.15 1rtr h PHE 184 Ca 0.10 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.66 1rtr h PHE 184 Cb 0.57 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 1rtr h PHE 184 CO 0.02 0.45 0.20 0.00 -2.23 0.00 0.00 178.31 176.76 1rtr h ALA 185 N 1.38 1.94 0.10 2.41 0.00 -0.39 0.42 119.26 125.11 1rtr h ALA 185 Ca 0.34 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.89 1rtr h ALA 185 Cb 0.16 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1rtr h ALA 185 CO -0.17 0.02 -1.98 0.28 0.00 0.00 0.00 179.25 177.40 1rtr n VAL 186 N -4.49 1.72 0.08 0.00 0.31 -1.05 -3.70 118.33 111.21 1rtr n VAL 186 Ca 0.03 -0.57 -0.10 0.00 -0.01 0.00 0.00 64.34 63.69 1rtr n VAL 186 Cb 0.17 -1.74 -0.07 0.00 -0.91 0.00 0.00 33.84 31.29 1rtr n VAL 186 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 1rtr h MET 187 N -0.08 0.14 -0.36 5.55 2.86 -0.93 -1.41 114.93 120.71 1rtr h MET 187 Ca -0.44 -0.19 -0.00 0.00 -2.06 0.00 0.00 59.70 57.01 1rtr h MET 187 Cb 1.93 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 33.64 1rtr h MET 187 CO 0.03 1.02 0.22 0.66 1.06 0.00 0.00 176.91 179.89 1rtr h SER 188 N 0.06 0.43 -0.83 1.22 4.64 -1.12 -1.34 113.55 116.61 1rtr h SER 188 Ca -0.05 -0.05 0.04 0.00 -0.47 0.00 0.00 61.79 61.26 1rtr h SER 188 Cb 1.69 -0.11 -0.05 0.00 -0.31 0.00 0.00 62.40 63.62 1rtr h SER 188 CO 0.15 0.35 0.53 0.00 -0.87 0.00 0.00 176.83 176.99 1rtr h ALA 189 N 1.09 1.11 -0.24 5.18 0.00 -1.61 -0.43 119.26 124.37 1rtr h ALA 189 Ca 0.13 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1rtr h ALA 189 Cb 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1rtr h ALA 189 CO -0.02 0.34 0.03 0.00 0.00 0.00 0.00 179.25 179.59 1rtr h ALA 190 N 1.36 1.61 0.05 0.00 0.00 -1.03 -0.46 119.26 120.79 1rtr h ALA 190 Ca 0.34 -0.12 -0.28 0.00 0.00 0.00 0.00 54.91 54.85 1rtr h ALA 190 Cb 0.05 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 17.76 1rtr h ALA 190 CO -0.13 0.29 -1.12 -0.44 0.00 0.00 0.00 179.25 177.85 1rtr h ASP 191 N 0.34 0.87 -0.32 0.00 3.45 -0.27 -2.33 116.42 118.16 1rtr h ASP 191 Ca 0.08 -0.74 -0.01 0.00 0.43 0.00 0.00 57.03 56.79 1rtr h ASP 191 Cb 0.19 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.67 1rtr h ASP 191 CO 0.00 1.54 0.16 0.40 -1.57 0.00 0.00 179.24 179.77 1rtr h ILE 192 N 0.33 1.15 0.00 0.35 2.04 -0.86 -2.83 117.51 117.70 1rtr h ILE 192 Ca -0.15 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.30 1rtr h ILE 192 Cb 1.78 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 1rtr h ILE 192 CO 0.22 0.15 0.00 0.00 0.00 0.00 0.00 178.15 178.52 1rtr h ALA 193 N 1.02 1.00 -5.36 1.87 0.00 -1.15 -3.47 119.26 113.17 1rtr h ALA 193 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.62 1rtr h ALA 193 Cb 0.10 0.00 0.11 0.00 0.00 0.00 0.00 17.79 18.00 1rtr h ALA 193 CO -0.02 0.00 -0.65 -1.71 0.00 0.00 0.00 179.25 176.87 1rtr n ASN 194 N -2.77 -6.32 -4.77 0.00 4.05 -0.90 -5.00 115.26 99.55 1rtr n ASN 194 Ca 0.01 -0.45 -0.31 0.00 0.45 0.00 0.00 54.58 54.28 1rtr n ASN 194 Cb 0.25 -5.01 0.09 0.00 1.23 0.00 0.00 39.78 36.34 1rtr n ASN 194 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1rtr s VAL 195 N -3.27 3.36 0.87 3.44 0.11 -1.09 -5.05 120.40 118.77 1rtr s VAL 195 Ca 0.49 0.44 -0.13 0.00 -2.93 0.00 0.00 61.98 59.85 1rtr s VAL 195 Cb -0.22 -2.98 0.13 0.00 -1.53 0.00 0.00 36.38 31.78 1rtr s VAL 195 CO 0.61 -0.58 1.23 1.51 -3.33 0.00 0.00 175.10 174.54 1rtr s ASP 196 N -3.49 3.93 0.14 3.54 1.47 -1.26 -4.87 116.67 116.13 1rtr s ASP 196 Ca 0.61 0.53 -0.15 0.00 1.18 0.00 0.00 52.55 54.72 1rtr s ASP 196 Cb -0.17 -0.84 0.01 0.00 -0.34 0.00 0.00 42.92 41.59 1rtr s ASP 196 CO 0.56 -2.24 1.67 0.44 0.68 0.00 0.00 175.17 176.28 1rtr h ASP 197 N -1.28 0.64 -0.44 2.11 5.19 -1.99 -1.87 116.42 118.78 1rtr h ASP 197 Ca -0.45 -0.19 0.06 0.00 -0.62 0.00 0.00 57.03 55.82 1rtr h ASP 197 Cb 1.29 -0.17 -0.05 0.00 0.18 0.00 0.00 39.33 40.58 1rtr h ASP 197 CO 0.53 0.66 0.15 0.74 -3.12 0.00 0.00 179.24 178.21 1rtr h THR 198 N 0.58 0.86 -0.41 0.35 2.02 -2.00 -0.73 112.91 113.59 1rtr h THR 198 Ca 0.15 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1rtr h THR 198 Cb 0.24 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 1rtr h THR 198 CO -0.01 0.06 0.21 0.74 0.37 0.00 0.00 175.52 176.89 1rtr h THR 199 N 0.32 1.13 -0.44 3.16 2.02 -1.88 -2.63 112.91 114.59 1rtr h THR 199 Ca 0.21 -0.36 -0.13 0.00 0.77 0.00 0.00 66.41 66.89 1rtr h THR 199 Cb 0.20 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 1rtr h THR 199 CO -0.21 0.15 -0.25 0.11 0.37 0.00 0.00 175.52 175.69 1rtr h LYS 200 N 0.56 0.93 -0.38 6.66 1.57 -0.42 -1.86 116.57 123.63 1rtr h LYS 200 Ca 0.14 -0.41 -0.10 0.00 -1.87 0.00 0.00 60.65 58.42 1rtr h LYS 200 Cb 0.04 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1rtr h LYS 200 CO -0.02 1.06 -0.18 0.93 -0.57 0.00 0.00 179.45 180.67 1rtr h GLU 201 N 0.79 0.72 -0.31 3.15 5.08 -0.84 0.17 114.58 123.35 1rtr h GLU 201 Ca 0.10 -0.26 -0.10 0.00 -1.00 0.00 0.00 59.36 58.09 1rtr h GLU 201 Cb 0.81 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 1rtr h GLU 201 CO 0.07 0.85 -0.20 0.45 -1.00 0.00 0.00 179.01 179.18 1rtr h HIS 202 N 0.64 0.79 -0.66 4.33 3.86 -1.45 -2.22 115.15 120.45 1rtr h HIS 202 Ca 0.10 -0.21 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 1rtr h HIS 202 Cb 0.66 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 28.92 1rtr h HIS 202 CO 0.03 0.93 0.38 -0.07 0.86 0.00 0.00 177.93 180.06 1rtr h LEU 203 N 0.43 0.80 -0.48 2.43 3.38 -1.00 0.20 115.31 121.07 1rtr h LEU 203 Ca 0.06 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1rtr h LEU 203 Cb 0.74 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1rtr h LEU 203 CO 0.06 0.64 0.30 -0.08 0.09 0.00 0.00 178.44 179.44 1rtr h GLU 204 N 0.90 0.64 -0.46 1.13 4.81 -0.67 -0.40 114.58 120.53 1rtr h GLU 204 Ca 0.23 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.33 1rtr h GLU 204 Cb -0.00 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 1rtr h GLU 204 CO -0.04 0.46 -0.03 1.03 -0.73 0.00 0.00 179.01 179.70 1rtr h SER 205 N 0.64 0.82 -0.36 1.04 0.87 -1.03 -1.06 113.55 114.46 1rtr h SER 205 Ca 0.17 -0.32 0.06 0.00 -1.23 0.00 0.00 61.79 60.46 1rtr h SER 205 Cb -0.03 -0.22 -0.05 0.00 -0.44 0.00 0.00 62.40 61.66 1rtr h SER 205 CO -0.03 0.95 0.07 0.22 -0.53 0.00 0.00 176.83 177.50 1rtr h TYR 206 N 0.67 0.11 -0.56 2.24 5.03 -0.36 -1.77 116.97 122.33 1rtr h TYR 206 Ca 0.13 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.39 1rtr h TYR 206 Cb 0.54 0.01 -0.02 0.00 1.55 0.00 0.00 36.73 38.81 1rtr h TYR 206 CO 0.04 0.01 0.09 0.66 -1.32 0.00 0.00 178.16 177.64 1rtr h SER 207 N 0.19 0.90 0.11 -2.11 4.64 -0.67 0.16 113.55 116.76 1rtr h SER 207 Ca 0.17 -0.26 0.02 0.00 -0.47 0.00 0.00 61.79 61.25 1rtr h SER 207 Cb 0.20 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 1rtr h SER 207 CO -0.23 0.93 -0.26 0.22 -0.87 0.00 0.00 176.83 176.61 1rtr h TYR 208 N 0.83 -0.71 -0.31 4.77 3.20 -1.04 -0.92 116.97 122.80 1rtr h TYR 208 Ca 0.17 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.98 1rtr h TYR 208 Cb 0.41 0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 1rtr h TYR 208 CO 0.03 -0.37 -0.14 0.45 -1.64 0.00 0.00 178.16 176.50 1rtr h HIS 209 N -0.47 0.57 -0.20 -3.82 3.86 -0.97 -2.31 115.15 111.81 1rtr h HIS 209 Ca 0.03 -0.09 0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1rtr h HIS 209 Cb 0.50 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.80 1rtr h HIS 209 CO -0.24 0.65 0.12 1.25 0.86 0.00 0.00 177.93 180.56 1rtr h LEU 210 N 0.49 0.20 -0.13 2.43 6.46 -0.48 0.41 115.31 124.69 1rtr h LEU 210 Ca 0.09 0.00 0.01 0.00 -0.12 0.00 0.00 57.88 57.85 1rtr h LEU 210 Cb 0.53 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.41 1rtr h LEU 210 CO 0.03 0.15 0.07 1.23 -0.62 0.00 0.00 178.44 179.30 1rtr h GLY 211 N 0.25 0.17 0.86 3.75 0.00 -0.93 0.16 103.07 107.32 1rtr h GLY 211 Ca 0.08 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.38 1rtr h GLY 211 CO -0.03 0.04 0.15 -0.33 0.00 0.00 0.00 176.54 176.37 1rtr h MET 212 N 0.15 0.30 -0.57 4.80 2.86 -1.36 -1.54 114.93 119.57 1rtr h MET 212 Ca 0.05 -0.02 0.11 0.00 -2.06 0.00 0.00 59.70 57.79 1rtr h MET 212 Cb 0.01 -0.07 -0.09 0.00 0.06 0.00 0.00 31.60 31.50 1rtr h MET 212 CO -0.03 0.20 0.02 1.98 1.06 0.00 0.00 176.91 180.14 1rtr h MET 213 N 0.31 0.14 -0.37 1.72 -1.53 -0.38 -1.06 114.93 113.77 1rtr h MET 213 Ca 0.13 -0.01 0.06 0.00 -3.44 0.00 0.00 59.70 56.43 1rtr h MET 213 Cb 0.04 -0.03 -0.05 0.00 -0.55 0.00 0.00 31.60 31.01 1rtr h MET 213 CO -0.09 0.09 0.06 0.74 0.14 0.00 0.00 176.91 177.86 1rtr h PHE 214 N 0.14 0.10 -0.55 1.39 0.04 -0.15 -1.70 116.94 116.22 1rtr h PHE 214 Ca 0.30 0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.97 1rtr h PHE 214 Cb 0.46 0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.61 1rtr h PHE 214 CO -0.33 0.00 -0.11 1.96 -0.60 0.00 0.00 178.31 179.24 1rtr h GLN 215 N 0.18 1.04 -0.22 1.51 1.08 -0.43 -2.65 115.11 115.62 1rtr h GLN 215 Ca 0.18 -0.39 -0.04 0.00 -1.45 0.00 0.00 58.65 56.94 1rtr h GLN 215 Cb 0.21 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 1rtr h GLN 215 CO -0.24 1.08 -0.02 0.82 -0.95 0.00 0.00 178.83 179.52 1rtr h ILE 216 N 0.92 1.27 -0.91 2.54 2.04 -1.03 -2.94 117.51 119.40 1rtr h ILE 216 Ca 0.14 -0.96 0.16 0.00 1.00 0.00 0.00 64.86 65.20 1rtr h ILE 216 Cb 0.69 1.45 -0.10 0.00 -0.74 0.00 0.00 36.82 38.12 1rtr h ILE 216 CO 0.05 0.30 0.49 0.50 0.00 0.00 0.00 178.15 179.49 1rtr h LYS 217 N 0.16 0.64 -0.16 2.37 1.63 -1.24 -2.03 116.57 117.94 1rtr h LYS 217 Ca 0.06 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.81 1rtr h LYS 217 Cb 0.45 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.93 1rtr h LYS 217 CO 0.02 0.43 0.04 -0.44 -3.45 0.00 0.00 179.45 176.04 1rtr h ASP 218 N 0.66 0.25 -0.88 4.20 3.32 -1.32 0.87 116.42 123.53 1rtr h ASP 218 Ca 0.51 -0.23 0.04 0.00 0.02 0.00 0.00 57.03 57.37 1rtr h ASP 218 Cb 0.76 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 40.19 1rtr h ASP 218 CO -0.38 0.42 0.57 0.44 -1.72 0.00 0.00 179.24 178.57 1rtr h ASP 219 N 0.07 0.92 -0.13 6.45 3.45 -1.29 -1.31 116.42 124.59 1rtr h ASP 219 Ca 0.05 -0.01 -0.03 0.00 0.43 0.00 0.00 57.03 57.48 1rtr h ASP 219 Cb 0.26 -0.21 -0.00 0.00 -0.56 0.00 0.00 39.33 38.82 1rtr h ASP 219 CO 0.00 0.62 -0.03 -0.07 -1.57 0.00 0.00 179.24 178.19 1rtr h LEU 220 N 1.06 0.25 -1.92 1.55 4.07 -1.05 -3.07 115.31 116.20 1rtr h LEU 220 Ca 0.36 -0.36 0.02 0.00 0.08 0.00 0.00 57.88 57.97 1rtr h LEU 220 Cb 0.08 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 41.75 1rtr h LEU 220 CO -0.12 0.56 0.09 -0.07 -1.08 0.00 0.00 178.44 177.82 1rtr h LEU 221 N -0.05 0.09 0.00 1.67 3.38 -0.48 -2.48 115.31 117.43 1rtr h LEU 221 Ca 0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1rtr h LEU 221 Cb 0.45 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1rtr h LEU 221 CO 0.01 0.06 0.00 0.47 0.09 0.00 0.00 178.44 179.08 1rtr n ASP 222 N -4.51 0.00 0.00 -0.43 10.43 -0.52 -5.09 116.55 116.42 1rtr n ASP 222 Ca -0.01 0.30 0.00 0.00 2.57 0.00 0.00 54.79 57.65 1rtr n ASP 222 Cb 0.13 -0.39 0.00 0.00 1.84 0.00 0.00 41.12 42.71 1rtr n ASP 222 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1rtr n SER 243 N -1.37 0.00 -4.12 0.00 2.88 -1.26 -5.01 113.62 104.75 1rtr n SER 243 Ca 0.00 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 1rtr n SER 243 Cb 0.00 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.37 1rtr n SER 243 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1rtr s THR 244 N 0.00 0.58 0.18 2.46 -4.23 -1.26 -5.04 115.64 108.32 1rtr s THR 244 Ca 0.00 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.41 1rtr s THR 244 Cb 0.00 -2.50 0.07 0.00 1.34 0.00 0.00 72.50 71.41 1rtr s THR 244 CO 0.00 0.00 1.67 1.88 -0.54 0.00 0.00 174.62 177.63 1rtr h TYR 245 N 2.04 1.08 -0.30 3.99 -1.99 -1.94 -2.24 116.97 117.61 1rtr h TYR 245 Ca -0.35 -0.15 -0.05 0.00 2.00 0.00 0.00 58.73 60.18 1rtr h TYR 245 Cb 1.26 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 39.68 1rtr h TYR 245 CO 1.13 0.93 0.00 0.28 -0.00 0.00 0.00 178.16 180.49 1rtr h VAL 246 N 0.92 1.26 0.00 -2.88 2.07 -1.89 -0.97 116.25 114.75 1rtr h VAL 246 Ca 0.18 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 1rtr h VAL 246 Cb 0.43 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1rtr h VAL 246 CO 0.01 0.30 -0.23 0.77 0.02 0.00 0.00 177.57 178.45 1rtr h SER 247 N 0.31 0.00 0.11 0.57 4.64 -1.88 0.26 113.55 117.56 1rtr h SER 247 Ca 0.08 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.07 1rtr h SER 247 Cb 0.43 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.50 1rtr h SER 247 CO 0.01 0.23 -1.80 -0.07 -0.87 0.00 0.00 176.83 174.33 1rtr h LEU 248 N 0.00 0.37 0.00 5.97 3.38 -1.35 -3.41 115.31 120.27 1rtr h LEU 248 Ca -0.00 -0.88 0.00 0.00 0.09 0.00 0.00 57.88 57.09 1rtr h LEU 248 Cb 0.64 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1rtr h LEU 248 CO 0.03 1.78 -1.22 0.18 0.09 0.00 0.00 178.44 179.29 1rtr n LEU 249 N -3.69 0.29 0.00 1.67 4.77 -0.38 -5.10 117.00 114.56 1rtr n LEU 249 Ca -0.31 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1rtr n LEU 249 Cb 0.98 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.07 1rtr n LEU 249 CO 0.40 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1rtr n GLY 250 N 1.53 -2.42 0.20 -0.72 0.00 0.91 -3.95 105.19 100.74 1rtr n GLY 250 Ca -0.00 -1.47 -0.02 0.00 0.00 0.00 0.00 46.02 44.53 1rtr n GLY 250 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1rtr h LYS 251 N 0.00 0.08 -0.23 1.61 3.64 -1.90 -0.85 116.57 118.92 1rtr h LYS 251 Ca 0.00 -0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 1rtr h LYS 251 Cb 0.00 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1rtr h LYS 251 CO 0.00 0.05 -0.39 -0.44 -2.27 0.00 0.00 179.45 176.40 1rtr h ASP 252 N 0.08 0.55 -0.50 4.20 3.45 -1.96 0.13 116.42 122.36 1rtr h ASP 252 Ca 0.25 -0.24 -0.03 0.00 0.43 0.00 0.00 57.03 57.43 1rtr h ASP 252 Cb 0.38 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.97 1rtr h ASP 252 CO -0.44 0.89 0.19 1.23 -1.57 0.00 0.00 179.24 179.54 1rtr h GLY 253 N 1.07 0.82 0.99 2.75 0.00 -1.58 -0.80 103.07 106.32 1rtr h GLY 253 Ca 0.04 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 1rtr h GLY 253 CO 0.08 0.43 0.32 0.00 0.00 0.00 0.00 176.54 177.36 1rtr h ALA 254 N 1.04 0.79 -0.50 3.60 0.00 -0.81 -2.27 119.26 121.10 1rtr h ALA 254 Ca 0.17 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1rtr h ALA 254 Cb 0.21 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1rtr h ALA 254 CO -0.01 0.32 0.12 1.49 0.00 0.00 0.00 179.25 181.17 1rtr h GLU 255 N 0.83 0.76 0.19 0.00 4.57 -0.81 -1.06 114.58 119.07 1rtr h GLU 255 Ca 0.21 -0.15 -0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1rtr h GLU 255 Cb 0.07 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 1rtr h GLU 255 CO -0.03 0.69 -0.14 -0.44 -1.18 0.00 0.00 179.01 177.91 1rtr h ASP 256 N 0.74 -0.37 -0.52 1.04 3.45 -0.82 -2.56 116.42 117.39 1rtr h ASP 256 Ca 0.17 0.03 0.02 0.00 0.43 0.00 0.00 57.03 57.68 1rtr h ASP 256 Cb 0.27 0.12 -0.03 0.00 -0.56 0.00 0.00 39.33 39.13 1rtr h ASP 256 CO -0.00 -0.23 0.31 0.11 -1.57 0.00 0.00 179.24 177.86 1rtr h LYS 257 N -0.34 0.61 -0.31 3.56 6.56 -1.16 -0.18 116.57 125.30 1rtr h LYS 257 Ca -0.01 -0.04 0.07 0.00 -1.06 0.00 0.00 60.65 59.61 1rtr h LYS 257 Cb 0.30 -0.14 -0.08 0.00 -0.57 0.00 0.00 32.23 31.75 1rtr h LYS 257 CO -0.00 0.40 -0.22 1.25 -2.06 0.00 0.00 179.45 178.81 1rtr h LEU 258 N 0.62 -0.74 -0.53 2.94 5.85 -1.15 -1.23 115.31 121.07 1rtr h LEU 258 Ca 0.21 0.15 -0.13 0.00 0.84 0.00 0.00 57.88 58.94 1rtr h LEU 258 Cb 0.01 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 1rtr h LEU 258 CO -0.09 -0.26 -0.23 0.74 -0.34 0.00 0.00 178.44 178.26 1rtr h THR 259 N -0.19 1.27 -0.69 1.05 2.02 -1.17 -1.36 112.91 113.84 1rtr h THR 259 Ca 0.16 -1.39 0.10 0.00 0.77 0.00 0.00 66.41 66.05 1rtr h THR 259 Cb 0.44 1.16 -0.07 0.00 -1.74 0.00 0.00 68.15 67.95 1rtr h THR 259 CO -0.43 0.48 0.32 0.22 0.37 0.00 0.00 175.52 176.48 1rtr h TYR 260 N 0.81 0.58 -0.05 3.16 3.20 -0.58 -1.46 116.97 122.63 1rtr h TYR 260 Ca 0.10 0.03 -0.24 0.00 3.14 0.00 0.00 58.73 61.77 1rtr h TYR 260 Cb 0.80 -0.15 0.01 0.00 1.54 0.00 0.00 36.73 38.92 1rtr h TYR 260 CO 0.05 0.19 -0.91 0.45 -1.64 0.00 0.00 178.16 176.30 1rtr h HIS 261 N 0.55 0.88 -0.93 -3.82 3.86 -0.88 -1.83 115.15 112.98 1rtr h HIS 261 Ca 0.34 -0.45 0.07 0.00 -1.16 0.00 0.00 60.37 59.18 1rtr h HIS 261 Cb 0.39 -0.11 -0.07 0.00 1.06 0.00 0.00 27.41 28.68 1rtr h HIS 261 CO -0.12 1.27 0.59 -0.09 0.86 0.00 0.00 177.93 180.43 1rtr h ARG 262 N 0.38 1.03 0.09 2.45 2.43 -1.05 -0.80 114.38 118.91 1rtr h ARG 262 Ca -0.09 -0.06 -0.26 0.00 -0.81 0.00 0.00 59.98 58.76 1rtr h ARG 262 Cb 1.55 -0.23 0.01 0.00 -0.42 0.00 0.00 29.97 30.87 1rtr h ARG 262 CO 0.17 0.68 -1.14 -0.44 -1.51 0.00 0.00 179.97 177.73 1rtr h ASP 263 N 1.06 0.54 -0.46 -3.80 3.32 -1.16 -2.25 116.42 113.66 1rtr h ASP 263 Ca 0.41 -0.51 -0.10 0.00 0.02 0.00 0.00 57.03 56.84 1rtr h ASP 263 Cb 0.19 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 1rtr h ASP 263 CO -0.18 1.36 -0.10 0.00 -1.72 0.00 0.00 179.24 178.60 1rtr h ALA 264 N 0.58 0.87 -0.02 3.45 0.00 -1.15 0.78 119.26 123.77 1rtr h ALA 264 Ca -0.13 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 1rtr h ALA 264 Cb 1.83 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.43 1rtr h ALA 264 CO 0.20 0.65 0.01 0.00 0.00 0.00 0.00 179.25 180.10 1rtr h ALA 265 N 1.04 0.03 -0.78 0.00 0.00 -1.06 -2.09 119.26 116.40 1rtr h ALA 265 Ca 0.14 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1rtr h ALA 265 Cb 0.63 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1rtr h ALA 265 CO 0.04 -0.43 0.49 0.28 0.00 0.00 0.00 179.25 179.63 1rtr h VAL 266 N -0.07 1.22 -0.97 0.00 2.07 -1.33 -2.51 116.25 114.65 1rtr h VAL 266 Ca 0.01 -0.45 0.12 0.00 0.82 0.00 0.00 66.70 67.20 1rtr h VAL 266 Cb 0.10 0.11 -0.08 0.00 -1.52 0.00 0.00 31.29 29.89 1rtr h VAL 266 CO -0.00 0.22 0.62 0.44 0.02 0.00 0.00 177.57 178.86 1rtr h ASP 267 N 1.07 0.86 -0.45 0.57 3.45 -0.52 -1.48 116.42 119.92 1rtr h ASP 267 Ca 0.28 0.04 -0.13 0.00 0.43 0.00 0.00 57.03 57.66 1rtr h ASP 267 Cb -0.06 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 38.57 1rtr h ASP 267 CO -0.06 0.46 -0.23 -0.33 -1.57 0.00 0.00 179.24 177.52 1rtr h GLU 268 N 0.92 0.95 -0.22 3.56 4.39 -1.12 -3.03 114.58 120.04 1rtr h GLU 268 Ca 0.48 -0.42 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 1rtr h GLU 268 Cb 0.53 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1rtr h GLU 268 CO -0.25 1.08 0.07 -0.07 -1.16 0.00 0.00 179.01 178.69 1rtr h LEU 269 N 0.79 0.27 0.00 1.33 3.38 -0.87 -2.81 115.31 117.40 1rtr h LEU 269 Ca 0.10 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1rtr h LEU 269 Cb 0.80 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1rtr h LEU 269 CO 0.07 0.26 -0.30 0.71 0.09 0.00 0.00 178.44 179.26 1rtr h THR 270 N 0.30 0.00 0.00 0.22 1.35 -1.29 -3.21 112.91 110.29 1rtr h THR 270 Ca 0.08 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 65.00 1rtr h THR 270 Cb 0.09 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 1rtr h THR 270 CO -0.01 0.00 -0.00 0.00 -0.25 0.00 0.00 175.52 175.26 1rtr n GLN 271 N -2.87 0.09 -2.35 4.72 6.02 -1.06 -4.88 117.38 117.04 1rtr n GLN 271 Ca 0.03 0.08 -0.41 0.00 -0.01 0.00 0.00 57.00 56.69 1rtr n GLN 271 Cb 0.52 -1.61 -0.03 0.00 1.02 0.00 0.00 30.24 30.14 1rtr n GLN 271 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1rtr s ILE 272 N -3.04 3.34 -0.07 5.09 1.01 -1.20 -4.93 121.20 121.40 1rtr s ILE 272 Ca 0.13 1.26 -0.41 0.00 0.00 0.00 0.00 60.65 61.62 1rtr s ILE 272 Cb 0.17 -3.80 -0.20 0.00 0.01 0.00 0.00 42.46 38.64 1rtr s ILE 272 CO 0.56 0.26 1.17 -0.67 0.00 0.00 0.00 174.94 176.26 1rtr n ASP 273 N 1.62 0.29 0.00 3.58 -0.08 -1.26 -4.83 116.55 115.87 1rtr n ASP 273 Ca 0.01 1.16 0.13 0.00 -1.51 0.00 0.00 54.79 54.59 1rtr n ASP 273 Cb 0.44 -0.93 0.78 0.00 2.34 0.00 0.00 41.12 43.75 1rtr n ASP 273 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1rtr n GLU 274 N 1.98 0.95 0.33 -0.67 -0.58 -1.26 -1.77 120.64 119.62 1rtr n GLU 274 Ca 0.22 0.00 0.22 0.00 -0.42 0.00 0.00 57.16 57.17 1rtr n GLU 274 Cb 0.06 -1.43 1.16 0.00 -0.57 0.00 0.00 31.44 30.66 1rtr n GLU 274 CO 0.00 0.00 0.00 -0.56 -0.48 0.00 0.00 177.13 176.09 1rtr h GLN 275 N 0.00 0.00 -5.07 3.49 3.07 -2.00 -3.40 115.11 111.20 1rtr h GLN 275 Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 58.65 58.11 1rtr h GLN 275 Cb 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 27.48 27.37 1rtr h GLN 275 CO 0.00 0.00 -0.58 -0.06 0.09 0.00 0.00 178.83 178.28 1rtr s PHE 276 N -4.18 3.17 -0.43 0.06 0.08 -0.73 -4.93 117.98 111.03 1rtr s PHE 276 Ca -0.05 -0.14 -0.26 0.00 0.12 0.00 0.00 56.93 56.60 1rtr s PHE 276 Cb 0.13 -2.20 0.02 0.00 -0.57 0.00 0.00 43.02 40.40 1rtr s PHE 276 CO 0.44 -0.13 0.96 1.21 -0.10 0.00 0.00 175.22 177.60 1rtr s ASN 277 N 1.15 6.60 0.00 1.36 3.84 -1.24 -4.89 114.94 121.76 1rtr s ASN 277 Ca 0.05 0.37 0.11 0.00 0.21 0.00 0.00 52.86 53.60 1rtr s ASN 277 Cb -0.14 -2.47 0.32 0.00 -0.55 0.00 0.00 41.25 38.41 1rtr s ASN 277 CO 0.04 -1.01 1.27 0.35 -2.79 0.00 0.00 177.10 174.96 1rtr n THR 278 N 6.31 0.49 -0.25 -5.21 -2.24 -1.26 -4.52 114.28 107.60 1rtr n THR 278 Ca 0.08 -0.49 0.05 0.00 -2.27 0.00 0.00 64.05 61.42 1rtr n THR 278 Cb 0.48 0.24 0.17 0.00 -2.10 0.00 0.00 70.33 69.13 1rtr n THR 278 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1rtr h LYS 279 N 2.14 0.24 -0.65 -0.78 3.64 -1.96 -1.78 116.57 117.41 1rtr h LYS 279 Ca 0.00 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 1rtr h LYS 279 Cb 0.49 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 1rtr h LYS 279 CO 0.00 0.16 0.27 0.45 -2.27 0.00 0.00 179.45 178.06 1rtr h HIS 280 N 0.25 0.99 -0.33 1.91 3.86 -1.93 -0.45 115.15 119.45 1rtr h HIS 280 Ca 0.41 -0.07 -0.08 0.00 -1.16 0.00 0.00 60.37 59.47 1rtr h HIS 280 Cb 0.70 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.85 1rtr h HIS 280 CO -0.27 0.77 -0.12 -0.07 0.86 0.00 0.00 177.93 179.10 1rtr h LEU 281 N 0.92 0.54 -0.65 2.43 3.38 -1.73 -2.21 115.31 117.99 1rtr h LEU 281 Ca 0.22 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1rtr h LEU 281 Cb 0.20 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1rtr h LEU 281 CO -0.02 0.69 -0.14 0.25 0.09 0.00 0.00 178.44 179.32 1rtr h LEU 282 N 0.51 0.91 -1.79 1.67 5.85 -0.92 -2.94 115.31 118.61 1rtr h LEU 282 Ca 0.09 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 1rtr h LEU 282 Cb 0.51 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.29 1rtr h LEU 282 CO 0.03 1.05 -0.14 -0.33 -0.34 0.00 0.00 178.44 178.71 1rtr h GLU 283 N 0.81 0.00 0.03 1.25 5.08 -0.55 -2.37 114.58 118.82 1rtr h GLU 283 Ca 0.12 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1rtr h GLU 283 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1rtr h GLU 283 CO 0.05 0.14 -0.01 0.82 -1.00 0.00 0.00 179.01 179.01 1rtr h ILE 284 N 0.00 1.40 -0.86 3.13 2.04 -1.24 -1.90 117.51 120.08 1rtr h ILE 284 Ca -0.00 -1.51 0.05 0.00 1.00 0.00 0.00 64.86 64.40 1rtr h ILE 284 Cb 0.39 2.39 -0.05 0.00 -0.74 0.00 0.00 36.82 38.81 1rtr h ILE 284 CO 0.02 0.38 0.56 -0.37 0.00 0.00 0.00 178.15 178.74 1rtr h VAL 285 N -0.71 1.11 -0.03 1.67 -1.51 -1.38 -2.47 116.25 112.94 1rtr h VAL 285 Ca -0.00 -0.35 -0.18 0.00 -1.23 0.00 0.00 66.70 64.94 1rtr h VAL 285 Cb 0.65 -0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 29.78 1rtr h VAL 285 CO 0.01 0.19 -0.77 0.44 -1.23 0.00 0.00 177.57 176.21 1rtr h ASP 286 N 1.03 0.27 -0.58 4.19 3.45 -1.48 -0.17 116.42 123.14 1rtr h ASP 286 Ca 0.35 -0.19 0.03 0.00 0.43 0.00 0.00 57.03 57.65 1rtr h ASP 286 Cb 0.09 -0.08 -0.04 0.00 -0.56 0.00 0.00 39.33 38.75 1rtr h ASP 286 CO -0.11 0.93 0.35 0.25 -1.57 0.00 0.00 179.24 179.09 1rtr h LEU 287 N 0.14 0.57 0.00 1.55 7.12 -0.89 -2.64 115.31 121.17 1rtr h LEU 287 Ca -0.03 0.00 -0.07 0.00 0.13 0.00 0.00 57.88 57.92 1rtr h LEU 287 Cb 1.34 -0.12 -0.01 0.00 -0.53 0.00 0.00 40.66 41.34 1rtr h LEU 287 CO 0.12 0.40 -1.43 0.49 -0.13 0.00 0.00 178.44 177.89 1rtr n PHE 288 N -4.75 0.69 -0.09 1.25 3.01 -1.05 -3.15 117.46 113.38 1rtr n PHE 288 Ca 0.05 0.21 -0.14 0.00 1.01 0.00 0.00 57.45 58.58 1rtr n PHE 288 Cb 0.08 -0.89 -0.04 0.00 -0.01 0.00 0.00 39.48 38.61 1rtr n PHE 288 CO 0.00 0.00 0.00 -0.92 1.01 0.00 0.00 176.76 176.85 1rtr h TYR 289 N 0.00 0.90 -0.01 1.38 5.03 -1.05 -3.30 116.97 119.92 1rtr h TYR 289 Ca -0.08 -0.29 -0.16 0.00 2.58 0.00 0.00 58.73 60.79 1rtr h TYR 289 Cb 1.23 -0.18 -0.02 0.00 1.55 0.00 0.00 36.73 39.31 1rtr h TYR 289 CO 0.00 1.06 -0.74 0.66 -1.32 0.00 0.00 178.16 177.81 1rtr h SER 290 N 0.49 0.06 0.00 -2.11 4.64 -1.58 -3.51 113.55 111.54 1rtr h SER 290 Ca 0.04 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1rtr h SER 290 Cb 0.93 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1rtr h SER 290 CO 0.08 0.78 0.00 -1.14 -0.87 0.00 0.00 176.83 175.68