#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r6t h ILE 3 N 0.00 0.00 -3.50 -0.18 -0.00 -2.13 -3.40 117.51 108.30 2r6t h ILE 3 Ca 0.00 -0.44 -0.70 0.00 -0.00 0.00 0.00 64.86 63.72 2r6t h ILE 3 Cb 0.00 1.40 -0.19 0.00 -0.00 0.00 0.00 36.82 38.03 2r6t h ILE 3 CO 0.00 0.00 -0.22 -0.72 -0.00 0.00 0.00 178.15 177.21 2r6t s TYR 4 N -3.65 3.17 -0.19 0.16 -0.85 -1.26 -4.94 117.35 109.79 2r6t s TYR 4 Ca 0.01 -0.43 0.18 0.00 -0.52 0.00 0.00 57.07 56.31 2r6t s TYR 4 Cb 0.09 -2.92 0.01 0.00 0.38 0.00 0.00 41.96 39.52 2r6t s TYR 4 CO 0.51 -0.72 1.15 1.79 -1.52 0.00 0.00 175.55 176.76 2r6t h THR 5 N 5.73 0.45 0.00 -3.49 1.35 -2.06 -3.48 112.91 111.42 2r6t h THR 5 Ca -0.27 -1.75 0.00 0.00 -0.55 0.00 0.00 66.41 63.84 2r6t h THR 5 Cb 1.11 2.04 0.00 0.00 -1.73 0.00 0.00 68.15 69.57 2r6t h THR 5 CO 0.80 0.26 0.00 0.29 -0.25 0.00 0.00 175.52 176.62 2r6t n LYS 6 N -2.97 0.00 0.00 4.72 5.02 -1.26 -4.87 118.16 118.80 2r6t n LYS 6 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 2r6t n LYS 6 Cb 0.71 -2.86 0.00 0.00 -0.02 0.00 0.00 35.03 32.86 2r6t n LYS 6 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2r6t n ASN 7 N 0.00 0.00 -0.27 4.39 3.02 -1.26 -2.50 115.26 118.63 2r6t n ASN 7 Ca 0.00 0.46 0.06 0.00 -0.03 0.00 0.00 54.58 55.07 2r6t n ASN 7 Cb 0.00 -0.46 -0.01 0.00 -0.61 0.00 0.00 39.78 38.71 2r6t n ASN 7 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2r6t n GLY 8 N -1.46 -0.11 0.27 7.41 0.00 -1.26 -4.64 105.19 105.41 2r6t n GLY 8 Ca 0.00 -0.36 0.18 0.00 0.00 0.00 0.00 46.02 45.84 2r6t n GLY 8 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2r6t h ASP 9 N 1.33 0.00 -0.64 1.61 5.19 -1.77 0.14 116.42 122.28 2r6t h ASP 9 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2r6t h ASP 9 Cb 0.42 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.93 2r6t h ASP 9 CO 0.00 0.00 0.00 0.29 -3.12 0.00 0.00 179.24 176.41 2r6t n LYS 10 N -2.79 2.65 -0.60 3.56 4.01 -1.26 -4.94 118.16 118.79 2r6t n LYS 10 Ca -0.02 -2.38 0.00 0.00 -0.51 0.00 0.00 58.31 55.40 2r6t n LYS 10 Cb 0.10 -1.56 0.00 0.00 -0.51 0.00 0.00 35.03 33.07 2r6t n LYS 10 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2r6t n GLY 11 N 1.47 0.69 3.54 0.72 0.00 0.48 -5.06 105.19 107.02 2r6t n GLY 11 Ca 0.22 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 2r6t n GLY 11 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r6t s GLN 12 N -0.57 1.93 0.09 1.61 -0.21 -1.24 -1.97 119.66 119.31 2r6t s GLN 12 Ca 0.00 -1.49 -0.21 0.00 0.02 0.00 0.00 55.36 53.68 2r6t s GLN 12 Cb 0.00 -2.00 0.05 0.00 1.00 0.00 0.00 33.01 32.06 2r6t s GLN 12 CO 0.00 0.38 0.51 -0.08 -2.12 0.00 0.00 175.29 173.98 2r6t s THR 13 N -2.09 0.03 0.23 -0.19 -1.32 -0.57 -4.10 115.64 107.63 2r6t s THR 13 Ca 0.27 -0.26 -0.11 0.00 -1.21 0.00 0.00 61.69 60.38 2r6t s THR 13 Cb -0.07 -1.03 -0.07 0.00 -1.51 0.00 0.00 72.50 69.82 2r6t s THR 13 CO 0.15 -0.14 0.58 -0.13 -2.21 0.00 0.00 174.62 172.87 2r6t s ARG 14 N -3.07 3.87 0.00 7.08 3.00 -1.26 -0.70 118.95 127.86 2r6t s ARG 14 Ca -0.02 0.37 0.00 0.00 0.00 0.00 0.00 55.73 56.09 2r6t s ARG 14 Cb -0.00 -2.67 0.00 0.00 0.00 0.00 0.00 34.95 32.28 2r6t s ARG 14 CO -0.07 0.33 0.00 0.44 0.00 0.00 0.00 175.30 176.00 2r6t n ILE 15 N 0.01 0.00 -1.88 1.52 -5.35 -1.11 -4.94 119.36 107.61 2r6t n ILE 15 Ca -0.00 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 62.06 2r6t n ILE 15 Cb 0.52 -0.56 -0.03 0.00 -1.74 0.00 0.00 39.64 37.83 2r6t n ILE 15 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2r6t s ILE 16 N 0.17 3.28 0.00 7.28 -1.09 -0.62 -4.80 121.20 125.42 2r6t s ILE 16 Ca 0.00 0.44 0.00 0.00 -2.23 0.00 0.00 60.65 58.86 2r6t s ILE 16 Cb 0.00 -3.28 0.00 0.00 -1.58 0.00 0.00 42.46 37.60 2r6t s ILE 16 CO 0.00 -0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.29 2r6t n GLY 17 N 4.24 2.23 0.00 6.18 0.00 -1.26 -4.52 105.19 112.05 2r6t n GLY 17 Ca 0.18 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2r6t n GLY 17 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2r6t n GLN 19 N 0.00 0.00 -3.14 1.61 7.27 -1.26 -5.09 117.38 116.77 2r6t n GLN 19 Ca 0.00 0.00 -0.41 0.00 0.07 0.00 0.00 57.00 56.66 2r6t n GLN 19 Cb 0.00 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 32.58 2r6t n GLN 19 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2r6t s ILE 20 N 0.00 4.98 0.27 1.69 1.09 -1.26 -2.77 121.20 125.21 2r6t s ILE 20 Ca 0.00 0.96 0.10 0.00 -1.10 0.00 0.00 60.65 60.61 2r6t s ILE 20 Cb 0.00 -3.94 -0.04 0.00 -1.06 0.00 0.00 42.46 37.42 2r6t s ILE 20 CO 0.00 -0.03 -0.03 -0.76 -0.10 0.00 0.00 174.94 174.02 2r6t s LEU 21 N 2.51 3.11 0.45 2.97 1.43 0.13 -4.93 118.68 124.35 2r6t s LEU 21 Ca 0.25 -0.71 -0.23 0.00 -1.03 0.00 0.00 54.13 52.41 2r6t s LEU 21 Cb -0.15 -1.63 -0.08 0.00 0.03 0.00 0.00 46.19 44.36 2r6t s LEU 21 CO 0.10 -0.01 1.16 -0.31 0.23 0.00 0.00 176.35 177.52 2r6t s TYR 22 N -2.36 2.92 0.31 0.29 2.02 -1.26 -1.51 117.35 117.76 2r6t s TYR 22 Ca 0.31 1.55 0.35 0.00 -0.37 0.00 0.00 57.07 58.91 2r6t s TYR 22 Cb -0.06 -3.36 1.63 0.00 -0.40 0.00 0.00 41.96 39.77 2r6t s TYR 22 CO 0.19 -1.42 2.09 0.87 -1.57 0.00 0.00 175.55 175.71 2r6t h LYS 23 N 2.11 0.00 -0.01 -0.62 1.57 -1.75 -1.30 116.57 116.57 2r6t h LYS 23 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 2r6t h LYS 23 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2r6t h LYS 23 CO 0.60 0.04 -0.05 0.27 -0.57 0.00 0.00 179.45 179.75 2r6t n ASN 24 N -3.22 0.84 -4.65 0.86 6.94 -1.26 -4.35 115.26 110.42 2r6t n ASN 24 Ca -0.01 -1.10 -0.47 0.00 -0.02 0.00 0.00 54.58 52.99 2r6t n ASN 24 Cb 0.24 -0.01 -0.04 0.00 -2.36 0.00 0.00 39.78 37.62 2r6t n ASN 24 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2r6t n ASP 25 N -0.46 2.56 -0.10 0.53 -0.08 -0.49 -5.12 116.55 113.39 2r6t n ASP 25 Ca 0.18 1.12 0.26 0.00 -1.51 0.00 0.00 54.79 54.84 2r6t n ASP 25 Cb 0.27 -1.37 0.71 0.00 2.34 0.00 0.00 41.12 43.08 2r6t n ASP 25 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2r6t h PRO 26 N 4.81 0.00 0.45 -0.67 0.13 -1.91 -1.68 132.00 133.13 2r6t h PRO 26 Ca -0.45 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.66 2r6t h PRO 26 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2r6t h PRO 26 CO 0.80 0.00 -0.22 -0.09 -0.23 0.00 0.00 178.00 178.26 2r6t h ARG 27 N 0.00 -0.59 -0.89 0.86 2.43 -1.94 -2.14 114.38 112.12 2r6t h ARG 27 Ca 0.36 0.04 0.23 0.00 -0.81 0.00 0.00 59.98 59.80 2r6t h ARG 27 Cb 1.65 0.13 -0.16 0.00 -0.42 0.00 0.00 29.97 31.18 2r6t h ARG 27 CO -0.00 -0.39 0.06 0.28 -1.51 0.00 0.00 179.97 178.40 2r6t h VAL 28 N -0.86 0.18 -0.38 0.20 2.07 -1.74 -0.15 116.25 115.57 2r6t h VAL 28 Ca -0.06 -0.03 0.06 0.00 0.82 0.00 0.00 66.70 67.49 2r6t h VAL 28 Cb 0.47 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.28 2r6t h VAL 28 CO 0.10 0.01 0.06 0.00 0.02 0.00 0.00 177.57 177.76 2r6t h ALA 29 N 1.86 0.39 0.32 1.67 0.00 -1.34 0.45 119.26 122.61 2r6t h ALA 29 Ca 0.53 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.52 2r6t h ALA 29 Cb 1.04 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2r6t h ALA 29 CO -0.79 -0.35 -0.25 0.00 0.00 0.00 0.00 179.25 177.86 2r6t h ALA 30 N 1.29 -0.57 -0.84 0.00 0.00 -0.36 0.23 119.26 119.02 2r6t h ALA 30 Ca 0.18 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2r6t h ALA 30 Cb 0.22 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 2r6t h ALA 30 CO -0.25 -0.84 0.55 -0.92 0.00 0.00 0.00 179.25 177.79 2r6t h TYR 31 N -0.58 1.05 -0.12 0.00 -0.00 -1.25 -2.60 116.97 113.47 2r6t h TYR 31 Ca -0.02 0.02 -0.01 0.00 -0.00 0.00 0.00 58.73 58.73 2r6t h TYR 31 Cb 0.51 -0.35 -0.01 0.00 -0.00 0.00 0.00 36.73 36.88 2r6t h TYR 31 CO -0.13 0.65 0.05 0.78 -0.00 0.00 0.00 178.16 179.51 2r6t h GLY 32 N 1.13 0.19 1.38 1.82 0.00 0.23 -1.82 103.07 106.00 2r6t h GLY 32 Ca 0.31 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.49 2r6t h GLY 32 CO -0.07 0.09 0.11 0.83 0.00 0.00 0.00 176.54 177.51 2r6t h GLU 33 N 0.05 0.78 -0.46 4.80 4.39 -0.46 -1.16 114.58 122.53 2r6t h GLU 33 Ca 0.04 -0.16 -0.06 0.00 0.34 0.00 0.00 59.36 59.52 2r6t h GLU 33 Cb 0.14 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 2r6t h GLU 33 CO -0.00 0.71 0.02 0.28 -1.16 0.00 0.00 179.01 178.86 2r6t h VAL 34 N 0.75 1.23 -0.18 3.13 2.07 -1.43 0.13 116.25 121.94 2r6t h VAL 34 Ca 0.17 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 2r6t h VAL 34 Cb 0.30 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 2r6t h VAL 34 CO -0.00 0.33 0.10 -0.78 0.02 0.00 0.00 177.57 177.24 2r6t h ASP 35 N 0.70 0.22 -0.38 0.57 3.58 -0.84 -0.12 116.42 120.15 2r6t h ASP 35 Ca 0.14 -0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.52 2r6t h ASP 35 Cb 0.40 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 2r6t h ASP 35 CO 0.01 0.23 0.22 -0.08 -2.88 0.00 0.00 179.24 176.75 2r6t h GLU 36 N 0.20 0.52 -0.62 0.28 4.81 -0.87 -0.95 114.58 117.95 2r6t h GLU 36 Ca 0.06 -0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.30 2r6t h GLU 36 Cb 0.05 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 29.27 2r6t h GLU 36 CO -0.01 0.41 0.33 1.25 -0.73 0.00 0.00 179.01 180.26 2r6t h LEU 37 N 0.49 0.48 -0.56 1.64 5.85 -0.71 -0.34 115.31 122.17 2r6t h LEU 37 Ca 0.14 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 2r6t h LEU 37 Cb 0.03 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 2r6t h LEU 37 CO -0.02 0.31 0.27 -1.13 -0.34 0.00 0.00 178.44 177.53 2r6t h ASN 38 N 0.62 0.73 0.02 1.25 -0.00 -0.51 0.14 115.58 117.83 2r6t h ASN 38 Ca 0.28 -0.13 -0.09 0.00 -0.00 0.00 0.00 56.30 56.37 2r6t h ASN 38 Cb 0.19 -0.19 -0.01 0.00 -0.00 0.00 0.00 38.32 38.31 2r6t h ASN 38 CO -0.19 0.65 -0.26 0.28 -0.00 0.00 0.00 177.43 177.91 2r6t h SER 39 N 0.75 0.39 -0.45 1.15 0.02 -0.90 -1.00 113.55 113.51 2r6t h SER 39 Ca 0.19 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 60.95 2r6t h SER 39 Cb 0.11 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.53 2r6t h SER 39 CO -0.03 0.65 0.03 -0.25 -1.14 0.00 0.00 176.83 176.10 2r6t h TRP 40 N 0.34 0.82 -0.84 3.45 2.91 -0.50 -0.65 115.95 121.48 2r6t h TRP 40 Ca 0.05 -0.13 0.06 0.00 1.13 0.00 0.00 58.89 60.01 2r6t h TRP 40 Cb 0.64 -0.22 -0.06 0.00 -0.51 0.00 0.00 29.16 29.01 2r6t h TRP 40 CO 0.02 0.79 0.52 0.28 -1.03 0.00 0.00 178.44 179.02 2r6t h VAL 41 N 0.61 1.03 -0.76 2.65 2.07 -0.17 0.10 116.25 121.79 2r6t h VAL 41 Ca 0.13 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2r6t h VAL 41 Cb 0.44 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.18 2r6t h VAL 41 CO 0.02 0.17 0.44 1.23 0.02 0.00 0.00 177.57 179.45 2r6t h GLY 42 N 0.94 1.12 1.00 2.17 0.00 -0.97 -1.60 103.07 105.74 2r6t h GLY 42 Ca 0.37 -0.49 -0.03 0.00 0.00 0.00 0.00 47.33 47.19 2r6t h GLY 42 CO -0.18 0.47 0.30 -1.82 0.00 0.00 0.00 176.54 175.31 2r6t h TYR 43 N 1.05 0.96 -0.44 5.60 3.20 -0.27 -2.30 116.97 124.76 2r6t h TYR 43 Ca 0.27 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 2r6t h TYR 43 Cb -0.00 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 37.95 2r6t h TYR 43 CO -0.00 0.73 0.14 1.15 -1.64 0.00 0.00 178.16 178.53 2r6t h THR 44 N 0.91 1.18 -0.13 1.81 2.02 -0.17 -2.90 112.91 115.63 2r6t h THR 44 Ca 0.22 -0.62 -0.18 0.00 0.77 0.00 0.00 66.41 66.60 2r6t h THR 44 Cb 0.15 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 67.26 2r6t h THR 44 CO -0.02 0.23 -0.68 0.50 0.37 0.00 0.00 175.52 175.91 2r6t h LYS 45 N 0.63 0.53 0.00 6.66 3.64 -1.04 -2.45 116.57 124.54 2r6t h LYS 45 Ca 0.15 -0.40 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 2r6t h LYS 45 Cb 0.19 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 2r6t h LYS 45 CO -0.01 1.02 0.00 0.66 -2.27 0.00 0.00 179.45 178.86 2r6t h SER 46 N 0.38 0.00 0.92 4.20 4.64 -1.21 -2.25 113.55 120.22 2r6t h SER 46 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2r6t h SER 46 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2r6t h SER 46 CO 0.13 0.00 -0.37 0.18 -0.87 0.00 0.00 176.83 175.89 2r6t n LEU 47 N -2.38 0.56 -4.64 5.97 4.77 -0.92 -4.90 117.00 115.46 2r6t n LEU 47 Ca 0.01 0.29 -0.48 0.00 -0.03 0.00 0.00 56.01 55.80 2r6t n LEU 47 Cb 0.18 -0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 40.95 2r6t n LEU 47 CO 0.18 -0.03 1.05 -0.38 -1.33 0.00 0.00 177.39 176.89 2r6t n ILE 48 N -1.90 0.18 -3.19 -0.08 5.41 -0.85 -4.85 119.36 114.08 2r6t n ILE 48 Ca 0.05 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2r6t n ILE 48 Cb 0.40 -1.27 0.00 0.00 -0.71 0.00 0.00 39.64 38.05 2r6t n ILE 48 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2r6t n ASN 49 N 2.90 1.90 0.27 4.38 0.23 -1.26 -4.99 115.26 118.69 2r6t n ASN 49 Ca 0.17 -0.24 0.17 0.00 -0.53 0.00 0.00 54.58 54.14 2r6t n ASN 49 Cb 0.26 0.00 0.65 0.00 -2.08 0.00 0.00 39.78 38.61 2r6t n ASN 49 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2r6t h SER 50 N 0.00 0.00 1.22 0.53 4.64 -2.00 -2.34 113.55 115.60 2r6t h SER 50 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2r6t h SER 50 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2r6t h SER 50 CO 0.00 0.01 -0.71 0.45 -0.87 0.00 0.00 176.83 175.71 2r6t h HIS 51 N 0.00 0.00 0.00 4.77 3.86 -1.96 -3.37 115.15 118.45 2r6t h HIS 51 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2r6t h HIS 51 Cb 0.55 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.02 2r6t h HIS 51 CO 0.00 0.00 -0.21 0.25 0.86 0.00 0.00 177.93 178.83 2r6t n THR 52 N -2.70 0.84 0.25 2.45 -2.24 -1.08 -4.80 114.28 106.99 2r6t n THR 52 Ca 0.01 -0.99 0.10 0.00 -2.27 0.00 0.00 64.05 60.90 2r6t n THR 52 Cb 0.53 0.26 0.66 0.00 -2.10 0.00 0.00 70.33 69.67 2r6t n THR 52 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2r6t h GLN 53 N 0.00 0.00 0.00 -0.78 5.75 -1.59 -2.73 115.11 115.76 2r6t h GLN 53 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2r6t h GLN 53 Cb 1.12 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.67 2r6t h GLN 53 CO 0.00 0.12 0.01 -0.39 -2.65 0.00 0.00 178.83 175.92 2r6t h VAL 54 N 0.00 0.00 0.00 2.39 -1.51 -1.89 -2.66 116.25 112.58 2r6t h VAL 54 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2r6t h VAL 54 Cb 0.26 0.97 0.00 0.00 -2.13 0.00 0.00 31.29 30.39 2r6t h VAL 54 CO 0.02 0.00 -0.27 0.18 -1.23 0.00 0.00 177.57 176.27 2r6t n LEU 55 N -3.04 0.28 0.02 4.19 4.77 -1.03 -4.25 117.00 117.94 2r6t n LEU 55 Ca -0.03 0.24 -0.12 0.00 -0.03 0.00 0.00 56.01 56.07 2r6t n LEU 55 Cb 0.08 -0.36 -0.07 0.00 -2.33 0.00 0.00 43.42 40.74 2r6t n LEU 55 CO 0.19 0.06 0.84 -1.28 -1.33 0.00 0.00 177.39 175.88 2r6t h SER 56 N 0.00 0.03 -0.02 -1.43 0.87 -1.67 -2.83 113.55 108.50 2r6t h SER 56 Ca 0.00 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.49 2r6t h SER 56 Cb 0.51 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.46 2r6t h SER 56 CO 0.00 0.09 0.01 0.78 -0.53 0.00 0.00 176.83 177.18 2r6t h ASN 57 N -0.04 0.02 -0.88 6.23 2.35 -1.81 -2.21 115.58 119.24 2r6t h ASN 57 Ca 0.01 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.58 2r6t h ASN 57 Cb 0.07 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 2r6t h ASN 57 CO -0.00 0.18 0.48 1.05 -1.65 0.00 0.00 177.43 177.49 2r6t h GLU 58 N -0.14 1.23 -0.87 0.81 4.11 -1.81 0.76 114.58 118.67 2r6t h GLU 58 Ca 0.01 -0.15 0.01 0.00 0.07 0.00 0.00 59.36 59.29 2r6t h GLU 58 Cb 0.16 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 29.13 2r6t h GLU 58 CO -0.00 0.90 0.56 -0.07 0.07 0.00 0.00 179.01 180.48 2r6t h LEU 59 N 1.23 1.01 -1.00 3.06 3.38 -1.47 -0.15 115.31 121.37 2r6t h LEU 59 Ca 0.31 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 2r6t h LEU 59 Cb 0.03 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 2r6t h LEU 59 CO -0.05 0.74 0.51 -0.33 0.09 0.00 0.00 178.44 179.41 2r6t h GLU 60 N 1.18 1.21 -0.39 1.13 4.39 -0.51 -2.00 114.58 119.58 2r6t h GLU 60 Ca 0.32 -0.12 -0.01 0.00 0.34 0.00 0.00 59.36 59.88 2r6t h GLU 60 Cb -0.12 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.27 2r6t h GLU 60 CO -0.07 0.86 0.19 1.49 -1.16 0.00 0.00 179.01 180.32 2r6t h GLU 61 N 1.22 0.57 -0.82 2.33 4.57 -0.47 -2.88 114.58 119.09 2r6t h GLU 61 Ca 0.31 -0.08 0.01 0.00 -1.18 0.00 0.00 59.36 58.42 2r6t h GLU 61 Cb -0.02 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.42 2r6t h GLU 61 CO -0.06 0.49 0.54 0.82 -1.18 0.00 0.00 179.01 179.63 2r6t h ILE 62 N 0.50 1.20 -0.98 2.32 2.04 -0.67 -1.11 117.51 120.82 2r6t h ILE 62 Ca 0.14 -0.38 0.12 0.00 1.00 0.00 0.00 64.86 65.74 2r6t h ILE 62 Cb 0.11 0.01 -0.08 0.00 -0.74 0.00 0.00 36.82 36.11 2r6t h ILE 62 CO -0.02 0.20 0.60 1.56 0.00 0.00 0.00 178.15 180.50 2r6t h GLN 63 N 1.10 0.93 -0.16 2.37 4.20 -1.19 0.22 115.11 122.58 2r6t h GLN 63 Ca 0.30 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.93 2r6t h GLN 63 Cb -0.12 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.45 2r6t h GLN 63 CO -0.07 0.62 -0.01 1.96 -0.67 0.00 0.00 178.83 180.66 2r6t h GLN 64 N 0.96 0.29 -0.88 1.46 1.08 -1.13 -2.34 115.11 114.54 2r6t h GLN 64 Ca 0.48 -0.10 0.13 0.00 -1.45 0.00 0.00 58.65 57.72 2r6t h GLN 64 Cb 0.48 -0.02 -0.07 0.00 -0.05 0.00 0.00 27.48 27.82 2r6t h GLN 64 CO -0.27 0.52 0.57 -0.07 -0.95 0.00 0.00 178.83 178.63 2r6t h LEU 65 N 0.02 0.66 -0.56 1.46 3.38 -0.61 -2.31 115.31 117.35 2r6t h LEU 65 Ca 0.04 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.90 2r6t h LEU 65 Cb 0.40 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2r6t h LEU 65 CO 0.01 0.35 -0.71 -0.07 0.09 0.00 0.00 178.44 178.10 2r6t h LEU 66 N 0.70 0.00 -0.18 1.67 3.38 -0.44 -2.13 115.31 118.31 2r6t h LEU 66 Ca 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.39 2r6t h LEU 66 Cb 0.67 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 2r6t h LEU 66 CO -0.19 0.71 0.07 0.15 0.09 0.00 0.00 178.44 179.27 2r6t h PHE 67 N 0.00 0.27 -0.76 1.13 3.57 -0.87 -1.55 116.94 118.73 2r6t h PHE 67 Ca -0.01 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.55 2r6t h PHE 67 Cb 1.27 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 39.87 2r6t h PHE 67 CO 0.00 0.32 0.43 -0.44 -2.23 0.00 0.00 178.31 176.39 2r6t h ASP 68 N 0.14 0.64 -0.18 0.41 3.32 -1.42 -0.16 116.42 119.17 2r6t h ASP 68 Ca 0.06 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2r6t h ASP 68 Cb 0.16 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2r6t h ASP 68 CO -0.01 0.39 0.12 0.00 -1.72 0.00 0.00 179.24 178.02 2r6t h GLY 70 N 0.23 0.69 0.78 0.00 0.00 -1.05 -1.68 103.07 102.04 2r6t h GLY 70 Ca 0.07 -0.43 0.01 0.00 0.00 0.00 0.00 47.33 46.97 2r6t h GLY 70 CO -0.01 0.40 -0.15 0.84 0.00 0.00 0.00 176.54 177.61 2r6t h HIS 71 N 0.61 -0.40 -0.28 5.60 6.17 -0.76 -1.78 115.15 124.31 2r6t h HIS 71 Ca 0.13 0.00 -0.10 0.00 0.71 0.00 0.00 60.37 61.11 2r6t h HIS 71 Cb 0.38 0.16 -0.01 0.00 2.52 0.00 0.00 27.41 30.46 2r6t h HIS 71 CO 0.02 -0.23 -0.24 -0.44 0.71 0.00 0.00 177.93 177.75 2r6t h ASP 72 N -0.32 0.55 -0.13 3.26 5.19 -1.17 -2.31 116.42 121.48 2r6t h ASP 72 Ca 0.01 -0.19 -0.05 0.00 -0.62 0.00 0.00 57.03 56.18 2r6t h ASP 72 Cb 0.32 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.66 2r6t h ASP 72 CO -0.06 0.78 -0.07 -0.07 -3.12 0.00 0.00 179.24 176.71 2r6t h LEU 73 N 0.48 0.40 0.00 1.55 3.38 -1.23 -2.13 115.31 117.77 2r6t h LEU 73 Ca 0.07 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2r6t h LEU 73 Cb 0.68 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.32 2r6t h LEU 73 CO 0.05 0.52 0.00 0.00 0.09 0.00 0.00 178.44 179.10 2r6t n ALA 74 N -2.48 2.64 -3.52 1.53 0.00 -0.68 -4.78 120.51 113.21 2r6t n ALA 74 Ca 0.01 -0.14 -0.35 0.00 0.00 0.00 0.00 53.44 52.95 2r6t n ALA 74 Cb 0.27 -1.37 -0.14 0.00 0.00 0.00 0.00 19.45 18.21 2r6t n ALA 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2r6t s THR 75 N -2.00 3.29 0.40 0.00 2.01 -0.80 -1.58 115.64 116.96 2r6t s THR 75 Ca 0.34 -0.73 -0.27 0.00 0.31 0.00 0.00 61.69 61.34 2r6t s THR 75 Cb 0.16 -2.60 -0.10 0.00 0.01 0.00 0.00 72.50 69.97 2r6t s THR 75 CO 0.27 0.27 1.41 -2.84 -0.69 0.00 0.00 174.62 173.04 2r6t s PRO 76 N 1.42 3.99 0.49 4.92 0.02 -1.26 -4.91 135.00 139.67 2r6t s PRO 76 Ca 0.03 2.41 0.28 0.00 0.02 0.00 0.00 61.00 63.73 2r6t s PRO 76 Cb -0.16 -2.85 1.13 0.00 0.02 0.00 0.00 34.50 32.64 2r6t s PRO 76 CO -0.03 -0.56 1.91 0.00 -0.33 0.00 0.00 177.00 177.99 2r6t h ALA 77 N 2.80 1.04 -0.25 -1.55 0.00 -1.94 -2.68 119.26 116.68 2r6t h ALA 77 Ca -0.50 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2r6t h ALA 77 Cb 1.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2r6t h ALA 77 CO 0.63 0.17 0.00 -0.40 0.00 0.00 0.00 179.25 179.66 2r6t n ASP 78 N -3.32 2.71 -4.64 0.00 5.75 -1.26 -4.93 116.55 110.86 2r6t n ASP 78 Ca 0.00 -1.88 -0.43 0.00 -0.01 0.00 0.00 54.79 52.48 2r6t n ASP 78 Cb 0.37 -0.16 -0.03 0.00 -1.03 0.00 0.00 41.12 40.27 2r6t n ASP 78 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2r6t s ASP 79 N -1.60 6.40 0.26 -1.12 -1.08 -1.01 -4.90 116.67 113.61 2r6t s ASP 79 Ca 0.35 1.94 -0.01 0.00 -0.52 0.00 0.00 52.55 54.31 2r6t s ASP 79 Cb 0.21 -2.53 0.33 0.00 -1.46 0.00 0.00 42.92 39.47 2r6t s ASP 79 CO 0.30 -1.19 1.72 -0.33 0.52 0.00 0.00 175.17 176.18 2r6t h GLU 80 N 10.70 0.67 0.00 4.34 4.39 -1.91 -3.25 114.58 129.52 2r6t h GLU 80 Ca -0.37 -0.22 -0.03 0.00 0.34 0.00 0.00 59.36 59.07 2r6t h GLU 80 Cb 1.18 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.77 2r6t h GLU 80 CO 0.98 0.79 -0.79 0.00 -1.16 0.00 0.00 179.01 178.82 2r6t h ARG 81 N 0.60 0.00 -5.41 2.33 -0.00 -1.99 -3.47 114.38 106.45 2r6t h ARG 81 Ca 0.10 0.00 -0.52 0.00 -0.50 0.00 0.00 59.98 59.06 2r6t h ARG 81 Cb 0.60 0.00 -0.30 0.00 0.00 0.00 0.00 29.97 30.27 2r6t h ARG 81 CO 0.04 0.06 -0.82 -1.01 0.00 0.00 0.00 179.97 178.24 2r6t s HIS 82 N -3.25 1.43 0.01 3.04 3.76 -1.23 -5.14 115.29 113.91 2r6t s HIS 82 Ca 0.01 -0.30 0.02 0.00 -0.15 0.00 0.00 55.06 54.64 2r6t s HIS 82 Cb 0.08 -0.93 -0.01 0.00 1.11 0.00 0.00 32.58 32.83 2r6t s HIS 82 CO 0.76 -0.05 -0.06 0.45 -0.85 0.00 0.00 174.74 175.00 2r6t s SER 83 N -0.28 0.65 0.18 1.40 0.15 -1.26 -4.59 113.70 109.95 2r6t s SER 83 Ca 0.04 -0.20 -0.32 0.00 0.70 0.00 0.00 55.95 56.17 2r6t s SER 83 Cb -0.07 -0.04 -0.12 0.00 -1.71 0.00 0.00 66.02 64.08 2r6t s SER 83 CO -0.00 -0.00 1.74 0.49 1.20 0.00 0.00 173.24 176.67 2r6t n PHE 84 N 2.61 2.67 0.51 3.44 3.72 -1.26 -4.91 117.46 124.25 2r6t n PHE 84 Ca -0.15 0.02 0.05 0.00 -0.05 0.00 0.00 57.45 57.32 2r6t n PHE 84 Cb 0.57 -2.68 -0.06 0.00 -0.94 0.00 0.00 39.48 36.38 2r6t n PHE 84 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 2r6t n LYS 85 N 4.33 3.35 -3.50 -1.08 2.85 -1.26 -4.99 118.16 117.86 2r6t n LYS 85 Ca 0.17 -0.03 -0.37 0.00 -1.05 0.00 0.00 58.31 57.03 2r6t n LYS 85 Cb 0.35 -1.02 -0.08 0.00 -0.65 0.00 0.00 35.03 33.63 2r6t n LYS 85 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 177.40 177.47 2r6t s PHE 86 N -2.00 3.39 -0.17 5.58 5.36 -1.26 -5.07 117.98 123.81 2r6t s PHE 86 Ca 0.04 0.52 0.01 0.00 -0.96 0.00 0.00 56.93 56.54 2r6t s PHE 86 Cb 0.08 -2.41 0.01 0.00 -0.34 0.00 0.00 43.02 40.37 2r6t s PHE 86 CO 0.44 0.08 -0.19 0.15 -1.46 0.00 0.00 175.22 174.24 2r6t s LYS 87 N 0.99 3.05 0.55 10.12 1.02 -1.26 -4.80 119.74 129.40 2r6t s LYS 87 Ca 0.16 -0.81 0.33 0.00 0.02 0.00 0.00 55.97 55.66 2r6t s LYS 87 Cb -0.14 -2.57 1.39 0.00 -0.52 0.00 0.00 37.83 36.00 2r6t s LYS 87 CO 0.06 -0.12 2.00 -0.56 -0.92 0.00 0.00 175.35 175.80 2r6t h GLN 88 N 7.69 0.00 0.58 1.68 -0.00 -1.98 -3.40 115.11 119.68 2r6t h GLN 88 Ca -0.40 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.22 2r6t h GLN 88 Cb 1.16 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 28.65 2r6t h GLN 88 CO 0.60 0.03 -0.28 0.93 -0.00 0.00 0.00 178.83 180.12 2r6t h GLU 89 N 0.00 -0.75 0.36 0.06 4.39 -1.96 0.24 114.58 116.92 2r6t h GLU 89 Ca -0.00 0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 2r6t h GLU 89 Cb 0.50 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.32 2r6t h GLU 89 CO 0.00 -0.50 -0.18 1.96 -1.16 0.00 0.00 179.01 179.13 2r6t h GLN 90 N -0.79 -0.48 -0.53 2.33 4.20 -2.00 -0.51 115.11 117.33 2r6t h GLN 90 Ca -0.08 0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.70 2r6t h GLN 90 Cb 0.59 0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.44 2r6t h GLN 90 CO 0.13 -0.32 0.29 -1.35 -0.67 0.00 0.00 178.83 176.91 2r6t h PRO 91 N -0.50 0.55 -0.37 1.46 0.11 -1.76 -1.97 132.00 129.52 2r6t h PRO 91 Ca -0.05 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.89 2r6t h PRO 91 Cb 0.39 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.37 2r6t h PRO 91 CO 0.07 0.37 -0.33 1.15 -0.21 0.00 0.00 178.00 179.05 2r6t h THR 92 N 0.57 1.28 -0.89 -1.15 2.02 -0.48 -1.63 112.91 112.63 2r6t h THR 92 Ca 0.23 -1.50 0.07 0.00 0.77 0.00 0.00 66.41 65.97 2r6t h THR 92 Cb 0.09 1.40 -0.06 0.00 -1.74 0.00 0.00 68.15 67.84 2r6t h THR 92 CO -0.13 0.50 0.55 0.58 0.37 0.00 0.00 175.52 177.39 2r6t h VAL 93 N 0.68 1.04 -0.44 3.16 2.07 -1.02 -1.12 116.25 120.63 2r6t h VAL 93 Ca 0.06 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 2r6t h VAL 93 Cb 0.92 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 2r6t h VAL 93 CO 0.08 0.18 -0.03 -0.25 0.02 0.00 0.00 177.57 177.58 2r6t h TRP 94 N 1.00 0.77 -0.15 1.57 7.01 -0.95 -0.75 115.95 124.46 2r6t h TRP 94 Ca 0.39 -0.11 -0.12 0.00 2.11 0.00 0.00 58.89 61.15 2r6t h TRP 94 Cb 0.19 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 27.02 2r6t h TRP 94 CO -0.03 0.74 -0.45 -0.07 -2.79 0.00 0.00 178.44 175.84 2r6t h LEU 95 N 0.68 0.38 -0.78 0.65 3.38 -1.00 -2.96 115.31 115.66 2r6t h LEU 95 Ca 0.13 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 2r6t h LEU 95 Cb 0.46 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2r6t h LEU 95 CO 0.02 0.78 -0.32 -0.33 0.09 0.00 0.00 178.44 178.69 2r6t h GLU 96 N 0.29 0.56 -0.24 1.13 5.08 -0.12 -1.10 114.58 120.17 2r6t h GLU 96 Ca 0.02 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.08 2r6t h GLU 96 Cb 0.91 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 2r6t h GLU 96 CO 0.08 0.81 -0.07 1.05 -1.00 0.00 0.00 179.01 179.87 2r6t h GLU 97 N 0.48 0.47 -0.99 2.33 4.11 -1.16 -2.18 114.58 117.64 2r6t h GLU 97 Ca 0.06 -0.19 0.05 0.00 0.07 0.00 0.00 59.36 59.35 2r6t h GLU 97 Cb 0.79 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.95 2r6t h GLU 97 CO 0.06 0.71 0.64 0.87 0.07 0.00 0.00 179.01 181.37 2r6t h LYS 98 N 0.21 1.17 -0.14 1.06 1.57 -1.45 -0.25 116.57 118.74 2r6t h LYS 98 Ca 0.06 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2r6t h LYS 98 Cb 0.55 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2r6t h LYS 98 CO 0.03 0.77 0.09 0.82 -0.57 0.00 0.00 179.45 180.59 2r6t h ILE 99 N 1.20 1.03 -0.49 1.86 2.04 -1.13 0.16 117.51 122.18 2r6t h ILE 99 Ca 0.41 -0.06 -0.07 0.00 1.00 0.00 0.00 64.86 66.14 2r6t h ILE 99 Cb 0.09 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 2r6t h ILE 99 CO -0.15 0.03 0.02 0.44 0.00 0.00 0.00 178.15 178.50 2r6t h ASP 100 N 0.18 0.76 -0.16 1.72 3.32 -0.97 0.05 116.42 121.32 2r6t h ASP 100 Ca 0.05 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 56.87 2r6t h ASP 100 Cb -0.01 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 2r6t h ASP 100 CO -0.02 0.82 -0.14 -1.13 -1.72 0.00 0.00 179.24 177.05 2r6t h ASN 101 N 0.75 0.39 0.36 6.45 -1.24 -0.95 -2.45 115.58 118.89 2r6t h ASN 101 Ca 0.15 -0.47 -0.16 0.00 0.71 0.00 0.00 56.30 56.53 2r6t h ASN 101 Cb 0.43 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.36 2r6t h ASN 101 CO 0.02 0.78 -0.66 1.88 -1.29 0.00 0.00 177.43 178.16 2r6t h TYR 102 N 0.01 0.35 -0.80 0.67 0.05 -0.47 -2.82 116.97 113.97 2r6t h TYR 102 Ca 0.03 -0.15 -0.03 0.00 0.05 0.00 0.00 58.73 58.63 2r6t h TYR 102 Cb 0.66 -0.06 -0.04 0.00 1.01 0.00 0.00 36.73 38.30 2r6t h TYR 102 CO 0.08 0.84 0.36 1.15 -1.05 0.00 0.00 178.16 179.55 2r6t h THR 103 N 0.19 1.25 -0.02 -2.88 2.02 -1.01 -2.91 112.91 109.55 2r6t h THR 103 Ca -0.01 -0.74 -0.18 0.00 0.77 0.00 0.00 66.41 66.25 2r6t h THR 103 Cb 1.19 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2r6t h THR 103 CO 0.10 0.31 -0.77 0.06 0.37 0.00 0.00 175.52 175.59 2r6t h GLN 104 N 1.15 0.19 -0.30 6.66 -0.00 -1.35 -3.29 115.11 118.16 2r6t h GLN 104 Ca 0.27 -0.17 -0.03 0.00 -0.00 0.00 0.00 58.65 58.72 2r6t h GLN 104 Cb 0.14 0.04 -0.01 0.00 -0.00 0.00 0.00 27.48 27.65 2r6t h GLN 104 CO -0.03 0.87 0.08 0.28 -0.00 0.00 0.00 178.83 180.02 2r6t h VAL 105 N 0.12 1.21 -3.92 1.86 2.07 -1.46 -3.47 116.25 112.67 2r6t h VAL 105 Ca -0.03 -0.71 -0.49 0.00 0.82 0.00 0.00 66.70 66.30 2r6t h VAL 105 Cb 1.35 1.10 0.01 0.00 -1.52 0.00 0.00 31.29 32.23 2r6t h VAL 105 CO 0.12 0.24 0.23 0.68 0.02 0.00 0.00 177.57 178.85 2r6t s VAL 106 N -5.32 4.69 0.09 2.57 -7.23 -1.10 -4.99 120.40 109.11 2r6t s VAL 106 Ca -0.13 0.83 -0.32 0.00 -1.81 0.00 0.00 61.98 60.55 2r6t s VAL 106 Cb 0.09 -3.74 -0.11 0.00 0.56 0.00 0.00 36.38 33.17 2r6t s VAL 106 CO 0.74 -0.64 1.81 -2.65 -0.31 0.00 0.00 175.10 174.05 2r6t n PRO 107 N -1.55 2.60 -3.00 4.82 -0.02 -1.26 -4.97 135.00 131.61 2r6t n PRO 107 Ca 0.04 0.94 -0.42 0.00 -2.02 0.00 0.00 63.50 62.05 2r6t n PRO 107 Cb 0.54 -2.81 -0.05 0.00 -0.02 0.00 0.00 33.50 31.15 2r6t n PRO 107 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r6t s ALA 108 N 2.74 3.50 0.00 3.55 0.00 -1.26 -5.13 121.76 125.16 2r6t s ALA 108 Ca 0.83 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.24 2r6t s ALA 108 Cb -0.55 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.31 2r6t s ALA 108 CO 0.40 -1.24 0.00 0.36 0.00 0.00 0.00 175.76 175.28 2r6t n LYS 111 N 6.17 0.00 -1.88 0.00 -0.00 -1.26 -5.25 118.16 115.94 2r6t n LYS 111 Ca 0.02 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 57.92 2r6t n LYS 111 Cb 0.48 0.00 -0.01 0.00 -0.00 0.00 0.00 35.03 35.51 2r6t n LYS 111 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 2r6t s PHE 112 N 0.00 2.71 -0.06 5.58 5.99 -1.26 -4.88 117.98 126.06 2r6t s PHE 112 Ca 0.00 1.20 -0.18 0.00 0.00 0.00 0.00 56.93 57.96 2r6t s PHE 112 Cb 0.00 -3.94 -0.05 0.00 0.00 0.00 0.00 43.02 39.03 2r6t s PHE 112 CO 0.00 -2.75 0.49 0.42 -0.00 0.00 0.00 175.22 173.38 2r6t s ILE 113 N -1.05 5.08 -0.01 3.12 1.01 -1.26 -0.47 121.20 127.63 2r6t s ILE 113 Ca 0.52 0.99 -0.08 0.00 0.00 0.00 0.00 60.65 62.08 2r6t s ILE 113 Cb -0.45 -3.82 -0.05 0.00 0.01 0.00 0.00 42.46 38.15 2r6t s ILE 113 CO 0.60 0.41 0.29 -0.76 0.00 0.00 0.00 174.94 175.47 2r6t s LEU 114 N 0.02 4.39 -0.18 2.97 1.43 0.38 -4.83 118.68 122.86 2r6t s LEU 114 Ca 0.26 0.64 -0.29 0.00 -1.03 0.00 0.00 54.13 53.71 2r6t s LEU 114 Cb -0.16 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.45 2r6t s LEU 114 CO 0.13 0.28 1.37 -2.16 0.23 0.00 0.00 176.35 176.20 2r6t s PRO 115 N -1.53 4.11 0.00 1.29 0.04 -1.26 -3.89 135.00 133.76 2r6t s PRO 115 Ca 0.25 1.66 0.00 0.00 0.04 0.00 0.00 61.00 62.95 2r6t s PRO 115 Cb -0.14 -3.85 0.00 0.00 0.04 0.00 0.00 34.50 30.55 2r6t s PRO 115 CO 0.14 -0.88 0.00 0.41 0.04 0.00 0.00 177.00 176.71 2r6t n GLY 116 N 3.95 -2.37 0.00 0.56 0.00 -1.26 -4.97 105.19 101.10 2r6t n GLY 116 Ca 0.15 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.89 2r6t n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r6t n GLY 117 N -0.63 0.35 3.71 -0.02 0.00 -1.26 -4.43 105.19 102.91 2r6t n GLY 117 Ca 0.00 -1.16 -0.30 0.00 0.00 0.00 0.00 46.02 44.56 2r6t n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2r6t s THR 118 N 0.00 2.72 0.16 2.61 -4.23 -1.26 -4.74 115.64 110.90 2r6t s THR 118 Ca 0.00 0.23 -0.16 0.00 -1.18 0.00 0.00 61.69 60.59 2r6t s THR 118 Cb 0.00 -2.60 0.05 0.00 1.34 0.00 0.00 72.50 71.28 2r6t s THR 118 CO 0.00 -0.31 1.73 -0.61 -0.54 0.00 0.00 174.62 174.90 2r6t h GLN 119 N -1.56 0.21 -0.56 3.99 4.15 -1.99 -1.11 115.11 118.25 2r6t h GLN 119 Ca -0.47 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 58.93 2r6t h GLN 119 Cb 1.27 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.88 2r6t h GLN 119 CO 0.51 0.14 0.33 1.25 -1.93 0.00 0.00 178.83 179.12 2r6t h LEU 120 N 0.22 0.68 -0.34 -2.39 5.85 -1.91 -1.15 115.31 116.27 2r6t h LEU 120 Ca 0.18 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2r6t h LEU 120 Cb 0.20 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 2r6t h LEU 120 CO -0.23 0.55 0.17 0.00 -0.34 0.00 0.00 178.44 178.59 2r6t h ALA 121 N 1.16 0.43 -0.41 1.25 0.00 -1.80 0.21 119.26 120.11 2r6t h ALA 121 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2r6t h ALA 121 Cb 0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2r6t h ALA 121 CO -0.04 -0.01 0.26 0.77 0.00 0.00 0.00 179.25 180.24 2r6t h SER 122 N 0.41 0.48 -0.31 0.00 0.02 -1.12 -0.24 113.55 112.78 2r6t h SER 122 Ca 0.12 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2r6t h SER 122 Cb 0.10 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 2r6t h SER 122 CO -0.02 0.36 0.18 0.00 -1.14 0.00 0.00 176.83 176.22 2r6t h ALA 123 N 1.14 1.70 -0.19 3.77 0.00 -0.90 0.12 119.26 124.89 2r6t h ALA 123 Ca 0.15 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 2r6t h ALA 123 Cb -0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2r6t h ALA 123 CO -0.03 0.26 -0.34 -0.07 0.00 0.00 0.00 179.25 179.06 2r6t h LEU 124 N 0.46 0.40 -0.52 0.00 3.38 0.01 -2.08 115.31 116.96 2r6t h LEU 124 Ca 0.12 -0.16 -0.15 0.00 0.09 0.00 0.00 57.88 57.79 2r6t h LEU 124 Cb 0.01 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2r6t h LEU 124 CO -0.02 0.72 -0.39 0.45 0.09 0.00 0.00 178.44 179.29 2r6t h HIS 125 N 0.33 0.92 -0.54 1.13 3.86 0.19 -1.93 115.15 119.12 2r6t h HIS 125 Ca 0.04 -0.27 0.03 0.00 -1.16 0.00 0.00 60.37 59.01 2r6t h HIS 125 Cb 0.77 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 29.00 2r6t h HIS 125 CO 0.02 1.04 0.31 0.28 0.86 0.00 0.00 177.93 180.44 2r6t h VAL 126 N 0.63 1.02 -0.08 2.45 2.07 -0.65 -2.63 116.25 119.06 2r6t h VAL 126 Ca 0.05 -0.21 -0.06 0.00 0.82 0.00 0.00 66.70 67.31 2r6t h VAL 126 Cb 0.94 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2r6t h VAL 126 CO 0.09 0.11 -0.24 0.00 0.02 0.00 0.00 177.57 177.55 2r6t h ALA 127 N 1.26 1.47 -0.65 1.67 0.00 -1.22 -0.66 119.26 121.12 2r6t h ALA 127 Ca 0.23 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2r6t h ALA 127 Cb 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2r6t h ALA 127 CO -0.12 0.38 0.40 -0.09 0.00 0.00 0.00 179.25 179.82 2r6t h ARG 128 N 0.12 0.88 0.00 0.00 2.43 -1.01 -0.23 114.38 116.58 2r6t h ARG 128 Ca 0.02 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.03 2r6t h ARG 128 Cb 0.49 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 2r6t h ARG 128 CO 0.03 0.62 -0.51 1.79 -1.51 0.00 0.00 179.97 180.40 2r6t h THR 129 N 0.89 0.62 0.12 0.20 1.35 -1.05 -2.85 112.91 112.19 2r6t h THR 129 Ca 0.23 -1.90 -0.28 0.00 -0.55 0.00 0.00 66.41 63.92 2r6t h THR 129 Cb -0.04 2.27 0.01 0.00 -1.73 0.00 0.00 68.15 68.66 2r6t h THR 129 CO -0.05 0.35 -1.21 0.40 -0.25 0.00 0.00 175.52 174.77 2r6t h ILE 130 N 0.00 1.42 -0.39 6.82 2.04 -1.05 -1.94 117.51 124.41 2r6t h ILE 130 Ca -0.02 -2.80 0.08 0.00 1.00 0.00 0.00 64.86 63.12 2r6t h ILE 130 Cb 1.31 2.81 -0.08 0.00 -0.74 0.00 0.00 36.82 40.12 2r6t h ILE 130 CO 0.05 0.83 -0.11 0.74 0.00 0.00 0.00 178.15 179.66 2r6t h THR 131 N 0.14 0.58 -0.57 -0.27 2.02 -1.06 -1.18 112.91 112.57 2r6t h THR 131 Ca -0.15 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 2r6t h THR 131 Cb 1.90 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 68.87 2r6t h THR 131 CO 0.21 0.00 0.30 0.11 0.37 0.00 0.00 175.52 176.51 2r6t h LYS 132 N -0.01 0.81 -0.39 6.66 1.57 -1.44 -0.55 116.57 123.21 2r6t h LYS 132 Ca 0.19 -0.11 0.05 0.00 -1.87 0.00 0.00 60.65 58.92 2r6t h LYS 132 Cb 0.31 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 2r6t h LYS 132 CO -0.41 0.64 0.12 -0.09 -0.57 0.00 0.00 179.45 179.13 2r6t h ARG 133 N 0.78 0.26 -0.41 3.15 2.43 -1.12 0.13 114.38 119.59 2r6t h ARG 133 Ca 0.20 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 2r6t h ARG 133 Cb 0.08 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 2r6t h ARG 133 CO -0.03 0.17 0.11 0.00 -1.51 0.00 0.00 179.97 178.71 2r6t h ALA 134 N 1.27 1.42 -0.29 2.80 0.00 -0.99 -2.41 119.26 121.06 2r6t h ALA 134 Ca 0.18 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2r6t h ALA 134 Cb 0.19 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2r6t h ALA 134 CO -0.21 0.43 -0.08 1.49 0.00 0.00 0.00 179.25 180.87 2r6t h GLU 135 N 0.60 0.56 -0.77 0.00 4.81 -0.28 0.11 114.58 119.61 2r6t h GLU 135 Ca 0.14 -0.22 0.07 0.00 -0.13 0.00 0.00 59.36 59.22 2r6t h GLU 135 Cb 0.21 -0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.50 2r6t h GLU 135 CO -0.00 0.77 0.45 0.00 -0.73 0.00 0.00 179.01 179.49 2r6t h ARG 136 N 0.32 0.78 -0.33 1.92 3.08 -0.61 -0.52 114.38 119.02 2r6t h ARG 136 Ca 0.07 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 2r6t h ARG 136 Cb 0.57 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 2r6t h ARG 136 CO 0.03 0.52 -0.21 0.37 -1.07 0.00 0.00 179.97 179.61 2r6t h GLN 137 N 0.80 0.62 -0.21 0.04 5.75 -1.24 -0.68 115.11 120.20 2r6t h GLN 137 Ca 0.35 -0.23 -0.08 0.00 -0.15 0.00 0.00 58.65 58.54 2r6t h GLN 137 Cb 0.23 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 2r6t h GLN 137 CO -0.20 0.79 -0.21 0.82 -2.65 0.00 0.00 178.83 177.38 2r6t h ILE 138 N 0.55 1.24 -0.15 2.39 2.04 -0.14 -2.52 117.51 120.92 2r6t h ILE 138 Ca 0.08 -1.11 -0.17 0.00 1.00 0.00 0.00 64.86 64.67 2r6t h ILE 138 Cb 0.66 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 2r6t h ILE 138 CO 0.05 0.35 -0.61 0.58 0.00 0.00 0.00 178.15 178.52 2r6t h VAL 139 N 0.34 1.33 -0.52 1.67 2.07 -0.81 -0.71 116.25 119.62 2r6t h VAL 139 Ca 0.06 -1.89 0.04 0.00 0.82 0.00 0.00 66.70 65.72 2r6t h VAL 139 Cb 0.56 1.87 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 2r6t h VAL 139 CO 0.04 0.58 0.29 -0.61 0.02 0.00 0.00 177.57 177.89 2r6t h GLN 140 N 0.39 0.55 0.66 1.57 -0.00 -0.90 -1.11 115.11 116.27 2r6t h GLN 140 Ca -0.01 -0.03 -0.03 0.00 -0.00 0.00 0.00 58.65 58.58 2r6t h GLN 140 Cb 1.16 -0.12 0.01 0.00 0.00 0.00 0.00 27.48 28.52 2r6t h GLN 140 CO 0.11 0.37 -0.32 1.25 0.00 0.00 0.00 178.83 180.24 2r6t h LEU 141 N 0.57 -0.75 -1.71 -2.39 5.85 -1.46 -3.11 115.31 112.32 2r6t h LEU 141 Ca 0.22 -0.01 0.45 0.00 0.84 0.00 0.00 57.88 59.39 2r6t h LEU 141 Cb 0.08 0.19 -0.09 0.00 0.37 0.00 0.00 40.66 41.21 2r6t h LEU 141 CO -0.13 -0.45 1.03 -0.03 -0.34 0.00 0.00 178.44 178.52 2r6t h MET 142 N -1.02 0.06 0.00 1.25 4.05 -0.97 0.39 114.93 118.69 2r6t h MET 142 Ca -0.09 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2r6t h MET 142 Cb 0.71 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.50 2r6t h MET 142 CO 0.15 0.04 0.00 0.00 0.23 0.00 0.00 176.91 177.33 2r6t h ARG 143 N 0.06 0.00 0.00 0.39 3.08 -1.13 -3.31 114.38 113.47 2r6t h ARG 143 Ca 0.80 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.84 2r6t h ARG 143 Cb 2.84 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 32.89 2r6t h ARG 143 CO -0.20 0.00 -1.14 0.39 -1.07 0.00 0.00 179.97 177.95 2r6t n GLU 144 N -2.38 0.64 -4.13 0.04 1.02 0.11 -5.07 120.64 110.87 2r6t n GLU 144 Ca 0.04 -0.02 -0.09 0.00 -0.02 0.00 0.00 57.16 57.07 2r6t n GLU 144 Cb 0.39 -1.07 -0.10 0.00 -0.02 0.00 0.00 31.44 30.63 2r6t n GLU 144 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2r6t s GLU 145 N -2.18 0.75 0.07 3.49 0.41 0.58 -5.12 118.70 116.69 2r6t s GLU 145 Ca -0.01 -1.30 -0.30 0.00 -0.41 0.00 0.00 54.97 52.94 2r6t s GLU 145 Cb 0.02 0.07 -0.05 0.00 -1.78 0.00 0.00 34.13 32.38 2r6t s GLU 145 CO 0.12 -0.11 1.12 -0.65 -0.49 0.00 0.00 175.26 175.25 2r6t s GLN 146 N -3.91 4.51 0.30 1.61 1.11 -1.26 -4.07 119.66 117.94 2r6t s GLN 146 Ca 0.12 1.66 0.08 0.00 0.01 0.00 0.00 55.36 57.22 2r6t s GLN 146 Cb 0.07 -3.36 -0.06 0.00 -1.01 0.00 0.00 33.01 28.65 2r6t s GLN 146 CO -0.06 -0.12 -0.07 0.96 0.01 0.00 0.00 175.29 176.01 2r6t s ILE 147 N 0.74 1.85 -0.51 1.08 -4.36 -1.26 -4.21 121.20 114.52 2r6t s ILE 147 Ca 0.55 -2.15 -0.27 0.00 -0.26 0.00 0.00 60.65 58.52 2r6t s ILE 147 Cb -0.27 -2.53 -0.04 0.00 1.25 0.00 0.00 42.46 40.87 2r6t s ILE 147 CO 0.30 -0.26 2.05 0.21 0.24 0.00 0.00 174.94 177.48 2r6t s ASN 148 N -3.50 5.10 0.51 4.36 3.84 -1.26 -4.83 114.94 119.16 2r6t s ASN 148 Ca 0.31 0.80 0.26 0.00 0.21 0.00 0.00 52.86 54.44 2r6t s ASN 148 Cb 0.03 -2.52 1.40 0.00 -0.55 0.00 0.00 41.25 39.61 2r6t s ASN 148 CO 0.14 -2.42 2.06 1.56 -2.79 0.00 0.00 177.10 175.64 2r6t h GLN 149 N 16.15 0.00 -1.00 0.43 1.08 -1.97 -1.56 115.11 128.24 2r6t h GLN 149 Ca -0.27 0.00 0.14 0.00 -1.45 0.00 0.00 58.65 57.07 2r6t h GLN 149 Cb 1.20 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 28.54 2r6t h GLN 149 CO 1.16 0.13 0.62 -0.44 -0.95 0.00 0.00 178.83 179.35 2r6t h ASP 150 N 0.00 0.88 -0.49 1.46 5.19 -1.89 -1.36 116.42 120.22 2r6t h ASP 150 Ca -0.00 0.06 0.03 0.00 -0.62 0.00 0.00 57.03 56.51 2r6t h ASP 150 Cb 0.35 -0.11 -0.04 0.00 0.18 0.00 0.00 39.33 39.71 2r6t h ASP 150 CO 0.02 0.43 0.26 0.58 -3.12 0.00 0.00 179.24 177.41 2r6t h VAL 151 N 0.93 0.99 -0.52 -1.35 2.07 -1.59 -2.05 116.25 114.73 2r6t h VAL 151 Ca 0.52 -0.18 -0.10 0.00 0.82 0.00 0.00 66.70 67.77 2r6t h VAL 151 Cb 0.61 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 2r6t h VAL 151 CO -0.30 0.09 -0.06 0.25 0.02 0.00 0.00 177.57 177.58 2r6t h LEU 152 N 0.52 0.92 0.08 2.57 5.85 -1.34 -0.07 115.31 123.82 2r6t h LEU 152 Ca 0.21 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 2r6t h LEU 152 Cb 0.08 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.87 2r6t h LEU 152 CO -0.13 1.01 -0.04 0.40 -0.34 0.00 0.00 178.44 179.34 2r6t h ILE 153 N 0.85 0.94 -0.12 4.05 2.04 -1.21 -1.58 117.51 122.48 2r6t h ILE 153 Ca 0.15 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 2r6t h ILE 153 Cb 0.58 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 2r6t h ILE 153 CO 0.04 0.02 0.05 0.15 0.00 0.00 0.00 178.15 178.40 2r6t h PHE 154 N -0.13 0.18 -0.57 1.37 3.57 -1.05 -1.74 116.94 118.56 2r6t h PHE 154 Ca -0.01 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.51 2r6t h PHE 154 Cb 0.11 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.75 2r6t h PHE 154 CO -0.06 0.25 0.33 0.82 -2.23 0.00 0.00 178.31 177.42 2r6t h ILE 155 N 0.05 1.03 -0.04 1.41 1.08 -1.03 0.20 117.51 120.21 2r6t h ILE 155 Ca 0.04 -0.22 0.03 0.00 -0.39 0.00 0.00 64.86 64.32 2r6t h ILE 155 Cb 0.15 0.33 -0.04 0.00 -3.07 0.00 0.00 36.82 34.19 2r6t h ILE 155 CO -0.00 0.12 -0.20 -1.13 -0.69 0.00 0.00 178.15 176.24 2r6t h ASN 156 N 0.64 -0.59 -0.09 1.72 -1.24 -1.12 -1.56 115.58 113.33 2r6t h ASN 156 Ca 0.24 0.09 -0.01 0.00 0.71 0.00 0.00 56.30 57.32 2r6t h ASN 156 Cb 0.07 0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.36 2r6t h ASN 156 CO -0.12 -0.26 0.03 -0.09 -1.29 0.00 0.00 177.43 175.70 2r6t h ARG 157 N -0.30 0.21 -0.81 6.67 9.65 -0.71 -3.13 114.38 125.96 2r6t h ARG 157 Ca 0.07 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.90 2r6t h ARG 157 Cb 0.40 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.90 2r6t h ARG 157 CO -0.21 0.21 0.41 1.25 2.80 0.00 0.00 179.97 184.42 2r6t h LEU 158 N 0.21 1.04 -1.13 3.80 5.85 0.42 -0.89 115.31 124.61 2r6t h LEU 158 Ca 0.05 -0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 2r6t h LEU 158 Cb 0.10 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2r6t h LEU 158 CO -0.00 0.86 -0.20 0.77 -0.34 0.00 0.00 178.44 179.52 2r6t h SER 159 N 1.15 0.36 -0.15 1.25 4.64 -1.44 -1.09 113.55 118.26 2r6t h SER 159 Ca 0.28 -0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 61.48 2r6t h SER 159 Cb 0.08 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 2r6t h SER 159 CO -0.04 0.58 0.03 0.44 -0.87 0.00 0.00 176.83 176.97 2r6t h ASP 160 N 0.33 0.23 -0.46 4.97 5.19 -1.49 -2.00 116.42 123.19 2r6t h ASP 160 Ca 0.06 -0.25 0.09 0.00 -0.62 0.00 0.00 57.03 56.31 2r6t h ASP 160 Cb 0.55 -0.06 -0.10 0.00 0.18 0.00 0.00 39.33 39.90 2r6t h ASP 160 CO 0.04 0.42 -0.25 0.22 -3.12 0.00 0.00 179.24 176.55 2r6t h TYR 161 N 0.04 -0.65 -0.38 4.55 3.20 -0.96 -1.33 116.97 121.43 2r6t h TYR 161 Ca 0.05 0.05 0.04 0.00 3.14 0.00 0.00 58.73 62.01 2r6t h TYR 161 Cb 0.28 0.36 -0.04 0.00 1.54 0.00 0.00 36.73 38.87 2r6t h TYR 161 CO 0.01 -0.33 0.16 0.74 -1.64 0.00 0.00 178.16 177.11 2r6t h PHE 162 N -0.15 0.29 -0.19 -3.82 0.04 -0.97 0.43 116.94 112.57 2r6t h PHE 162 Ca 0.21 0.02 0.05 0.00 2.80 0.00 0.00 57.97 61.05 2r6t h PHE 162 Cb 0.49 -0.08 -0.07 0.00 2.20 0.00 0.00 35.95 38.49 2r6t h PHE 162 CO -0.51 0.14 -0.35 0.35 -0.60 0.00 0.00 178.31 177.34 2r6t h PHE 163 N 0.34 -0.97 -0.15 -0.55 3.57 -1.14 0.23 116.94 118.27 2r6t h PHE 163 Ca 0.17 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.75 2r6t h PHE 163 Cb 0.12 0.45 -0.04 0.00 2.79 0.00 0.00 35.95 39.27 2r6t h PHE 163 CO -0.12 -0.41 -0.09 0.00 -2.23 0.00 0.00 178.31 175.46 2r6t h ALA 164 N 0.42 0.04 -0.78 2.41 0.00 -0.33 -2.38 119.26 118.64 2r6t h ALA 164 Ca 0.11 0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.19 2r6t h ALA 164 Cb 0.56 0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.47 2r6t h ALA 164 CO -0.41 -0.53 0.41 0.00 0.00 0.00 0.00 179.25 178.72 2r6t h ALA 165 N 1.05 1.12 -0.49 0.00 0.00 0.11 -2.35 119.26 118.70 2r6t h ALA 165 Ca 0.09 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2r6t h ALA 165 Cb 0.21 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2r6t h ALA 165 CO -0.20 -0.02 0.31 0.00 0.00 0.00 0.00 179.25 179.33 2r6t h ALA 166 N 1.48 0.63 -0.45 0.00 0.00 -0.17 -0.16 119.26 120.59 2r6t h ALA 166 Ca 0.40 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.21 2r6t h ALA 166 Cb 0.45 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2r6t h ALA 166 CO -0.29 0.02 -0.05 0.00 0.00 0.00 0.00 179.25 178.93 2r6t h ARG 167 N 0.62 0.77 -0.41 0.00 3.08 -1.10 -1.77 114.38 115.56 2r6t h ARG 167 Ca 0.19 -0.22 -0.15 0.00 0.07 0.00 0.00 59.98 59.87 2r6t h ARG 167 Cb -0.02 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 2r6t h ARG 167 CO -0.07 0.81 -0.32 -0.92 -1.07 0.00 0.00 179.97 178.39 2r6t h TYR 168 N 0.71 1.10 -0.30 3.04 3.20 -1.11 -0.89 116.97 122.72 2r6t h TYR 168 Ca 0.13 -0.31 0.03 0.00 3.14 0.00 0.00 58.73 61.72 2r6t h TYR 168 Cb 0.50 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 2r6t h TYR 168 CO 0.03 1.13 0.12 0.00 -1.64 0.00 0.00 178.16 177.80 2r6t h ALA 169 N 0.79 0.35 -0.83 1.82 0.00 -0.74 0.77 119.26 121.43 2r6t h ALA 169 Ca 0.07 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.06 2r6t h ALA 169 Cb 0.91 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.63 2r6t h ALA 169 CO 0.08 -0.28 0.52 -0.91 0.00 0.00 0.00 179.25 178.67 2r6t h ASN 170 N 0.26 0.83 -0.18 0.00 2.35 -1.04 -2.53 115.58 115.28 2r6t h ASN 170 Ca 0.13 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.91 2r6t h ASN 170 Cb 0.08 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 2r6t h ASN 170 CO -0.12 0.55 0.05 0.22 -1.65 0.00 0.00 177.43 176.48 2r6t h TYR 171 N 0.97 0.08 -0.00 1.19 3.20 -0.31 0.29 116.97 122.39 2r6t h TYR 171 Ca 0.35 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.23 2r6t h TYR 171 Cb 0.11 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.37 2r6t h TYR 171 CO -0.03 0.03 0.08 -0.07 -1.64 0.00 0.00 178.16 176.53 2r6t h LEU 172 N 0.12 0.00 -3.13 2.82 3.38 -0.43 -1.82 115.31 116.25 2r6t h LEU 172 Ca 0.08 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 2r6t h LEU 172 Cb 0.06 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 2r6t h LEU 172 CO -0.10 0.00 -0.56 -0.62 0.09 0.00 0.00 178.44 177.25 2r6t n GLU 173 N -3.07 1.92 -3.84 1.13 1.02 -1.13 -4.88 120.64 111.80 2r6t n GLU 173 Ca -0.03 -3.45 -0.24 0.00 -0.02 0.00 0.00 57.16 53.42 2r6t n GLU 173 Cb 0.15 -1.72 0.01 0.00 -0.02 0.00 0.00 31.44 29.86 2r6t n GLU 173 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2r6t n GLN 174 N -1.03 -4.37 -4.29 3.49 3.00 -0.68 -4.97 117.38 108.52 2r6t n GLN 174 Ca 0.23 0.53 -0.30 0.00 -0.01 0.00 0.00 57.00 57.46 2r6t n GLN 174 Cb 0.74 -5.00 -0.17 0.00 0.00 0.00 0.00 30.24 25.82 2r6t n GLN 174 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.06 175.92 2r6t s GLN 175 N -6.30 2.39 0.37 -1.09 2.00 0.08 -5.04 119.66 112.08 2r6t s GLN 175 Ca 0.12 -0.61 -0.26 0.00 -2.00 0.00 0.00 55.36 52.61 2r6t s GLN 175 Cb -0.06 -2.08 -0.09 0.00 0.80 0.00 0.00 33.01 31.58 2r6t s GLN 175 CO 0.85 -0.13 1.20 -2.14 -0.50 0.00 0.00 175.29 174.56 2r6t s PRO 176 N 1.18 4.18 0.52 1.67 0.02 -1.26 -4.08 135.00 137.23 2r6t s PRO 176 Ca -0.01 1.93 -0.23 0.00 0.02 0.00 0.00 61.00 62.71 2r6t s PRO 176 Cb -0.14 -2.82 -0.06 0.00 0.02 0.00 0.00 34.50 31.50 2r6t s PRO 176 CO -0.06 -0.24 1.34 -0.51 -0.33 0.00 0.00 177.00 177.21 2r6t s ASP 177 N -0.95 5.51 -0.11 2.53 1.01 -1.26 -4.88 116.67 118.51 2r6t s ASP 177 Ca 0.54 2.73 -0.30 0.00 0.71 0.00 0.00 52.55 56.23 2r6t s ASP 177 Cb -0.33 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 40.94 2r6t s ASP 177 CO 0.42 -1.41 1.27 0.00 0.21 0.00 0.00 175.17 175.66 2r6t s MET 178 N -2.79 4.28 -0.08 8.23 0.00 -1.25 -4.97 119.30 122.72 2r6t s MET 178 Ca 0.68 1.71 -0.00 0.00 0.00 0.00 0.00 55.69 58.09 2r6t s MET 178 Cb -0.39 -3.69 -0.03 0.00 0.00 0.00 0.00 34.83 30.72 2r6t s MET 178 CO 0.47 -0.61 -0.06 -0.51 0.00 0.00 0.00 175.02 174.32 2r6t s LEU 179 N 2.98 3.24 -0.03 0.18 1.43 -1.26 0.14 118.68 125.36 2r6t s LEU 179 Ca 0.57 -0.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.36 2r6t s LEU 179 Cb -0.24 -1.72 -0.08 0.00 0.03 0.00 0.00 46.19 44.19 2r6t s LEU 179 CO 0.19 0.35 1.98 -0.47 0.23 0.00 0.00 176.35 178.62 2r6t s TYR 180 N -0.71 1.34 -2.00 0.29 5.04 0.39 -4.80 117.35 116.90 2r6t s TYR 180 Ca 0.11 -0.19 0.21 0.00 -2.44 0.00 0.00 57.07 54.75 2r6t s TYR 180 Cb -0.11 -4.15 1.24 0.00 0.35 0.00 0.00 41.96 39.28 2r6t s TYR 180 CO 0.02 -5.08 1.62 2.89 -1.34 0.00 0.00 175.55 173.66