#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qct s ARG 4 N 0.00 0.69 -0.59 -1.09 1.70 -1.26 -5.10 118.95 113.30 2qct s ARG 4 Ca 0.00 -0.47 -0.26 0.00 -0.47 0.00 0.00 55.73 54.53 2qct s ARG 4 Cb 0.00 0.02 -0.04 0.00 -0.57 0.00 0.00 34.95 34.36 2qct s ARG 4 CO 0.00 -0.92 2.09 -2.00 -1.08 0.00 0.00 175.30 173.39 2qct s GLU 5 N 1.43 2.39 -0.16 3.89 2.12 -1.26 -4.63 118.70 122.47 2qct s GLU 5 Ca 0.21 0.86 0.18 0.00 0.36 0.00 0.00 54.97 56.58 2qct s GLU 5 Cb 0.01 -4.51 0.44 0.00 0.26 0.00 0.00 34.13 30.33 2qct s GLU 5 CO -0.08 -3.03 1.32 1.51 -0.54 0.00 0.00 175.26 174.43 2qct n ILE 6 N 7.59 2.14 -2.76 -3.70 3.06 -1.26 -4.06 119.36 120.38 2qct n ILE 6 Ca 0.28 -2.03 -0.01 0.00 -2.50 0.00 0.00 62.75 58.49 2qct n ILE 6 Cb 0.53 -0.25 0.08 0.00 0.54 0.00 0.00 39.64 40.53 2qct n ILE 6 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2qct n LEU 7 N -0.86 0.47 -0.79 9.51 4.77 -1.26 -5.06 117.00 123.77 2qct n LEU 7 Ca 0.19 -3.05 0.00 0.00 -0.03 0.00 0.00 56.01 53.13 2qct n LEU 7 Cb 0.80 0.33 0.00 0.00 -2.33 0.00 0.00 43.42 42.22 2qct n LEU 7 CO 0.10 1.26 0.17 0.00 -1.33 0.00 0.00 177.39 177.60 2qct n GLN 8 N -0.89 0.00 -2.56 3.23 6.02 -1.26 -4.76 117.38 117.16 2qct n GLN 8 Ca -0.02 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.56 2qct n GLN 8 Cb 0.83 -0.20 -0.03 0.00 1.02 0.00 0.00 30.24 31.87 2qct n GLN 8 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2qct s LYS 9 N 0.90 3.48 0.00 -1.09 2.36 -1.26 -4.41 119.74 119.71 2qct s LYS 9 Ca 0.00 -0.88 0.00 0.00 -2.55 0.00 0.00 55.97 52.54 2qct s LYS 9 Cb 0.00 -5.03 0.00 0.00 -1.05 0.00 0.00 37.83 31.75 2qct s LYS 9 CO 0.00 -2.19 0.00 0.34 1.55 0.00 0.00 175.35 175.05 2qct n PHE 10 N 9.00 0.00 -1.95 4.03 -0.00 -1.26 -5.00 117.46 122.28 2qct n PHE 10 Ca 0.25 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.27 2qct n PHE 10 Cb 0.50 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 39.96 2qct n PHE 10 CO 0.00 0.00 0.00 -0.48 -0.00 0.00 0.00 176.76 176.28 2qct s LEU 11 N -2.11 4.36 0.00 -2.13 0.05 -1.26 -5.11 118.68 112.48 2qct s LEU 11 Ca 0.00 2.42 0.00 0.00 0.05 0.00 0.00 54.13 56.60 2qct s LEU 11 Cb 0.00 -3.55 0.00 0.00 -2.05 0.00 0.00 46.19 40.59 2qct s LEU 11 CO 0.00 -0.90 0.00 0.47 -0.55 0.00 0.00 176.35 175.37 2qct n ASP 12 N 6.07 0.00 0.00 1.48 8.00 -1.26 -5.24 116.55 125.61 2qct n ASP 12 Ca 0.16 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.66 2qct n ASP 12 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.51 2qct n ASP 12 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2qct n GLU 23 N -0.07 0.00 0.07 -1.24 2.13 -1.26 -5.32 120.64 114.94 2qct n GLU 23 Ca 0.00 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.78 2qct n GLU 23 Cb 0.00 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 31.63 2qct n GLU 23 CO 0.00 0.00 0.00 0.74 -0.41 0.00 0.00 177.13 177.46 2qct h PHE 24 N 0.00 0.00 0.00 4.31 0.05 -2.01 -3.10 116.94 116.19 2qct h PHE 24 Ca 0.00 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.78 2qct h PHE 24 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 37.95 2qct h PHE 24 CO 0.00 0.80 -0.04 0.00 -0.18 0.00 0.00 178.31 178.88 2qct h ALA 25 N 1.20 1.75 -0.02 2.45 0.00 -1.99 -2.17 119.26 120.49 2qct h ALA 25 Ca -0.07 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.59 2qct h ALA 25 Cb 1.67 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.47 2qct h ALA 25 CO 0.09 0.06 -0.79 -0.91 0.00 0.00 0.00 179.25 177.69 2qct h ASN 26 N 0.00 0.74 -0.34 0.00 -0.26 -1.97 0.11 115.58 113.85 2qct h ASN 26 Ca -0.00 -0.73 -0.04 0.00 -0.56 0.00 0.00 56.30 54.97 2qct h ASN 26 Cb 0.09 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.11 2qct h ASN 26 CO 0.01 1.37 0.07 -0.33 -1.06 0.00 0.00 177.43 177.48 2qct h GLU 27 N 0.18 0.55 -0.15 0.81 4.39 -1.58 -2.94 114.58 115.84 2qct h GLU 27 Ca -0.09 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 2qct h GLU 27 Cb 1.47 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 30.04 2qct h GLU 27 CO 0.16 0.61 0.08 0.35 -1.16 0.00 0.00 179.01 179.05 2qct h PHE 28 N 0.39 0.20 -0.35 4.33 3.57 -1.41 -1.85 116.94 121.82 2qct h PHE 28 Ca 0.10 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.70 2qct h PHE 28 Cb 0.32 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2qct h PHE 28 CO 0.02 0.20 0.36 1.25 -2.23 0.00 0.00 178.31 177.91 2qct h LEU 29 N 0.15 0.00 -0.92 0.59 7.12 -0.74 1.21 115.31 122.72 2qct h LEU 29 Ca 0.05 0.00 -0.11 0.00 0.13 0.00 0.00 57.88 57.96 2qct h LEU 29 Cb 0.06 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.18 2qct h LEU 29 CO -0.01 0.00 -0.51 0.11 -0.13 0.00 0.00 178.44 177.90 2qct h LYS 30 N 0.00 0.00 0.04 1.25 1.57 -1.16 0.21 116.57 118.49 2qct h LYS 30 Ca 0.17 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.71 2qct h LYS 30 Cb 0.89 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.18 2qct h LYS 30 CO -0.00 0.51 -1.12 -0.07 -0.57 0.00 0.00 179.45 178.20 2qct h LEU 31 N 0.00 0.15 -0.31 2.94 3.38 0.15 -3.11 115.31 118.51 2qct h LEU 31 Ca -0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2qct h LEU 31 Cb 0.95 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2qct h LEU 31 CO 0.07 1.13 0.18 0.11 0.09 0.00 0.00 178.44 180.01 2qct h LYS 32 N 0.03 0.42 0.00 1.13 1.79 -0.23 -3.30 116.57 116.40 2qct h LYS 32 Ca -0.07 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 2qct h LYS 32 Cb 1.85 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 32.41 2qct h LYS 32 CO 0.15 0.33 0.00 0.54 -1.08 0.00 0.00 179.45 179.40 2qct n ARG 33 N -4.83 -0.26 0.00 3.15 1.74 0.01 -3.56 116.66 112.91 2qct n ARG 33 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 2qct n ARG 33 Cb 0.06 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.50 2qct n ARG 33 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2qct n GLN 34 N -0.90 0.00 0.00 5.56 1.13 -1.25 -3.76 117.38 118.16 2qct n GLN 34 Ca 0.00 0.00 0.04 0.00 -1.94 0.00 0.00 57.00 55.10 2qct n GLN 34 Cb 0.00 0.00 0.21 0.00 0.11 0.00 0.00 30.24 30.56 2qct n GLN 34 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2qct n SER 35 N 1.97 0.00 -0.11 1.08 7.64 -1.24 0.14 113.62 123.10 2qct n SER 35 Ca 0.00 -0.53 -0.16 0.00 1.01 0.00 0.00 58.87 59.20 2qct n SER 35 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 2qct n SER 35 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2qct n THR 36 N -0.80 1.25 0.09 0.44 -1.04 -1.23 -4.13 114.28 108.86 2qct n THR 36 Ca 0.05 -0.47 -0.04 0.00 -2.04 0.00 0.00 64.05 61.55 2qct n THR 36 Cb 0.02 -1.30 0.13 0.00 -1.82 0.00 0.00 70.33 67.37 2qct n THR 36 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2qct h LYS 37 N -0.04 0.20 -1.00 -2.82 3.11 -1.25 -2.37 116.57 112.40 2qct h LYS 37 Ca -0.49 -0.13 0.04 0.00 -2.81 0.00 0.00 60.65 57.26 2qct h LYS 37 Cb 1.74 0.02 -0.06 0.00 -1.00 0.00 0.00 32.23 32.93 2qct h LYS 37 CO -0.09 0.74 0.65 1.88 -2.81 0.00 0.00 179.45 179.83 2qct h TYR 38 N 0.14 1.22 0.04 1.91 0.99 0.98 -2.25 116.97 120.00 2qct h TYR 38 Ca -0.01 0.03 -0.09 0.00 2.00 0.00 0.00 58.73 60.66 2qct h TYR 38 Cb 1.10 -0.41 0.01 0.00 1.00 0.00 0.00 36.73 38.44 2qct h TYR 38 CO 0.02 0.69 -0.39 0.87 -0.00 0.00 0.00 178.16 179.35 2qct h LYS 39 N 1.24 0.19 -0.15 4.88 1.57 -1.66 0.25 116.57 122.89 2qct h LYS 39 Ca 0.41 -0.26 0.04 0.00 -1.87 0.00 0.00 60.65 58.97 2qct h LYS 39 Cb 0.04 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2qct h LYS 39 CO -0.14 1.05 0.23 0.00 -0.57 0.00 0.00 179.45 180.02 2qct h ALA 40 N 0.16 1.65 -0.03 3.86 0.00 -1.33 0.47 119.26 124.04 2qct h ALA 40 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2qct h ALA 40 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2qct h ALA 40 CO 0.07 -0.31 -0.16 -0.25 0.00 0.00 0.00 179.25 178.61 2qct n ASP 41 N -3.52 2.67 -3.70 0.00 9.92 -0.86 -4.97 116.55 116.08 2qct n ASP 41 Ca 0.01 -1.83 -0.28 0.00 -0.53 0.00 0.00 54.79 52.16 2qct n ASP 41 Cb 0.34 0.16 0.03 0.00 -0.64 0.00 0.00 41.12 41.01 2qct n ASP 41 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 2qct n LYS 42 N 0.89 -2.21 -0.06 -1.24 0.00 0.16 -4.91 118.16 110.79 2qct n LYS 42 Ca 0.12 0.50 -0.18 0.00 -0.00 0.00 0.00 58.31 58.75 2qct n LYS 42 Cb 0.55 -4.47 -0.13 0.00 -0.00 0.00 0.00 35.03 30.99 2qct n LYS 42 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 2qct h THR 43 N -1.83 1.36 -3.39 0.58 2.02 -0.73 -3.42 112.91 107.50 2qct h THR 43 Ca -0.65 -2.31 -0.66 0.00 0.77 0.00 0.00 66.41 63.57 2qct h THR 43 Cb 1.36 2.88 -0.39 0.00 -1.74 0.00 0.00 68.15 70.25 2qct h THR 43 CO 0.52 0.52 -0.53 -0.31 0.37 0.00 0.00 175.52 176.09 2qct s TYR 44 N -2.32 3.31 0.29 3.16 1.51 -1.26 -5.08 117.35 116.96 2qct s TYR 44 Ca -0.22 -3.07 -0.30 0.00 -1.01 0.00 0.00 57.07 52.47 2qct s TYR 44 Cb 0.01 -2.93 -0.12 0.00 -0.11 0.00 0.00 41.96 38.82 2qct s TYR 44 CO 0.67 -0.75 1.58 -2.30 -1.11 0.00 0.00 175.55 173.65 2qct n PRO 45 N 3.04 2.64 -2.28 -1.71 -0.02 -1.26 -4.76 135.00 130.65 2qct n PRO 45 Ca 0.08 0.94 -0.22 0.00 -2.02 0.00 0.00 63.50 62.28 2qct n PRO 45 Cb 0.34 -2.71 0.02 0.00 -0.02 0.00 0.00 33.50 31.12 2qct n PRO 45 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2qct n THR 46 N 2.15 2.29 -0.12 3.45 -2.24 -1.26 -0.25 114.28 118.29 2qct n THR 46 Ca 0.09 -4.29 -0.11 0.00 -2.27 0.00 0.00 64.05 57.47 2qct n THR 46 Cb 0.36 -0.88 -0.02 0.00 -2.10 0.00 0.00 70.33 67.69 2qct n THR 46 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2qct h THR 47 N 2.65 1.27 0.00 4.28 1.35 -1.92 -2.97 112.91 117.57 2qct h THR 47 Ca 0.28 -1.07 -0.00 0.00 -0.55 0.00 0.00 66.41 65.06 2qct h THR 47 Cb 1.29 1.24 -0.00 0.00 -1.73 0.00 0.00 68.15 68.94 2qct h THR 47 CO 0.73 0.35 -0.01 0.58 -0.25 0.00 0.00 175.52 176.92 2qct h VAL 48 N 0.47 0.75 0.00 6.82 2.07 -1.91 -0.26 116.25 124.18 2qct h VAL 48 Ca 0.10 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2qct h VAL 48 Cb 0.53 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2qct h VAL 48 CO 0.03 0.01 -0.22 0.00 0.02 0.00 0.00 177.57 177.41 2qct h ALA 49 N 1.99 0.86 -0.01 1.67 0.00 -1.82 -3.22 119.26 118.72 2qct h ALA 49 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qct h ALA 49 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2qct h ALA 49 CO 0.00 0.00 -0.51 0.39 0.00 0.00 0.00 179.25 179.14 2qct n GLU 50 N -2.32 0.64 -1.64 0.00 1.02 -0.14 -4.56 120.64 113.64 2qct n GLU 50 Ca 0.05 -0.46 -0.45 0.00 -0.02 0.00 0.00 57.16 56.28 2qct n GLU 50 Cb 0.45 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.35 2qct n GLU 50 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2qct n LYS 51 N -0.78 1.74 -0.11 3.49 5.02 -1.04 -4.82 118.16 121.66 2qct n LYS 51 Ca 0.09 0.61 0.25 0.00 -2.02 0.00 0.00 58.31 57.24 2qct n LYS 51 Cb 0.38 -2.16 0.71 0.00 -0.02 0.00 0.00 35.03 33.93 2qct n LYS 51 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2qct h PRO 52 N 3.24 0.01 -0.82 1.97 0.13 -1.93 -0.80 132.00 133.80 2qct h PRO 52 Ca -0.44 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2qct h PRO 52 Cb 1.30 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2qct h PRO 52 CO 0.69 0.01 0.00 1.63 -0.23 0.00 0.00 178.00 180.09 2qct n LYS 53 N -4.32 1.88 0.00 0.86 4.01 -1.26 -3.56 118.16 115.77 2qct n LYS 53 Ca 0.15 -0.74 0.00 0.00 -0.51 0.00 0.00 58.31 57.21 2qct n LYS 53 Cb 0.82 -1.63 0.00 0.00 -0.51 0.00 0.00 35.03 33.71 2qct n LYS 53 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2qct n ASN 54 N 0.14 0.14 -0.14 4.39 3.02 -0.31 -4.83 115.26 117.66 2qct n ASN 54 Ca 0.07 -0.84 0.28 0.00 -0.03 0.00 0.00 54.58 54.05 2qct n ASN 54 Cb 0.44 0.03 0.72 0.00 -0.61 0.00 0.00 39.78 40.36 2qct n ASN 54 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2qct h ILE 55 N 0.69 0.45 -0.57 2.41 1.08 -1.60 0.31 117.51 120.28 2qct h ILE 55 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2qct h ILE 55 Cb 0.34 0.52 0.00 0.00 -3.07 0.00 0.00 36.82 34.61 2qct h ILE 55 CO 0.00 0.00 0.00 2.29 -0.69 0.00 0.00 178.15 179.75 2qct n LYS 56 N -4.06 4.03 0.00 2.37 2.85 -1.26 -3.92 118.16 118.17 2qct n LYS 56 Ca 0.17 -2.78 0.04 0.00 -1.05 0.00 0.00 58.31 54.69 2qct n LYS 56 Cb 0.96 -2.02 0.02 0.00 -0.65 0.00 0.00 35.03 33.34 2qct n LYS 56 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2qct n LYS 57 N 0.84 0.59 -4.35 -1.58 5.02 0.11 -4.85 118.16 113.93 2qct n LYS 57 Ca 0.25 -0.82 -0.34 0.00 -2.02 0.00 0.00 58.31 55.38 2qct n LYS 57 Cb 0.97 -1.10 -0.13 0.00 -0.02 0.00 0.00 35.03 34.75 2qct n LYS 57 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2qct s ASN 58 N -0.73 4.39 0.46 4.39 0.01 -1.23 -4.46 114.94 117.77 2qct s ASN 58 Ca 0.08 -0.28 0.25 0.00 -0.71 0.00 0.00 52.86 52.20 2qct s ASN 58 Cb 0.06 -1.72 0.97 0.00 0.41 0.00 0.00 41.25 40.97 2qct s ASN 58 CO 0.11 0.10 1.84 -0.09 -1.51 0.00 0.00 177.10 177.56 2qct h ARG 59 N 7.18 0.00 -3.59 -0.60 2.43 -1.91 -3.43 114.38 114.46 2qct h ARG 59 Ca -0.33 0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 58.62 2qct h ARG 59 Cb 1.19 0.00 -0.28 0.00 -0.42 0.00 0.00 29.97 30.46 2qct h ARG 59 CO 0.60 0.19 -0.66 0.71 -1.51 0.00 0.00 179.97 179.29 2qct s TYR 60 N -3.64 -0.06 0.28 2.20 1.51 -1.26 -5.06 117.35 111.32 2qct s TYR 60 Ca 0.01 0.15 0.13 0.00 -1.01 0.00 0.00 57.07 56.35 2qct s TYR 60 Cb 0.10 0.01 0.51 0.00 -0.11 0.00 0.00 41.96 42.46 2qct s TYR 60 CO 0.62 -0.03 1.69 1.57 -1.11 0.00 0.00 175.55 178.29 2qct h LYS 61 N 6.15 0.00 -0.71 -0.62 -0.00 -1.96 -3.17 116.57 116.27 2qct h LYS 61 Ca -0.26 0.00 -0.06 0.00 -0.00 0.00 0.00 60.65 60.33 2qct h LYS 61 Cb 1.20 0.00 -0.04 0.00 -0.00 0.00 0.00 32.23 33.39 2qct h LYS 61 CO 0.48 0.51 0.08 -0.40 -0.00 0.00 0.00 179.45 180.12 2qct n ASP 62 N -3.81 4.69 -3.60 7.07 5.68 -1.26 -4.56 116.55 120.76 2qct n ASP 62 Ca -0.01 -2.84 -0.28 0.00 -0.50 0.00 0.00 54.79 51.15 2qct n ASP 62 Cb 0.55 -0.67 -0.12 0.00 -1.14 0.00 0.00 41.12 39.74 2qct n ASP 62 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 2qct s ILE 63 N -2.48 1.04 -0.05 2.12 -1.09 -1.20 -5.10 121.20 114.45 2qct s ILE 63 Ca 0.45 -2.64 0.04 0.00 -2.23 0.00 0.00 60.65 56.27 2qct s ILE 63 Cb 0.35 -1.72 -0.02 0.00 -1.58 0.00 0.00 42.46 39.48 2qct s ILE 63 CO 0.12 -1.03 -0.16 -0.76 -1.23 0.00 0.00 174.94 171.88 2qct s LEU 64 N 0.18 2.61 0.46 2.97 1.43 -1.26 -4.73 118.68 120.34 2qct s LEU 64 Ca 0.23 -0.25 -0.24 0.00 -1.03 0.00 0.00 54.13 52.84 2qct s LEU 64 Cb -0.13 -1.52 -0.07 0.00 0.03 0.00 0.00 46.19 44.49 2qct s LEU 64 CO -0.08 0.34 1.36 -2.16 0.23 0.00 0.00 176.35 176.04 2qct s PRO 65 N -0.70 3.64 0.47 1.29 0.04 -1.26 -4.66 135.00 133.83 2qct s PRO 65 Ca 0.11 2.25 -0.23 0.00 0.04 0.00 0.00 61.00 63.17 2qct s PRO 65 Cb -0.11 -2.57 -0.07 0.00 0.04 0.00 0.00 34.50 31.79 2qct s PRO 65 CO 0.00 -0.79 1.18 0.71 0.04 0.00 0.00 177.00 178.14 2qct s TYR 66 N -1.27 2.81 0.00 0.56 4.12 -1.26 -4.47 117.35 117.85 2qct s TYR 66 Ca 0.63 1.52 -0.17 0.00 0.02 0.00 0.00 57.07 59.06 2qct s TYR 66 Cb -0.40 -3.41 -0.10 0.00 -1.52 0.00 0.00 41.96 36.53 2qct s TYR 66 CO 0.50 -1.64 0.93 -0.44 0.02 0.00 0.00 175.55 174.93 2qct h ASP 67 N 1.93 -0.53 -1.30 2.29 3.45 -0.92 -0.23 116.42 121.12 2qct h ASP 67 Ca -0.50 0.02 0.44 0.00 0.43 0.00 0.00 57.03 57.42 2qct h ASP 67 Cb 1.25 0.14 -0.13 0.00 -0.56 0.00 0.00 39.33 40.03 2qct h ASP 67 CO 0.60 -0.27 0.83 0.10 -1.57 0.00 0.00 179.24 178.93 2qct h TYR 68 N -0.86 0.55 0.00 4.55 -0.00 -1.93 0.76 116.97 120.04 2qct h TYR 68 Ca -0.06 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.69 2qct h TYR 68 Cb 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 36.73 37.08 2qct h TYR 68 CO 0.05 -0.23 -1.68 0.45 -0.00 0.00 0.00 178.16 176.75 2qct n SER 69 N -4.74 0.29 -4.47 0.10 2.88 -1.23 -5.02 113.62 101.43 2qct n SER 69 Ca 0.37 -0.22 -0.43 0.00 -1.33 0.00 0.00 58.87 57.27 2qct n SER 69 Cb 1.43 1.64 0.00 0.00 -0.75 0.00 0.00 64.21 66.53 2qct n SER 69 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 2qct n ARG 70 N -2.09 0.63 -3.05 -1.46 1.85 0.26 -2.32 116.66 110.48 2qct n ARG 70 Ca -0.02 0.23 -0.40 0.00 -1.00 0.00 0.00 57.85 56.66 2qct n ARG 70 Cb 0.51 -1.50 -0.05 0.00 -1.05 0.00 0.00 32.46 30.36 2qct n ARG 70 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2qct s VAL 71 N -1.37 5.00 -0.26 8.89 1.01 -0.67 -4.80 120.40 128.20 2qct s VAL 71 Ca 0.63 1.38 -0.09 0.00 0.00 0.00 0.00 61.98 63.89 2qct s VAL 71 Cb -0.65 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 2qct s VAL 71 CO 0.58 0.15 0.12 -1.83 0.00 0.00 0.00 175.10 174.12 2qct s GLU 72 N 1.52 3.75 0.09 2.72 -1.05 -1.26 -4.43 118.70 120.03 2qct s GLU 72 Ca 0.34 -0.43 -0.28 0.00 -0.15 0.00 0.00 54.97 54.46 2qct s GLU 72 Cb -0.17 -3.45 -0.06 0.00 -0.44 0.00 0.00 34.13 30.01 2qct s GLU 72 CO 0.14 -0.19 0.87 -0.51 0.95 0.00 0.00 175.26 176.51 2qct s LEU 73 N 1.67 4.49 -0.06 1.83 1.43 -1.16 -4.91 118.68 121.96 2qct s LEU 73 Ca 0.07 1.64 0.04 0.00 -1.03 0.00 0.00 54.13 54.85 2qct s LEU 73 Cb -0.15 -3.42 -0.06 0.00 0.03 0.00 0.00 46.19 42.58 2qct s LEU 73 CO 0.06 -0.01 -0.00 -1.20 0.23 0.00 0.00 176.35 175.43 2qct n SER 74 N 2.71 3.56 -4.58 2.29 7.64 -1.26 -4.33 113.62 119.64 2qct n SER 74 Ca -0.00 -0.01 -0.42 0.00 1.01 0.00 0.00 58.87 59.45 2qct n SER 74 Cb 0.50 0.46 -0.03 0.00 -1.01 0.00 0.00 64.21 64.12 2qct n SER 74 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2qct n LEU 75 N -2.33 3.02 -4.57 -3.43 7.94 -1.26 -4.94 117.00 111.43 2qct n LEU 75 Ca -0.10 0.08 -0.34 0.00 -1.11 0.00 0.00 56.01 54.54 2qct n LEU 75 Cb 0.67 -1.55 -0.11 0.00 0.53 0.00 0.00 43.42 42.97 2qct n LEU 75 CO 0.11 -0.85 -0.33 -0.63 -1.11 0.00 0.00 177.39 174.58 2qct s ILE 76 N 8.99 4.12 -0.06 1.96 1.01 -1.26 -4.98 121.20 130.98 2qct s ILE 76 Ca 1.01 -0.29 0.08 0.00 0.00 0.00 0.00 60.65 61.45 2qct s ILE 76 Cb -0.34 -2.78 0.12 0.00 0.01 0.00 0.00 42.46 39.47 2qct s ILE 76 CO 0.34 0.52 1.04 0.35 0.00 0.00 0.00 174.94 177.20 2qct n THR 77 N 3.08 1.29 -3.61 2.92 -2.24 -1.26 -5.07 114.28 109.39 2qct n THR 77 Ca -0.18 -1.45 0.00 0.00 -2.27 0.00 0.00 64.05 60.16 2qct n THR 77 Cb 0.53 0.21 -0.01 0.00 -2.10 0.00 0.00 70.33 68.96 2qct n THR 77 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2qct s SER 78 N -1.75 -0.06 0.00 3.42 0.15 -1.26 -4.99 113.70 109.21 2qct s SER 78 Ca 0.14 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.71 2qct s SER 78 Cb 0.12 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.55 2qct s SER 78 CO 0.01 -0.22 0.64 0.47 1.20 0.00 0.00 173.24 175.34 2qct n ASP 79 N -0.37 0.71 0.00 5.45 8.00 -1.26 -3.22 116.55 125.85 2qct n ASP 79 Ca -0.06 -1.99 0.00 0.00 0.71 0.00 0.00 54.79 53.46 2qct n ASP 79 Cb 0.62 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.36 2qct n ASP 79 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2qct n GLU 80 N -0.14 3.76 -1.73 -1.24 0.28 -1.26 -5.05 120.64 115.26 2qct n GLU 80 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.58 2qct n GLU 80 Cb 0.18 -0.68 -0.03 0.00 1.43 0.00 0.00 31.44 32.34 2qct n GLU 80 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2qct s ASP 81 N -0.75 6.43 0.42 -1.84 1.11 -1.20 -4.99 116.67 115.85 2qct s ASP 81 Ca 0.00 2.77 0.06 0.00 0.18 0.00 0.00 52.55 55.56 2qct s ASP 81 Cb 0.00 -2.57 0.06 0.00 1.07 0.00 0.00 42.92 41.48 2qct s ASP 81 CO 0.00 -0.99 0.53 -1.54 1.18 0.00 0.00 175.17 174.36 2qct n SER 82 N 5.23 1.68 -1.64 0.27 3.41 -1.26 -4.94 113.62 116.37 2qct n SER 82 Ca 0.17 -2.18 -0.03 0.00 -0.26 0.00 0.00 58.87 56.58 2qct n SER 82 Cb 0.38 -0.26 0.24 0.00 -0.26 0.00 0.00 64.21 64.30 2qct n SER 82 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2qct n SER 83 N -2.39 4.13 -4.48 4.04 3.41 -1.26 -4.79 113.62 112.27 2qct n SER 83 Ca 0.09 -2.84 -0.33 0.00 -0.26 0.00 0.00 58.87 55.53 2qct n SER 83 Cb 0.44 -0.67 -0.13 0.00 -0.26 0.00 0.00 64.21 63.59 2qct n SER 83 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2qct s TYR 84 N -2.31 2.79 -0.23 7.33 5.04 -1.26 -2.99 117.35 125.70 2qct s TYR 84 Ca 0.40 -0.22 -0.26 0.00 -2.44 0.00 0.00 57.07 54.55 2qct s TYR 84 Cb 0.32 -1.70 0.07 0.00 0.35 0.00 0.00 41.96 41.00 2qct s TYR 84 CO 0.10 0.13 0.74 -1.50 -1.34 0.00 0.00 175.55 173.69 2qct s ILE 85 N -0.49 0.00 -0.53 3.14 2.07 -1.26 -4.98 121.20 119.15 2qct s ILE 85 Ca 0.07 0.00 -0.27 0.00 -1.41 0.00 0.00 60.65 59.03 2qct s ILE 85 Cb -0.12 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.46 2qct s ILE 85 CO 0.02 0.00 1.75 0.21 -1.91 0.00 0.00 174.94 175.01 2qct s ASN 86 N 0.10 5.61 -0.23 4.50 3.84 -1.26 -4.63 114.94 122.87 2qct s ASN 86 Ca -0.02 0.58 -0.27 0.00 0.21 0.00 0.00 52.86 53.36 2qct s ASN 86 Cb -0.04 -2.53 0.13 0.00 -0.55 0.00 0.00 41.25 38.25 2qct s ASN 86 CO 0.02 -2.06 1.04 0.00 -2.79 0.00 0.00 177.10 173.31 2qct s ALA 87 N 7.87 -1.97 0.04 1.71 0.00 -1.26 -3.86 121.76 124.29 2qct s ALA 87 Ca 0.67 1.75 0.01 0.00 0.00 0.00 0.00 51.96 54.40 2qct s ALA 87 Cb -0.15 -1.16 -0.02 0.00 0.00 0.00 0.00 23.12 21.78 2qct s ALA 87 CO 0.25 -0.26 -0.06 -0.80 0.00 0.00 0.00 175.76 174.89 2qct s ASN 88 N -0.33 0.68 -0.13 0.00 0.01 -0.69 -1.66 114.94 112.82 2qct s ASN 88 Ca 0.01 -0.56 -0.16 0.00 -0.71 0.00 0.00 52.86 51.44 2qct s ASN 88 Cb -0.03 0.06 -0.04 0.00 0.41 0.00 0.00 41.25 41.65 2qct s ASN 88 CO -0.04 -0.25 0.40 -0.36 -1.51 0.00 0.00 177.10 175.35 2qct s PHE 89 N -1.55 3.50 -0.11 2.20 0.40 -0.98 -1.22 117.98 120.22 2qct s PHE 89 Ca -0.11 0.78 0.01 0.00 -0.60 0.00 0.00 56.93 57.01 2qct s PHE 89 Cb -0.09 -2.46 -0.02 0.00 0.51 0.00 0.00 43.02 40.96 2qct s PHE 89 CO -0.00 0.20 -0.13 0.42 0.70 0.00 0.00 175.22 176.41 2qct s ILE 90 N 0.53 3.12 0.48 0.64 -1.09 0.12 -4.86 121.20 120.14 2qct s ILE 90 Ca 0.22 -0.65 -0.20 0.00 -2.23 0.00 0.00 60.65 57.79 2qct s ILE 90 Cb -0.14 -2.29 -0.09 0.00 -1.58 0.00 0.00 42.46 38.35 2qct s ILE 90 CO 0.08 0.54 1.00 -0.54 -1.23 0.00 0.00 174.94 174.79 2qct s LYS 91 N 0.06 3.93 0.00 2.79 1.02 -1.26 0.29 119.74 126.57 2qct s LYS 91 Ca -0.05 1.22 0.00 0.00 0.02 0.00 0.00 55.97 57.17 2qct s LYS 91 Cb -0.14 -2.12 0.00 0.00 -0.52 0.00 0.00 37.83 35.04 2qct s LYS 91 CO 0.04 -0.30 0.00 0.41 -0.92 0.00 0.00 175.35 174.58 2qct n GLY 92 N -0.57 1.69 0.14 -3.33 0.00 0.54 -4.74 105.19 98.92 2qct n GLY 92 Ca 0.08 -1.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.20 2qct n GLY 92 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2qct h VAL 93 N 0.00 1.43 0.00 1.61 2.07 -1.97 -3.36 116.25 116.02 2qct h VAL 93 Ca 0.00 -2.57 -0.08 0.00 0.82 0.00 0.00 66.70 64.86 2qct h VAL 93 Cb 0.00 2.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 2qct h VAL 93 CO 0.00 0.76 -2.03 -1.22 0.02 0.00 0.00 177.57 175.10 2qct n TYR 94 N -3.70 0.00 -3.70 1.57 0.53 -1.26 -5.10 117.16 105.50 2qct n TYR 94 Ca -0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.81 2qct n TYR 94 Cb 0.87 -0.59 0.00 0.00 -1.03 0.00 0.00 39.34 38.59 2qct n TYR 94 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2qct n GLY 95 N 1.45 0.53 3.95 2.72 0.00 -1.26 -5.18 105.19 107.40 2qct n GLY 95 Ca -0.10 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 2qct n GLY 95 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2qct s PRO 96 N -1.19 0.65 -1.90 1.61 0.04 -1.26 0.20 135.00 133.16 2qct s PRO 96 Ca 0.00 -0.67 0.00 0.00 0.04 0.00 0.00 61.00 60.37 2qct s PRO 96 Cb 0.00 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.60 2qct s PRO 96 CO 0.00 -2.34 0.00 1.63 0.04 0.00 0.00 177.00 176.33 2qct n LYS 97 N -3.63 -1.62 0.00 4.56 4.01 -1.25 -4.69 118.16 115.54 2qct n LYS 97 Ca 0.17 1.07 -0.21 0.00 -0.51 0.00 0.00 58.31 58.82 2qct n LYS 97 Cb 0.59 -5.62 -0.14 0.00 -0.51 0.00 0.00 35.03 29.35 2qct n LYS 97 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2qct h ALA 98 N 0.65 0.13 -3.60 7.82 0.00 -1.61 -3.30 119.26 119.35 2qct h ALA 98 Ca -0.46 -1.00 -0.67 0.00 0.00 0.00 0.00 54.91 52.79 2qct h ALA 98 Cb 1.35 0.41 -0.21 0.00 0.00 0.00 0.00 17.79 19.34 2qct h ALA 98 CO 0.59 0.70 -0.85 0.71 0.00 0.00 0.00 179.25 180.39 2qct s TYR 99 N -2.45 2.27 -0.31 0.00 4.12 0.14 -2.44 117.35 118.68 2qct s TYR 99 Ca -0.19 -0.38 0.00 0.00 0.02 0.00 0.00 57.07 56.52 2qct s TYR 99 Cb 0.03 -1.19 0.10 0.00 -1.52 0.00 0.00 41.96 39.39 2qct s TYR 99 CO 0.76 0.39 0.08 0.96 0.02 0.00 0.00 175.55 177.77 2qct s ILE 100 N -1.32 1.13 -0.16 2.71 -4.36 -1.01 0.12 121.20 118.30 2qct s ILE 100 Ca 0.16 -1.54 -0.23 0.00 -0.26 0.00 0.00 60.65 58.79 2qct s ILE 100 Cb -0.09 -1.83 -0.02 0.00 1.25 0.00 0.00 42.46 41.76 2qct s ILE 100 CO 0.07 -0.64 0.70 0.00 0.24 0.00 0.00 174.94 175.32 2qct s ALA 101 N 1.49 3.49 0.08 2.27 0.00 -0.36 -0.95 121.76 127.78 2qct s ALA 101 Ca 0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.96 2qct s ALA 101 Cb -0.18 -3.04 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 2qct s ALA 101 CO -0.21 -0.47 0.00 0.99 0.00 0.00 0.00 175.76 176.07 2qct s THR 102 N 1.70 0.18 0.59 0.00 2.01 -0.36 -1.70 115.64 118.06 2qct s THR 102 Ca 0.34 -1.84 -0.08 0.00 0.31 0.00 0.00 61.69 60.42 2qct s THR 102 Cb -0.16 -1.69 -0.01 0.00 0.01 0.00 0.00 72.50 70.64 2qct s THR 102 CO 0.13 -0.82 0.93 0.00 -0.69 0.00 0.00 174.62 174.17 2qct s GLN 103 N -3.96 3.21 0.31 4.92 -2.07 -1.25 -3.46 119.66 117.35 2qct s GLN 103 Ca 0.13 0.28 -0.29 0.00 -1.82 0.00 0.00 55.36 53.66 2qct s GLN 103 Cb 0.08 -2.22 -0.11 0.00 -1.09 0.00 0.00 33.01 29.68 2qct s GLN 103 CO -0.06 -0.60 1.46 0.20 -1.32 0.00 0.00 175.29 174.97 2qct s GLY 104 N -4.24 2.56 0.74 2.60 0.00 0.48 -4.84 107.32 104.62 2qct s GLY 104 Ca 0.53 1.43 -0.12 0.00 0.00 0.00 0.00 44.72 46.56 2qct s GLY 104 CO 0.48 2.27 1.11 2.56 0.00 0.00 0.00 173.10 179.51 2qct s PRO 105 N -1.11 2.36 0.43 2.90 0.04 -1.26 -4.82 135.00 133.55 2qct s PRO 105 Ca 0.57 1.30 0.08 0.00 0.04 0.00 0.00 61.00 62.99 2qct s PRO 105 Cb -0.44 -1.90 0.01 0.00 0.04 0.00 0.00 34.50 32.21 2qct s PRO 105 CO 0.51 -1.58 0.56 -0.51 0.04 0.00 0.00 177.00 176.02 2qct s LEU 106 N -5.55 3.57 0.51 -3.56 1.43 -1.26 -2.29 118.68 111.53 2qct s LEU 106 Ca 0.64 -0.51 0.23 0.00 -1.03 0.00 0.00 54.13 53.46 2qct s LEU 106 Cb -0.19 -2.47 1.33 0.00 0.03 0.00 0.00 46.19 44.88 2qct s LEU 106 CO 0.50 -0.79 2.01 0.77 0.23 0.00 0.00 176.35 179.07 2qct h SER 107 N 0.67 0.06 -0.55 2.29 4.64 -1.96 -0.34 113.55 118.35 2qct h SER 107 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 2qct h SER 107 Cb 1.28 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2qct h SER 107 CO 0.47 0.03 0.00 0.35 -0.87 0.00 0.00 176.83 176.81 2qct n THR 108 N -4.41 0.85 -0.77 2.95 -2.24 -1.26 -4.14 114.28 105.26 2qct n THR 108 Ca 0.09 -0.77 0.01 0.00 -2.27 0.00 0.00 64.05 61.10 2qct n THR 108 Cb 0.53 0.32 0.01 0.00 -2.10 0.00 0.00 70.33 69.09 2qct n THR 108 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2qct n THR 109 N 1.09 0.49 0.27 4.28 -2.24 -0.15 -4.79 114.28 113.23 2qct n THR 109 Ca 0.19 -0.52 -0.16 0.00 -2.27 0.00 0.00 64.05 61.30 2qct n THR 109 Cb 0.51 0.68 -0.08 0.00 -2.10 0.00 0.00 70.33 69.34 2qct n THR 109 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2qct h LEU 110 N 0.00 -0.58 -1.11 3.22 3.38 -1.67 0.74 115.31 119.30 2qct h LEU 110 Ca 0.00 -0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.01 2qct h LEU 110 Cb 0.87 0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 2qct h LEU 110 CO 0.00 -0.32 0.61 0.25 0.09 0.00 0.00 178.44 179.07 2qct h LEU 111 N -0.81 0.93 -0.58 1.67 5.85 -1.88 0.37 115.31 120.85 2qct h LEU 111 Ca -0.07 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.57 2qct h LEU 111 Cb 0.58 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 2qct h LEU 111 CO 0.11 0.58 0.02 0.44 -0.34 0.00 0.00 178.44 179.26 2qct h ASP 112 N 1.05 0.99 0.48 1.25 3.32 -1.79 -0.88 116.42 120.84 2qct h ASP 112 Ca 0.41 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 2qct h ASP 112 Cb 0.24 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 2qct h ASP 112 CO -0.17 1.05 -0.38 0.15 -1.72 0.00 0.00 179.24 178.17 2qct h PHE 113 N 0.91 -1.03 -0.33 4.55 3.57 0.36 -2.17 116.94 122.80 2qct h PHE 113 Ca 0.17 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 2qct h PHE 113 Cb 0.53 0.39 -0.02 0.00 2.79 0.00 0.00 35.95 39.63 2qct h PHE 113 CO 0.04 -0.55 0.12 -1.49 -2.23 0.00 0.00 178.31 174.20 2qct h TRP 114 N -0.85 0.46 0.33 0.41 -0.00 -0.28 -2.34 115.95 113.69 2qct h TRP 114 Ca -0.05 -0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 58.82 2qct h TRP 114 Cb 0.73 -0.15 -0.01 0.00 -0.00 0.00 0.00 29.16 29.74 2qct h TRP 114 CO -0.17 0.38 -0.21 0.00 -0.00 0.00 0.00 178.44 178.44 2qct h ARG 115 N 0.47 -0.51 -0.08 0.49 3.08 -0.85 -1.38 114.38 115.60 2qct h ARG 115 Ca 0.12 0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.23 2qct h ARG 115 Cb 0.12 0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.22 2qct h ARG 115 CO -0.01 -0.34 -0.52 1.98 -1.07 0.00 0.00 179.97 180.01 2qct h MET 116 N -0.53 -0.59 -0.86 0.04 4.05 -1.02 1.29 114.93 117.31 2qct h MET 116 Ca -0.03 0.04 0.18 0.00 -0.28 0.00 0.00 59.70 59.60 2qct h MET 116 Cb 0.44 0.13 -0.16 0.00 -0.80 0.00 0.00 31.60 31.21 2qct h MET 116 CO 0.03 -0.39 -0.20 0.82 0.23 0.00 0.00 176.91 177.40 2qct h ILE 117 N -0.61 0.14 0.25 1.77 1.08 -1.31 -1.05 117.51 117.78 2qct h ILE 117 Ca 0.03 -0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.49 2qct h ILE 117 Cb 0.69 0.14 0.00 0.00 -3.07 0.00 0.00 36.82 34.58 2qct h ILE 117 CO -0.40 0.00 -0.12 -0.25 -0.69 0.00 0.00 178.15 176.69 2qct h TRP 118 N 0.00 -0.31 -0.05 1.37 2.91 0.03 -1.11 115.95 118.79 2qct h TRP 118 Ca 0.42 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.45 2qct h TRP 118 Cb 0.66 0.10 -0.00 0.00 -0.51 0.00 0.00 29.16 29.41 2qct h TRP 118 CO -0.66 0.05 0.12 1.49 -1.03 0.00 0.00 178.44 178.41 2qct h GLU 119 N -0.77 0.00 -0.11 2.65 4.81 0.24 -1.76 114.58 119.64 2qct h GLU 119 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2qct h GLU 119 Cb 0.50 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2qct h GLU 119 CO 0.06 0.00 0.00 0.66 -0.73 0.00 0.00 179.01 179.00 2qct n TYR 120 N -3.35 0.13 -1.85 0.92 4.02 -0.48 -4.99 117.16 111.56 2qct n TYR 120 Ca -0.02 -0.10 -0.12 0.00 -0.01 0.00 0.00 57.90 57.65 2qct n TYR 120 Cb 0.20 -0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.49 2qct n TYR 120 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2qct n SER 121 N 0.87 -4.12 -4.68 7.72 7.64 -0.66 -4.62 113.62 115.77 2qct n SER 121 Ca 0.10 0.12 -0.45 0.00 1.01 0.00 0.00 58.87 59.65 2qct n SER 121 Cb 0.40 -3.05 -0.04 0.00 -1.01 0.00 0.00 64.21 60.52 2qct n SER 121 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2qct n VAL 122 N -3.42 0.05 0.23 0.44 0.31 -0.46 -4.83 118.33 110.65 2qct n VAL 122 Ca -0.13 -0.01 0.06 0.00 -0.01 0.00 0.00 64.34 64.24 2qct n VAL 122 Cb 0.52 -1.65 -0.08 0.00 -0.91 0.00 0.00 33.84 31.71 2qct n VAL 122 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2qct n LEU 123 N 3.77 0.23 -3.91 7.52 7.94 -1.26 -4.87 117.00 126.43 2qct n LEU 123 Ca 0.17 -0.22 -0.23 0.00 -1.11 0.00 0.00 56.01 54.62 2qct n LEU 123 Cb 0.30 0.00 -0.17 0.00 0.53 0.00 0.00 43.42 44.08 2qct n LEU 123 CO 0.64 0.06 -0.43 -0.63 -1.11 0.00 0.00 177.39 175.92 2qct s ILE 124 N -2.50 0.78 -0.28 1.96 1.01 -1.26 -1.61 121.20 119.30 2qct s ILE 124 Ca -0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 60.65 60.42 2qct s ILE 124 Cb 0.08 -0.80 0.04 0.00 0.01 0.00 0.00 42.46 41.79 2qct s ILE 124 CO 0.48 0.30 -0.02 -0.63 0.00 0.00 0.00 174.94 175.07 2qct s ILE 125 N 1.25 3.00 -0.42 2.92 1.01 -0.45 -1.07 121.20 127.44 2qct s ILE 125 Ca -0.05 -1.18 -0.11 0.00 0.00 0.00 0.00 60.65 59.31 2qct s ILE 125 Cb -0.14 -2.63 0.07 0.00 0.01 0.00 0.00 42.46 39.77 2qct s ILE 125 CO -0.02 0.04 0.27 -0.69 0.00 0.00 0.00 174.94 174.54 2qct s VAL 126 N 1.30 4.50 -0.33 2.92 1.01 -0.27 0.55 120.40 130.09 2qct s VAL 126 Ca -0.02 -1.22 -0.13 0.00 0.00 0.00 0.00 61.98 60.61 2qct s VAL 126 Cb -0.18 -3.69 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 2qct s VAL 126 CO -0.02 -0.46 0.23 -0.32 0.00 0.00 0.00 175.10 174.53 2qct s MET 127 N 1.49 3.59 -0.71 2.72 0.00 -0.83 -1.55 119.30 124.01 2qct s MET 127 Ca 0.03 -0.57 -0.02 0.00 0.00 0.00 0.00 55.69 55.13 2qct s MET 127 Cb -0.22 -3.78 0.38 0.00 0.00 0.00 0.00 34.83 31.21 2qct s MET 127 CO 0.04 -0.39 2.07 0.00 0.00 0.00 0.00 175.02 176.74 2qct n ALA 128 N 5.10 6.36 -3.83 4.11 0.00 0.47 -0.23 120.51 132.50 2qct n ALA 128 Ca -0.13 -3.62 -0.12 0.00 0.00 0.00 0.00 53.44 49.57 2qct n ALA 128 Cb 0.50 -1.87 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 2qct n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qct s MET 130 N -2.70 1.25 0.28 0.00 1.00 -1.26 -4.35 119.30 113.52 2qct s MET 130 Ca 0.24 -0.90 -0.02 0.00 0.00 0.00 0.00 55.69 55.01 2qct s MET 130 Cb -0.00 -1.35 0.63 0.00 0.00 0.00 0.00 34.83 34.11 2qct s MET 130 CO 0.17 0.34 1.60 0.93 0.00 0.00 0.00 175.02 178.06 2qct h GLU 131 N 4.85 0.06 -5.24 2.03 5.08 -1.94 -3.38 114.58 116.05 2qct h GLU 131 Ca -0.41 -0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.38 2qct h GLU 131 Cb 1.17 -0.01 -0.31 0.00 0.50 0.00 0.00 28.75 30.09 2qct h GLU 131 CO 0.44 0.04 -0.84 0.71 -1.00 0.00 0.00 179.01 178.36 2qct s TYR 132 N -6.05 1.72 -0.15 4.33 2.02 -1.26 -1.69 117.35 116.28 2qct s TYR 132 Ca -0.13 -0.51 -0.04 0.00 -0.37 0.00 0.00 57.07 56.02 2qct s TYR 132 Cb 0.26 -1.16 0.05 0.00 -0.40 0.00 0.00 41.96 40.71 2qct s TYR 132 CO 0.77 -0.18 0.07 -1.21 -1.57 0.00 0.00 175.55 173.43 2qct s GLU 133 N 0.09 0.20 -0.81 -0.62 2.02 -0.64 -4.86 118.70 114.09 2qct s GLU 133 Ca -0.05 -0.07 -0.03 0.00 0.02 0.00 0.00 54.97 54.85 2qct s GLU 133 Cb -0.12 -1.63 -0.03 0.00 0.10 0.00 0.00 34.13 32.45 2qct s GLU 133 CO 0.02 -0.59 0.69 -1.33 0.02 0.00 0.00 175.26 174.08 2qct n MET 134 N 5.22 -2.96 -2.34 1.61 2.81 -1.26 -3.11 117.12 117.10 2qct n MET 134 Ca -0.07 0.63 -0.15 0.00 -1.81 0.00 0.00 57.70 56.29 2qct n MET 134 Cb 0.49 -4.78 -0.01 0.00 -0.71 0.00 0.00 33.22 28.21 2qct n MET 134 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qct n GLY 135 N -1.22 -0.33 2.99 3.03 0.00 -1.26 -4.96 105.19 103.44 2qct n GLY 135 Ca -0.12 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.80 2qct n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qct s LYS 136 N -4.89 0.34 0.01 1.61 2.47 -1.18 -5.13 119.74 112.96 2qct s LYS 136 Ca 0.00 -0.58 -0.30 0.00 -1.56 0.00 0.00 55.97 53.52 2qct s LYS 136 Cb 0.00 -0.00 -0.04 0.00 -1.46 0.00 0.00 37.83 36.33 2qct s LYS 136 CO 0.00 -0.02 1.11 0.21 0.16 0.00 0.00 175.35 176.81 2qct s LYS 137 N -1.34 4.46 0.00 4.03 2.47 -1.26 -1.61 119.74 126.49 2qct s LYS 137 Ca -0.13 1.60 0.00 0.00 -1.56 0.00 0.00 55.97 55.88 2qct s LYS 137 Cb -0.09 -3.44 0.00 0.00 -1.46 0.00 0.00 37.83 32.84 2qct s LYS 137 CO -0.01 -0.23 0.00 1.63 0.16 0.00 0.00 175.35 176.91 2qct n LYS 138 N 4.24 2.53 -3.77 4.03 4.76 -0.68 -4.96 118.16 124.31 2qct n LYS 138 Ca 0.08 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.39 2qct n LYS 138 Cb 0.48 -0.93 -0.10 0.00 -1.84 0.00 0.00 35.03 32.64 2qct n LYS 138 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qct s GLU 140 N -0.54 4.13 0.23 0.00 2.56 -0.97 -4.81 118.70 119.30 2qct s GLU 140 Ca -0.06 0.25 -0.32 0.00 0.00 0.00 0.00 54.97 54.84 2qct s GLU 140 Cb -0.04 -3.36 -0.12 0.00 2.00 0.00 0.00 34.13 32.61 2qct s GLU 140 CO 0.02 0.37 1.63 0.54 -0.56 0.00 0.00 175.26 177.27 2qct n ARG 141 N 3.03 2.59 0.00 4.30 5.12 -1.26 -4.62 116.66 125.81 2qct n ARG 141 Ca -0.12 0.93 0.00 0.00 -1.93 0.00 0.00 57.85 56.73 2qct n ARG 141 Cb 0.52 -2.73 0.00 0.00 -1.16 0.00 0.00 32.46 29.09 2qct n ARG 141 CO 0.00 0.00 0.00 2.48 -1.93 0.00 0.00 177.63 178.18 2qct n TYR 142 N 3.13 0.00 -3.27 -1.55 4.11 -1.26 -5.03 117.16 113.28 2qct n TYR 142 Ca 0.13 0.00 -0.22 0.00 -0.00 0.00 0.00 57.90 57.82 2qct n TYR 142 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.68 2qct n TYR 142 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.86 178.53 2qct s TRP 143 N -1.24 3.27 -0.04 -3.48 -2.14 -1.26 -4.98 118.94 109.06 2qct s TRP 143 Ca 0.00 0.12 -0.02 0.00 2.66 0.00 0.00 56.10 58.85 2qct s TRP 143 Cb 0.00 -2.08 -0.04 0.00 -3.10 0.00 0.00 33.47 28.25 2qct s TRP 143 CO 0.00 -0.11 0.10 0.00 -2.66 0.00 0.00 176.95 174.28 2qct s ALA 144 N -2.36 3.66 -0.11 2.67 0.00 -1.26 -5.07 121.76 119.29 2qct s ALA 144 Ca 0.45 -0.79 -0.03 0.00 0.00 0.00 0.00 51.96 51.59 2qct s ALA 144 Cb -0.10 -1.70 -0.03 0.00 0.00 0.00 0.00 23.12 21.29 2qct s ALA 144 CO 0.35 0.67 -0.00 -1.21 0.00 0.00 0.00 175.76 175.57 2qct s GLU 145 N -1.46 3.21 0.32 0.00 2.02 -1.26 -4.55 118.70 116.97 2qct s GLU 145 Ca 0.20 -0.42 -0.29 0.00 0.02 0.00 0.00 54.97 54.48 2qct s GLU 145 Cb -0.12 -2.86 -0.12 0.00 0.10 0.00 0.00 34.13 31.13 2qct s GLU 145 CO 0.10 0.57 1.44 -0.35 0.02 0.00 0.00 175.26 177.05 2qct n PRO 146 N 2.54 2.40 0.00 0.39 -0.04 -1.26 -2.25 135.00 136.78 2qct n PRO 146 Ca -0.18 0.85 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 2qct n PRO 146 Cb 0.53 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 2qct n PRO 146 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qct n GLY 147 N 1.27 2.72 3.76 0.55 0.00 -1.26 -5.05 105.19 107.17 2qct n GLY 147 Ca 0.06 -0.51 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 2qct n GLY 147 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qct s GLU 148 N 0.00 1.70 0.74 1.61 2.02 -0.95 -5.06 118.70 118.75 2qct s GLU 148 Ca 0.00 0.78 -0.08 0.00 0.02 0.00 0.00 54.97 55.70 2qct s GLU 148 Cb 0.00 -1.86 0.07 0.00 0.10 0.00 0.00 34.13 32.44 2qct s GLU 148 CO 0.00 -1.92 1.06 1.41 0.02 0.00 0.00 175.26 175.82 2qct s MET 149 N -5.02 2.05 0.85 1.61 -2.45 -1.26 -4.93 119.30 110.15 2qct s MET 149 Ca 0.62 -0.25 -0.12 0.00 -1.25 0.00 0.00 55.69 54.69 2qct s MET 149 Cb -0.16 -2.13 0.11 0.00 1.25 0.00 0.00 34.83 33.90 2qct s MET 149 CO 0.56 -1.37 1.18 -0.65 1.05 0.00 0.00 175.02 175.79 2qct s GLN 150 N -5.33 1.43 -0.24 4.11 -0.21 -1.26 -4.93 119.66 113.22 2qct s GLN 150 Ca 0.61 1.65 0.02 0.00 0.02 0.00 0.00 55.36 57.66 2qct s GLN 150 Cb -0.10 -1.76 0.06 0.00 1.00 0.00 0.00 33.01 32.20 2qct s GLN 150 CO 0.46 -2.35 -0.09 -0.51 -2.12 0.00 0.00 175.29 170.68 2qct s LEU 151 N -6.06 2.91 -0.11 2.90 1.02 -0.90 -4.98 118.68 113.48 2qct s LEU 151 Ca 0.70 -1.21 -0.24 0.00 0.02 0.00 0.00 54.13 53.40 2qct s LEU 151 Cb -0.26 -1.37 -0.03 0.00 0.02 0.00 0.00 46.19 44.55 2qct s LEU 151 CO 0.53 -0.19 0.75 -1.61 0.02 0.00 0.00 176.35 175.85 2qct s GLU 152 N 1.26 4.38 -0.69 1.70 8.01 -1.26 -2.20 118.70 129.89 2qct s GLU 152 Ca -0.06 0.92 0.05 0.00 0.01 0.00 0.00 54.97 55.89 2qct s GLU 152 Cb -0.19 -3.50 0.20 0.00 -4.31 0.00 0.00 34.13 26.34 2qct s GLU 152 CO -0.06 -0.09 0.62 1.19 0.01 0.00 0.00 175.26 176.93 2qct n PHE 153 N 4.34 3.45 0.00 1.61 3.01 -0.29 -4.98 117.46 124.61 2qct n PHE 153 Ca 0.01 -4.23 0.00 0.00 1.01 0.00 0.00 57.45 54.24 2qct n PHE 153 Cb 0.50 -0.62 0.00 0.00 -0.01 0.00 0.00 39.48 39.35 2qct n PHE 153 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qct n GLY 154 N 1.51 1.52 0.74 1.37 0.00 -1.26 -3.38 105.19 105.69 2qct n GLY 154 Ca 0.24 -0.57 0.09 0.00 0.00 0.00 0.00 46.02 45.78 2qct n GLY 154 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2qct n PRO 155 N 2.31 1.60 -3.48 1.61 -0.04 -1.26 -4.96 135.00 130.79 2qct n PRO 155 Ca 0.00 -1.64 -0.37 0.00 -0.04 0.00 0.00 63.50 61.44 2qct n PRO 155 Cb 0.00 -1.35 -0.08 0.00 -0.04 0.00 0.00 33.50 32.03 2qct n PRO 155 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2qct s PHE 156 N -1.43 3.38 -0.43 0.54 0.40 -1.22 -4.53 117.98 114.68 2qct s PHE 156 Ca 0.22 0.52 -0.16 0.00 -0.60 0.00 0.00 56.93 56.92 2qct s PHE 156 Cb 0.15 -2.43 0.03 0.00 0.51 0.00 0.00 43.02 41.28 2qct s PHE 156 CO 0.23 0.06 0.38 -1.12 0.70 0.00 0.00 175.22 175.46 2qct s SER 157 N 0.94 6.15 -0.25 1.36 0.01 0.78 -1.13 113.70 121.56 2qct s SER 157 Ca 0.16 -0.90 -0.10 0.00 1.31 0.00 0.00 55.95 56.42 2qct s SER 157 Cb -0.14 -2.19 -0.05 0.00 0.21 0.00 0.00 66.02 63.85 2qct s SER 157 CO 0.06 -0.55 0.16 -0.69 0.41 0.00 0.00 173.24 172.63 2qct s VAL 158 N 1.88 5.25 0.27 3.43 1.01 -0.93 -0.31 120.40 131.00 2qct s VAL 158 Ca 0.08 0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.25 2qct s VAL 158 Cb -0.19 -3.46 -0.06 0.00 0.00 0.00 0.00 36.38 32.67 2qct s VAL 158 CO 0.11 0.33 -0.00 -0.55 0.00 0.00 0.00 175.10 174.98 2qct s SER 159 N 1.24 2.26 -0.07 3.32 0.15 0.05 -2.11 113.70 118.54 2qct s SER 159 Ca 0.07 -1.26 0.01 0.00 0.70 0.00 0.00 55.95 55.48 2qct s SER 159 Cb -0.14 -0.07 0.02 0.00 -1.71 0.00 0.00 66.02 64.12 2qct s SER 159 CO 0.06 -0.49 -0.09 0.00 1.20 0.00 0.00 173.24 173.92 2qct n GLU 161 N 4.15 0.55 -3.98 0.00 2.13 -1.05 -4.60 120.64 117.84 2qct n GLU 161 Ca -0.21 0.51 -0.11 0.00 0.66 0.00 0.00 57.16 58.01 2qct n GLU 161 Cb 0.51 -1.69 -0.03 0.00 0.27 0.00 0.00 31.44 30.51 2qct n GLU 161 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2qct s ALA 162 N -2.48 -0.11 -0.30 4.31 0.00 -1.26 -4.99 121.76 116.94 2qct s ALA 162 Ca -0.28 -1.01 -0.06 0.00 0.00 0.00 0.00 51.96 50.62 2qct s ALA 162 Cb 0.07 1.00 0.17 0.00 0.00 0.00 0.00 23.12 24.35 2qct s ALA 162 CO 0.50 -0.88 0.69 -1.83 0.00 0.00 0.00 175.76 174.24 2qct s GLU 163 N -3.35 0.51 0.06 0.00 -1.05 -1.26 -1.94 118.70 111.67 2qct s GLU 163 Ca 0.23 1.04 -0.31 0.00 -0.15 0.00 0.00 54.97 55.78 2qct s GLU 163 Cb -0.02 0.60 -0.06 0.00 -0.44 0.00 0.00 34.13 34.21 2qct s GLU 163 CO 0.13 -0.42 1.27 0.15 0.95 0.00 0.00 175.26 177.34 2qct s LYS 164 N 2.85 4.38 -0.43 -4.83 1.02 -0.49 -4.81 119.74 117.43 2qct s LYS 164 Ca 0.10 1.87 -0.04 0.00 0.02 0.00 0.00 55.97 57.91 2qct s LYS 164 Cb -0.13 -3.37 0.11 0.00 -0.52 0.00 0.00 37.83 33.93 2qct s LYS 164 CO -0.19 -0.36 0.24 1.03 -0.92 0.00 0.00 175.35 175.15 2qct s ARG 165 N 1.33 2.10 0.43 1.68 0.52 -1.26 -0.37 118.95 123.38 2qct s ARG 165 Ca 0.61 -1.83 -0.02 0.00 -0.52 0.00 0.00 55.73 53.96 2qct s ARG 165 Cb -0.31 -3.65 0.09 0.00 0.52 0.00 0.00 34.95 31.60 2qct s ARG 165 CO 0.29 -1.10 0.59 1.63 0.02 0.00 0.00 175.30 176.73 2qct n LYS 166 N 4.62 -0.03 -0.23 3.54 5.02 -0.80 -5.02 118.16 125.26 2qct n LYS 166 Ca -0.03 -1.38 -0.07 0.00 -2.02 0.00 0.00 58.31 54.81 2qct n LYS 166 Cb 0.41 -0.46 0.04 0.00 -0.02 0.00 0.00 35.03 34.99 2qct n LYS 166 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2qct h SER 167 N -0.49 0.86 -0.00 4.39 4.64 -2.04 -3.35 113.55 117.56 2qct h SER 167 Ca -0.19 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2qct h SER 167 Cb 0.66 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2qct h SER 167 CO 0.19 0.78 -0.03 0.47 -0.87 0.00 0.00 176.83 177.36 2qct n ASP 168 N -4.45 0.92 -3.51 4.97 8.00 -1.26 -5.00 116.55 116.21 2qct n ASP 168 Ca 0.04 -0.96 -0.13 0.00 0.71 0.00 0.00 54.79 54.45 2qct n ASP 168 Cb 0.15 0.28 -0.04 0.00 -0.02 0.00 0.00 41.12 41.49 2qct n ASP 168 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2qct s TYR 169 N -0.50 -0.48 -0.01 1.24 1.13 -1.26 -3.18 117.35 114.30 2qct s TYR 169 Ca 0.03 0.43 0.03 0.00 -1.41 0.00 0.00 57.07 56.14 2qct s TYR 169 Cb 0.02 0.43 -0.03 0.00 -1.10 0.00 0.00 41.96 41.28 2qct s TYR 169 CO 0.05 -0.73 -0.06 0.42 -2.51 0.00 0.00 175.55 172.72 2qct s ILE 170 N -2.96 3.69 -0.34 -3.49 1.01 -0.23 -1.91 121.20 116.97 2qct s ILE 170 Ca -0.03 -0.69 -0.06 0.00 0.00 0.00 0.00 60.65 59.87 2qct s ILE 170 Cb -0.00 -2.58 0.05 0.00 0.01 0.00 0.00 42.46 39.93 2qct s ILE 170 CO -0.06 0.44 0.11 -0.63 0.00 0.00 0.00 174.94 174.80 2qct s ILE 171 N -0.96 3.70 -0.31 2.92 1.01 0.50 -0.90 121.20 127.16 2qct s ILE 171 Ca 0.16 -1.21 -0.09 0.00 0.00 0.00 0.00 60.65 59.51 2qct s ILE 171 Cb -0.11 -3.12 -0.00 0.00 0.01 0.00 0.00 42.46 39.23 2qct s ILE 171 CO 0.06 -0.21 0.14 -0.13 0.00 0.00 0.00 174.94 174.80 2qct s ARG 172 N 1.38 3.29 -0.33 2.79 0.52 0.43 -1.39 118.95 125.64 2qct s ARG 172 Ca -0.01 -0.74 -0.23 0.00 -0.52 0.00 0.00 55.73 54.22 2qct s ARG 172 Cb -0.20 -3.53 0.00 0.00 0.52 0.00 0.00 34.95 31.75 2qct s ARG 172 CO 0.02 -0.42 0.78 -0.08 0.02 0.00 0.00 175.30 175.62 2qct s THR 173 N 1.59 4.77 -0.01 0.02 -1.32 -0.82 0.11 115.64 119.98 2qct s THR 173 Ca 0.04 1.03 0.03 0.00 -1.21 0.00 0.00 61.69 61.58 2qct s THR 173 Cb -0.17 -4.17 -0.03 0.00 -1.51 0.00 0.00 72.50 66.61 2qct s THR 173 CO 0.06 -0.34 -0.07 -0.76 -2.21 0.00 0.00 174.62 171.30 2qct s LEU 174 N 3.02 3.16 -0.28 9.08 1.43 0.58 -2.54 118.68 133.13 2qct s LEU 174 Ca 0.32 -0.13 -0.03 0.00 -1.03 0.00 0.00 54.13 53.26 2qct s LEU 174 Cb -0.14 -1.79 0.04 0.00 0.03 0.00 0.00 46.19 44.32 2qct s LEU 174 CO 0.15 0.29 -0.00 -0.54 0.23 0.00 0.00 176.35 176.48 2qct s LYS 175 N -1.33 2.67 -0.47 1.70 -0.14 -0.00 -0.83 119.74 121.34 2qct s LYS 175 Ca 0.16 -1.10 -0.12 0.00 -1.36 0.00 0.00 55.97 53.55 2qct s LYS 175 Cb -0.11 -3.16 0.10 0.00 -1.68 0.00 0.00 37.83 32.98 2qct s LYS 175 CO 0.07 -0.52 0.36 0.08 -0.76 0.00 0.00 175.35 174.57 2qct s VAL 176 N 1.32 4.62 -0.50 3.17 1.01 -0.40 -0.77 120.40 128.85 2qct s VAL 176 Ca -0.02 -1.45 -0.18 0.00 0.00 0.00 0.00 61.98 60.32 2qct s VAL 176 Cb -0.18 -3.89 0.06 0.00 0.00 0.00 0.00 36.38 32.37 2qct s VAL 176 CO -0.01 -0.66 0.58 -0.75 0.00 0.00 0.00 175.10 174.25 2qct s LYS 177 N 1.49 3.09 0.00 2.72 2.20 0.58 -2.25 119.74 127.57 2qct s LYS 177 Ca 0.04 -0.99 0.00 0.00 -0.36 0.00 0.00 55.97 54.66 2qct s LYS 177 Cb -0.25 -4.11 0.00 0.00 -1.51 0.00 0.00 37.83 31.96 2qct s LYS 177 CO 0.02 -1.19 0.08 0.34 -0.36 0.00 0.00 175.35 174.25 2qct n PHE 178 N 5.98 0.00 0.00 4.03 7.35 -0.90 -0.15 117.46 133.77 2qct n PHE 178 Ca -0.08 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.61 2qct n PHE 178 Cb 0.45 -0.32 0.00 0.00 0.35 0.00 0.00 39.48 39.96 2qct n PHE 178 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 2qct n ASN 179 N -1.47 0.00 -0.47 -2.13 3.02 -1.26 -4.47 115.26 108.47 2qct n ASN 179 Ca 0.00 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.59 2qct n ASN 179 Cb 0.00 0.00 0.10 0.00 -0.61 0.00 0.00 39.78 39.27 2qct n ASN 179 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2qct n SER 180 N 0.00 2.51 -4.80 6.41 7.64 -1.26 -4.97 113.62 119.16 2qct n SER 180 Ca 0.00 -1.86 -0.38 0.00 1.01 0.00 0.00 58.87 57.63 2qct n SER 180 Cb 0.00 -0.14 -0.06 0.00 -1.01 0.00 0.00 64.21 63.00 2qct n SER 180 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2qct s GLU 181 N -0.94 4.32 -0.08 1.43 -6.30 -1.26 -5.09 118.70 110.78 2qct s GLU 181 Ca 0.17 0.88 0.01 0.00 -2.50 0.00 0.00 54.97 53.53 2qct s GLU 181 Cb 0.09 -3.19 0.02 0.00 0.00 0.00 0.00 34.13 31.05 2qct s GLU 181 CO 0.12 0.58 -0.10 0.99 0.02 0.00 0.00 175.26 176.87 2qct s THR 182 N -1.19 1.08 0.21 -1.70 2.01 -1.26 -2.11 115.64 112.68 2qct s THR 182 Ca 0.33 -0.39 0.11 0.00 0.31 0.00 0.00 61.69 62.05 2qct s THR 182 Cb -0.20 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.23 2qct s THR 182 CO 0.22 0.36 -0.19 -0.13 -0.69 0.00 0.00 174.62 174.18 2qct s ARG 183 N 1.10 1.70 -0.25 4.92 3.00 -0.95 -4.99 118.95 123.47 2qct s ARG 183 Ca -0.06 -1.52 -0.02 0.00 0.00 0.00 0.00 55.73 54.12 2qct s ARG 183 Cb -0.14 -1.91 0.02 0.00 0.00 0.00 0.00 34.95 32.92 2qct s ARG 183 CO -0.01 0.39 -0.05 0.99 0.00 0.00 0.00 175.30 176.62 2qct s THR 184 N -1.89 2.98 0.15 0.02 2.01 -1.26 -1.27 115.64 116.38 2qct s THR 184 Ca 0.24 -0.98 0.04 0.00 0.31 0.00 0.00 61.69 61.30 2qct s THR 184 Cb -0.07 -2.51 -0.04 0.00 0.01 0.00 0.00 72.50 69.89 2qct s THR 184 CO 0.12 0.19 0.16 -0.63 -0.69 0.00 0.00 174.62 173.78 2qct s ILE 185 N 1.34 4.64 -0.25 1.82 1.09 -0.01 -4.91 121.20 124.92 2qct s ILE 185 Ca 0.00 -0.98 0.03 0.00 -1.10 0.00 0.00 60.65 58.60 2qct s ILE 185 Cb -0.17 -3.36 0.06 0.00 -1.06 0.00 0.00 42.46 37.93 2qct s ILE 185 CO -0.04 -0.09 -0.12 -0.31 -0.10 0.00 0.00 174.94 174.29 2qct s TYR 186 N -1.72 3.14 -0.30 3.97 1.51 -0.63 -0.31 117.35 123.01 2qct s TYR 186 Ca 0.31 -2.20 -0.18 0.00 -1.01 0.00 0.00 57.07 53.99 2qct s TYR 186 Cb -0.10 -1.90 -0.02 0.00 -0.11 0.00 0.00 41.96 39.83 2qct s TYR 186 CO 0.24 -0.86 0.51 -1.14 -1.11 0.00 0.00 175.55 173.19 2qct s GLN 187 N 1.15 3.86 -0.85 -0.62 0.74 0.30 -1.34 119.66 122.90 2qct s GLN 187 Ca -0.07 0.09 -0.13 0.00 0.05 0.00 0.00 55.36 55.30 2qct s GLN 187 Cb -0.19 -3.72 0.22 0.00 1.10 0.00 0.00 33.01 30.42 2qct s GLN 187 CO -0.06 -0.49 0.79 -0.06 -0.55 0.00 0.00 175.29 174.92 2qct s PHE 188 N 2.35 3.80 -0.44 1.67 0.40 0.19 0.16 117.98 126.12 2qct s PHE 188 Ca 0.20 -2.07 -0.25 0.00 -0.60 0.00 0.00 56.93 54.21 2qct s PHE 188 Cb -0.15 -3.81 0.02 0.00 0.51 0.00 0.00 43.02 39.59 2qct s PHE 188 CO 0.11 -0.98 0.91 -1.58 0.70 0.00 0.00 175.22 174.38 2qct s HIS 189 N 0.03 2.96 -0.75 0.36 2.46 -0.07 -1.97 115.29 118.32 2qct s HIS 189 Ca 0.19 0.44 -0.18 0.00 0.47 0.00 0.00 55.06 55.97 2qct s HIS 189 Cb -0.10 -3.87 0.13 0.00 -0.13 0.00 0.00 32.58 28.61 2qct s HIS 189 CO -0.09 -1.03 0.88 -0.47 -2.47 0.00 0.00 174.74 171.56 2qct s TYR 190 N 3.64 3.12 0.00 3.88 5.04 0.68 -1.06 117.35 132.66 2qct s TYR 190 Ca 0.36 -1.22 0.00 0.00 -2.44 0.00 0.00 57.07 53.77 2qct s TYR 190 Cb -0.11 -4.10 0.00 0.00 0.35 0.00 0.00 41.96 38.10 2qct s TYR 190 CO 0.24 -1.35 0.22 1.63 -1.34 0.00 0.00 175.55 174.96 2qct n LYS 191 N 6.18 0.00 -1.71 4.97 4.76 -1.19 -3.52 118.16 127.65 2qct n LYS 191 Ca 0.06 0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 55.11 2qct n LYS 191 Cb 0.46 -0.68 0.04 0.00 -1.84 0.00 0.00 35.03 33.01 2qct n LYS 191 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2qct n ASN 192 N -0.27 2.17 -4.16 4.39 5.15 -1.25 -4.68 115.26 116.61 2qct n ASN 192 Ca 0.00 0.95 -0.31 0.00 -0.60 0.00 0.00 54.58 54.62 2qct n ASN 192 Cb 0.00 -1.52 -0.17 0.00 -0.53 0.00 0.00 39.78 37.56 2qct n ASN 192 CO 0.00 0.00 0.00 0.86 1.40 0.00 0.00 177.26 179.52 2qct s TRP 193 N -1.33 2.34 -0.53 1.20 -0.11 -1.26 -4.99 118.94 114.27 2qct s TRP 193 Ca 0.72 -1.02 -0.23 0.00 1.22 0.00 0.00 56.10 56.79 2qct s TRP 193 Cb -0.43 -1.60 0.04 0.00 -1.50 0.00 0.00 33.47 29.98 2qct s TRP 193 CO 0.49 -0.45 0.85 -1.25 -4.62 0.00 0.00 176.95 171.98 2qct s PRO 194 N 0.57 3.29 0.00 5.86 0.04 -1.26 -5.05 135.00 138.45 2qct s PRO 194 Ca -0.14 -0.40 0.00 0.00 0.04 0.00 0.00 61.00 60.50 2qct s PRO 194 Cb -0.17 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.32 2qct s PRO 194 CO 0.05 -1.38 0.00 -3.47 0.04 0.00 0.00 177.00 172.23 2qct n ASP 195 N 7.07 -1.89 0.00 6.66 -0.08 -1.26 -4.76 116.55 122.29 2qct n ASP 195 Ca -0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2qct n ASP 195 Cb 0.47 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.93 2qct n ASP 195 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2qct n HIS 196 N -2.91 0.00 0.00 -0.67 -0.00 -1.26 -4.30 115.22 106.07 2qct n HIS 196 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2qct n HIS 196 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 2qct n HIS 196 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2qct n ASP 197 N -0.44 0.00 -3.48 4.39 3.85 -1.26 -3.49 116.55 116.12 2qct n ASP 197 Ca 0.00 0.00 -0.30 0.00 -0.71 0.00 0.00 54.79 53.78 2qct n ASP 197 Cb 0.00 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 39.71 2qct n ASP 197 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.20 177.52 2qct n VAL 198 N 0.27 3.06 0.00 2.12 0.24 -1.26 -4.93 118.33 117.83 2qct n VAL 198 Ca 0.00 -5.41 0.00 0.00 -2.04 0.00 0.00 64.34 56.89 2qct n VAL 198 Cb 0.00 -2.01 0.00 0.00 -1.47 0.00 0.00 33.84 30.36 2qct n VAL 198 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2qct n PRO 199 N 0.78 0.00 -0.06 7.34 -0.02 -1.23 0.03 135.00 141.84 2qct n PRO 199 Ca 0.30 0.04 -0.05 0.00 -2.02 0.00 0.00 63.50 61.78 2qct n PRO 199 Cb 0.39 -1.75 -0.11 0.00 -0.02 0.00 0.00 33.50 32.01 2qct n PRO 199 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2qct n SER 200 N -0.87 1.68 0.05 2.55 3.41 -1.26 -4.43 113.62 114.75 2qct n SER 200 Ca 0.00 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.71 2qct n SER 200 Cb 0.25 0.95 0.42 0.00 -0.26 0.00 0.00 64.21 65.57 2qct n SER 200 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2qct n SER 201 N -2.43 0.26 -0.05 4.04 3.41 0.10 -3.43 113.62 115.53 2qct n SER 201 Ca -0.19 0.55 -0.13 0.00 -0.26 0.00 0.00 58.87 58.84 2qct n SER 201 Cb 0.86 -0.61 -0.07 0.00 -0.26 0.00 0.00 64.21 64.12 2qct n SER 201 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 2qct h ILE 202 N 0.00 1.35 -0.27 -1.33 -2.65 -1.77 -3.35 117.51 109.48 2qct h ILE 202 Ca 0.00 -1.23 0.03 0.00 1.03 0.00 0.00 64.86 64.69 2qct h ILE 202 Cb 0.37 1.89 -0.04 0.00 -2.05 0.00 0.00 36.82 37.00 2qct h ILE 202 CO 0.00 0.36 -0.13 0.47 0.03 0.00 0.00 178.15 178.87 2qct n ASP 203 N -4.63 -0.23 -0.17 2.16 10.43 -1.22 0.11 116.55 123.00 2qct n ASP 203 Ca -0.06 0.48 0.14 0.00 2.57 0.00 0.00 54.79 57.91 2qct n ASP 203 Cb 0.33 -0.09 0.48 0.00 1.84 0.00 0.00 41.12 43.68 2qct n ASP 203 CO 0.00 0.00 0.00 1.55 -1.07 0.00 0.00 177.20 177.68 2qct h PRO 204 N 0.00 0.45 -0.81 -0.24 0.13 -1.84 0.80 132.00 130.49 2qct h PRO 204 Ca 0.07 -0.03 0.02 0.00 -0.87 0.00 0.00 66.00 65.19 2qct h PRO 204 Cb 0.14 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.12 2qct h PRO 204 CO -0.26 0.30 0.53 0.97 -0.23 0.00 0.00 178.00 179.30 2qct h ILE 205 N 0.47 1.16 -0.10 -3.56 2.10 0.50 0.21 117.51 118.29 2qct h ILE 205 Ca 0.37 -0.36 -0.08 0.00 1.08 0.00 0.00 64.86 65.86 2qct h ILE 205 Cb 0.77 0.02 -0.01 0.00 -1.09 0.00 0.00 36.82 36.51 2qct h ILE 205 CO -0.12 0.19 -0.32 -0.07 -1.08 0.00 0.00 178.15 176.75 2qct h LEU 206 N 1.05 0.19 -0.32 2.19 -0.00 -0.94 -1.77 115.31 115.71 2qct h LEU 206 Ca 0.31 -0.06 0.07 0.00 -0.00 0.00 0.00 57.88 58.19 2qct h LEU 206 Cb -0.05 -0.05 -0.07 0.00 -0.00 0.00 0.00 40.66 40.49 2qct h LEU 206 CO -0.09 0.51 -0.11 -0.33 -0.00 0.00 0.00 178.44 178.42 2qct h GLU 207 N 0.17 -0.04 0.81 1.13 5.08 0.89 -1.31 114.58 121.32 2qct h GLU 207 Ca 0.02 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 2qct h GLU 207 Cb 0.66 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.92 2qct h GLU 207 CO 0.05 -0.02 -0.40 1.25 -1.00 0.00 0.00 179.01 178.89 2qct h LEU 208 N -0.04 -0.95 -1.35 1.33 5.85 -0.28 -0.71 115.31 119.17 2qct h LEU 208 Ca 0.16 0.03 0.27 0.00 0.84 0.00 0.00 57.88 59.18 2qct h LEU 208 Cb 0.28 0.25 -0.10 0.00 0.37 0.00 0.00 40.66 41.46 2qct h LEU 208 CO -0.35 -0.67 0.67 0.40 -0.34 0.00 0.00 178.44 178.15 2qct h ILE 209 N -1.10 0.52 -0.05 4.05 5.03 -1.22 1.18 117.51 125.91 2qct h ILE 209 Ca -0.11 -0.14 -0.07 0.00 -0.12 0.00 0.00 64.86 64.42 2qct h ILE 209 Cb 0.85 0.09 0.00 0.00 -3.03 0.00 0.00 36.82 34.73 2qct h ILE 209 CO 0.18 0.07 -0.25 -0.25 -0.68 0.00 0.00 178.15 177.22 2qct h TRP 210 N 0.40 0.36 -0.30 1.37 7.01 -1.18 -1.43 115.95 122.17 2qct h TRP 210 Ca 0.60 -0.16 0.00 0.00 2.11 0.00 0.00 58.89 61.45 2qct h TRP 210 Cb 1.51 -0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 28.50 2qct h TRP 210 CO -0.00 0.88 0.19 -0.44 -2.79 0.00 0.00 178.44 176.28 2qct h ASP 211 N -0.27 0.33 0.41 2.65 3.45 0.89 -0.37 116.42 123.52 2qct h ASP 211 Ca -0.02 -0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.43 2qct h ASP 211 Cb 0.91 -0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 39.57 2qct h ASP 211 CO 0.05 0.24 -0.45 0.58 -1.57 0.00 0.00 179.24 178.09 2qct h VAL 212 N 0.40 0.10 0.00 -1.35 2.07 0.12 -1.32 116.25 116.27 2qct h VAL 212 Ca 0.11 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.63 2qct h VAL 212 Cb -0.04 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.83 2qct h VAL 212 CO -0.03 0.00 0.00 0.54 0.02 0.00 0.00 177.57 178.10 2qct n ARG 213 N -5.53 0.05 0.10 1.57 5.12 -0.54 -0.04 116.66 117.40 2qct n ARG 213 Ca -0.11 0.19 0.05 0.00 -1.93 0.00 0.00 57.85 56.05 2qct n ARG 213 Cb 0.43 -1.50 -0.01 0.00 -1.16 0.00 0.00 32.46 30.22 2qct n ARG 213 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2qct n TYR 215 N -2.94 0.92 -4.03 0.00 4.01 0.94 -4.93 117.16 111.13 2qct n TYR 215 Ca -0.03 0.31 -0.20 0.00 -0.16 0.00 0.00 57.90 57.82 2qct n TYR 215 Cb 0.70 -1.10 -0.17 0.00 -0.31 0.00 0.00 39.34 38.46 2qct n TYR 215 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 2qct s GLN 216 N -2.45 0.72 0.00 -0.72 0.74 -0.85 -5.05 119.66 112.04 2qct s GLN 216 Ca -0.28 -0.03 0.00 0.00 0.05 0.00 0.00 55.36 55.09 2qct s GLN 216 Cb 0.07 -0.83 0.00 0.00 1.10 0.00 0.00 33.01 33.35 2qct s GLN 216 CO 0.64 -0.14 0.00 -0.85 -0.55 0.00 0.00 175.29 174.38 2qct n GLU 217 N 4.34 0.00 -2.03 1.67 0.28 -1.26 -4.17 120.64 119.46 2qct n GLU 217 Ca -0.21 0.00 -0.41 0.00 -0.16 0.00 0.00 57.16 56.39 2qct n GLU 217 Cb 0.51 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.36 2qct n GLU 217 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2qct n ASP 218 N 0.00 4.03 -4.01 -1.84 5.68 -1.26 -4.85 116.55 114.30 2qct n ASP 218 Ca 0.00 -2.83 -0.19 0.00 -0.50 0.00 0.00 54.79 51.27 2qct n ASP 218 Cb 0.00 -1.64 -0.15 0.00 -1.14 0.00 0.00 41.12 38.19 2qct n ASP 218 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2qct s ASP 219 N 4.22 1.03 0.20 -1.12 3.68 -1.26 -5.04 116.67 118.37 2qct s ASP 219 Ca 0.54 -0.16 -0.11 0.00 2.13 0.00 0.00 52.55 54.94 2qct s ASP 219 Cb 0.08 -0.14 0.12 0.00 -1.45 0.00 0.00 42.92 41.54 2qct s ASP 219 CO 0.03 0.10 1.86 0.77 0.13 0.00 0.00 175.17 178.05 2qct h SER 220 N 6.00 0.80 -3.93 -0.34 4.64 -1.98 -3.44 113.55 115.28 2qct h SER 220 Ca -0.31 -0.04 -0.55 0.00 -0.47 0.00 0.00 61.79 60.43 2qct h SER 220 Cb 1.18 -0.20 0.13 0.00 -0.31 0.00 0.00 62.40 63.19 2qct h SER 220 CO 0.50 0.59 0.68 1.33 -0.87 0.00 0.00 176.83 179.06 2qct n VAL 221 N -4.59 2.86 -1.75 0.95 0.24 -1.26 -4.83 118.33 109.95 2qct n VAL 221 Ca 0.06 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.34 61.55 2qct n VAL 221 Cb 0.03 -1.81 0.04 0.00 -1.47 0.00 0.00 33.84 30.63 2qct n VAL 221 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2qct s PRO 222 N -2.46 3.07 -0.24 7.34 0.04 -1.24 -4.92 135.00 136.59 2qct s PRO 222 Ca 0.62 0.73 -0.08 0.00 0.04 0.00 0.00 61.00 62.31 2qct s PRO 222 Cb -0.45 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.03 2qct s PRO 222 CO 0.57 -0.94 0.09 0.42 0.04 0.00 0.00 177.00 177.17 2qct s ILE 223 N -3.18 4.53 -0.08 0.56 1.09 -1.02 -4.12 121.20 118.97 2qct s ILE 223 Ca 0.57 -0.10 -0.30 0.00 -1.10 0.00 0.00 60.65 59.72 2qct s ILE 223 Cb -0.12 -3.11 -0.02 0.00 -1.06 0.00 0.00 42.46 38.15 2qct s ILE 223 CO 0.54 0.35 1.04 0.00 -0.10 0.00 0.00 174.94 176.77 2qct s ILE 225 N 1.95 1.02 -0.02 0.00 1.01 -0.12 -1.11 121.20 123.94 2qct s ILE 225 Ca 0.50 -0.38 -0.09 0.00 0.00 0.00 0.00 60.65 60.68 2qct s ILE 225 Cb -0.20 -0.97 0.01 0.00 0.01 0.00 0.00 42.46 41.31 2qct s ILE 225 CO 0.20 0.34 0.20 -1.38 0.00 0.00 0.00 174.94 174.29 2qct s HIS 226 N 0.99 -0.07 0.00 3.97 -3.43 -0.60 -1.22 115.29 114.93 2qct s HIS 226 Ca -0.09 0.11 0.00 0.00 -0.80 0.00 0.00 55.06 54.28 2qct s HIS 226 Cb -0.15 0.01 0.00 0.00 -1.43 0.00 0.00 32.58 31.02 2qct s HIS 226 CO -0.00 -0.28 0.00 0.00 -2.00 0.00 0.00 174.74 172.46 2qct n SER 228 N 0.00 0.45 -0.30 0.00 2.88 -1.26 -2.35 113.62 113.04 2qct n SER 228 Ca 0.00 0.22 0.06 0.00 -1.33 0.00 0.00 58.87 57.82 2qct n SER 228 Cb 0.00 -0.58 0.24 0.00 -0.75 0.00 0.00 64.21 63.12 2qct n SER 228 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qct n ALA 229 N -2.77 2.51 -1.35 -1.46 0.00 -1.26 0.18 120.51 116.36 2qct n ALA 229 Ca -0.02 -0.31 -0.12 0.00 0.00 0.00 0.00 53.44 52.99 2qct n ALA 229 Cb 0.09 -1.07 -0.05 0.00 0.00 0.00 0.00 19.45 18.42 2qct n ALA 229 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qct n GLY 230 N 0.85 1.21 0.00 0.00 0.00 -1.23 -4.56 105.19 101.46 2qct n GLY 230 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qct n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qct n GLY 232 N 1.52 -0.83 0.23 0.00 0.00 -1.26 -2.91 105.19 101.94 2qct n GLY 232 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 2qct n GLY 232 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qct h ARG 233 N 0.00 0.00 -0.84 1.61 3.08 -1.92 -2.93 114.38 113.38 2qct h ARG 233 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qct h ARG 233 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2qct h ARG 233 CO 0.00 0.21 0.52 1.15 -1.07 0.00 0.00 179.97 180.78 2qct h THR 234 N 0.00 1.23 -0.50 2.04 2.02 -1.86 -2.50 112.91 113.34 2qct h THR 234 Ca -0.00 -0.47 -0.05 0.00 0.77 0.00 0.00 66.41 66.66 2qct h THR 234 Cb 0.52 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 2qct h THR 234 CO 0.03 0.23 0.11 1.23 0.37 0.00 0.00 175.52 177.49 2qct h GLY 235 N 1.15 0.86 0.36 2.16 0.00 -1.28 -2.86 103.07 103.47 2qct h GLY 235 Ca 0.30 -0.55 0.02 0.00 0.00 0.00 0.00 47.33 47.11 2qct h GLY 235 CO -0.06 0.51 -0.35 -2.08 0.00 0.00 0.00 176.54 174.56 2qct h VAL 236 N 0.69 0.27 -0.97 4.60 2.07 -1.53 0.52 116.25 121.90 2qct h VAL 236 Ca 0.16 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.79 2qct h VAL 236 Cb 0.34 0.27 -0.08 0.00 -1.52 0.00 0.00 31.29 30.30 2qct h VAL 236 CO 0.00 0.00 0.62 0.40 0.02 0.00 0.00 177.57 178.61 2qct h ILE 237 N -0.56 0.93 0.04 4.57 2.04 -1.47 0.22 117.51 123.27 2qct h ILE 237 Ca 0.03 -0.33 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 2qct h ILE 237 Cb 0.61 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2qct h ILE 237 CO -0.22 0.17 -0.02 0.00 0.00 0.00 0.00 178.15 178.09 2qct h ALA 239 N 0.34 0.59 0.08 0.00 0.00 0.37 0.31 119.26 120.95 2qct h ALA 239 Ca -0.00 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2qct h ALA 239 Cb 0.53 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2qct h ALA 239 CO 0.01 -0.10 -0.04 0.82 0.00 0.00 0.00 179.25 179.94 2qct h ILE 240 N 0.48 1.11 -0.84 0.00 2.04 -0.62 -1.03 117.51 118.66 2qct h ILE 240 Ca 0.20 -0.74 0.11 0.00 1.00 0.00 0.00 64.86 65.43 2qct h ILE 240 Cb 0.09 1.59 -0.06 0.00 -0.74 0.00 0.00 36.82 37.70 2qct h ILE 240 CO -0.13 0.18 0.54 -0.78 0.00 0.00 0.00 178.15 177.97 2qct h ASP 241 N -0.45 0.67 -0.27 1.72 3.58 -0.27 -1.15 116.42 120.24 2qct h ASP 241 Ca -0.01 0.03 -0.15 0.00 0.42 0.00 0.00 57.03 57.31 2qct h ASP 241 Cb 0.38 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.32 2qct h ASP 241 CO 0.02 0.38 -0.41 0.22 -2.88 0.00 0.00 179.24 176.57 2qct h TYR 242 N 0.73 0.99 -0.05 0.28 3.20 -0.12 -1.45 116.97 120.55 2qct h TYR 242 Ca 0.40 -0.30 -0.18 0.00 3.14 0.00 0.00 58.73 61.79 2qct h TYR 242 Cb 0.54 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 2qct h TYR 242 CO -0.00 1.09 -0.74 1.15 -1.64 0.00 0.00 178.16 178.02 2qct h THR 243 N 0.67 1.41 0.00 1.81 2.02 -0.39 -2.42 112.91 116.01 2qct h THR 243 Ca 0.05 -2.22 -0.16 0.00 0.77 0.00 0.00 66.41 64.86 2qct h THR 243 Cb 0.98 2.17 -0.02 0.00 -1.74 0.00 0.00 68.15 69.54 2qct h THR 243 CO 0.09 0.66 -0.75 -0.25 0.37 0.00 0.00 175.52 175.65 2qct h TRP 244 N 0.21 0.00 0.00 3.16 2.91 -1.22 0.27 115.95 121.27 2qct h TRP 244 Ca -0.03 0.00 -0.11 0.00 1.13 0.00 0.00 58.89 59.88 2qct h TRP 244 Cb 1.31 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.94 2qct h TRP 244 CO 0.04 0.75 -0.51 0.52 -1.03 0.00 0.00 178.44 178.20 2qct h MET 245 N 0.00 0.00 0.03 2.65 2.86 -1.21 0.58 114.93 119.84 2qct h MET 245 Ca -0.01 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2qct h MET 245 Cb 1.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.00 2qct h MET 245 CO 0.10 0.51 -0.02 -0.07 1.06 0.00 0.00 176.91 178.49 2qct h LEU 246 N 0.00 -0.04 -1.50 1.22 3.38 -1.02 -3.13 115.31 114.22 2qct h LEU 246 Ca -0.01 -0.62 0.10 0.00 0.09 0.00 0.00 57.88 57.45 2qct h LEU 246 Cb 0.95 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.67 2qct h LEU 246 CO 0.07 0.63 0.46 0.25 0.09 0.00 0.00 178.44 179.94 2qct h LEU 247 N -0.73 0.50 0.00 1.67 6.46 -0.18 0.27 115.31 123.30 2qct h LEU 247 Ca -0.00 0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 2qct h LEU 247 Cb 0.65 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.49 2qct h LEU 247 CO 0.01 0.30 0.00 0.29 -0.62 0.00 0.00 178.44 178.41 2qct n LYS 248 N -4.49 0.07 0.00 1.25 5.02 0.20 -2.39 118.16 117.82 2qct n LYS 248 Ca 0.12 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.64 2qct n LYS 248 Cb 0.36 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 2qct n LYS 248 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2qct n ASP 249 N -1.42 0.96 0.00 4.39 10.43 0.78 -4.97 116.55 126.73 2qct n ASP 249 Ca 0.04 -1.45 0.00 0.00 2.57 0.00 0.00 54.79 55.95 2qct n ASP 249 Cb 0.13 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.09 2qct n ASP 249 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2qct n GLY 250 N -0.23 0.00 0.00 0.44 0.00 -0.18 -4.69 105.19 100.54 2qct n GLY 250 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 2qct n GLY 250 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qct n ILE 251 N -1.19 0.00 -1.59 -0.61 0.13 -1.11 -4.84 119.36 110.16 2qct n ILE 251 Ca 0.00 0.00 -0.55 0.00 -1.10 0.00 0.00 62.75 61.10 2qct n ILE 251 Cb 0.08 -0.50 -0.07 0.00 -0.84 0.00 0.00 39.64 38.31 2qct n ILE 251 CO 0.00 0.00 0.00 -0.38 2.80 0.00 0.00 176.55 178.97 2qct n ILE 252 N -0.72 0.03 -2.04 9.51 2.08 -1.25 -4.86 119.36 122.11 2qct n ILE 252 Ca 0.05 -0.01 -0.39 0.00 0.56 0.00 0.00 62.75 62.97 2qct n ILE 252 Cb 0.02 -0.66 0.01 0.00 -0.75 0.00 0.00 39.64 38.26 2qct n ILE 252 CO 0.00 0.00 0.00 -2.84 0.56 0.00 0.00 176.55 174.27 2qct s PRO 253 N 0.76 3.70 0.23 0.38 0.02 -1.26 -4.89 135.00 133.93 2qct s PRO 253 Ca 0.88 2.08 -0.07 0.00 0.02 0.00 0.00 61.00 63.91 2qct s PRO 253 Cb -1.06 -2.54 0.32 0.00 0.02 0.00 0.00 34.50 31.24 2qct s PRO 253 CO 0.52 -0.69 1.80 1.49 -0.33 0.00 0.00 177.00 179.80 2qct h GLU 254 N 2.20 0.69 -0.66 5.54 4.81 -1.97 0.03 114.58 125.23 2qct h GLU 254 Ca -0.50 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2qct h GLU 254 Cb 1.26 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.48 2qct h GLU 254 CO 0.61 0.45 0.00 0.27 -0.73 0.00 0.00 179.01 179.61 2qct n ASN 255 N -4.79 3.63 -4.18 1.04 6.94 -1.26 -4.99 115.26 111.65 2qct n ASN 255 Ca 0.11 -2.42 -0.38 0.00 -0.02 0.00 0.00 54.58 51.87 2qct n ASN 255 Cb 0.23 -0.53 0.03 0.00 -2.36 0.00 0.00 39.78 37.15 2qct n ASN 255 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 2qct n PHE 256 N 0.55 -3.49 -3.60 -2.53 -0.00 -0.00 -5.01 117.46 103.38 2qct n PHE 256 Ca 0.17 0.27 -0.13 0.00 -0.00 0.00 0.00 57.45 57.77 2qct n PHE 256 Cb 0.73 -1.62 -0.06 0.00 -0.00 0.00 0.00 39.48 38.52 2qct n PHE 256 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2qct s SER 257 N -1.05 -0.60 0.28 -2.13 0.15 -1.26 -5.01 113.70 104.08 2qct s SER 257 Ca 0.52 0.97 0.02 0.00 0.70 0.00 0.00 55.95 58.16 2qct s SER 257 Cb -0.37 0.92 0.41 0.00 -1.71 0.00 0.00 66.02 65.27 2qct s SER 257 CO 0.71 -0.33 1.73 0.58 1.20 0.00 0.00 173.24 177.13 2qct h VAL 258 N 3.44 1.26 0.76 4.45 2.07 -1.98 -2.29 116.25 123.97 2qct h VAL 258 Ca -0.27 -1.24 -0.04 0.00 0.82 0.00 0.00 66.70 65.98 2qct h VAL 258 Cb 1.16 1.32 0.01 0.00 -1.52 0.00 0.00 31.29 32.25 2qct h VAL 258 CO 0.19 0.39 -0.37 0.15 0.02 0.00 0.00 177.57 177.95 2qct h PHE 259 N 0.44 -0.95 -0.72 1.57 3.57 -1.98 -2.55 116.94 116.32 2qct h PHE 259 Ca 0.07 -0.02 0.14 0.00 3.53 0.00 0.00 57.97 61.68 2qct h PHE 259 Cb 0.65 0.31 -0.14 0.00 2.79 0.00 0.00 35.95 39.57 2qct h PHE 259 CO 0.02 -0.59 -0.25 0.77 -2.23 0.00 0.00 178.31 176.03 2qct h SER 260 N -1.15 -0.89 -0.39 0.41 0.02 -1.94 -1.01 113.55 108.60 2qct h SER 260 Ca -0.10 0.23 0.07 0.00 -0.84 0.00 0.00 61.79 61.15 2qct h SER 260 Cb 0.79 0.52 -0.07 0.00 0.14 0.00 0.00 62.40 63.78 2qct h SER 260 CO 0.17 -0.27 -0.01 0.25 -1.14 0.00 0.00 176.83 175.83 2qct h LEU 261 N -0.05 -0.19 -0.90 5.07 5.85 -1.40 -2.13 115.31 121.56 2qct h LEU 261 Ca 0.32 0.09 -0.09 0.00 0.84 0.00 0.00 57.88 59.04 2qct h LEU 261 Cb 0.55 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 2qct h LEU 261 CO -0.76 -0.06 -0.18 0.40 -0.34 0.00 0.00 178.44 177.51 2qct h ILE 262 N 0.09 1.26 0.02 4.05 1.08 -0.87 -1.93 117.51 121.20 2qct h ILE 262 Ca 0.19 -1.19 0.03 0.00 -0.39 0.00 0.00 64.86 63.50 2qct h ILE 262 Cb 0.28 1.19 -0.05 0.00 -3.07 0.00 0.00 36.82 35.16 2qct h ILE 262 CO -0.33 0.39 -0.46 -0.09 -0.69 0.00 0.00 178.15 176.97 2qct h ARG 263 N 0.55 -0.60 -0.05 2.37 9.65 -0.53 0.35 114.38 126.12 2qct h ARG 263 Ca 0.09 0.04 -0.21 0.00 -1.10 0.00 0.00 59.98 58.81 2qct h ARG 263 Cb 0.61 0.14 -0.00 0.00 -1.39 0.00 0.00 29.97 29.33 2qct h ARG 263 CO 0.04 -0.40 -0.83 1.05 2.80 0.00 0.00 179.97 182.63 2qct h GLU 264 N -0.62 0.43 -0.30 0.20 4.11 -1.55 -2.31 114.58 114.54 2qct h GLU 264 Ca 0.03 -0.40 0.01 0.00 0.07 0.00 0.00 59.36 59.07 2qct h GLU 264 Cb 0.69 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.02 2qct h GLU 264 CO -0.32 1.05 0.20 1.98 0.07 0.00 0.00 179.01 181.99 2qct h MET 265 N 0.27 0.37 0.00 1.06 4.05 -1.13 0.90 114.93 120.45 2qct h MET 265 Ca -0.05 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.34 2qct h MET 265 Cb 1.44 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 32.15 2qct h MET 265 CO 0.14 0.24 0.00 0.54 0.23 0.00 0.00 176.91 178.07 2qct n ARG 266 N -4.49 0.78 0.02 0.39 1.74 0.12 -2.11 116.66 113.12 2qct n ARG 266 Ca 0.02 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.14 2qct n ARG 266 Cb 0.09 -1.39 -0.09 0.00 -1.02 0.00 0.00 32.46 30.05 2qct n ARG 266 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2qct n THR 267 N -0.89 0.78 0.03 0.55 -1.04 0.31 -4.37 114.28 109.66 2qct n THR 267 Ca 0.14 -0.63 -0.20 0.00 -2.04 0.00 0.00 64.05 61.33 2qct n THR 267 Cb 0.07 -0.43 -0.14 0.00 -1.82 0.00 0.00 70.33 68.01 2qct n THR 267 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 2qct h GLN 268 N 0.00 0.27 -3.92 -2.82 4.20 -1.31 -3.47 115.11 108.07 2qct h GLN 268 Ca -0.13 -0.46 -0.34 0.00 0.06 0.00 0.00 58.65 57.78 2qct h GLN 268 Cb 1.37 0.17 -0.32 0.00 0.30 0.00 0.00 27.48 29.00 2qct h GLN 268 CO 0.02 1.15 -0.75 0.50 -0.67 0.00 0.00 178.83 179.08 2qct s ARG 269 N -2.58 0.38 0.20 1.46 3.52 -1.19 -4.44 118.95 116.31 2qct s ARG 269 Ca -0.17 -0.03 -0.32 0.00 -0.13 0.00 0.00 55.73 55.08 2qct s ARG 269 Cb 0.06 -0.47 -0.13 0.00 -1.56 0.00 0.00 34.95 32.86 2qct s ARG 269 CO 0.81 -0.05 1.61 -0.35 -0.81 0.00 0.00 175.30 176.52 2qct n PRO 270 N 3.71 2.43 -3.72 5.12 -0.04 -1.26 -3.12 135.00 138.12 2qct n PRO 270 Ca -0.22 0.87 -0.23 0.00 -0.04 0.00 0.00 63.50 63.89 2qct n PRO 270 Cb 0.53 -2.66 0.03 0.00 -0.04 0.00 0.00 33.50 31.36 2qct n PRO 270 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2qct n SER 271 N 3.32 -1.69 0.00 3.54 7.64 -1.26 -4.84 113.62 120.33 2qct n SER 271 Ca 0.15 -0.87 0.00 0.00 1.01 0.00 0.00 58.87 59.16 2qct n SER 271 Cb 0.32 -3.85 0.02 0.00 -1.01 0.00 0.00 64.21 59.69 2qct n SER 271 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2qct n LEU 272 N -4.24 0.01 -3.33 -3.43 4.77 -1.18 -3.61 117.00 105.99 2qct n LEU 272 Ca -0.27 0.50 -0.09 0.00 -0.03 0.00 0.00 56.01 56.12 2qct n LEU 272 Cb 0.67 -0.50 -0.07 0.00 -2.33 0.00 0.00 43.42 41.18 2qct n LEU 272 CO 0.69 -0.51 -0.06 -0.69 -1.33 0.00 0.00 177.39 175.50 2qct s VAL 273 N -3.00 -0.61 -2.56 4.08 1.01 -1.15 -2.45 120.40 115.72 2qct s VAL 273 Ca -0.00 -0.15 0.24 0.00 0.00 0.00 0.00 61.98 62.08 2qct s VAL 273 Cb 0.00 -0.87 0.19 0.00 0.00 0.00 0.00 36.38 35.70 2qct s VAL 273 CO 0.01 -0.18 1.30 0.00 0.00 0.00 0.00 175.10 176.23 2qct n GLN 274 N 5.36 1.80 -4.10 2.72 10.64 -1.24 -4.95 117.38 127.62 2qct n GLN 274 Ca -0.02 -1.42 -0.14 0.00 -1.83 0.00 0.00 57.00 53.58 2qct n GLN 274 Cb 0.50 -1.47 -0.12 0.00 -0.86 0.00 0.00 30.24 28.29 2qct n GLN 274 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 2qct s THR 275 N -2.18 0.63 0.29 -0.39 -4.23 -1.26 -5.03 115.64 103.47 2qct s THR 275 Ca 0.26 -1.01 -0.02 0.00 -1.18 0.00 0.00 61.69 59.74 2qct s THR 275 Cb 0.20 -0.66 0.27 0.00 1.34 0.00 0.00 72.50 73.64 2qct s THR 275 CO 0.40 -0.28 1.94 -0.61 -0.54 0.00 0.00 174.62 175.53 2qct h GLN 276 N 4.67 1.13 -0.26 3.99 4.15 -1.97 -0.54 115.11 126.28 2qct h GLN 276 Ca -0.36 -0.07 0.05 0.00 0.77 0.00 0.00 58.65 59.04 2qct h GLN 276 Cb 1.20 -0.26 -0.04 0.00 0.21 0.00 0.00 27.48 28.59 2qct h GLN 276 CO 0.42 0.75 -0.01 0.93 -1.93 0.00 0.00 178.83 178.99 2qct h GLU 277 N 1.17 0.06 -0.74 1.69 3.07 -1.99 0.19 114.58 118.03 2qct h GLU 277 Ca 0.35 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 59.20 2qct h GLU 277 Cb -0.05 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 27.81 2qct h GLU 277 CO -0.09 0.04 0.44 1.96 -1.40 0.00 0.00 179.01 179.96 2qct h GLN 278 N 0.06 1.00 -0.69 2.33 4.20 -1.70 -0.50 115.11 119.81 2qct h GLN 278 Ca 0.13 -0.09 -0.07 0.00 0.06 0.00 0.00 58.65 58.67 2qct h GLN 278 Cb 0.17 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 2qct h GLN 278 CO -0.22 0.71 0.14 -0.92 -0.67 0.00 0.00 178.83 177.87 2qct h TYR 279 N 1.02 1.19 -0.22 2.96 3.20 0.34 -2.15 116.97 123.31 2qct h TYR 279 Ca 0.27 -0.15 -0.20 0.00 3.14 0.00 0.00 58.73 61.79 2qct h TYR 279 Cb -0.03 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 37.91 2qct h TYR 279 CO 0.00 0.98 -0.64 0.93 -1.64 0.00 0.00 178.16 177.79 2qct h GLU 280 N 1.06 0.78 -0.54 1.82 5.08 -0.07 -2.75 114.58 119.97 2qct h GLU 280 Ca 0.21 -0.55 -0.01 0.00 -1.00 0.00 0.00 59.36 58.01 2qct h GLU 280 Cb 0.41 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 2qct h GLU 280 CO 0.01 1.17 0.28 1.25 -1.00 0.00 0.00 179.01 180.72 2qct h LEU 281 N 0.57 0.68 -1.23 1.33 7.12 -1.05 0.15 115.31 122.88 2qct h LEU 281 Ca -0.01 -0.11 0.19 0.00 0.13 0.00 0.00 57.88 58.08 2qct h LEU 281 Cb 1.25 -0.17 -0.09 0.00 -0.53 0.00 0.00 40.66 41.11 2qct h LEU 281 CO 0.13 0.60 0.61 0.58 -0.13 0.00 0.00 178.44 180.23 2qct h VAL 282 N 0.72 0.70 0.35 1.05 2.07 -1.30 -0.13 116.25 119.71 2qct h VAL 282 Ca 0.19 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2qct h VAL 282 Cb 0.08 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 29.89 2qct h VAL 282 CO -0.03 0.11 -0.17 0.22 0.02 0.00 0.00 177.57 177.73 2qct h TYR 283 N 0.62 -0.43 -0.04 1.57 3.20 -0.68 -2.89 116.97 118.33 2qct h TYR 283 Ca 0.53 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.40 2qct h TYR 283 Cb 1.01 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 39.42 2qct h TYR 283 CO -0.00 -0.27 0.16 -0.91 -1.64 0.00 0.00 178.16 175.50 2qct h ASN 284 N -1.01 0.00 0.86 -2.11 2.35 -0.61 0.59 115.58 115.65 2qct h ASN 284 Ca -0.05 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.52 2qct h ASN 284 Cb 0.36 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 2qct h ASN 284 CO 0.08 0.00 -0.85 0.00 -1.65 0.00 0.00 177.43 175.00 2qct h ALA 285 N 1.72 0.59 0.10 -0.83 0.00 -1.05 -2.39 119.26 117.39 2qct h ALA 285 Ca 0.02 -0.78 -0.23 0.00 0.00 0.00 0.00 54.91 53.92 2qct h ALA 285 Cb 0.34 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.02 2qct h ALA 285 CO -0.00 1.07 -0.96 0.28 0.00 0.00 0.00 179.25 179.64 2qct h VAL 286 N 0.00 1.39 -0.29 0.00 2.07 -0.69 -3.08 116.25 115.65 2qct h VAL 286 Ca -0.01 -2.40 0.07 0.00 0.82 0.00 0.00 66.70 65.18 2qct h VAL 286 Cb 1.51 2.85 -0.07 0.00 -1.52 0.00 0.00 31.29 34.07 2qct h VAL 286 CO 0.11 0.70 -0.16 0.25 0.02 0.00 0.00 177.57 178.50 2qct h LEU 287 N -0.03 -0.53 -0.81 2.57 5.85 -1.35 -1.59 115.31 119.42 2qct h LEU 287 Ca -0.15 0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.70 2qct h LEU 287 Cb 1.69 0.28 -0.04 0.00 0.37 0.00 0.00 40.66 42.96 2qct h LEU 287 CO 0.18 -0.20 0.53 -0.08 -0.34 0.00 0.00 178.44 178.54 2qct h GLU 288 N -0.12 1.05 -0.78 1.25 4.57 -1.52 0.15 114.58 119.19 2qct h GLU 288 Ca 0.15 -0.06 0.08 0.00 -1.18 0.00 0.00 59.36 58.35 2qct h GLU 288 Cb 0.36 -0.24 -0.06 0.00 -0.16 0.00 0.00 28.75 28.64 2qct h GLU 288 CO -0.37 0.70 0.45 -0.07 -1.18 0.00 0.00 179.01 178.54 2qct h LEU 289 N 1.09 0.66 -0.03 1.64 3.38 -1.24 0.64 115.31 121.45 2qct h LEU 289 Ca 0.30 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.26 2qct h LEU 289 Cb -0.11 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.55 2qct h LEU 289 CO -0.07 0.40 -0.16 -0.26 0.09 0.00 0.00 178.44 178.45 2qct h PHE 290 N 0.79 0.21 -0.96 1.13 0.05 -0.64 -3.05 116.94 114.47 2qct h PHE 290 Ca 0.36 -0.10 0.15 0.00 3.82 0.00 0.00 57.97 62.21 2qct h PHE 290 Cb 0.27 -0.03 -0.10 0.00 2.00 0.00 0.00 35.95 38.09 2qct h PHE 290 CO -0.06 0.81 0.57 0.87 -0.18 0.00 0.00 178.31 180.32 2qct h LYS 291 N -0.44 0.79 0.00 1.51 1.57 -0.36 -3.39 116.57 116.25 2qct h LYS 291 Ca -0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2qct h LYS 291 Cb 0.83 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.96 2qct h LYS 291 CO 0.03 0.52 0.00 0.54 -0.57 0.00 0.00 179.45 179.97 2qct n ARG 292 N -4.74 3.71 0.00 3.15 1.74 0.22 -4.55 116.66 116.19 2qct n ARG 292 Ca 0.20 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 2qct n ARG 292 Cb 0.46 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.90 2qct n ARG 292 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2qct n GLN 293 N 0.00 0.00 0.00 5.56 1.13 -1.20 -4.97 117.38 117.90 2qct n GLN 293 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2qct n GLN 293 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2qct n GLN 293 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29