#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3brg s PRO 54 N 0.00 4.64 -0.07 0.54 0.02 -1.26 -5.03 135.00 133.84 3brg s PRO 54 Ca 0.00 1.75 -0.04 0.00 0.02 0.00 0.00 61.00 62.74 3brg s PRO 54 Cb 0.00 -3.22 -0.04 0.00 0.02 0.00 0.00 34.50 31.26 3brg s PRO 54 CO 0.00 0.19 0.10 0.15 -0.33 0.00 0.00 177.00 177.11 3brg s LYS 55 N -1.09 3.24 0.51 5.54 3.01 -1.26 -4.91 119.74 124.78 3brg s LYS 55 Ca 0.46 -0.31 -0.21 0.00 -1.01 0.00 0.00 55.97 54.90 3brg s LYS 55 Cb -0.31 -3.00 -0.06 0.00 -1.01 0.00 0.00 37.83 33.45 3brg s LYS 55 CO 0.38 0.71 1.15 1.03 0.51 0.00 0.00 175.35 179.14 3brg s ARG 56 N -1.31 3.52 0.11 1.68 0.52 -1.22 -3.36 118.95 118.89 3brg s ARG 56 Ca 0.18 1.69 -0.31 0.00 -0.52 0.00 0.00 55.73 56.77 3brg s ARG 56 Cb -0.12 -2.17 -0.10 0.00 0.52 0.00 0.00 34.95 33.08 3brg s ARG 56 CO 0.08 -0.73 1.71 -1.17 0.02 0.00 0.00 175.30 175.21 3brg s LEU 57 N -3.47 4.38 0.35 2.53 2.96 -1.26 -4.86 118.68 119.29 3brg s LEU 57 Ca 0.69 2.64 -0.04 0.00 -0.22 0.00 0.00 54.13 57.19 3brg s LEU 57 Cb -0.26 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.81 3brg s LEU 57 CO 0.30 -0.93 0.61 0.42 -1.32 0.00 0.00 176.35 175.44 3brg s THR 58 N 2.33 5.00 0.42 3.68 -4.23 -1.26 -4.97 115.64 116.60 3brg s THR 58 Ca 0.76 0.02 0.08 0.00 -1.18 0.00 0.00 61.69 61.37 3brg s THR 58 Cb -0.43 -3.78 0.26 0.00 1.34 0.00 0.00 72.50 69.88 3brg s THR 58 CO 0.34 -0.48 2.06 0.03 -0.54 0.00 0.00 174.62 176.02 3brg h ARG 59 N 1.19 0.49 -0.35 3.99 3.08 -1.95 -1.85 114.38 118.98 3brg h ARG 59 Ca -0.48 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.47 3brg h ARG 59 Cb 1.20 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 3brg h ARG 59 CO 0.64 0.33 -0.05 1.49 -1.07 0.00 0.00 179.97 181.31 3brg h GLU 60 N 0.50 0.64 -0.35 0.04 4.81 -1.94 -1.52 114.58 116.77 3brg h GLU 60 Ca 0.13 -0.23 -0.07 0.00 -0.13 0.00 0.00 59.36 59.07 3brg h GLU 60 Cb -0.04 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 3brg h GLU 60 CO -0.03 0.79 -0.07 0.00 -0.73 0.00 0.00 179.01 178.97 3brg h ALA 61 N 0.83 1.23 -0.14 2.92 0.00 -1.76 -0.43 119.26 121.91 3brg h ALA 61 Ca 0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3brg h ALA 61 Cb 0.53 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3brg h ALA 61 CO 0.03 0.50 0.04 1.98 0.00 0.00 0.00 179.25 181.80 3brg h MET 62 N 0.54 0.22 -0.49 0.00 1.85 -1.17 -1.25 114.93 114.63 3brg h MET 62 Ca 0.10 -0.05 0.09 0.00 -0.61 0.00 0.00 59.70 59.24 3brg h MET 62 Cb 0.45 -0.03 -0.08 0.00 0.43 0.00 0.00 31.60 32.38 3brg h MET 62 CO 0.02 0.36 0.04 0.00 -0.40 0.00 0.00 176.91 176.93 3brg h ARG 63 N 0.04 0.15 -0.62 0.39 3.08 -1.05 0.66 114.38 117.03 3brg h ARG 63 Ca 0.05 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 3brg h ARG 63 Cb 0.23 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 3brg h ARG 63 CO -0.00 0.10 0.38 -0.91 -1.07 0.00 0.00 179.97 178.47 3brg h ASN 64 N 0.16 0.74 -0.08 7.04 -0.26 -0.86 -2.42 115.58 119.91 3brg h ASN 64 Ca 0.25 -0.05 -0.00 0.00 -0.56 0.00 0.00 56.30 55.94 3brg h ASN 64 Cb 0.36 -0.19 -0.00 0.00 -1.06 0.00 0.00 38.32 37.43 3brg h ASN 64 CO -0.38 0.57 0.04 0.22 -1.06 0.00 0.00 177.43 176.83 3brg h TYR 65 N 0.84 0.10 -0.49 1.19 3.20 -0.74 -2.73 116.97 118.35 3brg h TYR 65 Ca 0.22 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.19 3brg h TYR 65 Cb -0.04 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 3brg h TYR 65 CO -0.02 0.13 0.34 -0.07 -1.64 0.00 0.00 178.16 176.89 3brg h LEU 66 N 0.05 0.21 -0.38 2.82 4.07 -0.68 0.42 115.31 121.81 3brg h LEU 66 Ca 0.03 0.00 -0.17 0.00 0.08 0.00 0.00 57.88 57.82 3brg h LEU 66 Cb 0.06 -0.04 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 3brg h LEU 66 CO -0.00 0.13 -0.48 0.50 -1.08 0.00 0.00 178.44 177.51 3brg h LYS 67 N 0.23 0.85 0.00 1.13 3.64 -1.14 -3.40 116.57 117.89 3brg h LYS 67 Ca 0.23 -0.50 -0.33 0.00 -1.27 0.00 0.00 60.65 58.79 3brg h LYS 67 Cb 0.60 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.41 3brg h LYS 67 CO -0.04 1.14 -2.10 0.39 -2.27 0.00 0.00 179.45 176.56 3brg n GLU 68 N -4.02 0.42 -3.64 1.90 1.02 -0.89 -5.06 120.64 110.37 3brg n GLU 68 Ca -0.03 0.17 -0.21 0.00 -0.02 0.00 0.00 57.16 57.07 3brg n GLU 68 Cb 0.59 -1.23 0.05 0.00 -0.02 0.00 0.00 31.44 30.83 3brg n GLU 68 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3brg n ARG 69 N -3.76 -5.56 -1.53 3.49 1.74 0.14 -4.90 116.66 106.27 3brg n ARG 69 Ca -0.38 0.69 -0.39 0.00 -0.77 0.00 0.00 57.85 57.00 3brg n ARG 69 Cb 0.79 -5.42 -0.02 0.00 -1.02 0.00 0.00 32.46 26.78 3brg n ARG 69 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3brg n GLY 70 N -1.48 4.56 3.70 -0.13 0.00 -1.26 -4.86 105.19 105.71 3brg n GLY 70 Ca -0.26 -1.68 -0.32 0.00 0.00 0.00 0.00 46.02 43.76 3brg n GLY 70 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3brg s ASP 71 N 1.62 3.52 -0.19 1.61 1.01 -1.26 -3.23 116.67 119.76 3brg s ASP 71 Ca 0.65 2.23 -0.08 0.00 0.71 0.00 0.00 52.55 56.05 3brg s ASP 71 Cb 0.18 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.49 3brg s ASP 71 CO -0.07 -2.71 0.08 -1.10 0.21 0.00 0.00 175.17 171.58 3brg s GLN 72 N -4.39 4.03 -0.03 8.23 -0.21 0.40 -1.61 119.66 126.08 3brg s GLN 72 Ca 0.69 -0.30 0.07 0.00 0.02 0.00 0.00 55.36 55.84 3brg s GLN 72 Cb -0.25 -3.27 -0.02 0.00 1.00 0.00 0.00 33.01 30.47 3brg s GLN 72 CO 0.53 0.29 -0.23 0.99 -2.12 0.00 0.00 175.29 174.75 3brg s THR 73 N 0.34 1.82 -0.18 -0.19 2.01 -0.36 -0.99 115.64 118.09 3brg s THR 73 Ca 0.05 -0.98 -0.01 0.00 0.31 0.00 0.00 61.69 61.06 3brg s THR 73 Cb -0.12 -1.52 -0.01 0.00 0.01 0.00 0.00 72.50 70.86 3brg s THR 73 CO -0.01 0.51 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.64 3brg s VAL 74 N -0.44 3.00 -0.09 3.82 1.01 0.05 -1.01 120.40 126.74 3brg s VAL 74 Ca 0.06 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 3brg s VAL 74 Cb -0.10 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 3brg s VAL 74 CO 0.00 0.48 -0.05 -0.76 0.00 0.00 0.00 175.10 174.78 3brg s LEU 75 N 0.99 3.27 -0.23 3.92 1.43 0.10 -0.73 118.68 127.44 3brg s LEU 75 Ca -0.01 -0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 3brg s LEU 75 Cb -0.15 -1.74 0.03 0.00 0.03 0.00 0.00 46.19 44.37 3brg s LEU 75 CO -0.01 0.32 -0.11 -0.63 0.23 0.00 0.00 176.35 176.14 3brg s ILE 76 N -0.52 2.50 -0.14 -0.59 1.01 0.14 -0.80 121.20 122.80 3brg s ILE 76 Ca 0.08 -1.13 -0.04 0.00 0.00 0.00 0.00 60.65 59.56 3brg s ILE 76 Cb -0.12 -2.25 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 3brg s ILE 76 CO 0.02 0.25 -0.02 -0.76 0.00 0.00 0.00 174.94 174.43 3brg s LEU 77 N 1.27 3.37 0.10 2.97 1.43 0.37 -1.23 118.68 126.96 3brg s LEU 77 Ca -0.00 -0.05 -0.25 0.00 -1.03 0.00 0.00 54.13 52.79 3brg s LEU 77 Cb -0.16 -1.81 0.07 0.00 0.03 0.00 0.00 46.19 44.32 3brg s LEU 77 CO -0.07 0.21 0.62 -1.38 0.23 0.00 0.00 176.35 175.97 3brg s HIS 78 N 0.10 -0.57 0.61 0.29 -3.43 -1.07 -0.03 115.29 111.19 3brg s HIS 78 Ca 0.00 0.54 -0.17 0.00 -0.80 0.00 0.00 55.06 54.63 3brg s HIS 78 Cb -0.13 0.52 -0.02 0.00 -1.43 0.00 0.00 32.58 31.51 3brg s HIS 78 CO 0.02 -0.78 1.15 0.00 -2.00 0.00 0.00 174.74 173.13 3brg s ALA 79 N -3.07 2.52 -1.39 -1.38 0.00 -1.26 -0.54 121.76 116.64 3brg s ALA 79 Ca -0.02 0.80 0.29 0.00 0.00 0.00 0.00 51.96 53.03 3brg s ALA 79 Cb -0.01 -3.39 1.33 0.00 0.00 0.00 0.00 23.12 21.05 3brg s ALA 79 CO -0.07 -1.16 1.94 1.63 0.00 0.00 0.00 175.76 178.10 3brg n LYS 80 N -1.88 0.40 -4.00 0.00 5.02 -0.20 -4.77 118.16 112.74 3brg n LYS 80 Ca 0.12 -0.07 -0.11 0.00 -2.02 0.00 0.00 58.31 56.23 3brg n LYS 80 Cb 0.51 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.90 3brg n LYS 80 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3brg s VAL 81 N -2.64 0.23 -0.02 -0.18 1.01 -1.26 -1.09 120.40 116.44 3brg s VAL 81 Ca 0.25 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.48 3brg s VAL 81 Cb 0.20 -0.32 0.01 0.00 0.00 0.00 0.00 36.38 36.27 3brg s VAL 81 CO 0.49 -0.35 -0.04 0.00 0.00 0.00 0.00 175.10 175.21 3brg s ALA 82 N -1.12 0.47 -0.10 5.51 0.00 -0.24 -4.88 121.76 121.40 3brg s ALA 82 Ca -0.11 -0.09 -0.27 0.00 0.00 0.00 0.00 51.96 51.50 3brg s ALA 82 Cb -0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.78 3brg s ALA 82 CO -0.00 0.04 0.88 -1.14 0.00 0.00 0.00 175.76 175.53 3brg s GLN 83 N 0.40 4.41 0.59 0.00 0.74 -1.26 -0.16 119.66 124.38 3brg s GLN 83 Ca -0.04 1.17 -0.18 0.00 0.05 0.00 0.00 55.36 56.35 3brg s GLN 83 Cb -0.08 -3.52 -0.04 0.00 1.10 0.00 0.00 33.01 30.48 3brg s GLN 83 CO -0.00 -0.19 1.15 -1.59 -0.55 0.00 0.00 175.29 174.11 3brg s LYS 84 N 1.61 3.07 -0.13 1.67 -2.85 -0.09 -4.67 119.74 118.35 3brg s LYS 84 Ca 0.43 1.65 -0.12 0.00 -1.00 0.00 0.00 55.97 56.94 3brg s LYS 84 Cb -0.18 -1.96 -0.05 0.00 -2.06 0.00 0.00 37.83 33.58 3brg s LYS 84 CO 0.18 -1.09 0.25 -1.12 0.10 0.00 0.00 175.35 173.67 3brg s SER 85 N -1.87 6.45 0.09 0.03 0.01 -0.05 -4.89 113.70 113.48 3brg s SER 85 Ca 0.73 0.53 0.02 0.00 1.31 0.00 0.00 55.95 58.54 3brg s SER 85 Cb -0.26 -2.15 -0.04 0.00 0.21 0.00 0.00 66.02 63.78 3brg s SER 85 CO 0.32 0.23 0.19 -0.31 0.41 0.00 0.00 173.24 174.08 3brg s TYR 86 N -0.19 3.41 0.00 2.43 1.51 -1.26 -0.89 117.35 122.37 3brg s TYR 86 Ca 0.16 0.17 0.00 0.00 -1.01 0.00 0.00 57.07 56.39 3brg s TYR 86 Cb -0.13 -1.69 0.00 0.00 -0.11 0.00 0.00 41.96 40.03 3brg s TYR 86 CO 0.05 0.56 0.00 0.41 -1.11 0.00 0.00 175.55 175.45 3brg n GLY 87 N 0.13 3.47 0.61 0.71 0.00 -1.26 -1.38 105.19 107.47 3brg n GLY 87 Ca -0.06 -0.13 0.08 0.00 0.00 0.00 0.00 46.02 45.90 3brg n GLY 87 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3brg n ASN 88 N 4.23 1.80 -4.72 1.61 4.13 -1.26 -4.93 115.26 116.12 3brg n ASN 88 Ca 0.00 -1.87 -0.38 0.00 1.68 0.00 0.00 54.58 54.01 3brg n ASN 88 Cb 0.00 -0.18 0.06 0.00 -1.54 0.00 0.00 39.78 38.11 3brg n ASN 88 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3brg n GLU 89 N 0.45 1.31 -3.95 3.52 1.02 -0.48 -5.04 120.64 117.46 3brg n GLU 89 Ca 0.14 0.50 -0.31 0.00 -0.02 0.00 0.00 57.16 57.47 3brg n GLU 89 Cb 0.31 -2.49 -0.15 0.00 -0.02 0.00 0.00 31.44 29.09 3brg n GLU 89 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3brg s LYS 90 N -3.08 1.52 -0.53 3.49 1.02 -1.26 -4.64 119.74 116.26 3brg s LYS 90 Ca 0.77 -1.37 -0.13 0.00 0.02 0.00 0.00 55.97 55.27 3brg s LYS 90 Cb -0.40 -2.75 0.13 0.00 -0.52 0.00 0.00 37.83 34.29 3brg s LYS 90 CO 0.45 -0.78 0.45 1.03 -0.92 0.00 0.00 175.35 175.58 3brg s ARG 91 N 1.21 2.80 0.35 1.68 0.52 -1.26 -5.06 118.95 119.19 3brg s ARG 91 Ca 0.02 -1.79 -0.28 0.00 -0.52 0.00 0.00 55.73 53.15 3brg s ARG 91 Cb -0.19 -4.14 -0.11 0.00 0.52 0.00 0.00 34.95 31.04 3brg s ARG 91 CO -0.10 -1.27 1.39 -0.06 0.02 0.00 0.00 175.30 175.28 3brg s PHE 92 N 1.38 2.84 0.14 -0.53 2.99 -1.26 -4.58 117.98 118.97 3brg s PHE 92 Ca 0.05 1.31 -0.35 0.00 0.00 0.00 0.00 56.93 57.94 3brg s PHE 92 Cb -0.27 -3.83 -0.15 0.00 0.00 0.00 0.00 43.02 38.77 3brg s PHE 92 CO 0.01 -2.36 1.46 1.19 -0.00 0.00 0.00 175.22 175.51 3brg n PHE 93 N 0.64 1.93 -3.74 0.36 0.99 0.41 -4.99 117.46 113.07 3brg n PHE 93 Ca 0.00 0.44 -0.15 0.00 -0.00 0.00 0.00 57.45 57.75 3brg n PHE 93 Cb 0.41 -2.44 -0.15 0.00 -1.00 0.00 0.00 39.48 36.29 3brg n PHE 93 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3brg s PRO 95 N 1.30 2.45 0.17 0.00 0.04 -1.26 -4.93 135.00 132.77 3brg s PRO 95 Ca -0.07 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.02 3brg s PRO 95 Cb -0.12 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.43 3brg s PRO 95 CO -0.05 -1.52 1.30 -1.25 0.04 0.00 0.00 177.00 175.53 3brg s PRO 96 N -4.38 4.39 0.36 0.56 0.04 -1.24 -4.57 135.00 130.16 3brg s PRO 96 Ca 0.66 2.01 -0.26 0.00 0.04 0.00 0.00 61.00 63.44 3brg s PRO 96 Cb -0.20 -3.22 -0.12 0.00 0.04 0.00 0.00 34.50 30.99 3brg s PRO 96 CO 0.48 -0.27 1.10 -2.30 0.04 0.00 0.00 177.00 176.05 3brg n PRO 97 N 3.00 1.60 -4.92 0.56 -0.02 -1.25 -4.52 135.00 129.45 3brg n PRO 97 Ca 0.07 0.57 -0.28 0.00 -2.02 0.00 0.00 63.50 61.84 3brg n PRO 97 Cb 0.43 -2.08 -0.17 0.00 -0.02 0.00 0.00 33.50 31.66 3brg n PRO 97 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3brg s VAL 99 N 0.43 4.92 -0.10 0.00 1.01 -0.61 -0.48 120.40 125.57 3brg s VAL 99 Ca -0.15 0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.88 3brg s VAL 99 Cb -0.16 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 3brg s VAL 99 CO 0.06 0.35 -0.17 -0.31 0.00 0.00 0.00 175.10 175.03 3brg s TYR 100 N 1.19 2.68 -0.39 5.22 1.51 0.02 -1.67 117.35 125.91 3brg s TYR 100 Ca 0.06 -0.64 -0.17 0.00 -1.01 0.00 0.00 57.07 55.31 3brg s TYR 100 Cb -0.14 -1.73 0.01 0.00 -0.11 0.00 0.00 41.96 39.98 3brg s TYR 100 CO 0.05 -0.18 0.41 -0.51 -1.11 0.00 0.00 175.55 174.21 3brg s LEU 101 N 0.05 4.70 0.23 -1.29 1.43 0.19 -0.72 118.68 123.27 3brg s LEU 101 Ca -0.07 -0.50 0.09 0.00 -1.03 0.00 0.00 54.13 52.62 3brg s LEU 101 Cb -0.15 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.65 3brg s LEU 101 CO 0.05 -0.49 -0.04 -0.04 0.23 0.00 0.00 176.35 176.06 3brg s MET 102 N 2.10 2.21 0.00 1.70 -1.94 -0.18 -4.90 119.30 118.30 3brg s MET 102 Ca 0.12 -1.35 0.00 0.00 -1.71 0.00 0.00 55.69 52.75 3brg s MET 102 Cb -0.17 -2.17 0.00 0.00 2.01 0.00 0.00 34.83 34.50 3brg s MET 102 CO 0.13 0.39 0.00 0.41 -0.01 0.00 0.00 175.02 175.94 3brg n GLY 103 N -0.52 1.84 0.01 -0.03 0.00 -1.26 -1.23 105.19 104.01 3brg n GLY 103 Ca -0.08 -1.87 0.14 0.00 0.00 0.00 0.00 46.02 44.21 3brg n GLY 103 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3brg n SER 104 N -0.15 0.18 0.24 1.61 3.41 -1.23 -3.85 113.62 113.83 3brg n SER 104 Ca 0.00 0.14 0.12 0.00 -0.26 0.00 0.00 58.87 58.87 3brg n SER 104 Cb 0.00 -0.25 0.58 0.00 -0.26 0.00 0.00 64.21 64.28 3brg n SER 104 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3brg h GLY 105 N 5.00 0.00 0.90 5.00 0.00 -1.27 -2.81 103.07 109.88 3brg h GLY 105 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3brg h GLY 105 CO 0.00 0.00 0.09 1.49 0.00 0.00 0.00 176.54 178.12 3brg h TRP 106 N 0.00 0.37 -0.31 5.60 4.06 -1.77 0.93 115.95 124.82 3brg h TRP 106 Ca -0.00 -0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.90 3brg h TRP 106 Cb 0.59 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 28.63 3brg h TRP 106 CO 0.00 0.39 0.10 -0.22 -3.56 0.00 0.00 178.44 175.16 3brg h LYS 107 N 0.24 0.48 -0.34 0.49 3.64 -1.79 -1.53 116.57 117.75 3brg h LYS 107 Ca 0.08 -0.10 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 3brg h LYS 107 Cb 0.18 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 3brg h LYS 107 CO -0.01 0.51 0.16 0.87 -2.27 0.00 0.00 179.45 178.72 3brg h LYS 108 N 0.34 0.32 -0.61 1.90 1.57 -1.45 -0.93 116.57 117.71 3brg h LYS 108 Ca 0.10 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.91 3brg h LYS 108 Cb 0.23 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.42 3brg h LYS 108 CO -0.00 0.21 0.33 -0.22 -0.57 0.00 0.00 179.45 179.20 3brg h LYS 109 N 0.33 0.60 -0.36 3.15 1.63 -0.74 -0.86 116.57 120.33 3brg h LYS 109 Ca 0.14 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.90 3brg h LYS 109 Cb 0.07 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.55 3brg h LYS 109 CO -0.11 0.40 0.19 -0.22 -3.45 0.00 0.00 179.45 176.26 3brg h LYS 110 N 0.62 0.50 -0.67 1.90 3.64 -0.88 -0.89 116.57 120.79 3brg h LYS 110 Ca 0.27 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.54 3brg h LYS 110 Cb 0.16 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 3brg h LYS 110 CO -0.17 0.42 0.24 0.93 -2.27 0.00 0.00 179.45 178.60 3brg h GLU 111 N 0.45 1.01 -0.09 1.90 5.08 -0.96 -2.01 114.58 119.97 3brg h GLU 111 Ca 0.13 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3brg h GLU 111 Cb 0.07 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 3brg h GLU 111 CO -0.02 0.84 0.04 0.37 -1.00 0.00 0.00 179.01 179.24 3brg h GLN 112 N 0.98 0.12 -0.92 2.33 -0.00 -0.79 -1.56 115.11 115.28 3brg h GLN 112 Ca 0.22 -0.02 0.01 0.00 -0.00 0.00 0.00 58.65 58.86 3brg h GLN 112 Cb 0.23 -0.02 -0.05 0.00 0.00 0.00 0.00 27.48 27.65 3brg h GLN 112 CO -0.01 0.21 0.61 0.52 0.00 0.00 0.00 178.83 180.15 3brg h MET 113 N 0.01 1.21 -0.11 1.69 2.86 -1.06 -2.10 114.93 117.44 3brg h MET 113 Ca 0.03 -0.07 -0.17 0.00 -2.06 0.00 0.00 59.70 57.42 3brg h MET 113 Cb 0.13 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 3brg h MET 113 CO -0.00 0.80 -0.67 0.93 1.06 0.00 0.00 176.91 179.03 3brg h GLU 114 N 1.24 0.43 -0.90 1.72 5.08 -1.31 -0.48 114.58 120.36 3brg h GLU 114 Ca 0.34 -0.32 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3brg h GLU 114 Cb -0.14 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 3brg h GLU 114 CO -0.07 0.94 0.53 -0.09 -1.00 0.00 0.00 179.01 179.32 3brg h ARG 115 N 0.31 1.23 0.00 2.33 9.65 -1.05 -2.05 114.38 124.79 3brg h ARG 115 Ca -0.02 -0.12 0.00 0.00 -1.10 0.00 0.00 59.98 58.74 3brg h ARG 115 Cb 1.22 -0.25 0.00 0.00 -1.39 0.00 0.00 29.97 29.55 3brg h ARG 115 CO 0.12 0.87 0.00 -0.25 2.80 0.00 0.00 179.97 183.51 3brg n ASP 116 N -4.35 0.00 0.00 -3.80 10.43 -0.81 -4.89 116.55 113.13 3brg n ASP 116 Ca 0.10 -0.85 0.00 0.00 2.57 0.00 0.00 54.79 56.61 3brg n ASP 116 Cb 0.07 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.03 3brg n ASP 116 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3brg n GLY 117 N 0.64 0.88 3.77 0.44 0.00 -0.77 -5.07 105.19 105.08 3brg n GLY 117 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 3brg n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3brg s SER 119 N -0.95 2.34 0.17 0.00 1.04 -1.26 -4.25 113.70 110.78 3brg s SER 119 Ca 0.54 0.49 -0.14 0.00 0.48 0.00 0.00 55.95 57.32 3brg s SER 119 Cb -0.33 -0.68 0.05 0.00 0.10 0.00 0.00 66.02 65.16 3brg s SER 119 CO 0.42 -3.24 1.80 -0.33 0.98 0.00 0.00 173.24 172.88 3brg h GLU 120 N -1.98 0.69 -0.17 4.02 5.08 -1.98 -2.29 114.58 117.94 3brg h GLU 120 Ca -0.45 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 57.78 3brg h GLU 120 Cb 1.27 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 3brg h GLU 120 CO 0.40 0.50 -0.17 -0.56 -1.00 0.00 0.00 179.01 178.18 3brg h GLN 121 N 0.68 0.29 0.00 2.33 -0.00 -1.96 -2.08 115.11 114.37 3brg h GLN 121 Ca 0.18 -0.08 -0.10 0.00 -0.00 0.00 0.00 58.65 58.65 3brg h GLN 121 Cb -0.01 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.48 27.42 3brg h GLN 121 CO -0.03 0.46 -0.49 0.93 -0.00 0.00 0.00 178.83 179.70 3brg h GLU 122 N 0.27 0.00 0.00 0.06 5.08 -1.79 -2.93 114.58 115.27 3brg h GLU 122 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3brg h GLU 122 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3brg h GLU 122 CO 0.03 0.49 -0.49 -1.13 -1.00 0.00 0.00 179.01 176.90 3brg n SER 123 N -3.89 0.49 -4.67 1.42 3.41 -0.88 -1.92 113.62 107.58 3brg n SER 123 Ca -0.01 -0.20 -0.42 0.00 -0.26 0.00 0.00 58.87 57.97 3brg n SER 123 Cb 0.51 0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.66 3brg n SER 123 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3brg s GLN 124 N -3.01 4.20 0.25 4.33 2.00 -0.81 -4.72 119.66 121.90 3brg s GLN 124 Ca 0.11 2.16 -0.30 0.00 -2.00 0.00 0.00 55.36 55.33 3brg s GLN 124 Cb 0.17 -3.83 -0.10 0.00 0.80 0.00 0.00 33.01 30.06 3brg s GLN 124 CO 0.70 -0.77 1.36 -2.14 -0.50 0.00 0.00 175.29 173.94 3brg s PRO 125 N 3.44 4.33 0.14 1.67 0.02 -1.26 -0.14 135.00 143.20 3brg s PRO 125 Ca 0.71 2.19 0.10 0.00 0.02 0.00 0.00 61.00 64.02 3brg s PRO 125 Cb -0.34 -3.13 -0.04 0.00 0.02 0.00 0.00 34.50 31.01 3brg s PRO 125 CO 0.29 -0.31 -0.24 0.00 -0.33 0.00 0.00 177.00 176.41 3brg s ALA 127 N -1.25 -0.19 0.10 0.00 0.00 -1.26 -1.78 121.76 117.38 3brg s ALA 127 Ca 0.13 0.27 0.10 0.00 0.00 0.00 0.00 51.96 52.46 3brg s ALA 127 Cb -0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.82 3brg s ALA 127 CO 0.06 -0.05 -0.25 -0.06 0.00 0.00 0.00 175.76 175.46 3brg s PHE 128 N 0.19 2.16 0.02 0.00 0.40 0.08 -0.49 117.98 120.34 3brg s PHE 128 Ca -0.01 -0.39 0.04 0.00 -0.60 0.00 0.00 56.93 55.96 3brg s PHE 128 Cb -0.02 -1.21 -0.02 0.00 0.51 0.00 0.00 43.02 42.29 3brg s PHE 128 CO -0.01 0.25 -0.12 -1.50 0.70 0.00 0.00 175.22 174.54 3brg s ILE 129 N -1.01 0.92 0.17 0.64 2.07 -0.00 -0.28 121.20 123.71 3brg s ILE 129 Ca 0.11 -0.75 -0.03 0.00 -1.41 0.00 0.00 60.65 58.58 3brg s ILE 129 Cb -0.10 -0.82 0.01 0.00 0.13 0.00 0.00 42.46 41.68 3brg s ILE 129 CO 0.04 0.07 0.26 0.61 -1.91 0.00 0.00 174.94 174.02 3brg n GLY 130 N 2.29 2.31 1.80 1.50 0.00 -0.60 -0.59 105.19 111.89 3brg n GLY 130 Ca -0.16 -1.37 -0.16 0.00 0.00 0.00 0.00 46.02 44.33 3brg n GLY 130 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3brg n ILE 131 N -0.26 2.94 -0.01 -0.61 -5.35 -1.26 -0.98 119.36 113.83 3brg n ILE 131 Ca -0.01 -2.25 0.00 0.00 -0.27 0.00 0.00 62.75 60.22 3brg n ILE 131 Cb 0.27 -0.41 0.00 0.00 -1.74 0.00 0.00 39.64 37.76 3brg n ILE 131 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3brg n GLY 132 N -1.12 0.99 0.00 3.28 0.00 -1.25 -4.68 105.19 102.41 3brg n GLY 132 Ca 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.50 3brg n GLY 132 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3brg n ASN 133 N 0.02 0.00 -4.48 1.61 2.04 -1.26 -5.00 115.26 108.20 3brg n ASN 133 Ca 0.00 0.00 -0.30 0.00 -0.44 0.00 0.00 54.58 53.84 3brg n ASN 133 Cb 0.00 0.00 0.20 0.00 -2.53 0.00 0.00 39.78 37.45 3brg n ASN 133 CO 0.00 0.00 0.00 -0.24 -0.44 0.00 0.00 177.26 176.58 3brg n SER 134 N 0.00 -1.40 0.00 0.53 2.88 -1.26 -4.93 113.62 109.44 3brg n SER 134 Ca 0.00 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 3brg n SER 134 Cb 0.00 -1.25 0.00 0.00 -0.75 0.00 0.00 64.21 62.21 3brg n SER 134 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3brg n ASP 135 N -3.71 0.00 -2.08 -3.46 9.92 -1.26 -4.76 116.55 111.21 3brg n ASP 135 Ca 0.05 0.00 -0.09 0.00 -0.53 0.00 0.00 54.79 54.23 3brg n ASP 135 Cb 0.55 0.00 -0.12 0.00 -0.64 0.00 0.00 41.12 40.91 3brg n ASP 135 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3brg n GLN 136 N 0.00 1.48 -0.17 -1.24 1.13 -1.26 -3.58 117.38 113.73 3brg n GLN 136 Ca 0.00 -0.71 0.01 0.00 -1.94 0.00 0.00 57.00 54.36 3brg n GLN 136 Cb 0.00 -1.83 0.07 0.00 0.11 0.00 0.00 30.24 28.60 3brg n GLN 136 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 3brg n GLU 137 N 2.54 1.71 -2.90 -1.09 2.13 -1.26 -4.91 120.64 116.85 3brg n GLU 137 Ca 0.31 -0.59 -0.39 0.00 0.66 0.00 0.00 57.16 57.14 3brg n GLU 137 Cb 0.68 -1.62 -0.06 0.00 0.27 0.00 0.00 31.44 30.71 3brg n GLU 137 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 3brg s MET 138 N -1.29 4.63 -0.13 5.31 -1.94 -1.24 -4.84 119.30 119.81 3brg s MET 138 Ca 0.10 1.25 -0.06 0.00 -1.71 0.00 0.00 55.69 55.27 3brg s MET 138 Cb 0.08 -3.20 -0.04 0.00 2.01 0.00 0.00 34.83 33.68 3brg s MET 138 CO 0.03 0.52 0.10 -0.65 -0.01 0.00 0.00 175.02 175.01 3brg s GLN 139 N -1.29 3.48 0.25 2.03 -0.21 0.24 -4.83 119.66 119.33 3brg s GLN 139 Ca 0.39 -0.23 -0.30 0.00 0.02 0.00 0.00 55.36 55.24 3brg s GLN 139 Cb -0.23 -3.13 -0.09 0.00 1.00 0.00 0.00 33.01 30.56 3brg s GLN 139 CO 0.27 0.65 1.14 -1.14 -2.12 0.00 0.00 175.29 174.09 3brg s GLN 140 N -0.68 4.58 -0.01 2.91 0.74 -1.26 -0.82 119.66 125.12 3brg s GLN 140 Ca 0.12 1.84 0.01 0.00 0.05 0.00 0.00 55.36 57.39 3brg s GLN 140 Cb -0.12 -3.20 -0.04 0.00 1.10 0.00 0.00 33.01 30.75 3brg s GLN 140 CO 0.03 0.10 0.02 -0.51 -0.55 0.00 0.00 175.29 174.37 3brg s LEU 141 N -1.06 3.60 -0.31 3.68 1.43 0.36 -4.93 118.68 121.45 3brg s LEU 141 Ca 0.47 0.03 -0.12 0.00 -1.03 0.00 0.00 54.13 53.48 3brg s LEU 141 Cb -0.32 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 43.80 3brg s LEU 141 CO 0.40 0.28 0.23 0.21 0.23 0.00 0.00 176.35 177.70 3brg s ASN 142 N -1.57 6.05 0.00 2.29 2.47 -1.26 -4.34 114.94 118.58 3brg s ASN 142 Ca 0.20 -0.22 0.17 0.00 0.42 0.00 0.00 52.86 53.43 3brg s ASN 142 Cb -0.12 -2.13 0.26 0.00 -1.45 0.00 0.00 41.25 37.81 3brg s ASN 142 CO 0.11 -0.16 1.17 0.18 -3.72 0.00 0.00 177.10 174.68 3brg n LEU 143 N 5.10 2.81 -4.67 3.21 4.77 -1.26 -4.53 117.00 122.42 3brg n LEU 143 Ca -0.13 -1.35 -0.42 0.00 -0.03 0.00 0.00 56.01 54.08 3brg n LEU 143 Cb 0.51 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.44 3brg n LEU 143 CO 0.35 0.58 1.48 -1.61 -1.33 0.00 0.00 177.39 176.87 3brg s GLU 144 N -1.29 4.16 0.00 3.23 2.02 -1.26 -2.16 118.70 123.39 3brg s GLU 144 Ca 0.26 2.43 0.00 0.00 0.02 0.00 0.00 54.97 57.68 3brg s GLU 144 Cb 0.16 -4.00 0.00 0.00 0.10 0.00 0.00 34.13 30.39 3brg s GLU 144 CO 0.23 -0.88 0.00 0.41 0.02 0.00 0.00 175.26 175.03 3brg n GLY 145 N 4.32 3.05 3.74 -1.39 0.00 -1.26 -4.98 105.19 108.66 3brg n GLY 145 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 3brg n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3brg s LYS 146 N -0.15 2.70 0.60 1.61 1.02 -0.92 -5.00 119.74 119.61 3brg s LYS 146 Ca 0.00 -0.88 0.38 0.00 0.02 0.00 0.00 55.97 55.49 3brg s LYS 146 Cb 0.00 -2.57 1.86 0.00 -0.52 0.00 0.00 37.83 36.60 3brg s LYS 146 CO 0.00 0.51 2.18 -0.97 -0.92 0.00 0.00 175.35 176.14 3brg h ASN 147 N 2.88 0.00 -5.07 2.83 -1.24 -1.91 -3.46 115.58 109.61 3brg h ASN 147 Ca -0.47 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.52 3brg h ASN 147 Cb 1.19 0.00 -0.10 0.00 0.73 0.00 0.00 38.32 40.14 3brg h ASN 147 CO 0.62 0.02 0.06 -0.72 -1.29 0.00 0.00 177.43 176.12 3brg s TYR 148 N -3.97 -0.17 -0.13 0.67 1.13 -1.26 -0.64 117.35 112.98 3brg s TYR 148 Ca -0.02 -0.17 -0.12 0.00 -1.41 0.00 0.00 57.07 55.35 3brg s TYR 148 Cb 0.11 0.43 0.03 0.00 -1.10 0.00 0.00 41.96 41.44 3brg s TYR 148 CO 0.49 -0.93 0.35 0.00 -2.51 0.00 0.00 175.55 172.95 3brg s THR 150 N 0.13 5.02 -0.65 0.00 -4.23 -1.26 -1.58 115.64 113.07 3brg s THR 150 Ca -0.00 0.37 -0.15 0.00 -1.18 0.00 0.00 61.69 60.73 3brg s THR 150 Cb -0.03 -3.63 0.17 0.00 1.34 0.00 0.00 72.50 70.35 3brg s THR 150 CO 0.01 0.05 0.60 0.00 -0.54 0.00 0.00 174.62 174.74 3brg s ALA 151 N -1.67 3.82 -0.66 3.99 0.00 0.73 -4.93 121.76 123.04 3brg s ALA 151 Ca 0.42 -2.85 0.25 0.00 0.00 0.00 0.00 51.96 49.78 3brg s ALA 151 Cb -0.12 -3.36 0.44 0.00 0.00 0.00 0.00 23.12 20.08 3brg s ALA 151 CO 0.21 -2.12 1.42 1.63 0.00 0.00 0.00 175.76 176.90 3brg n LYS 152 N 4.74 0.28 -1.84 0.00 5.02 -1.26 -3.77 118.16 121.33 3brg n LYS 152 Ca -0.03 0.11 -0.10 0.00 -2.02 0.00 0.00 58.31 56.28 3brg n LYS 152 Cb 0.43 -1.71 0.07 0.00 -0.02 0.00 0.00 35.03 33.79 3brg n LYS 152 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3brg n THR 153 N -2.14 1.94 -3.50 -0.18 -2.24 -1.26 -4.83 114.28 102.07 3brg n THR 153 Ca 0.04 -3.41 -0.36 0.00 -2.27 0.00 0.00 64.05 58.04 3brg n THR 153 Cb 0.44 -0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 68.41 3brg n THR 153 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3brg s LEU 154 N -3.21 4.40 0.23 3.22 1.43 -1.26 -4.98 118.68 118.50 3brg s LEU 154 Ca 0.41 0.92 -0.12 0.00 -1.03 0.00 0.00 54.13 54.31 3brg s LEU 154 Cb 0.38 -2.88 -0.00 0.00 0.03 0.00 0.00 46.19 43.72 3brg s LEU 154 CO -0.02 0.22 0.44 -0.72 0.23 0.00 0.00 176.35 176.50 3brg s TYR 155 N -1.28 0.36 -0.08 0.29 -0.85 -1.26 -0.44 117.35 114.08 3brg s TYR 155 Ca 0.30 -0.71 -0.01 0.00 -0.52 0.00 0.00 57.07 56.13 3brg s TYR 155 Cb -0.15 0.14 0.03 0.00 0.38 0.00 0.00 41.96 42.36 3brg s TYR 155 CO 0.16 -0.94 -0.02 -1.50 -1.52 0.00 0.00 175.55 171.74 3brg s ILE 156 N -4.00 0.51 0.59 -3.49 2.07 -1.26 -5.02 121.20 110.60 3brg s ILE 156 Ca 0.21 0.03 -0.16 0.00 -1.41 0.00 0.00 60.65 59.33 3brg s ILE 156 Cb 0.00 -0.64 -0.04 0.00 0.13 0.00 0.00 42.46 41.92 3brg s ILE 156 CO 0.07 0.28 1.06 -0.55 -1.91 0.00 0.00 174.94 173.89 3brg s SER 157 N 1.88 5.74 0.24 4.50 0.15 -1.26 -0.87 113.70 124.08 3brg s SER 157 Ca 0.04 1.85 0.22 0.00 0.70 0.00 0.00 55.95 58.76 3brg s SER 157 Cb -0.12 -2.54 0.96 0.00 -1.71 0.00 0.00 66.02 62.61 3brg s SER 157 CO -0.06 -1.20 1.68 -0.90 1.20 0.00 0.00 173.24 173.96 3brg n ASP 158 N -2.01 0.60 0.27 5.45 5.75 -0.06 -2.08 116.55 124.46 3brg n ASP 158 Ca 0.09 0.66 0.16 0.00 -0.01 0.00 0.00 54.79 55.68 3brg n ASP 158 Cb 0.53 -0.78 0.68 0.00 -1.03 0.00 0.00 41.12 40.51 3brg n ASP 158 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 3brg h SER 159 N 0.00 0.00 -3.11 -1.12 4.64 -1.92 -3.41 113.55 108.63 3brg h SER 159 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 3brg h SER 159 Cb 0.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3brg h SER 159 CO 0.00 0.06 0.65 -0.62 -0.87 0.00 0.00 176.83 176.05 3brg s ASP 160 N -5.81 7.02 0.00 4.97 -1.08 -0.88 -4.92 116.67 115.96 3brg s ASP 160 Ca 0.00 2.00 0.22 0.00 -0.52 0.00 0.00 52.55 54.25 3brg s ASP 160 Cb 0.10 -2.57 0.09 0.00 -1.46 0.00 0.00 42.92 39.08 3brg s ASP 160 CO 0.56 -0.55 1.15 0.29 0.52 0.00 0.00 175.17 177.14 3brg n LYS 161 N 4.46 1.77 -1.87 4.34 4.76 -1.26 -4.95 118.16 125.41 3brg n LYS 161 Ca 0.10 -1.46 -0.41 0.00 -2.87 0.00 0.00 58.31 53.67 3brg n LYS 161 Cb 0.46 -1.45 -0.01 0.00 -1.84 0.00 0.00 35.03 32.19 3brg n LYS 161 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3brg s ARG 162 N -2.14 4.17 0.12 1.97 0.52 -1.26 -4.91 118.95 117.41 3brg s ARG 162 Ca 0.23 2.49 0.24 0.00 -0.52 0.00 0.00 55.73 58.16 3brg s ARG 162 Cb 0.18 -3.01 0.29 0.00 0.52 0.00 0.00 34.95 32.93 3brg s ARG 162 CO 0.41 -0.49 1.27 0.87 0.02 0.00 0.00 175.30 177.38 3brg h LYS 163 N 3.73 0.00 -3.09 3.54 1.79 -1.94 -3.45 116.57 117.15 3brg h LYS 163 Ca -0.49 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 57.92 3brg h LYS 163 Cb 1.23 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.73 3brg h LYS 163 CO 0.70 0.00 -0.03 -3.38 -1.08 0.00 0.00 179.45 175.66 3brg s HIS 164 N -3.18 -0.31 0.27 -1.35 -3.43 -1.26 -1.70 115.29 104.33 3brg s HIS 164 Ca 0.05 0.17 -0.19 0.00 -0.80 0.00 0.00 55.06 54.30 3brg s HIS 164 Cb 0.13 0.29 0.01 0.00 -1.43 0.00 0.00 32.58 31.59 3brg s HIS 164 CO 0.73 -0.66 0.66 -0.59 -2.00 0.00 0.00 174.74 172.88 3brg s PHE 165 N -3.06 -0.04 0.06 0.38 -0.12 -0.59 -4.96 117.98 109.64 3brg s PHE 165 Ca -0.02 -0.39 0.09 0.00 -0.05 0.00 0.00 56.93 56.57 3brg s PHE 165 Cb 0.00 0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 42.93 3brg s PHE 165 CO -0.07 -1.17 -0.26 -1.64 -0.05 0.00 0.00 175.22 172.03 3brg s MET 166 N -3.95 1.76 0.30 1.99 -1.94 -1.26 -0.97 119.30 115.23 3brg s MET 166 Ca 0.14 -1.14 -0.29 0.00 -1.71 0.00 0.00 55.69 52.70 3brg s MET 166 Cb -0.05 -1.98 -0.09 0.00 2.01 0.00 0.00 34.83 34.72 3brg s MET 166 CO 0.08 0.51 1.11 -0.51 -0.01 0.00 0.00 175.02 176.19 3brg s LEU 167 N -1.36 4.48 -0.19 -0.03 1.43 -1.26 -3.78 118.68 117.97 3brg s LEU 167 Ca 0.12 2.27 -0.02 0.00 -1.03 0.00 0.00 54.13 55.48 3brg s LEU 167 Cb -0.10 -3.71 -0.00 0.00 0.03 0.00 0.00 46.19 42.40 3brg s LEU 167 CO 0.03 -0.24 -0.10 -0.55 0.23 0.00 0.00 176.35 175.72 3brg s SER 168 N -0.95 3.97 -0.24 2.29 0.15 -0.15 -0.85 113.70 117.91 3brg s SER 168 Ca 0.47 -0.43 -0.05 0.00 0.70 0.00 0.00 55.95 56.65 3brg s SER 168 Cb -0.31 -1.65 -0.00 0.00 -1.71 0.00 0.00 66.02 62.35 3brg s SER 168 CO 0.40 0.04 -0.01 -0.69 1.20 0.00 0.00 173.24 174.18 3brg s VAL 169 N 1.11 3.56 -0.23 4.45 1.01 -0.01 -1.56 120.40 128.73 3brg s VAL 169 Ca 0.01 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 3brg s VAL 169 Cb -0.14 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 3brg s VAL 169 CO -0.03 0.32 0.11 -0.75 0.00 0.00 0.00 175.10 174.76 3brg s LYS 170 N 1.48 3.92 0.06 2.72 2.20 0.61 -0.90 119.74 129.84 3brg s LYS 170 Ca 0.05 -0.35 0.08 0.00 -0.36 0.00 0.00 55.97 55.39 3brg s LYS 170 Cb -0.15 -3.41 -0.03 0.00 -1.51 0.00 0.00 37.83 32.73 3brg s LYS 170 CO -0.01 0.02 -0.23 -1.64 -0.36 0.00 0.00 175.35 173.13 3brg s MET 171 N 1.12 1.47 0.19 4.03 -1.94 -0.21 -0.74 119.30 123.21 3brg s MET 171 Ca 0.06 -1.05 -0.19 0.00 -1.71 0.00 0.00 55.69 52.80 3brg s MET 171 Cb -0.14 -1.65 0.04 0.00 2.01 0.00 0.00 34.83 35.09 3brg s MET 171 CO 0.04 0.42 0.56 -0.59 -0.01 0.00 0.00 175.02 175.44 3brg s PHE 172 N -0.87 -0.25 0.49 -0.03 -0.12 -0.73 -1.75 117.98 114.72 3brg s PHE 172 Ca 0.09 -0.07 -0.08 0.00 -0.05 0.00 0.00 56.93 56.82 3brg s PHE 172 Cb -0.09 0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 42.73 3brg s PHE 172 CO 0.02 -0.93 0.83 0.71 -0.05 0.00 0.00 175.22 175.81 3brg s TYR 173 N -3.84 3.55 0.66 3.49 1.51 -0.28 0.46 117.35 122.91 3brg s TYR 173 Ca 0.07 0.96 0.31 0.00 -1.01 0.00 0.00 57.07 57.40 3brg s TYR 173 Cb -0.01 -2.42 1.70 0.00 -0.11 0.00 0.00 41.96 41.12 3brg s TYR 173 CO -0.05 -0.32 1.96 0.78 -1.11 0.00 0.00 175.55 176.82 3brg h GLY 174 N 0.35 0.00 0.78 0.71 0.00 -0.25 0.32 103.07 104.97 3brg h GLY 174 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3brg h GLY 174 CO 0.62 0.00 -0.05 1.16 0.00 0.00 0.00 176.54 178.27 3brg n ASN 175 N -2.94 0.45 0.00 0.19 2.04 -0.81 -4.67 115.26 109.52 3brg n ASN 175 Ca -0.02 -0.81 0.00 0.00 -0.44 0.00 0.00 54.58 53.32 3brg n ASN 175 Cb 0.36 -0.06 0.00 0.00 -2.53 0.00 0.00 39.78 37.55 3brg n ASN 175 CO 0.00 0.00 0.00 -1.54 -0.44 0.00 0.00 177.26 175.28 3brg n SER 176 N -0.82 -1.71 -4.68 0.53 3.41 0.11 -5.04 113.62 105.42 3brg n SER 176 Ca 0.18 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.37 3brg n SER 176 Cb 0.24 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.87 3brg n SER 176 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3brg s ASP 177 N -2.00 6.73 0.17 4.04 1.01 -1.24 -4.77 116.67 120.61 3brg s ASP 177 Ca 0.00 2.24 -0.31 0.00 0.71 0.00 0.00 52.55 55.20 3brg s ASP 177 Cb 0.00 -2.55 -0.09 0.00 1.01 0.00 0.00 42.92 41.29 3brg s ASP 177 CO 0.00 -0.83 1.41 -0.62 0.21 0.00 0.00 175.17 175.34 3brg s ASP 178 N 2.43 6.77 -0.15 0.27 3.68 -1.26 -1.13 116.67 127.28 3brg s ASP 178 Ca 0.69 2.46 -0.13 0.00 2.13 0.00 0.00 52.55 57.71 3brg s ASP 178 Cb -0.34 -2.60 -0.04 0.00 -1.45 0.00 0.00 42.92 38.49 3brg s ASP 178 CO 0.29 -0.66 -0.25 -0.38 0.13 0.00 0.00 175.17 174.30 3brg n ILE 179 N 3.28 1.34 -2.29 4.11 5.41 -0.72 -4.58 119.36 125.91 3brg n ILE 179 Ca 0.09 0.20 0.00 0.00 1.00 0.00 0.00 62.75 64.05 3brg n ILE 179 Cb 0.41 -2.30 0.00 0.00 -0.71 0.00 0.00 39.64 37.04 3brg n ILE 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3brg n GLY 180 N 1.54 0.01 3.23 7.39 0.00 -0.91 -1.17 105.19 115.28 3brg n GLY 180 Ca -0.10 -1.46 -0.33 0.00 0.00 0.00 0.00 46.02 44.13 3brg n GLY 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3brg s VAL 181 N -2.89 2.37 -0.11 1.61 1.01 -1.26 -1.04 120.40 120.08 3brg s VAL 181 Ca 0.00 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.13 3brg s VAL 181 Cb 0.00 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.41 3brg s VAL 181 CO 0.00 0.54 -0.23 -0.36 0.00 0.00 0.00 175.10 175.05 3brg s PHE 182 N 0.71 2.61 -0.08 5.22 0.40 -0.07 -4.75 117.98 122.02 3brg s PHE 182 Ca -0.08 -1.10 -0.11 0.00 -0.60 0.00 0.00 56.93 55.04 3brg s PHE 182 Cb -0.16 -1.75 -0.05 0.00 0.51 0.00 0.00 43.02 41.58 3brg s PHE 182 CO 0.01 -0.46 0.27 -0.51 0.70 0.00 0.00 175.22 175.23 3brg s LEU 183 N 0.47 4.41 1.12 -0.37 1.43 -1.26 -0.83 118.68 123.65 3brg s LEU 183 Ca -0.15 0.67 -0.16 0.00 -1.03 0.00 0.00 54.13 53.47 3brg s LEU 183 Cb -0.17 -2.31 0.25 0.00 0.03 0.00 0.00 46.19 43.98 3brg s LEU 183 CO 0.06 0.34 1.09 -0.94 0.23 0.00 0.00 176.35 177.13 3brg s SER 184 N -0.89 1.58 1.01 2.29 1.04 -0.03 -4.86 113.70 113.84 3brg s SER 184 Ca 0.19 0.94 -0.13 0.00 0.48 0.00 0.00 55.95 57.43 3brg s SER 184 Cb -0.14 -1.42 0.19 0.00 0.10 0.00 0.00 66.02 64.75 3brg s SER 184 CO 0.08 -3.75 1.11 -0.54 0.98 0.00 0.00 173.24 171.11 3brg s LYS 185 N -5.13 0.34 0.30 4.02 -0.14 -1.26 -4.69 119.74 113.18 3brg s LYS 185 Ca 0.68 0.39 -0.29 0.00 -1.36 0.00 0.00 55.97 55.39 3brg s LYS 185 Cb -0.15 -1.74 -0.10 0.00 -1.68 0.00 0.00 37.83 34.16 3brg s LYS 185 CO 0.57 -2.76 1.43 0.50 -0.76 0.00 0.00 175.35 174.33 3brg s ARG 186 N -5.07 4.25 -0.12 1.68 3.52 -1.26 -4.51 118.95 117.43 3brg s ARG 186 Ca 0.66 2.36 0.03 0.00 -0.13 0.00 0.00 55.73 58.64 3brg s ARG 186 Cb -0.17 -3.06 0.01 0.00 -1.56 0.00 0.00 34.95 30.17 3brg s ARG 186 CO 0.57 -0.39 -0.20 0.42 -0.81 0.00 0.00 175.30 174.88 3brg s ILE 187 N -0.56 1.89 -0.02 4.11 1.01 -0.15 -4.79 121.20 122.69 3brg s ILE 187 Ca 0.55 -0.88 -0.24 0.00 0.00 0.00 0.00 60.65 60.08 3brg s ILE 187 Cb -0.43 -1.67 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 3brg s ILE 187 CO 0.50 0.52 0.73 -0.75 0.00 0.00 0.00 174.94 175.94 3brg s LYS 188 N 0.77 4.45 -0.14 2.79 2.20 -0.25 -1.54 119.74 128.03 3brg s LYS 188 Ca -0.09 0.96 -0.27 0.00 -0.36 0.00 0.00 55.97 56.21 3brg s LYS 188 Cb -0.16 -3.41 -0.02 0.00 -1.51 0.00 0.00 37.83 32.73 3brg s LYS 188 CO 0.00 0.15 0.89 0.08 -0.36 0.00 0.00 175.35 176.11 3brg s VAL 189 N 0.47 4.86 0.28 4.02 1.01 -0.69 -1.08 120.40 129.28 3brg s VAL 189 Ca 0.38 1.77 0.10 0.00 0.00 0.00 0.00 61.98 64.23 3brg s VAL 189 Cb -0.19 -4.20 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 3brg s VAL 189 CO 0.20 0.04 -0.03 0.27 0.00 0.00 0.00 175.10 175.58 3brg s ILE 190 N 1.97 3.13 -0.14 2.22 -5.25 0.78 -4.92 121.20 118.99 3brg s ILE 190 Ca 0.42 -2.01 -0.19 0.00 -0.99 0.00 0.00 60.65 57.88 3brg s ILE 190 Cb -0.17 -2.74 -0.25 0.00 2.95 0.00 0.00 42.46 42.25 3brg s ILE 190 CO 0.15 -0.35 0.50 0.77 -1.79 0.00 0.00 174.94 174.23 3brg h SER 191 N 1.93 0.23 -5.02 4.36 4.64 -1.93 -0.21 113.55 117.56 3brg h SER 191 Ca -0.43 -0.79 0.20 0.00 -0.47 0.00 0.00 61.79 60.30 3brg h SER 191 Cb 1.25 -0.07 -0.13 0.00 -0.31 0.00 0.00 62.40 63.14 3brg h SER 191 CO 0.61 1.49 0.61 -1.59 -0.87 0.00 0.00 176.83 177.09 3brg s LYS 192 N -2.41 0.77 0.53 4.77 -2.85 -1.26 -4.46 119.74 114.82 3brg s LYS 192 Ca -0.22 -0.37 -0.22 0.00 -1.00 0.00 0.00 55.97 54.16 3brg s LYS 192 Cb 0.04 0.30 -0.05 0.00 -2.06 0.00 0.00 37.83 36.05 3brg s LYS 192 CO 0.71 -0.35 1.38 -2.14 0.10 0.00 0.00 175.35 175.05 3brg s PRO 193 N -2.91 3.24 0.00 1.78 0.02 -1.26 -5.05 135.00 130.82 3brg s PRO 193 Ca 0.10 2.29 0.00 0.00 0.02 0.00 0.00 61.00 63.40 3brg s PRO 193 Cb 0.00 -2.34 0.00 0.00 0.02 0.00 0.00 34.50 32.18 3brg s PRO 193 CO -0.04 -1.12 0.00 -1.13 -0.33 0.00 0.00 177.00 174.38 3brg n SER 194 N -0.86 0.00 -3.69 2.53 3.41 -1.26 -5.09 113.62 108.66 3brg n SER 194 Ca 0.09 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.47 3brg n SER 194 Cb 0.44 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.31 3brg n SER 194 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 3brg s LYS 195 N 0.00 1.88 0.29 4.33 0.00 -1.26 -5.10 119.74 119.88 3brg s LYS 195 Ca 0.00 -2.13 0.10 0.00 0.00 0.00 0.00 55.97 53.94 3brg s LYS 195 Cb 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 37.83 37.66 3brg s LYS 195 CO 0.00 -0.59 -0.01 0.15 0.00 0.00 0.00 175.35 174.89 3brg s LYS 196 N -3.54 2.17 0.00 1.78 3.01 -1.26 -5.29 119.74 116.61 3brg s LYS 196 Ca 0.31 -1.56 0.00 0.00 -1.01 0.00 0.00 55.97 53.71 3brg s LYS 196 Cb 0.02 -2.05 0.00 0.00 -1.01 0.00 0.00 37.83 34.79 3brg s LYS 196 CO 0.22 0.28 0.00 1.63 0.51 0.00 0.00 175.35 177.98 3brg n LYS 197 N -0.90 0.00 0.00 1.68 4.76 -1.26 -5.09 118.16 117.35 3brg n LYS 197 Ca -0.05 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.39 3brg n LYS 197 Cb 0.60 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.79 3brg n LYS 197 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 3brg n LEU 200 N -1.43 0.32 0.05 -0.35 0.00 -1.26 -4.87 117.00 109.47 3brg n LEU 200 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 56.01 56.20 3brg n LEU 200 Cb 0.00 0.00 0.70 0.00 0.00 0.00 0.00 43.42 44.12 3brg n LEU 200 CO 0.00 0.05 1.17 0.07 0.00 0.00 0.00 177.39 178.68 3brg h LYS 201 N 0.00 0.00 -3.95 1.96 2.10 -2.05 -3.07 116.57 111.56 3brg h LYS 201 Ca 0.00 0.00 -0.73 0.00 -2.00 0.00 0.00 60.65 57.92 3brg h LYS 201 Cb 0.78 0.00 -0.10 0.00 -0.90 0.00 0.00 32.23 32.01 3brg h LYS 201 CO 0.00 0.00 2.49 0.09 -2.00 0.00 0.00 179.45 180.03 3brg n ASN 202 N -4.29 4.55 -0.43 7.07 3.02 -1.26 -4.83 115.26 119.10 3brg n ASN 202 Ca 0.07 -2.97 0.37 0.00 -0.03 0.00 0.00 54.58 52.02 3brg n ASN 202 Cb 0.53 -1.58 0.71 0.00 -0.61 0.00 0.00 39.78 38.82 3brg n ASN 202 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3brg h ALA 203 N 6.06 3.05 0.00 5.41 0.00 -1.93 0.19 119.26 132.04 3brg h ALA 203 Ca 0.47 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.31 3brg h ALA 203 Cb 0.66 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3brg h ALA 203 CO 1.71 -1.51 -0.32 -0.44 0.00 0.00 0.00 179.25 178.69 3brg h ASP 204 N 0.08 0.00 0.15 0.00 3.32 -1.90 -2.80 116.42 115.28 3brg h ASP 204 Ca 0.70 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.75 3brg h ASP 204 Cb 2.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 42.06 3brg h ASP 204 CO -0.14 0.32 -0.35 0.18 -1.72 0.00 0.00 179.24 177.53 3brg n LEU 205 N -4.11 1.34 -5.01 1.55 4.77 0.66 -4.90 117.00 111.30 3brg n LEU 205 Ca -0.02 -0.42 -0.19 0.00 -0.03 0.00 0.00 56.01 55.35 3brg n LEU 205 Cb 0.37 -0.08 0.04 0.00 -2.33 0.00 0.00 43.42 41.41 3brg n LEU 205 CO 0.38 0.25 0.26 0.00 -1.33 0.00 0.00 177.39 176.96 3brg s ILE 207 N -2.55 1.72 0.23 0.00 1.01 -1.23 -4.83 121.20 115.55 3brg s ILE 207 Ca 0.58 -1.02 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 3brg s ILE 207 Cb -0.08 -1.76 -0.08 0.00 0.01 0.00 0.00 42.46 40.55 3brg s ILE 207 CO 0.36 0.22 0.63 0.00 0.00 0.00 0.00 174.94 176.14 3brg s ALA 208 N 1.37 3.48 0.27 9.38 0.00 -1.26 -0.70 121.76 134.30 3brg s ALA 208 Ca -0.01 -0.08 -0.30 0.00 0.00 0.00 0.00 51.96 51.57 3brg s ALA 208 Cb -0.16 -2.61 -0.10 0.00 0.00 0.00 0.00 23.12 20.25 3brg s ALA 208 CO -0.09 0.42 1.44 0.45 0.00 0.00 0.00 175.76 177.99 3brg s SER 209 N -2.06 6.62 0.00 0.00 0.15 0.72 -2.42 113.70 116.71 3brg s SER 209 Ca 0.46 2.73 0.00 0.00 0.70 0.00 0.00 55.95 59.84 3brg s SER 209 Cb -0.13 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 3brg s SER 209 CO 0.20 -0.72 0.00 0.61 1.20 0.00 0.00 173.24 174.53 3brg n GLY 210 N 1.90 0.89 3.96 9.45 0.00 0.39 -4.80 105.19 116.98 3brg n GLY 210 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.84 3brg n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3brg s THR 211 N -2.31 2.43 -0.03 2.61 -4.23 -1.02 -4.67 115.64 108.43 3brg s THR 211 Ca 0.00 -0.49 -0.03 0.00 -1.18 0.00 0.00 61.69 59.99 3brg s THR 211 Cb 0.00 -2.94 -0.04 0.00 1.34 0.00 0.00 72.50 70.86 3brg s THR 211 CO 0.00 0.00 0.17 -0.54 -0.54 0.00 0.00 174.62 173.71 3brg s LYS 212 N -5.03 3.43 0.04 3.99 1.02 -1.26 -1.31 119.74 120.62 3brg s LYS 212 Ca 0.60 -0.30 0.01 0.00 0.02 0.00 0.00 55.97 56.31 3brg s LYS 212 Cb -0.10 -3.10 -0.02 0.00 -0.52 0.00 0.00 37.83 34.09 3brg s LYS 212 CO 0.42 0.69 -0.06 0.14 -0.92 0.00 0.00 175.35 175.62 3brg s VAL 213 N -1.27 0.42 0.20 3.17 -7.23 0.10 -1.73 120.40 114.05 3brg s VAL 213 Ca 0.25 -1.09 0.06 0.00 -1.81 0.00 0.00 61.98 59.39 3brg s VAL 213 Cb -0.12 -0.58 -0.04 0.00 0.56 0.00 0.00 36.38 36.19 3brg s VAL 213 CO 0.16 -0.45 0.13 0.00 -0.31 0.00 0.00 175.10 174.63 3brg s ALA 214 N -1.57 3.51 -0.10 1.32 0.00 0.12 -0.71 121.76 124.33 3brg s ALA 214 Ca -0.10 -1.32 -0.01 0.00 0.00 0.00 0.00 51.96 50.53 3brg s ALA 214 Cb -0.09 -1.27 0.02 0.00 0.00 0.00 0.00 23.12 21.79 3brg s ALA 214 CO -0.00 0.41 -0.06 -0.51 0.00 0.00 0.00 175.76 175.60 3brg s LEU 215 N -3.34 1.07 0.17 0.00 1.43 -1.26 -2.44 118.68 114.31 3brg s LEU 215 Ca 0.31 -0.25 0.07 0.00 -1.03 0.00 0.00 54.13 53.23 3brg s LEU 215 Cb -0.09 -0.74 -0.04 0.00 0.03 0.00 0.00 46.19 45.34 3brg s LEU 215 CO 0.23 -0.13 -0.13 0.72 0.23 0.00 0.00 176.35 177.27 3brg s PHE 216 N 1.72 1.55 -0.12 0.29 -0.12 -0.57 -1.35 117.98 119.37 3brg s PHE 216 Ca 0.04 -0.61 0.00 0.00 -0.05 0.00 0.00 56.93 56.31 3brg s PHE 216 Cb -0.13 -0.75 0.02 0.00 -0.63 0.00 0.00 43.02 41.53 3brg s PHE 216 CO -0.07 0.25 -0.11 1.21 -0.05 0.00 0.00 175.22 176.45 3brg s ASN 217 N -3.09 2.29 0.25 1.98 3.84 -0.10 0.05 114.94 120.15 3brg s ASN 217 Ca 0.18 -0.36 0.09 0.00 0.21 0.00 0.00 52.86 52.98 3brg s ASN 217 Cb -0.01 -0.95 -0.05 0.00 -0.55 0.00 0.00 41.25 39.69 3brg s ASN 217 CO 0.04 -0.07 -0.14 -0.60 -2.79 0.00 0.00 177.10 173.54 3brg s ARG 218 N 1.44 1.50 0.37 0.43 6.06 -1.26 -2.59 118.95 124.89 3brg s ARG 218 Ca 0.01 -1.69 0.07 0.00 -2.50 0.00 0.00 55.73 51.62 3brg s ARG 218 Cb -0.13 -1.35 -0.07 0.00 0.06 0.00 0.00 34.95 33.46 3brg s ARG 218 CO -0.07 0.20 -0.02 -0.51 -2.50 0.00 0.00 175.30 172.41 3brg s LEU 219 N -3.41 2.72 0.30 -0.88 1.43 -1.26 -5.01 118.68 112.56 3brg s LEU 219 Ca 0.26 -1.31 0.03 0.00 -1.03 0.00 0.00 54.13 52.08 3brg s LEU 219 Cb -0.01 -0.84 0.61 0.00 0.03 0.00 0.00 46.19 45.97 3brg s LEU 219 CO 0.11 -0.39 1.85 -0.09 0.23 0.00 0.00 176.35 178.05 3brg h ARG 220 N 1.93 0.91 -2.58 1.70 2.43 -2.04 -3.41 114.38 113.32 3brg h ARG 220 Ca -0.43 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 58.58 3brg h ARG 220 Cb 1.24 -0.21 -0.27 0.00 -0.42 0.00 0.00 29.97 30.32 3brg h ARG 220 CO 0.76 0.60 -0.34 0.45 -1.51 0.00 0.00 179.97 179.93 3brg s SER 221 N -5.73 -0.36 -0.03 -3.80 0.15 -1.26 -5.17 113.70 97.51 3brg s SER 221 Ca -0.11 0.94 -0.20 0.00 0.70 0.00 0.00 55.95 57.27 3brg s SER 221 Cb 0.22 1.06 0.04 0.00 -1.71 0.00 0.00 66.02 65.63 3brg s SER 221 CO 0.80 -0.21 0.43 0.00 1.20 0.00 0.00 173.24 175.46 3brg s GLN 222 N 2.03 0.79 -0.02 5.44 -2.07 -1.26 -5.06 119.66 119.51 3brg s GLN 222 Ca -0.05 -0.04 -0.25 0.00 -1.82 0.00 0.00 55.36 53.20 3brg s GLN 222 Cb -0.10 0.36 -0.19 0.00 -1.09 0.00 0.00 33.01 31.99 3brg s GLN 222 CO -0.13 -0.23 1.21 0.00 -1.32 0.00 0.00 175.29 174.83 3brg h THR 223 N 3.61 1.13 -2.75 3.63 1.03 -2.02 -3.45 112.91 114.09 3brg h THR 223 Ca -0.29 -0.97 -0.59 0.00 -0.01 0.00 0.00 66.41 64.55 3brg h THR 223 Cb 1.17 1.73 0.12 0.00 -1.07 0.00 0.00 68.15 70.09 3brg h THR 223 CO 0.39 0.23 0.17 0.52 -0.01 0.00 0.00 175.52 176.83 3brg n VAL 224 N -4.94 2.10 -1.86 0.00 0.31 -1.26 -4.96 118.33 107.73 3brg n VAL 224 Ca -0.09 -0.50 -0.40 0.00 -0.01 0.00 0.00 64.34 63.35 3brg n VAL 224 Cb 0.25 -1.11 0.01 0.00 -0.91 0.00 0.00 33.84 32.08 3brg n VAL 224 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3brg s SER 225 N -0.59 5.99 0.38 4.52 0.01 -1.26 -4.96 113.70 117.79 3brg s SER 225 Ca 0.59 2.86 -0.25 0.00 1.31 0.00 0.00 55.95 60.47 3brg s SER 225 Cb -0.64 -2.65 -0.12 0.00 0.21 0.00 0.00 66.02 62.82 3brg s SER 225 CO 0.59 -1.09 0.86 0.41 0.41 0.00 0.00 173.24 174.42 3brg n THR 226 N -0.10 2.13 -4.39 1.44 -1.04 -1.26 -4.88 114.28 106.17 3brg n THR 226 Ca 0.05 -0.50 -0.27 0.00 -2.04 0.00 0.00 64.05 61.29 3brg n THR 226 Cb 0.42 -0.88 -0.13 0.00 -1.82 0.00 0.00 70.33 67.92 3brg n THR 226 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3brg s ARG 227 N -1.73 1.30 -0.02 -2.82 0.52 -1.07 -4.28 118.95 110.86 3brg s ARG 227 Ca 0.62 -1.22 0.03 0.00 -0.52 0.00 0.00 55.73 54.64 3brg s ARG 227 Cb -0.63 -1.65 -0.00 0.00 0.52 0.00 0.00 34.95 33.19 3brg s ARG 227 CO 0.58 0.39 -0.11 0.71 0.02 0.00 0.00 175.30 176.89 3brg s TYR 228 N -1.07 1.07 0.14 -0.53 1.51 0.63 -0.92 117.35 118.17 3brg s TYR 228 Ca 0.10 -0.24 -0.32 0.00 -1.01 0.00 0.00 57.07 55.60 3brg s TYR 228 Cb -0.10 -0.72 -0.11 0.00 -0.11 0.00 0.00 41.96 40.91 3brg s TYR 228 CO 0.05 -0.07 1.79 -0.11 -1.11 0.00 0.00 175.55 176.10 3brg n LEU 229 N 3.06 3.92 -3.66 -1.29 0.00 -0.46 -0.41 117.00 118.16 3brg n LEU 229 Ca -0.16 1.01 -0.09 0.00 0.00 0.00 0.00 56.01 56.77 3brg n LEU 229 Cb 0.55 -1.53 -0.08 0.00 0.00 0.00 0.00 43.42 42.35 3brg n LEU 229 CO 0.25 0.13 0.24 -2.28 0.00 0.00 0.00 177.39 175.72 3brg s HIS 230 N 2.27 -0.87 -0.13 1.96 2.46 -0.67 -0.91 115.29 119.40 3brg s HIS 230 Ca 0.81 1.79 -0.25 0.00 0.47 0.00 0.00 55.06 57.88 3brg s HIS 230 Cb -0.51 0.48 -0.02 0.00 -0.13 0.00 0.00 32.58 32.39 3brg s HIS 230 CO 0.37 -0.45 0.79 0.08 -2.47 0.00 0.00 174.74 173.06 3brg s VAL 231 N 1.48 4.93 0.01 0.89 1.01 -1.26 -1.41 120.40 126.05 3brg s VAL 231 Ca -0.09 1.58 -0.29 0.00 0.00 0.00 0.00 61.98 63.18 3brg s VAL 231 Cb -0.06 -4.11 0.07 0.00 0.00 0.00 0.00 36.38 32.28 3brg s VAL 231 CO -0.16 0.10 0.67 -1.83 0.00 0.00 0.00 175.10 173.88 3brg s GLU 232 N 1.68 1.11 -1.86 2.72 -1.05 -0.57 -4.94 118.70 115.78 3brg s GLU 232 Ca 0.38 0.04 0.00 0.00 -0.15 0.00 0.00 54.97 55.25 3brg s GLU 232 Cb -0.17 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 34.04 3brg s GLU 232 CO 0.15 -0.39 0.00 0.41 0.95 0.00 0.00 175.26 176.38 3brg n GLY 233 N 0.52 1.35 1.42 -3.83 0.00 -1.26 -2.22 105.19 101.18 3brg n GLY 233 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3brg n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3brg n GLY 234 N -0.44 0.65 3.14 -0.02 0.00 -1.26 -5.04 105.19 102.22 3brg n GLY 234 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 3brg n GLY 234 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3brg s ASN 235 N -2.01 0.15 0.29 1.61 0.01 -0.94 -5.14 114.94 108.90 3brg s ASN 235 Ca 0.00 -0.51 -0.29 0.00 -0.71 0.00 0.00 52.86 51.35 3brg s ASN 235 Cb 0.00 0.25 -0.10 0.00 0.41 0.00 0.00 41.25 41.81 3brg s ASN 235 CO 0.00 -0.54 1.29 -0.36 -1.51 0.00 0.00 177.10 175.98 3brg s PHE 236 N -2.72 3.16 0.10 2.20 0.40 -1.26 -1.52 117.98 118.34 3brg s PHE 236 Ca -0.04 1.38 -0.01 0.00 -0.60 0.00 0.00 56.93 57.66 3brg s PHE 236 Cb -0.00 -3.62 -0.04 0.00 0.51 0.00 0.00 43.02 39.86 3brg s PHE 236 CO -0.05 -1.76 0.02 -1.01 0.70 0.00 0.00 175.22 173.12 3brg s HIS 237 N -0.78 0.72 -0.76 0.36 3.76 -0.50 -4.13 115.29 113.96 3brg s HIS 237 Ca 0.51 -1.17 -0.10 0.00 -0.15 0.00 0.00 55.06 54.16 3brg s HIS 237 Cb -0.38 -0.44 0.20 0.00 1.11 0.00 0.00 32.58 33.06 3brg s HIS 237 CO 0.47 -0.46 0.66 0.00 -0.85 0.00 0.00 174.74 174.56 3brg s ALA 238 N -3.99 3.92 0.24 -1.40 0.00 -0.38 -1.66 121.76 118.49 3brg s ALA 238 Ca 0.17 -3.33 -0.28 0.00 0.00 0.00 0.00 51.96 48.52 3brg s ALA 238 Cb 0.08 -3.20 -0.09 0.00 0.00 0.00 0.00 23.12 19.91 3brg s ALA 238 CO -0.03 -2.22 0.90 0.45 0.00 0.00 0.00 175.76 174.86 3brg s SER 239 N 1.54 7.51 0.34 0.00 0.15 0.46 -4.43 113.70 119.27 3brg s SER 239 Ca 0.18 1.84 0.23 0.00 0.70 0.00 0.00 55.95 58.90 3brg s SER 239 Cb -0.14 -2.57 0.25 0.00 -1.71 0.00 0.00 66.02 61.85 3brg s SER 239 CO -0.07 0.12 1.42 0.77 1.20 0.00 0.00 173.24 176.68 3brg h SER 240 N 3.95 0.00 0.00 5.45 4.64 -1.87 0.18 113.55 125.89 3brg h SER 240 Ca -0.46 -0.01 -0.29 0.00 -0.47 0.00 0.00 61.79 60.57 3brg h SER 240 Cb 1.20 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.24 3brg h SER 240 CO 0.67 0.00 -2.08 0.00 -0.87 0.00 0.00 176.83 174.55 3brg n GLN 241 N -2.90 0.96 -4.25 4.77 1.13 -1.26 -4.86 117.38 110.97 3brg n GLN 241 Ca 0.03 0.06 -0.17 0.00 -1.94 0.00 0.00 57.00 54.98 3brg n GLN 241 Cb 0.53 -1.39 -0.11 0.00 0.11 0.00 0.00 30.24 29.38 3brg n GLN 241 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 3brg s GLN 242 N -2.38 1.06 0.01 -1.09 -0.21 -1.26 -4.86 119.66 110.93 3brg s GLN 242 Ca -0.18 -1.33 0.05 0.00 0.02 0.00 0.00 55.36 53.92 3brg s GLN 242 Cb 0.06 -0.84 -0.02 0.00 1.00 0.00 0.00 33.01 33.21 3brg s GLN 242 CO 0.53 0.14 -0.16 1.67 -2.12 0.00 0.00 175.29 175.36 3brg s TRP 243 N -2.56 1.39 0.31 0.91 1.48 -1.26 -4.54 118.94 114.67 3brg s TRP 243 Ca 0.12 -0.31 0.01 0.00 -1.06 0.00 0.00 56.10 54.86 3brg s TRP 243 Cb -0.02 -0.86 -0.03 0.00 -1.16 0.00 0.00 33.47 31.39 3brg s TRP 243 CO 0.03 0.02 0.51 0.20 -4.06 0.00 0.00 176.95 173.64 3brg s GLY 244 N -0.75 1.39 -0.21 3.67 0.00 -0.08 -4.97 107.32 106.37 3brg s GLY 244 Ca 0.05 -0.93 -0.05 0.00 0.00 0.00 0.00 44.72 43.79 3brg s GLY 244 CO 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 173.10 172.22 3brg s ALA 245 N -2.21 2.96 -0.12 3.20 0.00 -1.26 -4.42 121.76 119.90 3brg s ALA 245 Ca 0.39 -1.06 0.00 0.00 0.00 0.00 0.00 51.96 51.29 3brg s ALA 245 Cb -0.10 -1.77 -0.01 0.00 0.00 0.00 0.00 23.12 21.24 3brg s ALA 245 CO 0.34 -0.27 -0.14 -0.06 0.00 0.00 0.00 175.76 175.63 3brg s PHE 246 N 1.21 2.78 0.25 0.00 0.40 0.11 -1.24 117.98 121.51 3brg s PHE 246 Ca 0.03 -0.67 -0.30 0.00 -0.60 0.00 0.00 56.93 55.39 3brg s PHE 246 Cb -0.15 -1.82 -0.11 0.00 0.51 0.00 0.00 43.02 41.45 3brg s PHE 246 CO 0.01 -0.22 1.56 0.71 0.70 0.00 0.00 175.22 177.98 3brg s TYR 247 N 0.31 2.88 -0.37 0.36 1.51 0.02 -0.73 117.35 121.34 3brg s TYR 247 Ca -0.11 0.77 -0.05 0.00 -1.01 0.00 0.00 57.07 56.68 3brg s TYR 247 Cb -0.16 -3.99 0.07 0.00 -0.11 0.00 0.00 41.96 37.77 3brg s TYR 247 CO 0.06 -3.41 0.14 -1.50 -1.11 0.00 0.00 175.55 169.73 3brg s ILE 248 N 0.29 3.49 -0.24 2.71 2.07 -0.42 -1.54 121.20 127.55 3brg s ILE 248 Ca 0.64 -1.57 -0.11 0.00 -1.41 0.00 0.00 60.65 58.20 3brg s ILE 248 Cb -0.46 -3.16 -0.05 0.00 0.13 0.00 0.00 42.46 38.93 3brg s ILE 248 CO 0.42 -0.40 0.20 -1.00 -1.91 0.00 0.00 174.94 172.26 3brg s HIS 249 N 1.28 3.30 -0.05 3.50 3.76 0.08 -0.46 115.29 126.70 3brg s HIS 249 Ca 0.02 0.26 -0.30 0.00 -0.15 0.00 0.00 55.06 54.89 3brg s HIS 249 Cb -0.21 -2.33 -0.03 0.00 1.11 0.00 0.00 32.58 31.11 3brg s HIS 249 CO -0.01 0.00 1.08 -1.17 -0.85 0.00 0.00 174.74 173.80 3brg s LEU 250 N 1.26 4.30 0.18 0.89 0.20 -1.26 -0.12 118.68 124.12 3brg s LEU 250 Ca 0.09 1.70 0.04 0.00 0.69 0.00 0.00 54.13 56.65 3brg s LEU 250 Cb -0.14 -3.56 -0.03 0.00 -0.43 0.00 0.00 46.19 42.02 3brg s LEU 250 CO 0.06 -0.45 0.26 -0.76 -0.29 0.00 0.00 176.35 175.17 3brg s LEU 251 N 1.75 4.17 0.00 -0.68 1.43 -0.59 -2.93 118.68 121.83 3brg s LEU 251 Ca 0.53 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.67 3brg s LEU 251 Cb -0.22 -2.74 0.00 0.00 0.03 0.00 0.00 46.19 43.26 3brg s LEU 251 CO 0.23 0.02 0.21 0.47 0.23 0.00 0.00 176.35 177.51 3brg n ASP 252 N -0.74 0.31 -0.47 2.29 9.92 -1.26 -4.73 116.55 121.87 3brg n ASP 252 Ca -0.08 -0.73 0.00 0.00 -0.53 0.00 0.00 54.79 53.45 3brg n ASP 252 Cb 0.55 -0.16 0.00 0.00 -0.64 0.00 0.00 41.12 40.88 3brg n ASP 252 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 3brg n ASP 253 N 0.20 -0.04 -0.08 -2.24 3.85 -1.26 -4.43 116.55 112.55 3brg n ASP 253 Ca 0.00 0.02 -0.14 0.00 -0.71 0.00 0.00 54.79 53.96 3brg n ASP 253 Cb 0.08 -0.21 -0.06 0.00 -1.35 0.00 0.00 41.12 39.57 3brg n ASP 253 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 3brg n ASP 254 N 0.30 1.81 -1.93 -1.12 9.92 -1.26 -5.09 116.55 119.17 3brg n ASP 254 Ca 0.00 0.08 0.00 0.00 -0.53 0.00 0.00 54.79 54.34 3brg n ASP 254 Cb 0.02 -0.37 0.00 0.00 -0.64 0.00 0.00 41.12 40.13 3brg n ASP 254 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3brg n GLU 255 N -3.40 -4.25 0.00 -1.24 4.71 -1.26 -5.28 120.64 109.92 3brg n GLU 255 Ca -0.29 3.02 0.00 0.00 -0.01 0.00 0.00 57.16 59.88 3brg n GLU 255 Cb 0.74 -3.41 0.00 0.00 -1.01 0.00 0.00 31.44 27.76 3brg n GLU 255 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3brg n THR 262 N 1.44 0.00 -2.22 2.62 -2.24 -1.26 -5.15 114.28 107.47 3brg n THR 262 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 3brg n THR 262 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 3brg n THR 262 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3brg s VAL 263 N -2.03 3.49 -0.01 2.28 1.01 -1.26 -4.28 120.40 119.59 3brg s VAL 263 Ca 0.00 1.05 0.05 0.00 0.00 0.00 0.00 61.98 63.08 3brg s VAL 263 Cb 0.00 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 3brg s VAL 263 CO 0.00 0.07 -0.15 -0.60 0.00 0.00 0.00 175.10 174.42 3brg s ARG 264 N 1.26 1.21 0.26 2.72 3.52 -1.15 -4.94 118.95 121.82 3brg s ARG 264 Ca 0.63 -0.53 0.03 0.00 -0.13 0.00 0.00 55.73 55.74 3brg s ARG 264 Cb -0.35 -1.17 0.04 0.00 -1.56 0.00 0.00 34.95 31.92 3brg s ARG 264 CO 0.30 0.32 0.36 -0.25 -0.81 0.00 0.00 175.30 175.21 3brg n ASP 265 N 2.72 0.83 0.00 -2.12 8.00 -1.26 -4.34 116.55 120.37 3brg n ASP 265 Ca -0.14 -1.62 0.00 0.00 0.71 0.00 0.00 54.79 53.74 3brg n ASP 265 Cb 0.55 -0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.45 3brg n ASP 265 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3brg n GLY 266 N 1.95 -2.48 3.84 0.44 0.00 -1.26 -4.85 105.19 102.83 3brg n GLY 266 Ca 0.07 -1.76 -0.33 0.00 0.00 0.00 0.00 46.02 43.99 3brg n GLY 266 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3brg s TYR 267 N -0.42 3.44 -0.02 1.61 2.02 -1.26 -0.20 117.35 122.52 3brg s TYR 267 Ca 0.00 1.30 -0.28 0.00 -0.37 0.00 0.00 57.07 57.73 3brg s TYR 267 Cb 0.00 -2.59 -0.03 0.00 -0.40 0.00 0.00 41.96 38.94 3brg s TYR 267 CO 0.00 0.14 0.87 0.42 -1.57 0.00 0.00 175.55 175.42 3brg s ILE 268 N -1.88 4.93 0.12 2.71 1.01 0.12 -4.86 121.20 123.35 3brg s ILE 268 Ca 0.52 1.83 0.08 0.00 0.00 0.00 0.00 60.65 63.08 3brg s ILE 268 Cb -0.12 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 3brg s ILE 268 CO 0.18 0.20 -0.14 -1.00 0.00 0.00 0.00 174.94 174.18 3brg s HIS 269 N 0.90 2.62 0.47 3.97 3.76 -1.26 -1.17 115.29 124.58 3brg s HIS 269 Ca 0.46 -0.22 -0.24 0.00 -0.15 0.00 0.00 55.06 54.91 3brg s HIS 269 Cb -0.20 -1.37 -0.08 0.00 1.11 0.00 0.00 32.58 32.04 3brg s HIS 269 CO 0.24 0.41 1.35 0.66 -0.85 0.00 0.00 174.74 176.55 3brg n TYR 270 N 0.70 2.35 -0.29 1.40 4.02 -0.44 -2.60 117.16 122.31 3brg n TYR 270 Ca -0.14 0.46 0.00 0.00 -0.01 0.00 0.00 57.90 58.20 3brg n TYR 270 Cb 0.53 -2.40 0.00 0.00 -0.02 0.00 0.00 39.34 37.45 3brg n TYR 270 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3brg n GLY 271 N 0.72 0.84 3.90 2.72 0.00 0.52 -4.06 105.19 109.83 3brg n GLY 271 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 3brg n GLY 271 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3brg s GLN 272 N -0.60 3.65 -0.14 1.61 -0.21 -1.07 -4.88 119.66 118.01 3brg s GLN 272 Ca 0.00 -0.01 -0.21 0.00 0.02 0.00 0.00 55.36 55.16 3brg s GLN 272 Cb 0.00 -2.71 -0.03 0.00 1.00 0.00 0.00 33.01 31.27 3brg s GLN 272 CO 0.00 0.31 0.64 0.99 -2.12 0.00 0.00 175.29 175.11 3brg s THR 273 N -1.91 5.05 0.15 -0.19 2.01 -1.26 -2.39 115.64 117.10 3brg s THR 273 Ca 0.43 1.26 0.07 0.00 0.31 0.00 0.00 61.69 63.76 3brg s THR 273 Cb -0.11 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 3brg s THR 273 CO 0.27 0.18 -0.14 0.68 -0.69 0.00 0.00 174.62 174.92 3brg s VAL 274 N 1.39 1.51 -0.11 3.82 -7.23 0.18 -1.54 120.40 118.42 3brg s VAL 274 Ca 0.32 -1.93 0.02 0.00 -1.81 0.00 0.00 61.98 58.58 3brg s VAL 274 Cb -0.16 -1.76 -0.01 0.00 0.56 0.00 0.00 36.38 35.00 3brg s VAL 274 CO 0.13 -0.48 -0.19 -0.75 -0.31 0.00 0.00 175.10 173.50 3brg s LYS 275 N -3.08 3.15 -0.27 4.82 2.20 0.83 -1.95 119.74 125.44 3brg s LYS 275 Ca 0.15 -0.78 -0.10 0.00 -0.36 0.00 0.00 55.97 54.87 3brg s LYS 275 Cb -0.03 -2.45 -0.05 0.00 -1.51 0.00 0.00 37.83 33.80 3brg s LYS 275 CO 0.04 0.23 0.17 -0.51 -0.36 0.00 0.00 175.35 174.92 3brg s LEU 276 N 0.26 3.94 -0.14 5.43 1.43 -1.26 -0.74 118.68 127.59 3brg s LEU 276 Ca -0.13 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 3brg s LEU 276 Cb -0.16 -2.09 0.02 0.00 0.03 0.00 0.00 46.19 43.99 3brg s LEU 276 CO 0.07 -0.03 -0.16 -0.69 0.23 0.00 0.00 176.35 175.77 3brg s VAL 277 N 1.64 1.65 0.08 -1.59 1.01 -0.59 -1.83 120.40 120.78 3brg s VAL 277 Ca 0.07 -0.70 -0.34 0.00 0.00 0.00 0.00 61.98 61.01 3brg s VAL 277 Cb -0.16 -1.53 -0.14 0.00 0.00 0.00 0.00 36.38 34.56 3brg s VAL 277 CO 0.09 0.47 1.64 0.00 0.00 0.00 0.00 175.10 177.31 3brg n SER 279 N 4.24 0.62 -0.13 0.00 3.41 -0.37 -1.78 113.62 119.60 3brg n SER 279 Ca 0.19 0.61 -0.27 0.00 -0.26 0.00 0.00 58.87 59.14 3brg n SER 279 Cb 0.28 -0.76 -0.09 0.00 -0.26 0.00 0.00 64.21 63.38 3brg n SER 279 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3brg n VAL 280 N -2.13 1.40 0.24 -3.33 0.31 -1.26 -4.72 118.33 108.83 3brg n VAL 280 Ca 0.04 -0.36 0.11 0.00 -0.01 0.00 0.00 64.34 64.11 3brg n VAL 280 Cb 0.30 -1.83 -0.14 0.00 -0.91 0.00 0.00 33.84 31.26 3brg n VAL 280 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3brg n THR 281 N -4.12 0.04 -0.92 2.52 -2.24 -1.25 -4.98 114.28 103.34 3brg n THR 281 Ca -0.50 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 60.90 3brg n THR 281 Cb 0.86 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 3brg n THR 281 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3brg n GLY 282 N 1.31 0.74 3.77 3.38 0.00 -0.73 -5.02 105.19 108.63 3brg n GLY 282 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 3brg n GLY 282 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3brg s MET 283 N -0.23 3.94 0.00 1.61 1.00 -1.26 -4.59 119.30 119.77 3brg s MET 283 Ca 0.00 2.23 0.06 0.00 0.00 0.00 0.00 55.69 57.98 3brg s MET 283 Cb 0.00 -2.76 -0.02 0.00 0.00 0.00 0.00 34.83 32.05 3brg s MET 283 CO 0.00 -0.54 -0.19 0.00 0.00 0.00 0.00 175.02 174.29 3brg s ALA 284 N -1.24 1.57 0.56 3.03 0.00 -1.26 -0.23 121.76 124.19 3brg s ALA 284 Ca 0.57 -0.86 -0.05 0.00 0.00 0.00 0.00 51.96 51.62 3brg s ALA 284 Cb -0.40 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.36 3brg s ALA 284 CO 0.51 0.37 0.86 -0.51 0.00 0.00 0.00 175.76 177.00 3brg s LEU 285 N -0.64 3.32 1.03 0.00 1.43 -0.76 -5.03 118.68 118.03 3brg s LEU 285 Ca 0.07 0.69 -0.12 0.00 -1.03 0.00 0.00 54.13 53.74 3brg s LEU 285 Cb -0.08 -3.54 0.21 0.00 0.03 0.00 0.00 46.19 42.81 3brg s LEU 285 CO -0.00 -0.97 1.07 -2.84 0.23 0.00 0.00 176.35 173.84 3brg s PRO 286 N -4.92 0.18 0.25 1.29 0.02 -1.26 -4.58 135.00 125.98 3brg s PRO 286 Ca 0.53 0.78 -0.31 0.00 0.02 0.00 0.00 61.00 62.01 3brg s PRO 286 Cb -0.10 -1.69 -0.13 0.00 0.02 0.00 0.00 34.50 32.60 3brg s PRO 286 CO 0.44 -2.97 1.54 0.54 -0.33 0.00 0.00 177.00 176.23 3brg n ARG 287 N -4.38 2.42 -4.51 5.54 1.74 -1.26 -4.76 116.66 111.45 3brg n ARG 287 Ca 0.05 0.86 -0.22 0.00 -0.77 0.00 0.00 57.85 57.77 3brg n ARG 287 Cb 0.55 -2.61 -0.14 0.00 -1.02 0.00 0.00 32.46 29.25 3brg n ARG 287 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3brg s LEU 288 N 0.05 2.14 -0.27 0.55 1.02 -0.82 -2.25 118.68 119.10 3brg s LEU 288 Ca 0.68 -0.44 -0.09 0.00 0.02 0.00 0.00 54.13 54.30 3brg s LEU 288 Cb -0.57 -0.75 -0.03 0.00 0.02 0.00 0.00 46.19 44.86 3brg s LEU 288 CO 0.46 0.10 0.12 -0.63 0.02 0.00 0.00 176.35 176.42 3brg s ILE 289 N -0.74 4.64 -0.14 -0.59 1.01 0.87 -0.64 121.20 125.61 3brg s ILE 289 Ca 0.04 -0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.26 3brg s ILE 289 Cb -0.08 -3.23 -0.01 0.00 0.01 0.00 0.00 42.46 39.16 3brg s ILE 289 CO 0.01 0.26 1.07 -0.51 0.00 0.00 0.00 174.94 175.76 3brg s ILE 290 N 1.65 4.63 0.19 2.92 2.07 -1.01 -1.17 121.20 130.49 3brg s ILE 290 Ca 0.06 1.93 0.09 0.00 -1.41 0.00 0.00 60.65 61.32 3brg s ILE 290 Cb -0.16 -4.24 -0.04 0.00 0.13 0.00 0.00 42.46 38.15 3brg s ILE 290 CO 0.06 -0.06 -0.19 -0.13 -1.91 0.00 0.00 174.94 172.72 3brg s ARG 291 N 2.48 1.35 0.08 3.50 0.52 0.74 -0.35 118.95 127.27 3brg s ARG 291 Ca 0.49 -1.49 -0.24 0.00 -0.52 0.00 0.00 55.73 53.98 3brg s ARG 291 Cb -0.19 -1.41 -0.06 0.00 0.52 0.00 0.00 34.95 33.81 3brg s ARG 291 CO 0.15 0.28 0.72 0.21 0.02 0.00 0.00 175.30 176.68 3brg s LYS 292 N -2.98 4.45 0.06 3.54 2.20 -1.26 -0.15 119.74 125.60 3brg s LYS 292 Ca 0.19 1.00 0.06 0.00 -0.36 0.00 0.00 55.97 56.86 3brg s LYS 292 Cb -0.05 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 3brg s LYS 292 CO 0.08 0.43 -0.11 0.14 -0.36 0.00 0.00 175.35 175.53 3brg s VAL 293 N -0.55 3.29 -0.04 4.02 -7.23 -1.01 -0.05 120.40 118.82 3brg s VAL 293 Ca 0.35 -1.10 0.02 0.00 -1.81 0.00 0.00 61.98 59.44 3brg s VAL 293 Cb -0.21 -2.47 0.01 0.00 0.56 0.00 0.00 36.38 34.28 3brg s VAL 293 CO 0.23 0.26 -0.08 1.51 -0.31 0.00 0.00 175.10 176.71 3brg s ASP 294 N -1.76 1.22 0.58 4.85 -4.77 -0.84 -4.71 116.67 111.24 3brg s ASP 294 Ca 0.18 -0.19 0.00 0.00 -3.30 0.00 0.00 52.55 49.24 3brg s ASP 294 Cb -0.11 -0.52 0.00 0.00 -1.09 0.00 0.00 42.92 41.20 3brg s ASP 294 CO 0.09 0.00 0.00 0.29 0.70 0.00 0.00 175.17 176.26 3brg n LYS 295 N 3.77 0.00 -0.21 2.11 5.02 -1.26 -2.51 118.16 125.08 3brg n LYS 295 Ca -0.23 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.15 3brg n LYS 295 Cb 0.52 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.68 3brg n LYS 295 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3brg n GLN 296 N 0.00 1.33 -5.02 1.97 6.02 -1.26 -4.99 117.38 115.42 3brg n GLN 296 Ca 0.00 -2.73 -0.31 0.00 -0.01 0.00 0.00 57.00 53.95 3brg n GLN 296 Cb 0.00 -1.51 -0.15 0.00 1.02 0.00 0.00 30.24 29.61 3brg n GLN 296 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3brg s THR 297 N -2.91 2.30 -0.20 5.09 -4.23 -1.04 -0.78 115.64 113.86 3brg s THR 297 Ca 0.33 -1.18 -0.18 0.00 -1.18 0.00 0.00 61.69 59.48 3brg s THR 297 Cb 0.30 -1.87 -0.03 0.00 1.34 0.00 0.00 72.50 72.24 3brg s THR 297 CO 0.00 0.47 0.49 0.00 -0.54 0.00 0.00 174.62 175.04 3brg s ALA 298 N -0.74 3.55 -0.39 3.99 0.00 0.72 -1.98 121.76 126.91 3brg s ALA 298 Ca 0.11 -0.44 -0.27 0.00 0.00 0.00 0.00 51.96 51.37 3brg s ALA 298 Cb -0.10 -2.77 0.02 0.00 0.00 0.00 0.00 23.12 20.26 3brg s ALA 298 CO 0.01 -0.42 0.98 -0.51 0.00 0.00 0.00 175.76 175.82 3brg s LEU 299 N 1.59 3.93 0.44 0.00 1.43 0.92 -1.82 118.68 125.18 3brg s LEU 299 Ca 0.23 0.56 0.24 0.00 -1.03 0.00 0.00 54.13 54.13 3brg s LEU 299 Cb -0.15 -3.34 0.62 0.00 0.03 0.00 0.00 46.19 43.35 3brg s LEU 299 CO 0.09 -0.95 1.70 -0.07 0.23 0.00 0.00 176.35 177.35 3brg h LEU 300 N 10.33 0.00 -0.98 1.79 3.38 -1.67 -3.32 115.31 124.84 3brg h LEU 300 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3brg h LEU 300 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3brg h LEU 300 CO 1.02 0.11 -0.47 0.47 0.09 0.00 0.00 178.44 179.65 3brg n ASP 301 N -3.15 1.99 -4.77 -0.43 9.92 -1.26 -4.97 116.55 113.89 3brg n ASP 301 Ca 0.02 -1.49 -0.41 0.00 -0.53 0.00 0.00 54.79 52.39 3brg n ASP 301 Cb 0.50 0.47 -0.03 0.00 -0.64 0.00 0.00 41.12 41.42 3brg n ASP 301 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3brg s ALA 302 N -2.48 3.47 0.00 2.24 0.00 -1.25 -4.94 121.76 118.80 3brg s ALA 302 Ca 0.19 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.29 3brg s ALA 302 Cb 0.18 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.87 3brg s ALA 302 CO 0.57 -0.49 0.55 -0.40 0.00 0.00 0.00 175.76 176.00 3brg n ASP 303 N 0.95 0.00 -4.80 0.00 3.85 -1.26 -3.93 116.55 111.36 3brg n ASP 303 Ca -0.00 -1.26 -0.30 0.00 -0.71 0.00 0.00 54.79 52.52 3brg n ASP 303 Cb 0.43 -0.05 0.09 0.00 -1.35 0.00 0.00 41.12 40.24 3brg n ASP 303 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.20 177.70 3brg s ASP 304 N -0.26 4.42 0.31 -1.12 3.84 -1.26 -4.30 116.67 118.31 3brg s ASP 304 Ca 0.00 1.31 -0.30 0.00 -0.00 0.00 0.00 52.55 53.56 3brg s ASP 304 Cb 0.00 -2.04 -0.12 0.00 -1.38 0.00 0.00 42.92 39.39 3brg s ASP 304 CO 0.00 -2.01 1.53 -2.65 -0.00 0.00 0.00 175.17 172.03 3brg n PRO 305 N -3.46 2.58 -2.18 2.11 -0.02 -1.26 -1.32 135.00 131.44 3brg n PRO 305 Ca 0.07 0.91 -0.41 0.00 -2.02 0.00 0.00 63.50 62.05 3brg n PRO 305 Cb 0.56 -2.65 -0.03 0.00 -0.02 0.00 0.00 33.50 31.36 3brg n PRO 305 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3brg s VAL 306 N -0.36 3.15 0.30 -1.45 1.01 -0.32 -4.57 120.40 118.16 3brg s VAL 306 Ca 0.61 0.92 0.09 0.00 0.00 0.00 0.00 61.98 63.60 3brg s VAL 306 Cb -0.51 -3.59 -0.06 0.00 0.00 0.00 0.00 36.38 32.22 3brg s VAL 306 CO 0.53 0.13 -0.10 -0.94 0.00 0.00 0.00 175.10 174.72 3brg s SER 307 N 0.49 3.25 0.15 3.32 1.04 -1.26 -3.51 113.70 117.18 3brg s SER 307 Ca 0.59 -1.16 -0.34 0.00 0.48 0.00 0.00 55.95 55.51 3brg s SER 307 Cb -0.37 -0.26 -0.15 0.00 0.10 0.00 0.00 66.02 65.34 3brg s SER 307 CO 0.37 -0.23 1.44 0.00 0.98 0.00 0.00 173.24 175.81 3brg n GLN 308 N -0.66 1.74 -1.28 4.02 1.13 -0.15 -2.56 117.38 119.63 3brg n GLN 308 Ca -0.05 0.63 -0.10 0.00 -1.94 0.00 0.00 57.00 55.54 3brg n GLN 308 Cb 0.63 -2.32 -0.04 0.00 0.11 0.00 0.00 30.24 28.62 3brg n GLN 308 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3brg n LEU 309 N 2.82 -0.51 -4.82 1.08 4.77 0.90 -4.67 117.00 116.56 3brg n LEU 309 Ca 0.16 0.24 -0.34 0.00 -0.03 0.00 0.00 56.01 56.04 3brg n LEU 309 Cb 0.26 -1.95 -0.07 0.00 -2.33 0.00 0.00 43.42 39.34 3brg n LEU 309 CO 0.63 -0.68 0.57 -2.28 -1.33 0.00 0.00 177.39 174.29 3brg s HIS 310 N -2.17 3.40 0.11 -1.77 2.46 -1.06 -4.77 115.29 111.49 3brg s HIS 310 Ca 0.00 1.50 -0.29 0.00 0.47 0.00 0.00 55.06 56.74 3brg s HIS 310 Cb 0.00 -2.75 -0.06 0.00 -0.13 0.00 0.00 32.58 29.64 3brg s HIS 310 CO 0.00 0.02 0.94 0.15 -2.47 0.00 0.00 174.74 173.37 3brg s LYS 311 N -2.90 4.68 0.18 2.88 1.02 -1.26 -2.22 119.74 122.12 3brg s LYS 311 Ca 0.57 1.41 -0.10 0.00 0.02 0.00 0.00 55.97 57.86 3brg s LYS 311 Cb -0.11 -3.37 -0.00 0.00 -0.52 0.00 0.00 37.83 33.83 3brg s LYS 311 CO 0.16 0.24 0.33 0.00 -0.92 0.00 0.00 175.35 175.16 3brg s ALA 313 N -3.97 1.20 -0.38 0.00 0.00 0.79 -0.78 121.76 118.63 3brg s ALA 313 Ca 0.17 -1.31 0.03 0.00 0.00 0.00 0.00 51.96 50.86 3brg s ALA 313 Cb 0.02 0.05 0.11 0.00 0.00 0.00 0.00 23.12 23.31 3brg s ALA 313 CO 0.01 -0.08 0.11 -0.06 0.00 0.00 0.00 175.76 175.74 3brg s PHE 314 N -2.89 3.36 -0.02 0.00 0.40 -1.26 -0.18 117.98 117.38 3brg s PHE 314 Ca 0.10 -2.90 -0.30 0.00 -0.60 0.00 0.00 56.93 53.23 3brg s PHE 314 Cb 0.00 -2.74 -0.03 0.00 0.51 0.00 0.00 43.02 40.76 3brg s PHE 314 CO -0.01 -0.89 1.11 -0.47 0.70 0.00 0.00 175.22 175.67 3brg s TYR 315 N 0.68 3.42 -0.41 0.36 5.04 -0.32 -0.50 117.35 125.63 3brg s TYR 315 Ca 0.13 1.42 -0.29 0.00 -2.44 0.00 0.00 57.07 55.89 3brg s TYR 315 Cb -0.21 -3.31 0.01 0.00 0.35 0.00 0.00 41.96 38.80 3brg s TYR 315 CO -0.08 -0.81 1.44 -0.51 -1.34 0.00 0.00 175.55 174.25 3brg s LEU 316 N 1.59 3.58 0.28 6.97 1.43 0.15 -0.09 118.68 132.59 3brg s LEU 316 Ca 0.54 0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 54.21 3brg s LEU 316 Cb -0.24 -3.54 -0.14 0.00 0.03 0.00 0.00 46.19 42.30 3brg s LEU 316 CO 0.25 -1.45 1.13 1.17 0.23 0.00 0.00 176.35 177.67 3brg n LYS 317 N 8.10 1.56 -1.36 1.70 4.81 -0.95 -2.89 118.16 129.13 3brg n LYS 317 Ca 0.17 0.55 -0.09 0.00 -0.87 0.00 0.00 58.31 58.07 3brg n LYS 317 Cb 0.48 -2.01 -0.03 0.00 0.02 0.00 0.00 35.03 33.49 3brg n LYS 317 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3brg n ASP 318 N 1.34 -3.97 -4.70 3.14 8.00 -1.26 -4.99 116.55 114.11 3brg n ASP 318 Ca 0.09 0.20 -0.23 0.00 0.71 0.00 0.00 54.79 55.56 3brg n ASP 318 Cb 0.32 -2.36 -0.07 0.00 -0.02 0.00 0.00 41.12 38.99 3brg n ASP 318 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3brg s THR 319 N -2.34 3.20 -1.22 -3.53 -1.32 -1.14 -5.04 115.64 104.25 3brg s THR 319 Ca 0.00 -1.78 -0.17 0.00 -1.21 0.00 0.00 61.69 58.53 3brg s THR 319 Cb 0.00 -2.93 0.11 0.00 -1.51 0.00 0.00 72.50 68.16 3brg s THR 319 CO 0.00 -0.26 1.57 -0.70 -2.21 0.00 0.00 174.62 173.02 3brg s GLU 320 N -3.77 3.96 -1.76 7.08 2.56 -1.26 -4.56 118.70 120.94 3brg s GLU 320 Ca 0.35 -2.09 -0.16 0.00 0.00 0.00 0.00 54.97 53.07 3brg s GLU 320 Cb -0.04 -5.32 0.16 0.00 2.00 0.00 0.00 34.13 30.93 3brg s GLU 320 CO 0.21 -2.06 0.45 2.89 -0.56 0.00 0.00 175.26 176.20 3brg n ARG 321 N 7.41 -1.13 -3.10 4.30 1.85 -1.26 -4.80 116.66 119.92 3brg n ARG 321 Ca 0.42 0.16 -0.39 0.00 -1.00 0.00 0.00 57.85 57.03 3brg n ARG 321 Cb 0.46 -4.44 -0.05 0.00 -1.05 0.00 0.00 32.46 27.37 3brg n ARG 321 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 3brg s MET 322 N -7.23 4.40 0.12 2.89 -1.94 -1.26 -0.87 119.30 115.42 3brg s MET 322 Ca 0.57 0.86 0.10 0.00 -1.71 0.00 0.00 55.69 55.51 3brg s MET 322 Cb -0.33 -3.38 -0.04 0.00 2.01 0.00 0.00 34.83 33.09 3brg s MET 322 CO 1.01 0.25 -0.23 0.71 -0.01 0.00 0.00 175.02 176.74 3brg s TYR 323 N 0.16 2.40 0.09 -0.03 2.02 0.04 -0.68 117.35 121.35 3brg s TYR 323 Ca 0.35 -0.33 -0.31 0.00 -0.37 0.00 0.00 57.07 56.41 3brg s TYR 323 Cb -0.19 -1.30 -0.09 0.00 -0.40 0.00 0.00 41.96 39.99 3brg s TYR 323 CO 0.19 0.34 1.67 -1.17 -1.57 0.00 0.00 175.55 175.01 3brg s LEU 324 N -2.03 4.37 -0.02 -1.29 2.96 0.35 -0.83 118.68 122.19 3brg s LEU 324 Ca 0.15 2.54 -0.04 0.00 -0.22 0.00 0.00 54.13 56.56 3brg s LEU 324 Cb -0.10 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.02 3brg s LEU 324 CO 0.07 -0.90 0.10 0.00 -1.32 0.00 0.00 176.35 174.31 3brg s LEU 326 N -0.58 4.28 -0.27 0.00 2.34 -0.62 0.83 118.68 124.65 3brg s LEU 326 Ca -0.07 0.79 -0.03 0.00 0.06 0.00 0.00 54.13 54.89 3brg s LEU 326 Cb -0.04 -3.28 0.09 0.00 -0.56 0.00 0.00 46.19 42.41 3brg s LEU 326 CO 0.00 0.07 0.10 -0.55 -1.06 0.00 0.00 176.35 174.92 3brg s SER 327 N -2.10 3.52 1.73 1.48 0.15 0.81 -4.68 113.70 114.62 3brg s SER 327 Ca 0.39 -1.29 0.00 0.00 0.70 0.00 0.00 55.95 55.76 3brg s SER 327 Cb -0.13 -0.54 0.00 0.00 -1.71 0.00 0.00 66.02 63.64 3brg s SER 327 CO 0.21 -0.41 0.00 0.00 1.20 0.00 0.00 173.24 174.24 3brg n GLN 328 N 5.09 0.00 -0.08 5.44 1.13 -1.26 -0.81 117.38 126.89 3brg n GLN 328 Ca -0.05 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.13 3brg n GLN 328 Cb 0.43 0.00 0.17 0.00 0.11 0.00 0.00 30.24 30.95 3brg n GLN 328 CO 0.00 0.00 0.00 -1.91 -1.44 0.00 0.00 177.06 173.71 3brg n GLU 329 N 7.42 2.38 -3.57 -1.09 2.13 -1.26 -4.71 120.64 121.95 3brg n GLU 329 Ca 0.00 -2.05 -0.31 0.00 0.66 0.00 0.00 57.16 55.47 3brg n GLU 329 Cb 0.00 -1.48 -0.04 0.00 0.27 0.00 0.00 31.44 30.18 3brg n GLU 329 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3brg s ARG 330 N -1.78 3.65 -0.25 5.31 1.81 0.01 -1.24 118.95 126.45 3brg s ARG 330 Ca 0.33 -0.03 -0.07 0.00 -1.72 0.00 0.00 55.73 54.24 3brg s ARG 330 Cb 0.21 -2.77 -0.02 0.00 -0.45 0.00 0.00 34.95 31.92 3brg s ARG 330 CO 0.31 0.39 0.06 0.42 -0.68 0.00 0.00 175.30 175.80 3brg s ILE 331 N -1.79 4.17 0.06 1.52 -1.09 -1.26 -0.13 121.20 122.69 3brg s ILE 331 Ca 0.42 -0.28 0.00 0.00 -2.23 0.00 0.00 60.65 58.57 3brg s ILE 331 Cb -0.12 -2.97 -0.00 0.00 -1.58 0.00 0.00 42.46 37.79 3brg s ILE 331 CO 0.25 0.31 0.01 2.30 -1.23 0.00 0.00 174.94 176.58 3brg n ILE 332 N 4.91 0.00 -4.71 2.92 -5.35 0.24 -4.97 119.36 112.40 3brg n ILE 332 Ca -0.16 -0.33 -0.32 0.00 -0.27 0.00 0.00 62.75 61.68 3brg n ILE 332 Cb 0.51 0.08 -0.12 0.00 -1.74 0.00 0.00 39.64 38.37 3brg n ILE 332 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3brg s GLN 333 N -2.24 2.28 -0.02 6.28 -2.07 -1.26 -0.82 119.66 121.82 3brg s GLN 333 Ca 0.01 -0.85 0.02 0.00 -1.82 0.00 0.00 55.36 52.72 3brg s GLN 333 Cb 0.00 -2.29 0.00 0.00 -1.09 0.00 0.00 33.01 29.63 3brg s GLN 333 CO 0.01 0.58 -0.07 0.12 -1.32 0.00 0.00 175.29 174.60 3brg s PHE 334 N -0.88 0.72 -0.05 9.60 5.36 -0.01 -4.88 117.98 127.85 3brg s PHE 334 Ca 0.14 -0.16 -0.30 0.00 -0.96 0.00 0.00 56.93 55.65 3brg s PHE 334 Cb -0.11 -0.53 -0.03 0.00 -0.34 0.00 0.00 43.02 42.02 3brg s PHE 334 CO 0.04 -0.08 1.07 -1.14 -1.46 0.00 0.00 175.22 173.65 3brg s GLN 335 N 0.20 4.44 0.62 10.12 0.74 -1.26 -0.78 119.66 133.74 3brg s GLN 335 Ca -0.03 1.50 -0.15 0.00 0.05 0.00 0.00 55.36 56.74 3brg s GLN 335 Cb -0.07 -3.50 -0.02 0.00 1.10 0.00 0.00 33.01 30.51 3brg s GLN 335 CO 0.00 -0.27 1.07 0.00 -0.55 0.00 0.00 175.29 175.54 3brg s ALA 336 N 1.71 2.65 -0.11 1.58 0.00 -0.05 -4.85 121.76 122.69 3brg s ALA 336 Ca 0.52 0.41 -0.05 0.00 0.00 0.00 0.00 51.96 52.85 3brg s ALA 336 Cb -0.22 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 3brg s ALA 336 CO 0.23 -1.00 0.07 0.95 0.00 0.00 0.00 175.76 176.01 3brg s THR 337 N -2.47 4.91 0.39 0.00 -4.23 -0.75 -4.94 115.64 108.54 3brg s THR 337 Ca 0.64 -0.02 0.39 0.00 -1.18 0.00 0.00 61.69 61.52 3brg s THR 337 Cb -0.17 -3.11 0.41 0.00 1.34 0.00 0.00 72.50 70.96 3brg s THR 337 CO 0.40 0.60 2.18 1.55 -0.54 0.00 0.00 174.62 178.81 3brg h PRO 338 N 5.19 0.00 -3.69 3.99 0.13 -1.89 -1.70 132.00 134.03 3brg h PRO 338 Ca -0.52 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3brg h PRO 338 Cb 1.21 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 3brg h PRO 338 CO 0.57 0.00 -0.51 0.00 -0.23 0.00 0.00 178.00 177.83 3brg h PRO 340 N 1.32 1.07 0.00 0.00 0.13 -1.93 -3.26 132.00 129.32 3brg h PRO 340 Ca -0.16 -0.26 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 3brg h PRO 340 Cb 0.35 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.35 3brg h PRO 340 CO 0.01 0.96 0.00 1.63 -0.23 0.00 0.00 178.00 180.37 3brg n LYS 341 N -4.27 0.00 -4.25 0.86 5.02 -1.26 -4.74 118.16 109.51 3brg n LYS 341 Ca 0.04 0.82 -0.20 0.00 -2.02 0.00 0.00 58.31 56.96 3brg n LYS 341 Cb 0.26 -1.41 -0.16 0.00 -0.02 0.00 0.00 35.03 33.71 3brg n LYS 341 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 3brg s GLU 342 N -2.63 0.86 0.37 1.97 -1.05 -1.23 -5.06 118.70 111.92 3brg s GLU 342 Ca 0.00 -0.19 0.26 0.00 -0.15 0.00 0.00 54.97 54.90 3brg s GLU 342 Cb 0.00 -0.82 0.81 0.00 -0.44 0.00 0.00 34.13 33.67 3brg s GLU 342 CO 0.00 0.01 1.76 1.96 0.95 0.00 0.00 175.26 179.93 3brg h GLN 343 N 6.78 0.00 -0.94 -4.83 4.20 -1.85 -3.17 115.11 115.30 3brg h GLN 343 Ca -0.35 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.29 3brg h GLN 343 Cb 1.16 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.91 3brg h GLN 343 CO 0.48 0.00 0.08 0.27 -0.67 0.00 0.00 178.83 178.99 3brg n ASN 344 N -2.72 2.71 -3.87 1.46 6.94 -1.26 -4.82 115.26 113.70 3brg n ASN 344 Ca 0.03 -2.33 -0.11 0.00 -0.02 0.00 0.00 54.58 52.15 3brg n ASN 344 Cb 0.40 -0.57 -0.11 0.00 -2.36 0.00 0.00 39.78 37.14 3brg n ASN 344 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3brg s LYS 345 N -1.19 0.32 -0.03 -3.83 1.02 -1.20 -1.81 119.74 113.03 3brg s LYS 345 Ca 0.15 -0.21 0.02 0.00 0.02 0.00 0.00 55.97 55.95 3brg s LYS 345 Cb 0.12 0.13 0.01 0.00 -0.52 0.00 0.00 37.83 37.57 3brg s LYS 345 CO 0.04 -0.07 -0.08 -1.21 -0.92 0.00 0.00 175.35 173.11 3brg s GLU 346 N -0.83 0.90 -0.06 1.68 2.02 -0.75 -4.43 118.70 117.23 3brg s GLU 346 Ca -0.09 -0.26 -0.30 0.00 0.02 0.00 0.00 54.97 54.34 3brg s GLU 346 Cb -0.05 -0.85 -0.02 0.00 0.10 0.00 0.00 34.13 33.31 3brg s GLU 346 CO 0.01 0.07 1.01 1.41 0.02 0.00 0.00 175.26 177.78 3brg s MET 347 N 0.31 4.48 0.22 1.61 1.75 -0.64 -0.20 119.30 126.83 3brg s MET 347 Ca -0.05 1.43 0.10 0.00 -1.25 0.00 0.00 55.69 55.92 3brg s MET 347 Cb -0.09 -3.50 -0.04 0.00 2.84 0.00 0.00 34.83 34.03 3brg s MET 347 CO 0.00 -0.21 -0.09 0.96 -0.65 0.00 0.00 175.02 175.03 3brg s ILE 348 N 1.59 3.13 0.57 10.11 -4.36 0.04 -1.81 121.20 130.46 3brg s ILE 348 Ca 0.50 -1.87 -0.20 0.00 -0.26 0.00 0.00 60.65 58.82 3brg s ILE 348 Cb -0.20 -2.60 -0.04 0.00 1.25 0.00 0.00 42.46 40.87 3brg s ILE 348 CO 0.23 -0.24 1.27 0.21 0.24 0.00 0.00 174.94 176.65 3brg s ASN 349 N -3.19 5.25 0.47 4.36 3.84 -1.26 -4.84 114.94 119.57 3brg s ASN 349 Ca 0.27 2.56 0.13 0.00 0.21 0.00 0.00 52.86 56.03 3brg s ASN 349 Cb -0.07 -2.62 1.09 0.00 -0.55 0.00 0.00 41.25 39.10 3brg s ASN 349 CO 0.16 -1.56 2.09 0.44 -2.79 0.00 0.00 177.10 175.44 3brg h ASP 350 N 1.20 0.16 0.41 -4.21 3.32 -1.97 0.65 116.42 115.99 3brg h ASP 350 Ca -0.51 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.54 3brg h ASP 350 Cb 1.30 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3brg h ASP 350 CO 0.56 0.15 0.00 0.61 -1.72 0.00 0.00 179.24 178.84 3brg n GLY 351 N -1.43 -0.91 1.09 2.75 0.00 -1.26 -2.82 105.19 102.60 3brg n GLY 351 Ca -0.01 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.07 3brg n GLY 351 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3brg n ALA 352 N -1.42 2.43 -2.66 4.61 0.00 0.22 -1.60 120.51 122.10 3brg n ALA 352 Ca 0.05 -0.91 -0.38 0.00 0.00 0.00 0.00 53.44 52.20 3brg n ALA 352 Cb 0.15 -0.83 -0.11 0.00 0.00 0.00 0.00 19.45 18.66 3brg n ALA 352 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3brg s SER 353 N -1.60 5.93 -0.01 0.00 0.15 -1.13 -4.48 113.70 112.57 3brg s SER 353 Ca 0.35 -0.01 0.07 0.00 0.70 0.00 0.00 55.95 57.06 3brg s SER 353 Cb 0.22 -2.09 -0.02 0.00 -1.71 0.00 0.00 66.02 62.41 3brg s SER 353 CO 0.31 -0.03 -0.22 0.26 1.20 0.00 0.00 173.24 174.76 3brg s TRP 354 N 1.61 1.96 -0.12 3.44 0.52 0.04 -4.60 118.94 121.78 3brg s TRP 354 Ca 0.07 -0.37 -0.12 0.00 0.02 0.00 0.00 56.10 55.70 3brg s TRP 354 Cb -0.15 -1.25 -0.05 0.00 -1.15 0.00 0.00 33.47 30.87 3brg s TRP 354 CO 0.09 -0.01 0.27 0.99 0.02 0.00 0.00 176.95 178.30 3brg s THR 355 N -0.55 5.30 -0.04 2.01 2.01 0.11 -0.27 115.64 124.22 3brg s THR 355 Ca 0.08 0.50 0.02 0.00 0.31 0.00 0.00 61.69 62.61 3brg s THR 355 Cb -0.09 -3.58 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 3brg s THR 355 CO -0.00 0.48 -0.07 -0.51 -0.69 0.00 0.00 174.62 173.82 3brg s ILE 356 N -0.17 3.63 -0.20 1.82 2.07 -0.94 -1.52 121.20 125.89 3brg s ILE 356 Ca 0.17 -0.62 -0.15 0.00 -1.41 0.00 0.00 60.65 58.64 3brg s ILE 356 Cb -0.13 -2.52 0.06 0.00 0.13 0.00 0.00 42.46 40.00 3brg s ILE 356 CO 0.05 0.51 0.51 -0.51 -1.91 0.00 0.00 174.94 173.59 3brg s ILE 357 N -0.88 -0.01 0.54 2.00 2.07 -1.02 -0.07 121.20 123.83 3brg s ILE 357 Ca 0.14 0.03 -0.20 0.00 -1.41 0.00 0.00 60.65 59.21 3brg s ILE 357 Cb -0.11 -0.72 -0.06 0.00 0.13 0.00 0.00 42.46 41.70 3brg s ILE 357 CO 0.04 0.01 1.16 -0.44 -1.91 0.00 0.00 174.94 173.80 3brg s SER 358 N 0.81 5.67 0.11 4.50 0.01 -1.26 -0.70 113.70 122.83 3brg s SER 358 Ca -0.04 2.25 0.05 0.00 1.31 0.00 0.00 55.95 59.51 3brg s SER 358 Cb -0.05 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.55 3brg s SER 358 CO -0.06 -1.26 -0.12 -0.89 0.41 0.00 0.00 173.24 171.32 3brg s THR 359 N -1.69 1.13 0.33 1.44 2.01 -0.71 -1.03 115.64 117.12 3brg s THR 359 Ca 0.72 -1.73 -0.00 0.00 0.31 0.00 0.00 61.69 60.99 3brg s THR 359 Cb -0.26 -1.50 -0.01 0.00 0.01 0.00 0.00 72.50 70.74 3brg s THR 359 CO 0.30 -0.53 0.40 -0.62 -0.69 0.00 0.00 174.62 173.47 3brg s ASP 360 N -2.56 1.04 -0.23 3.53 -1.08 0.30 -4.63 116.67 113.04 3brg s ASP 360 Ca 0.08 -1.54 -0.14 0.00 -0.52 0.00 0.00 52.55 50.44 3brg s ASP 360 Cb -0.03 0.61 0.07 0.00 -1.46 0.00 0.00 42.92 42.11 3brg s ASP 360 CO 0.01 -1.20 0.58 -0.75 0.52 0.00 0.00 175.17 174.34 3brg s LYS 361 N -3.27 0.60 -0.08 4.34 2.20 -1.26 -2.60 119.74 119.67 3brg s LYS 361 Ca 0.34 1.03 0.02 0.00 -0.36 0.00 0.00 55.97 56.99 3brg s LYS 361 Cb 0.01 0.11 -0.02 0.00 -1.51 0.00 0.00 37.83 36.41 3brg s LYS 361 CO 0.21 -0.14 -0.11 0.00 -0.36 0.00 0.00 175.35 174.95 3brg s ALA 362 N 1.38 2.76 -0.03 3.13 0.00 -0.36 -4.82 121.76 123.82 3brg s ALA 362 Ca -0.09 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 50.96 3brg s ALA 362 Cb -0.06 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 21.95 3brg s ALA 362 CO -0.15 0.47 -0.04 -2.00 0.00 0.00 0.00 175.76 174.04 3brg s GLU 363 N -0.44 0.62 -0.05 0.00 2.12 -1.26 -0.68 118.70 119.00 3brg s GLU 363 Ca 0.06 -0.10 0.01 0.00 0.36 0.00 0.00 54.97 55.30 3brg s GLU 363 Cb -0.12 -0.65 0.02 0.00 0.26 0.00 0.00 34.13 33.64 3brg s GLU 363 CO 0.02 -0.03 -0.04 0.71 -0.54 0.00 0.00 175.26 175.38 3brg s TYR 364 N 0.63 0.81 -0.03 5.30 1.51 0.10 -4.99 117.35 120.67 3brg s TYR 364 Ca -0.08 -0.25 0.04 0.00 -1.01 0.00 0.00 57.07 55.77 3brg s TYR 364 Cb -0.11 -0.74 -0.00 0.00 -0.11 0.00 0.00 41.96 41.00 3brg s TYR 364 CO -0.00 -0.23 -0.14 -0.08 -1.11 0.00 0.00 175.55 173.99 3brg s THR 365 N 1.11 1.14 0.07 -0.71 -1.32 -1.26 -0.77 115.64 113.91 3brg s THR 365 Ca -0.08 -0.57 -0.10 0.00 -1.21 0.00 0.00 61.69 59.73 3brg s THR 365 Cb -0.14 -0.98 0.01 0.00 -1.51 0.00 0.00 72.50 69.87 3brg s THR 365 CO -0.01 0.33 0.23 0.72 -2.21 0.00 0.00 174.62 173.68 3brg s PHE 366 N 0.01 0.06 -0.21 9.09 -0.12 -0.16 -4.09 117.98 122.55 3brg s PHE 366 Ca -0.01 -0.39 -0.14 0.00 -0.05 0.00 0.00 56.93 56.34 3brg s PHE 366 Cb -0.09 0.00 0.06 0.00 -0.63 0.00 0.00 43.02 42.36 3brg s PHE 366 CO 0.01 -0.53 0.52 -0.47 -0.05 0.00 0.00 175.22 174.70 3brg s TYR 367 N -3.38 -0.72 -1.00 3.49 5.04 0.18 -0.45 117.35 120.50 3brg s TYR 367 Ca 0.01 1.56 -0.22 0.00 -2.44 0.00 0.00 57.07 55.98 3brg s TYR 367 Cb 0.02 0.34 0.07 0.00 0.35 0.00 0.00 41.96 42.75 3brg s TYR 367 CO -0.08 -0.37 1.37 -1.21 -1.34 0.00 0.00 175.55 173.91 3brg s GLU 368 N 1.11 3.61 0.40 4.97 2.02 -1.26 0.33 118.70 129.87 3brg s GLU 368 Ca -0.07 -1.32 0.09 0.00 0.02 0.00 0.00 54.97 53.69 3brg s GLU 368 Cb -0.06 -5.25 0.83 0.00 0.10 0.00 0.00 34.13 29.76 3brg s GLU 368 CO -0.10 -2.09 1.98 0.78 0.02 0.00 0.00 175.26 175.84 3brg h GLY 369 N 12.15 0.37 -1.13 -1.39 0.00 -1.21 -2.77 103.07 109.08 3brg h GLY 369 Ca 0.20 -0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.30 3brg h GLY 369 CO 1.35 0.18 -0.08 1.03 0.00 0.00 0.00 176.54 179.01 3brg n MET 370 N -4.36 2.00 0.00 4.80 2.81 -1.20 -4.88 117.12 116.28 3brg n MET 370 Ca 0.00 -2.90 0.00 0.00 -1.81 0.00 0.00 57.70 52.99 3brg n MET 370 Cb 0.19 -1.71 0.00 0.00 -0.71 0.00 0.00 33.22 30.99 3brg n MET 370 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3brg n GLY 371 N -1.02 -2.60 3.69 3.03 0.00 -1.05 -4.97 105.19 102.28 3brg n GLY 371 Ca 0.22 -1.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.00 3brg n GLY 371 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3brg n PRO 372 N -0.17 1.70 -4.36 1.61 -0.02 -1.26 -4.80 135.00 127.70 3brg n PRO 372 Ca 0.00 0.62 -0.19 0.00 -2.02 0.00 0.00 63.50 61.91 3brg n PRO 372 Cb 0.00 -2.38 -0.10 0.00 -0.02 0.00 0.00 33.50 31.00 3brg n PRO 372 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3brg s VAL 373 N -1.27 1.80 -0.12 -1.45 -7.23 -1.26 -5.07 120.40 105.81 3brg s VAL 373 Ca 0.65 -2.23 0.20 0.00 -1.81 0.00 0.00 61.98 58.79 3brg s VAL 373 Cb -0.48 -2.07 -0.25 0.00 0.56 0.00 0.00 36.38 34.14 3brg s VAL 373 CO 0.54 -0.57 0.45 -0.11 -0.31 0.00 0.00 175.10 175.10 3brg n LEU 374 N -0.41 0.24 -4.79 1.32 0.00 -1.26 -4.92 117.00 107.19 3brg n LEU 374 Ca -0.08 0.10 -0.36 0.00 0.00 0.00 0.00 56.01 55.67 3brg n LEU 374 Cb 0.60 0.18 -0.06 0.00 0.00 0.00 0.00 43.42 44.14 3brg n LEU 374 CO 0.35 0.18 0.66 0.00 0.00 0.00 0.00 177.39 178.58 3brg s ALA 375 N -3.04 3.16 0.65 1.96 0.00 -1.26 -4.93 121.76 118.30 3brg s ALA 375 Ca -0.07 0.52 -0.18 0.00 0.00 0.00 0.00 51.96 52.23 3brg s ALA 375 Cb 0.10 -3.19 -0.01 0.00 0.00 0.00 0.00 23.12 20.02 3brg s ALA 375 CO 0.86 0.12 1.26 -0.35 0.00 0.00 0.00 175.76 177.65 3brg n PRO 376 N 0.24 1.08 0.20 0.00 -0.04 -1.26 -4.89 135.00 130.33 3brg n PRO 376 Ca 0.03 0.42 0.14 0.00 -0.04 0.00 0.00 63.50 64.06 3brg n PRO 376 Cb 0.51 -2.50 0.56 0.00 -0.04 0.00 0.00 33.50 32.02 3brg n PRO 376 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3brg h VAL 377 N 0.49 0.00 -2.78 0.52 -1.51 -1.43 -3.45 116.25 108.09 3brg h VAL 377 Ca -0.51 -0.42 -0.45 0.00 -1.23 0.00 0.00 66.70 64.10 3brg h VAL 377 Cb 1.34 1.30 0.04 0.00 -2.13 0.00 0.00 31.29 31.85 3brg h VAL 377 CO 0.53 0.00 -0.02 0.42 -1.23 0.00 0.00 177.57 177.26 3brg s THR 378 N -3.46 3.26 0.00 7.19 -4.23 -1.25 -4.19 115.64 112.96 3brg s THR 378 Ca 0.03 -0.51 -0.35 0.00 -1.18 0.00 0.00 61.69 59.68 3brg s THR 378 Cb 0.09 -3.23 -0.14 0.00 1.34 0.00 0.00 72.50 70.56 3brg s THR 378 CO 0.49 -0.18 1.68 -2.65 -0.54 0.00 0.00 174.62 173.42 3brg n PRO 379 N -2.29 1.89 -2.78 3.99 -0.02 -1.26 -4.95 135.00 129.58 3brg n PRO 379 Ca 0.05 0.69 -0.42 0.00 -2.02 0.00 0.00 63.50 61.79 3brg n PRO 379 Cb 0.59 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.58 3brg n PRO 379 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3brg s VAL 380 N 2.34 4.68 0.56 -1.45 1.01 -1.26 -4.94 120.40 121.35 3brg s VAL 380 Ca 0.87 1.60 -0.19 0.00 0.00 0.00 0.00 61.98 64.26 3brg s VAL 380 Cb -0.77 -4.27 -0.05 0.00 0.00 0.00 0.00 36.38 31.29 3brg s VAL 380 CO 0.48 -0.28 1.13 -2.16 0.00 0.00 0.00 175.10 174.26 3brg s PRO 381 N 3.22 3.26 -0.06 2.72 0.04 -1.26 -4.73 135.00 138.19 3brg s PRO 381 Ca 0.39 1.60 0.01 0.00 0.04 0.00 0.00 61.00 63.05 3brg s PRO 381 Cb -0.14 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.43 3brg s PRO 381 CO 0.11 -0.92 -0.08 0.14 0.04 0.00 0.00 177.00 176.29 3brg s VAL 382 N -1.83 0.85 -0.29 -0.36 -7.23 -0.82 -4.87 120.40 105.84 3brg s VAL 382 Ca 0.72 -0.30 -0.11 0.00 -1.81 0.00 0.00 61.98 60.49 3brg s VAL 382 Cb -0.24 -0.82 -0.04 0.00 0.56 0.00 0.00 36.38 35.84 3brg s VAL 382 CO 0.29 0.30 0.19 -0.69 -0.31 0.00 0.00 175.10 174.88 3brg s VAL 383 N 0.88 5.25 -0.08 1.32 1.01 -1.26 -0.74 120.40 126.78 3brg s VAL 383 Ca -0.11 0.06 -0.23 0.00 0.00 0.00 0.00 61.98 61.71 3brg s VAL 383 Cb -0.15 -3.54 -0.18 0.00 0.00 0.00 0.00 36.38 32.51 3brg s VAL 383 CO 0.01 0.20 0.83 -0.33 0.00 0.00 0.00 175.10 175.81 3brg h GLU 384 N 8.39 -0.09 -3.62 2.72 3.07 -0.93 -3.47 114.58 120.65 3brg h GLU 384 Ca -0.34 0.01 -0.07 0.00 -0.50 0.00 0.00 59.36 58.46 3brg h GLU 384 Cb 1.18 0.02 -0.12 0.00 -0.84 0.00 0.00 28.75 29.00 3brg h GLU 384 CO 0.57 0.49 -0.17 -1.54 -1.40 0.00 0.00 179.01 176.97 3brg s SER 385 N -5.76 -0.09 -0.06 1.42 1.04 -1.02 -5.04 113.70 104.20 3brg s SER 385 Ca -0.14 -0.68 0.05 0.00 0.48 0.00 0.00 55.95 55.66 3brg s SER 385 Cb -0.00 0.49 -0.01 0.00 0.10 0.00 0.00 66.02 66.60 3brg s SER 385 CO 0.54 -0.95 -0.22 -0.76 0.98 0.00 0.00 173.24 172.83 3brg s LEU 386 N -2.92 2.00 -0.09 2.42 1.02 -1.26 -2.35 118.68 117.50 3brg s LEU 386 Ca 0.13 -0.45 -0.00 0.00 0.02 0.00 0.00 54.13 53.82 3brg s LEU 386 Cb 0.01 -1.21 0.02 0.00 0.02 0.00 0.00 46.19 45.04 3brg s LEU 386 CO -0.02 0.19 -0.05 -1.58 0.02 0.00 0.00 176.35 174.92 3brg s GLN 387 N -0.01 1.12 0.11 1.70 2.00 -0.24 -4.99 119.66 119.35 3brg s GLN 387 Ca -0.06 -0.11 -0.25 0.00 -2.00 0.00 0.00 55.36 52.93 3brg s GLN 387 Cb -0.13 -1.27 -0.07 0.00 0.80 0.00 0.00 33.01 32.34 3brg s GLN 387 CO 0.04 -0.24 0.79 -1.17 -0.50 0.00 0.00 175.29 174.20 3brg s LEU 388 N 1.66 4.53 0.42 3.68 0.20 -1.26 0.34 118.68 128.25 3brg s LEU 388 Ca 0.02 1.57 0.07 0.00 0.69 0.00 0.00 54.13 56.48 3brg s LEU 388 Cb -0.13 -3.29 -0.03 0.00 -0.43 0.00 0.00 46.19 42.31 3brg s LEU 388 CO -0.05 0.11 0.27 0.20 -0.29 0.00 0.00 176.35 176.58 3brg s ASN 389 N -0.59 4.66 0.00 3.68 0.02 0.64 -4.93 114.94 118.42 3brg s ASN 389 Ca 0.38 -0.98 0.00 0.00 -1.02 0.00 0.00 52.86 51.24 3brg s ASN 389 Cb -0.22 -0.44 0.00 0.00 0.02 0.00 0.00 41.25 40.61 3brg s ASN 389 CO 0.25 -0.63 0.00 0.61 0.02 0.00 0.00 177.10 177.35 3brg n GLY 390 N -1.39 -1.05 0.00 0.66 0.00 -1.26 -3.86 105.19 98.29 3brg n GLY 390 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.45 3brg n GLY 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3brg n GLY 391 N 0.00 0.41 0.00 -0.02 0.00 -1.26 -5.09 105.19 99.23 3brg n GLY 391 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 3brg n GLY 391 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3brg n GLY 392 N 0.00 -1.45 0.26 -0.02 0.00 -1.26 -4.97 105.19 97.75 3brg n GLY 392 Ca 0.00 -1.61 0.15 0.00 0.00 0.00 0.00 46.02 44.56 3brg n GLY 392 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3brg h ASP 393 N -0.25 0.00 -2.83 1.61 1.82 -2.02 -3.43 116.42 111.32 3brg h ASP 393 Ca 0.00 0.00 -0.64 0.00 -0.39 0.00 0.00 57.03 56.00 3brg h ASP 393 Cb 0.00 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 39.95 3brg h ASP 393 CO 0.00 0.07 -0.35 -0.69 -1.61 0.00 0.00 179.24 176.66 3brg s VAL 394 N -3.67 5.29 -0.13 2.25 1.01 -1.26 -5.06 120.40 118.83 3brg s VAL 394 Ca 0.01 0.50 -0.29 0.00 0.00 0.00 0.00 61.98 62.20 3brg s VAL 394 Cb 0.09 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 3brg s VAL 394 CO 0.58 0.59 1.58 0.00 0.00 0.00 0.00 175.10 177.85 3brg s ALA 395 N -0.98 3.49 0.01 5.51 0.00 -1.26 -4.72 121.76 123.81 3brg s ALA 395 Ca 0.19 0.69 0.06 0.00 0.00 0.00 0.00 51.96 52.90 3brg s ALA 395 Cb -0.14 -3.77 -0.03 0.00 0.00 0.00 0.00 23.12 19.18 3brg s ALA 395 CO 0.08 -1.57 -0.18 -1.64 0.00 0.00 0.00 175.76 172.46 3brg s MET 396 N 4.20 2.20 -0.15 0.00 -1.94 -1.25 -1.71 119.30 120.64 3brg s MET 396 Ca 0.70 -0.90 -0.00 0.00 -1.71 0.00 0.00 55.69 53.78 3brg s MET 396 Cb -0.28 -2.23 -0.01 0.00 2.01 0.00 0.00 34.83 34.32 3brg s MET 396 CO 0.27 0.56 -0.13 -1.17 -0.01 0.00 0.00 175.02 174.54 3brg s LEU 397 N -1.18 2.62 -0.17 -0.03 2.96 -0.05 -0.26 118.68 122.57 3brg s LEU 397 Ca 0.13 -0.40 -0.15 0.00 -0.22 0.00 0.00 54.13 53.49 3brg s LEU 397 Cb -0.10 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 3brg s LEU 397 CO 0.04 0.11 0.37 -0.70 -1.32 0.00 0.00 176.35 174.84 3brg s GLU 398 N 0.67 4.24 -0.18 1.98 2.12 0.15 -1.74 118.70 125.95 3brg s GLU 398 Ca -0.07 0.21 -0.05 0.00 0.36 0.00 0.00 54.97 55.42 3brg s GLU 398 Cb -0.15 -3.47 -0.03 0.00 0.26 0.00 0.00 34.13 30.74 3brg s GLU 398 CO 0.02 0.12 -0.01 -0.51 -0.54 0.00 0.00 175.26 174.34 3brg s LEU 399 N 0.82 3.28 -0.09 2.70 1.02 0.11 -1.08 118.68 125.43 3brg s LEU 399 Ca 0.19 -0.16 0.01 0.00 0.02 0.00 0.00 54.13 54.20 3brg s LEU 399 Cb -0.14 -1.81 -0.02 0.00 0.02 0.00 0.00 46.19 44.23 3brg s LEU 399 CO 0.07 0.11 -0.12 0.42 0.02 0.00 0.00 176.35 176.85 3brg s THR 400 N 0.70 3.22 0.00 5.49 -4.23 -0.99 -1.96 115.64 117.86 3brg s THR 400 Ca -0.01 -0.63 0.00 0.00 -1.18 0.00 0.00 61.69 59.87 3brg s THR 400 Cb -0.14 -2.32 0.00 0.00 1.34 0.00 0.00 72.50 71.38 3brg s THR 400 CO 0.02 0.56 0.00 0.61 -0.54 0.00 0.00 174.62 175.27 3brg n GLY 401 N 2.91 1.07 3.13 3.99 0.00 -0.49 -0.19 105.19 115.62 3brg n GLY 401 Ca -0.18 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 3brg n GLY 401 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3brg s GLN 402 N 3.98 0.73 -1.32 1.61 -0.21 0.08 -4.17 119.66 120.36 3brg s GLN 402 Ca 0.00 -1.25 0.00 0.00 0.02 0.00 0.00 55.36 54.13 3brg s GLN 402 Cb 0.00 -0.05 0.00 0.00 1.00 0.00 0.00 33.01 33.96 3brg s GLN 402 CO 0.00 -0.05 0.00 0.09 -2.12 0.00 0.00 175.29 173.21 3brg n ASN 403 N 0.11 -4.57 -4.82 5.90 3.02 -0.70 -1.95 115.26 112.25 3brg n ASN 403 Ca -0.14 0.04 -0.32 0.00 -0.03 0.00 0.00 54.58 54.13 3brg n ASN 403 Cb 0.60 -3.67 -0.01 0.00 -0.61 0.00 0.00 39.78 36.10 3brg n ASN 403 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3brg s PHE 404 N -2.72 3.24 0.06 3.10 2.99 -0.83 -4.05 117.98 119.77 3brg s PHE 404 Ca 0.00 1.48 -0.09 0.00 0.00 0.00 0.00 56.93 58.32 3brg s PHE 404 Cb 0.00 -2.89 0.00 0.00 0.00 0.00 0.00 43.02 40.13 3brg s PHE 404 CO 0.00 -0.75 0.19 0.99 -0.00 0.00 0.00 175.22 175.65 3brg s THR 405 N -2.59 0.13 -0.88 0.64 2.01 -1.26 -4.34 115.64 109.35 3brg s THR 405 Ca 0.61 -1.04 0.16 0.00 0.31 0.00 0.00 61.69 61.73 3brg s THR 405 Cb -0.13 -1.12 0.14 0.00 0.01 0.00 0.00 72.50 71.41 3brg s THR 405 CO 0.36 -0.57 1.50 -2.65 -0.69 0.00 0.00 174.62 172.56 3brg n PRO 406 N 0.33 0.04 -0.19 4.92 -0.02 -1.26 -2.77 135.00 136.05 3brg n PRO 406 Ca -0.17 0.30 0.02 0.00 -2.02 0.00 0.00 63.50 61.63 3brg n PRO 406 Cb 0.61 -1.58 0.10 0.00 -0.02 0.00 0.00 33.50 32.61 3brg n PRO 406 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3brg n ASN 407 N -1.66 1.84 -4.63 2.55 0.23 -1.26 -4.88 115.26 107.44 3brg n ASN 407 Ca 0.03 -2.16 -0.33 0.00 -0.53 0.00 0.00 54.58 51.59 3brg n ASN 407 Cb 0.18 -0.39 -0.10 0.00 -2.08 0.00 0.00 39.78 37.38 3brg n ASN 407 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3brg s LEU 408 N -0.85 3.31 -0.03 -4.53 1.43 -1.12 -1.87 118.68 115.03 3brg s LEU 408 Ca 0.14 -0.05 0.04 0.00 -1.03 0.00 0.00 54.13 53.24 3brg s LEU 408 Cb 0.10 -1.84 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 3brg s LEU 408 CO 0.06 0.31 -0.16 -0.13 0.23 0.00 0.00 176.35 176.67 3brg s ARG 409 N -1.25 1.47 -0.01 1.70 1.81 -0.25 -4.88 118.95 117.55 3brg s ARG 409 Ca 0.16 -0.56 -0.30 0.00 -1.72 0.00 0.00 55.73 53.31 3brg s ARG 409 Cb -0.11 -1.35 -0.03 0.00 -0.45 0.00 0.00 34.95 33.01 3brg s ARG 409 CO 0.06 0.28 1.04 0.08 -0.68 0.00 0.00 175.30 176.08 3brg s VAL 410 N -0.14 4.66 -0.13 3.52 1.01 -1.26 -1.22 120.40 126.83 3brg s VAL 410 Ca 0.01 1.91 -0.02 0.00 0.00 0.00 0.00 61.98 63.88 3brg s VAL 410 Cb -0.09 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 3brg s VAL 410 CO 0.01 0.12 -0.04 0.26 0.00 0.00 0.00 175.10 175.45 3brg s TRP 411 N 1.22 3.02 -0.36 5.22 0.52 -0.30 -0.86 118.94 127.40 3brg s TRP 411 Ca 0.53 -0.18 -0.11 0.00 0.02 0.00 0.00 56.10 56.36 3brg s TRP 411 Cb -0.22 -1.88 0.01 0.00 -1.15 0.00 0.00 33.47 30.22 3brg s TRP 411 CO 0.27 0.10 0.21 -0.06 0.02 0.00 0.00 176.95 177.48 3brg s PHE 412 N -0.03 3.23 0.00 -1.98 0.40 0.68 -1.84 117.98 118.43 3brg s PHE 412 Ca 0.01 -0.75 0.00 0.00 -0.60 0.00 0.00 56.93 55.59 3brg s PHE 412 Cb -0.13 -2.45 0.00 0.00 0.51 0.00 0.00 43.02 40.95 3brg s PHE 412 CO 0.03 -0.57 0.00 0.41 0.70 0.00 0.00 175.22 175.79 3brg n GLY 413 N 5.03 3.10 1.39 4.36 0.00 0.04 -0.72 105.19 118.38 3brg n GLY 413 Ca -0.12 0.01 0.01 0.00 0.00 0.00 0.00 46.02 45.91 3brg n GLY 413 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3brg n ASP 414 N 3.31 3.75 -4.20 1.61 5.75 -1.26 -4.84 116.55 120.67 3brg n ASP 414 Ca 0.00 -2.62 -0.35 0.00 -0.01 0.00 0.00 54.79 51.81 3brg n ASP 414 Cb 0.00 -0.63 -0.14 0.00 -1.03 0.00 0.00 41.12 39.32 3brg n ASP 414 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3brg s VAL 415 N -2.03 2.96 0.15 2.12 1.01 0.10 -4.82 120.40 119.88 3brg s VAL 415 Ca 0.32 -1.12 -0.31 0.00 0.00 0.00 0.00 61.98 60.87 3brg s VAL 415 Cb 0.25 -2.56 -0.09 0.00 0.00 0.00 0.00 36.38 33.98 3brg s VAL 415 CO 0.09 0.10 1.45 -0.70 0.00 0.00 0.00 175.10 176.04 3brg s GLU 416 N 1.31 4.28 0.02 2.72 2.12 -1.26 -0.23 118.70 127.66 3brg s GLU 416 Ca -0.01 2.19 0.03 0.00 0.36 0.00 0.00 54.97 57.53 3brg s GLU 416 Cb -0.18 -3.20 -0.04 0.00 0.26 0.00 0.00 34.13 30.98 3brg s GLU 416 CO -0.03 -0.48 -0.03 0.00 -0.54 0.00 0.00 175.26 174.18 3brg s ALA 417 N 0.97 3.17 -0.09 6.30 0.00 -0.04 -4.93 121.76 127.14 3brg s ALA 417 Ca 0.66 -1.01 -0.34 0.00 0.00 0.00 0.00 51.96 51.27 3brg s ALA 417 Cb -0.40 -1.22 -0.11 0.00 0.00 0.00 0.00 23.12 21.39 3brg s ALA 417 CO 0.32 0.64 1.91 -1.91 0.00 0.00 0.00 175.76 176.72 3brg n GLU 418 N 1.33 2.19 -5.11 0.00 2.13 -1.26 -4.30 120.64 115.61 3brg n GLU 418 Ca -0.14 0.80 -0.30 0.00 0.66 0.00 0.00 57.16 58.18 3brg n GLU 418 Cb 0.52 -2.68 -0.16 0.00 0.27 0.00 0.00 31.44 29.39 3brg n GLU 418 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 3brg s THR 419 N 4.33 1.83 -0.25 6.31 2.01 -1.26 -1.05 115.64 127.56 3brg s THR 419 Ca 0.93 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.96 3brg s THR 419 Cb -0.67 -1.56 0.01 0.00 0.01 0.00 0.00 72.50 70.30 3brg s THR 419 CO 0.51 0.51 -0.03 -0.04 -0.69 0.00 0.00 174.62 174.88 3brg s MET 420 N -0.11 3.02 0.12 4.92 -1.94 0.28 -4.98 119.30 120.61 3brg s MET 420 Ca -0.03 -0.87 -0.30 0.00 -1.71 0.00 0.00 55.69 52.78 3brg s MET 420 Cb -0.13 -3.06 -0.07 0.00 2.01 0.00 0.00 34.83 33.58 3brg s MET 420 CO 0.03 -0.36 1.15 -0.47 -0.01 0.00 0.00 175.02 175.36 3brg s TYR 421 N 1.40 3.51 -0.06 -0.03 5.04 -1.26 -0.85 117.35 125.09 3brg s TYR 421 Ca 0.02 1.46 -0.06 0.00 -2.44 0.00 0.00 57.07 56.06 3brg s TYR 421 Cb -0.16 -3.35 -0.03 0.00 0.35 0.00 0.00 41.96 38.77 3brg s TYR 421 CO -0.03 -0.92 -0.13 0.54 -1.34 0.00 0.00 175.55 173.67 3brg n ARG 422 N 3.11 0.20 -3.82 4.97 5.12 -0.99 -4.96 116.66 120.29 3brg n ARG 422 Ca 0.06 0.09 -0.08 0.00 -1.93 0.00 0.00 57.85 55.98 3brg n ARG 422 Cb 0.46 -0.84 0.02 0.00 -1.16 0.00 0.00 32.46 30.94 3brg n ARG 422 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3brg n GLY 424 N -0.54 -0.57 0.05 0.00 0.00 -1.26 -1.98 105.19 100.90 3brg n GLY 424 Ca -0.08 0.07 0.01 0.00 0.00 0.00 0.00 46.02 46.02 3brg n GLY 424 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3brg n GLU 425 N -1.73 2.93 -3.74 1.61 4.71 -1.26 -1.71 120.64 121.44 3brg n GLU 425 Ca -0.00 -0.32 -0.12 0.00 -0.01 0.00 0.00 57.16 56.70 3brg n GLU 425 Cb 0.09 -0.82 -0.13 0.00 -1.01 0.00 0.00 31.44 29.57 3brg n GLU 425 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 3brg s SER 426 N -0.74 -0.27 0.01 1.62 0.15 -0.84 -1.39 113.70 112.23 3brg s SER 426 Ca 0.02 0.53 -0.02 0.00 0.70 0.00 0.00 55.95 57.18 3brg s SER 426 Cb 0.02 0.45 -0.01 0.00 -1.71 0.00 0.00 66.02 64.77 3brg s SER 426 CO 0.07 -0.14 0.02 -0.04 1.20 0.00 0.00 173.24 174.35 3brg s MET 427 N 0.92 0.28 0.11 5.44 -1.94 -0.83 -2.36 119.30 120.93 3brg s MET 427 Ca -0.06 -0.39 0.08 0.00 -1.71 0.00 0.00 55.69 53.60 3brg s MET 427 Cb -0.08 0.11 -0.04 0.00 2.01 0.00 0.00 34.83 36.83 3brg s MET 427 CO -0.06 -0.05 -0.15 -0.51 -0.01 0.00 0.00 175.02 174.24 3brg s LEU 428 N -1.06 2.83 0.05 -0.03 1.43 -0.03 -0.71 118.68 121.16 3brg s LEU 428 Ca -0.12 -0.50 -0.05 0.00 -1.03 0.00 0.00 54.13 52.44 3brg s LEU 428 Cb -0.07 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.48 3brg s LEU 428 CO -0.00 0.18 0.08 0.00 0.23 0.00 0.00 176.35 176.84 3brg s VAL 430 N -3.27 4.66 0.02 0.00 1.01 -0.21 -0.87 120.40 121.73 3brg s VAL 430 Ca 0.01 1.27 -0.30 0.00 0.00 0.00 0.00 61.98 62.96 3brg s VAL 430 Cb 0.03 -4.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.05 3brg s VAL 430 CO -0.08 -0.41 1.92 -0.69 0.00 0.00 0.00 175.10 175.84 3brg s VAL 431 N 3.28 3.10 0.81 2.92 1.01 -0.69 -4.52 120.40 126.30 3brg s VAL 431 Ca 0.37 0.13 -0.13 0.00 0.00 0.00 0.00 61.98 62.35 3brg s VAL 431 Cb -0.13 -3.09 0.08 0.00 0.00 0.00 0.00 36.38 33.24 3brg s VAL 431 CO 0.15 -0.01 1.15 -2.65 0.00 0.00 0.00 175.10 173.75 3brg n PRO 432 N 7.43 0.17 -2.10 2.72 -0.02 -1.26 -4.86 135.00 137.08 3brg n PRO 432 Ca 0.19 0.13 -0.38 0.00 -2.02 0.00 0.00 63.50 61.42 3brg n PRO 432 Cb 0.41 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 3brg n PRO 432 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3brg s ASP 433 N -2.09 6.07 0.64 2.55 3.68 -1.26 -4.90 116.67 121.35 3brg s ASP 433 Ca 0.73 2.52 0.29 0.00 2.13 0.00 0.00 52.55 58.21 3brg s ASP 433 Cb -0.29 -2.62 1.55 0.00 -1.45 0.00 0.00 42.92 40.11 3brg s ASP 433 CO 0.52 -1.00 1.90 -0.29 0.13 0.00 0.00 175.17 176.43 3brg h ILE 434 N 2.02 0.14 0.00 4.11 6.09 -1.92 -3.09 117.51 124.86 3brg h ILE 434 Ca -0.50 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 62.99 3brg h ILE 434 Cb 1.26 0.65 0.00 0.00 0.47 0.00 0.00 36.82 39.19 3brg h ILE 434 CO 0.61 0.00 -0.74 0.77 -3.07 0.00 0.00 178.15 175.72 3brg h SER 435 N 0.00 0.00 0.00 2.19 4.64 -1.75 0.75 113.55 119.38 3brg h SER 435 Ca 0.07 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 3brg h SER 435 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 3brg h SER 435 CO -0.00 0.11 0.00 0.00 -0.87 0.00 0.00 176.83 176.06 3brg n ALA 436 N -1.87 0.00 -0.02 5.18 0.00 -1.17 -3.56 120.51 119.07 3brg n ALA 436 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.45 3brg n ALA 436 Cb 0.45 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.86 3brg n ALA 436 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3brg n PHE 437 N 0.00 0.00 -3.81 0.00 3.72 0.05 -4.88 117.46 112.55 3brg n PHE 437 Ca 0.00 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.10 3brg n PHE 437 Cb 0.00 -0.22 -0.14 0.00 -0.94 0.00 0.00 39.48 38.19 3brg n PHE 437 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3brg s ARG 438 N -2.19 1.42 0.17 -1.08 1.81 -0.04 -5.09 118.95 113.96 3brg s ARG 438 Ca -0.02 -2.05 -0.34 0.00 -1.72 0.00 0.00 55.73 51.60 3brg s ARG 438 Cb 0.02 -2.64 -0.14 0.00 -0.45 0.00 0.00 34.95 31.74 3brg s ARG 438 CO 0.21 -1.11 1.52 -1.91 -0.68 0.00 0.00 175.30 173.33 3brg n GLU 439 N 3.65 2.03 0.00 3.54 2.13 -1.23 -1.40 120.64 129.36 3brg n GLU 439 Ca 0.06 0.73 0.00 0.00 0.66 0.00 0.00 57.16 58.61 3brg n GLU 439 Cb 0.35 -2.46 0.00 0.00 0.27 0.00 0.00 31.44 29.60 3brg n GLU 439 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3brg n GLY 440 N 3.07 1.99 3.72 8.31 0.00 -1.26 -5.01 105.19 116.00 3brg n GLY 440 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 3brg n GLY 440 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3brg s TRP 441 N -2.65 3.41 -2.10 1.61 0.52 -0.49 -4.89 118.94 114.35 3brg s TRP 441 Ca 0.00 1.27 0.17 0.00 0.02 0.00 0.00 56.10 57.56 3brg s TRP 441 Cb 0.00 -3.46 0.18 0.00 -1.15 0.00 0.00 33.47 29.04 3brg s TRP 441 CO 0.00 -1.41 1.09 0.54 0.02 0.00 0.00 176.95 177.19 3brg n ARG 442 N 3.77 1.58 -3.78 4.98 1.74 -1.26 -4.30 116.66 119.38 3brg n ARG 442 Ca 0.09 -1.63 -0.04 0.00 -0.77 0.00 0.00 57.85 55.50 3brg n ARG 442 Cb 0.46 -1.34 -0.01 0.00 -1.02 0.00 0.00 32.46 30.54 3brg n ARG 442 CO 0.00 0.00 0.00 1.67 -1.52 0.00 0.00 177.63 177.78 3brg s TRP 443 N -1.40 -0.10 -0.55 -1.55 -2.14 -1.26 -5.10 118.94 106.83 3brg s TRP 443 Ca 0.22 -0.24 -0.28 0.00 2.66 0.00 0.00 56.10 58.46 3brg s TRP 443 Cb 0.15 0.66 0.02 0.00 -3.10 0.00 0.00 33.47 31.20 3brg s TRP 443 CO 0.22 -0.91 1.31 0.08 -2.66 0.00 0.00 176.95 175.00 3brg s VAL 444 N -3.19 3.91 -0.04 -0.66 1.01 -1.26 -4.88 120.40 115.28 3brg s VAL 444 Ca 0.13 0.82 -0.13 0.00 0.00 0.00 0.00 61.98 62.80 3brg s VAL 444 Cb -0.02 -4.54 -0.31 0.00 0.00 0.00 0.00 36.38 31.50 3brg s VAL 444 CO 0.03 -1.19 0.73 0.03 0.00 0.00 0.00 175.10 174.70 3brg h ARG 445 N 10.31 0.40 -4.48 2.72 3.08 -1.96 -3.38 114.38 121.07 3brg h ARG 445 Ca -0.26 -0.68 -0.20 0.00 0.07 0.00 0.00 59.98 58.91 3brg h ARG 445 Cb 1.08 0.25 -0.15 0.00 0.08 0.00 0.00 29.97 31.23 3brg h ARG 445 CO 1.17 1.33 -0.64 1.14 -1.07 0.00 0.00 179.97 181.89 3brg s GLN 446 N -2.56 0.99 0.33 0.04 -2.07 -1.26 -4.86 119.66 110.27 3brg s GLN 446 Ca -0.15 -1.48 -0.29 0.00 -1.82 0.00 0.00 55.36 51.62 3brg s GLN 446 Cb 0.05 0.21 -0.12 0.00 -1.09 0.00 0.00 33.01 32.06 3brg s GLN 446 CO 0.86 -0.28 1.46 -2.30 -1.32 0.00 0.00 175.29 173.71 3brg n PRO 447 N -0.14 2.48 -3.84 9.60 -0.02 -1.26 -4.65 135.00 137.17 3brg n PRO 447 Ca -0.04 0.87 -0.25 0.00 -2.02 0.00 0.00 63.50 62.06 3brg n PRO 447 Cb 0.64 -2.57 -0.17 0.00 -0.02 0.00 0.00 33.50 31.38 3brg n PRO 447 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3brg s VAL 448 N -0.72 0.70 -0.14 -1.45 1.01 -0.61 -4.98 120.40 114.22 3brg s VAL 448 Ca 0.58 -0.08 -0.06 0.00 0.00 0.00 0.00 61.98 62.42 3brg s VAL 448 Cb -0.52 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 3brg s VAL 448 CO 0.58 0.31 0.07 -1.58 0.00 0.00 0.00 175.10 174.49 3brg s GLN 449 N 1.84 3.56 0.04 2.72 0.74 -1.26 -0.33 119.66 126.97 3brg s GLN 449 Ca 0.05 -0.29 0.04 0.00 0.05 0.00 0.00 55.36 55.21 3brg s GLN 449 Cb -0.12 -3.11 -0.02 0.00 1.10 0.00 0.00 33.01 30.86 3brg s GLN 449 CO -0.07 0.54 -0.12 0.14 -0.55 0.00 0.00 175.29 175.24 3brg s VAL 450 N -0.39 0.92 0.34 1.34 -7.23 0.80 -4.95 120.40 111.23 3brg s VAL 450 Ca 0.10 -0.97 -0.27 0.00 -1.81 0.00 0.00 61.98 59.03 3brg s VAL 450 Cb -0.12 -0.86 -0.09 0.00 0.56 0.00 0.00 36.38 35.87 3brg s VAL 450 CO 0.02 -0.09 1.10 -2.16 -0.31 0.00 0.00 175.10 173.66 3brg s PRO 451 N -1.18 4.38 -0.19 4.82 0.04 -1.26 -0.27 135.00 141.33 3brg s PRO 451 Ca -0.01 1.73 -0.09 0.00 0.04 0.00 0.00 61.00 62.67 3brg s PRO 451 Cb -0.08 -2.89 -0.05 0.00 0.04 0.00 0.00 34.50 31.52 3brg s PRO 451 CO 0.01 -0.01 0.10 0.08 0.04 0.00 0.00 177.00 177.22 3brg s VAL 452 N -1.36 5.12 0.02 -0.36 1.01 -0.80 -0.78 120.40 123.25 3brg s VAL 452 Ca 0.51 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.59 3brg s VAL 452 Cb -0.29 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 3brg s VAL 452 CO 0.37 0.45 -0.06 -0.89 0.00 0.00 0.00 175.10 174.97 3brg s THR 453 N 0.35 0.40 -0.07 3.92 2.01 -0.77 -3.87 115.64 117.62 3brg s THR 453 Ca 0.06 -0.61 -0.05 0.00 0.31 0.00 0.00 61.69 61.40 3brg s THR 453 Cb -0.12 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 71.94 3brg s THR 453 CO -0.01 -0.15 0.16 -0.76 -0.69 0.00 0.00 174.62 173.17 3brg s LEU 454 N -0.81 4.38 -0.01 4.42 1.43 -0.77 -1.15 118.68 126.17 3brg s LEU 454 Ca -0.05 0.41 0.01 0.00 -1.03 0.00 0.00 54.13 53.48 3brg s LEU 454 Cb -0.06 -2.32 0.01 0.00 0.03 0.00 0.00 46.19 43.85 3brg s LEU 454 CO -0.00 0.34 -0.03 -0.69 0.23 0.00 0.00 176.35 176.20 3brg s VAL 455 N -1.17 0.29 0.35 -1.59 1.01 -0.36 -0.33 120.40 118.60 3brg s VAL 455 Ca 0.21 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.08 3brg s VAL 455 Cb -0.12 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 3brg s VAL 455 CO 0.11 0.11 0.58 -0.60 0.00 0.00 0.00 175.10 175.30 3brg s ARG 456 N 0.30 3.52 0.63 2.72 3.52 0.24 -1.09 118.95 128.79 3brg s ARG 456 Ca -0.03 -0.19 0.37 0.00 -0.13 0.00 0.00 55.73 55.75 3brg s ARG 456 Cb -0.06 -2.62 2.12 0.00 -1.56 0.00 0.00 34.95 32.83 3brg s ARG 456 CO -0.01 0.11 2.31 -0.91 -0.81 0.00 0.00 175.30 175.99 3brg h ASN 457 N 0.87 0.00 -0.48 -2.12 2.35 -1.70 0.13 115.58 114.63 3brg h ASN 457 Ca -0.49 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.26 3brg h ASN 457 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 3brg h ASN 457 CO 0.62 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.51 3brg n ASP 458 N -3.44 2.88 0.00 5.81 5.75 -1.26 -3.41 116.55 122.89 3brg n ASP 458 Ca -0.03 -2.10 0.00 0.00 -0.01 0.00 0.00 54.79 52.65 3brg n ASP 458 Cb 0.09 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 39.80 3brg n ASP 458 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3brg n GLY 459 N 1.15 0.74 3.72 6.12 0.00 0.47 -4.58 105.19 112.80 3brg n GLY 459 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3brg n GLY 459 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3brg s VAL 460 N -2.67 4.02 -0.19 1.61 0.11 -1.25 -0.63 120.40 121.41 3brg s VAL 460 Ca 0.00 1.49 -0.07 0.00 -2.93 0.00 0.00 61.98 60.47 3brg s VAL 460 Cb 0.00 -3.95 -0.04 0.00 -1.53 0.00 0.00 36.38 30.86 3brg s VAL 460 CO 0.00 0.14 0.05 -0.63 -3.33 0.00 0.00 175.10 171.33 3brg s ILE 461 N 0.87 4.61 -0.39 7.04 1.01 0.15 -0.59 121.20 133.90 3brg s ILE 461 Ca 0.57 -0.09 -0.01 0.00 0.00 0.00 0.00 60.65 61.12 3brg s ILE 461 Cb -0.29 -3.08 0.11 0.00 0.01 0.00 0.00 42.46 39.20 3brg s ILE 461 CO 0.30 0.45 0.15 -0.31 0.00 0.00 0.00 174.94 175.53 3brg s TYR 462 N 0.51 3.65 0.55 3.97 1.51 0.55 -0.65 117.35 127.44 3brg s TYR 462 Ca 0.02 -2.62 -0.19 0.00 -1.01 0.00 0.00 57.07 53.28 3brg s TYR 462 Cb -0.13 -3.13 -0.06 0.00 -0.11 0.00 0.00 41.96 38.54 3brg s TYR 462 CO 0.01 -0.97 1.09 -1.54 -1.11 0.00 0.00 175.55 173.03 3brg s SER 463 N 1.51 5.85 0.20 2.29 1.04 -1.26 -1.84 113.70 121.50 3brg s SER 463 Ca 0.09 2.03 0.11 0.00 0.48 0.00 0.00 55.95 58.66 3brg s SER 463 Cb -0.21 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.30 3brg s SER 463 CO -0.05 -1.12 -0.22 -0.89 0.98 0.00 0.00 173.24 171.93 3brg s THR 464 N -1.99 2.44 -2.10 2.02 2.01 -1.25 -4.87 115.64 111.90 3brg s THR 464 Ca 0.69 -2.05 0.15 0.00 0.31 0.00 0.00 61.69 60.79 3brg s THR 464 Cb -0.20 -2.19 0.37 0.00 0.01 0.00 0.00 72.50 70.49 3brg s THR 464 CO 0.28 -0.15 1.37 -1.54 -0.69 0.00 0.00 174.62 173.88 3brg n SER 465 N 0.12 1.78 -4.79 3.53 3.41 -1.26 -4.89 113.62 111.52 3brg n SER 465 Ca -0.11 -1.88 -0.29 0.00 -0.26 0.00 0.00 58.87 56.33 3brg n SER 465 Cb 0.56 -0.18 -0.06 0.00 -0.26 0.00 0.00 64.21 64.27 3brg n SER 465 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3brg s LEU 466 N -1.22 3.84 0.32 1.04 1.43 -1.26 -5.05 118.68 117.77 3brg s LEU 466 Ca 0.27 -0.04 0.05 0.00 -1.03 0.00 0.00 54.13 53.37 3brg s LEU 466 Cb 0.14 -2.48 -0.06 0.00 0.03 0.00 0.00 46.19 43.82 3brg s LEU 466 CO 0.20 0.13 0.02 0.42 0.23 0.00 0.00 176.35 177.35 3brg s THR 467 N -1.55 1.35 -0.05 5.49 -4.23 -1.26 -1.91 115.64 113.48 3brg s THR 467 Ca 0.30 -2.03 0.03 0.00 -1.18 0.00 0.00 61.69 58.82 3brg s THR 467 Cb -0.11 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 71.02 3brg s THR 467 CO 0.23 -0.09 -0.15 0.12 -0.54 0.00 0.00 174.62 174.19 3brg s PHE 468 N -3.19 1.55 -0.17 3.99 5.36 0.63 -4.84 117.98 121.31 3brg s PHE 468 Ca 0.34 -0.49 -0.01 0.00 -0.96 0.00 0.00 56.93 55.81 3brg s PHE 468 Cb 0.08 -1.08 -0.01 0.00 -0.34 0.00 0.00 43.02 41.67 3brg s PHE 468 CO 0.14 -0.20 -0.11 0.99 -1.46 0.00 0.00 175.22 174.58 3brg s THR 469 N 0.28 2.97 -0.18 0.12 2.01 -1.26 -0.14 115.64 119.43 3brg s THR 469 Ca -0.08 -0.66 -0.26 0.00 0.31 0.00 0.00 61.69 61.00 3brg s THR 469 Cb -0.13 -2.28 -0.01 0.00 0.01 0.00 0.00 72.50 70.09 3brg s THR 469 CO 0.03 0.49 0.87 -0.31 -0.69 0.00 0.00 174.62 175.01 3brg s TYR 470 N 0.90 3.41 -0.09 4.92 1.51 0.56 -4.94 117.35 123.61 3brg s TYR 470 Ca -0.03 1.29 0.03 0.00 -1.01 0.00 0.00 57.07 57.35 3brg s TYR 470 Cb -0.15 -3.06 -0.01 0.00 -0.11 0.00 0.00 41.96 38.63 3brg s TYR 470 CO -0.00 -0.28 -0.18 0.99 -1.11 0.00 0.00 175.55 174.97 3brg s THR 471 N 2.33 2.68 0.47 -0.71 2.01 -1.26 -1.57 115.64 119.58 3brg s THR 471 Ca 0.39 -0.82 -0.23 0.00 0.31 0.00 0.00 61.69 61.34 3brg s THR 471 Cb -0.16 -2.06 -0.09 0.00 0.01 0.00 0.00 72.50 70.20 3brg s THR 471 CO 0.12 0.55 1.16 -2.65 -0.69 0.00 0.00 174.62 173.11 3brg n PRO 472 N 3.13 1.57 -2.71 4.92 -0.02 -1.26 -4.88 135.00 135.75 3brg n PRO 472 Ca -0.18 0.57 -0.42 0.00 -2.02 0.00 0.00 63.50 61.45 3brg n PRO 472 Cb 0.52 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 3brg n PRO 472 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3brg s GLU 473 N -2.33 4.59 0.00 -0.52 2.12 -1.26 -5.08 118.70 116.22 3brg s GLU 473 Ca 0.65 1.43 0.13 0.00 0.36 0.00 0.00 54.97 57.55 3brg s GLU 473 Cb -0.49 -3.44 0.78 0.00 0.26 0.00 0.00 34.13 31.24 3brg s GLU 473 CO 0.55 0.01 1.21 -0.35 -0.54 0.00 0.00 175.26 176.14