#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s9i s GLN 60 N 0.00 3.24 -0.28 -0.78 -1.52 -1.26 -5.01 119.66 114.05 1s9i s GLN 60 Ca 0.00 -0.40 -0.01 0.00 -1.95 0.00 0.00 55.36 53.00 1s9i s GLN 60 Cb 0.00 -2.89 0.19 0.00 -0.22 0.00 0.00 33.01 30.09 1s9i s GLN 60 CO 0.00 0.59 2.01 0.36 -0.25 0.00 0.00 175.29 178.00 1s9i n LYS 61 N 2.51 1.71 0.33 2.91 0.00 -1.26 -4.49 118.16 119.87 1s9i n LYS 61 Ca -0.18 -1.38 0.21 0.00 -0.00 0.00 0.00 58.31 56.96 1s9i n LYS 61 Cb 0.53 -1.54 1.15 0.00 -0.00 0.00 0.00 35.03 35.17 1s9i n LYS 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1s9i h ALA 62 N 1.42 1.07 -0.62 0.58 0.00 -2.03 -2.49 119.26 117.19 1s9i h ALA 62 Ca 0.26 -0.00 0.15 0.00 0.00 0.00 0.00 54.91 55.31 1s9i h ALA 62 Cb 0.93 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1s9i h ALA 62 CO 0.67 0.00 0.43 1.57 0.00 0.00 0.00 179.25 181.92 1s9i h LYS 63 N 0.00 0.19 0.00 0.00 2.10 -2.04 -3.43 116.57 113.39 1s9i h LYS 63 Ca -0.00 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 1s9i h LYS 63 Cb 0.03 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.32 1s9i h LYS 63 CO 0.00 0.13 -0.00 1.33 -2.00 0.00 0.00 179.45 178.90 1s9i n VAL 64 N -4.42 0.00 0.00 0.07 0.24 -0.94 -4.79 118.33 108.49 1s9i n VAL 64 Ca 0.12 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1s9i n VAL 64 Cb 0.56 -0.48 0.00 0.00 -1.47 0.00 0.00 33.84 32.45 1s9i n VAL 64 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1s9i n GLY 65 N 4.92 3.20 3.78 7.63 0.00 -1.26 -5.07 105.19 118.38 1s9i n GLY 65 Ca -0.00 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1s9i n GLY 65 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1s9i n GLU 66 N 0.00 2.64 -5.09 1.61 1.02 -1.26 -4.96 120.64 114.60 1s9i n GLU 66 Ca 0.00 0.93 -0.30 0.00 -0.02 0.00 0.00 57.16 57.76 1s9i n GLU 66 Cb 0.00 -2.67 -0.17 0.00 -0.02 0.00 0.00 31.44 28.58 1s9i n GLU 66 CO 0.00 0.00 0.00 -0.48 1.18 0.00 0.00 177.13 177.83 1s9i s LEU 67 N -2.15 2.00 0.00 -4.62 0.05 -1.26 -5.13 118.68 107.57 1s9i s LEU 67 Ca 0.54 -0.50 0.04 0.00 0.05 0.00 0.00 54.13 54.26 1s9i s LEU 67 Cb -0.47 -1.29 0.04 0.00 -2.05 0.00 0.00 46.19 42.43 1s9i s LEU 67 CO 0.63 0.14 0.36 0.29 -0.55 0.00 0.00 176.35 177.22 1s9i n LYS 68 N 3.53 0.80 -0.04 1.48 5.02 -1.26 -4.87 118.16 122.81 1s9i n LYS 68 Ca -0.20 -2.89 -0.15 0.00 -2.02 0.00 0.00 58.31 53.06 1s9i n LYS 68 Cb 0.53 0.29 -0.08 0.00 -0.02 0.00 0.00 35.03 35.74 1s9i n LYS 68 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 1s9i h ASP 69 N 0.53 0.43 -0.09 4.39 3.58 -1.99 -3.34 116.42 119.93 1s9i h ASP 69 Ca -0.29 -0.60 -0.04 0.00 0.42 0.00 0.00 57.03 56.52 1s9i h ASP 69 Cb 1.07 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.99 1s9i h ASP 69 CO 0.46 0.95 -0.05 0.44 -2.88 0.00 0.00 179.24 178.16 1s9i h ASP 70 N -0.08 0.31 0.00 2.28 3.32 -2.03 -2.90 116.42 117.33 1s9i h ASP 70 Ca -0.01 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1s9i h ASP 70 Cb 0.91 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.37 1s9i h ASP 70 CO 0.06 0.41 0.07 0.47 -1.72 0.00 0.00 179.24 178.53 1s9i n ASP 71 N -4.31 0.48 -4.91 6.45 9.92 -1.25 -4.67 116.55 118.25 1s9i n ASP 71 Ca 0.00 0.70 -0.32 0.00 -0.53 0.00 0.00 54.79 54.65 1s9i n ASP 71 Cb 0.23 -0.74 -0.04 0.00 -0.64 0.00 0.00 41.12 39.93 1s9i n ASP 71 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1s9i s PHE 72 N -3.46 3.52 -0.03 1.24 0.40 -1.10 -0.31 117.98 118.24 1s9i s PHE 72 Ca -0.02 0.30 -0.01 0.00 -0.60 0.00 0.00 56.93 56.60 1s9i s PHE 72 Cb 0.05 -1.79 0.03 0.00 0.51 0.00 0.00 43.02 41.82 1s9i s PHE 72 CO 0.17 0.59 0.04 -2.00 0.70 0.00 0.00 175.22 174.72 1s9i s GLU 73 N -2.39 0.00 0.14 0.44 2.12 -1.05 -4.96 118.70 113.01 1s9i s GLU 73 Ca 0.34 0.26 -0.31 0.00 0.36 0.00 0.00 54.97 55.61 1s9i s GLU 73 Cb -0.13 -0.41 -0.09 0.00 0.26 0.00 0.00 34.13 33.76 1s9i s GLU 73 CO 0.26 -0.24 1.48 1.03 -0.54 0.00 0.00 175.26 177.24 1s9i s ARG 74 N 1.58 4.27 -0.11 4.30 0.52 -1.26 -2.36 118.95 125.88 1s9i s ARG 74 Ca -0.03 2.22 -0.00 0.00 -0.52 0.00 0.00 55.73 57.40 1s9i s ARG 74 Cb -0.13 -3.20 -0.07 0.00 0.52 0.00 0.00 34.95 32.08 1s9i s ARG 74 CO -0.03 -0.52 -0.10 -0.89 0.02 0.00 0.00 175.30 173.78 1s9i n ILE 75 N 3.91 0.60 -3.90 1.52 5.41 -0.03 -4.98 119.36 121.90 1s9i n ILE 75 Ca 0.12 -0.22 -0.09 0.00 1.00 0.00 0.00 62.75 63.57 1s9i n ILE 75 Cb 0.40 -0.98 -0.02 0.00 -0.71 0.00 0.00 39.64 38.34 1s9i n ILE 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1s9i s SER 76 N -5.15 -0.05 -0.19 4.38 0.15 -1.12 -5.01 113.70 106.71 1s9i s SER 76 Ca -0.14 -0.90 -0.04 0.00 0.70 0.00 0.00 55.95 55.57 1s9i s SER 76 Cb 0.04 0.72 -0.02 0.00 -1.71 0.00 0.00 66.02 65.05 1s9i s SER 76 CO 0.23 -1.38 -0.02 -0.70 1.20 0.00 0.00 173.24 172.57 1s9i s GLU 77 N -3.47 3.57 -0.27 5.44 2.56 -1.26 -2.18 118.70 123.09 1s9i s GLU 77 Ca 0.17 -0.55 -0.10 0.00 0.00 0.00 0.00 54.97 54.49 1s9i s GLU 77 Cb -0.04 -3.01 -0.14 0.00 2.00 0.00 0.00 34.13 32.94 1s9i s GLU 77 CO 0.10 0.03 -0.29 1.28 -0.56 0.00 0.00 175.26 175.82 1s9i n LEU 78 N 4.18 2.26 0.00 2.70 4.77 -0.77 -4.90 117.00 125.25 1s9i n LEU 78 Ca -0.17 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1s9i n LEU 78 Cb 0.52 -0.86 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1s9i n LEU 78 CO 0.31 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 1s9i n GLY 79 N 1.56 0.33 2.97 -0.72 0.00 -1.00 -5.00 105.19 103.34 1s9i n GLY 79 Ca -0.51 -0.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 1s9i n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s9i s ALA 80 N -2.00 0.32 0.00 4.61 0.00 -1.26 -0.57 121.76 122.85 1s9i s ALA 80 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.55 1s9i s ALA 80 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.13 1s9i s ALA 80 CO 0.00 -0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.16 1s9i n GLY 81 N 2.26 4.38 3.57 0.00 0.00 0.11 -5.00 105.19 110.50 1s9i n GLY 81 Ca -0.18 -1.50 -0.28 0.00 0.00 0.00 0.00 46.02 44.06 1s9i n GLY 81 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1s9i s ASN 82 N -0.08 5.18 0.00 1.61 0.01 -1.26 -3.29 114.94 117.12 1s9i s ASN 82 Ca 0.00 -1.17 0.00 0.00 -0.71 0.00 0.00 52.86 50.98 1s9i s ASN 82 Cb 0.00 -2.57 0.00 0.00 0.41 0.00 0.00 41.25 39.09 1s9i s ASN 82 CO 0.00 -2.81 0.00 0.61 -1.51 0.00 0.00 177.10 173.39 1s9i n GLY 83 N 6.37 0.72 0.00 0.66 0.00 -1.26 -5.10 105.19 106.59 1s9i n GLY 83 Ca 0.42 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1s9i n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s9i n GLY 84 N -1.38 1.71 3.23 -0.02 0.00 -1.21 -4.61 105.19 102.90 1s9i n GLY 84 Ca 0.00 0.34 -0.32 0.00 0.00 0.00 0.00 46.02 46.04 1s9i n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s9i s VAL 85 N 0.00 2.10 -0.08 1.61 1.01 -0.34 0.04 120.40 124.73 1s9i s VAL 85 Ca 0.00 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 60.99 1s9i s VAL 85 Cb 0.00 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 1s9i s VAL 85 CO 0.00 0.56 -0.11 -0.69 0.00 0.00 0.00 175.10 174.86 1s9i s VAL 86 N 0.35 3.30 0.00 2.92 1.01 0.26 -0.25 120.40 127.99 1s9i s VAL 86 Ca -0.18 -0.62 0.00 0.00 0.00 0.00 0.00 61.98 61.18 1s9i s VAL 86 Cb -0.18 -2.34 -0.00 0.00 0.00 0.00 0.00 36.38 33.86 1s9i s VAL 86 CO 0.09 0.57 -0.01 0.42 0.00 0.00 0.00 175.10 176.16 1s9i s THR 87 N -0.41 0.11 -0.09 3.92 -4.23 0.15 -1.84 115.64 113.25 1s9i s THR 87 Ca 0.05 -0.10 -0.30 0.00 -1.18 0.00 0.00 61.69 60.16 1s9i s THR 87 Cb -0.12 -0.11 -0.03 0.00 1.34 0.00 0.00 72.50 73.57 1s9i s THR 87 CO 0.02 0.00 1.39 -0.75 -0.54 0.00 0.00 174.62 174.75 1s9i s LYS 88 N -0.11 4.24 0.14 3.99 2.20 -0.93 0.29 119.74 129.56 1s9i s LYS 88 Ca -0.00 1.87 0.01 0.00 -0.36 0.00 0.00 55.97 57.49 1s9i s LYS 88 Cb -0.01 -3.77 -0.04 0.00 -1.51 0.00 0.00 37.83 32.49 1s9i s LYS 88 CO -0.00 -0.70 -0.01 0.14 -0.36 0.00 0.00 175.35 174.42 1s9i s VAL 89 N 3.33 0.60 -0.03 4.02 -7.23 -0.82 -0.85 120.40 119.42 1s9i s VAL 89 Ca 0.62 -1.95 0.05 0.00 -1.81 0.00 0.00 61.98 58.89 1s9i s VAL 89 Cb -0.27 -1.98 -0.02 0.00 0.56 0.00 0.00 36.38 34.67 1s9i s VAL 89 CO 0.22 -0.59 -0.19 -1.58 -0.31 0.00 0.00 175.10 172.65 1s9i s GLN 90 N -3.91 2.32 0.16 4.82 0.74 -1.00 -1.43 119.66 121.38 1s9i s GLN 90 Ca 0.20 -0.80 -0.23 0.00 0.05 0.00 0.00 55.36 54.58 1s9i s GLN 90 Cb 0.06 -2.24 -0.08 0.00 1.10 0.00 0.00 33.01 31.85 1s9i s GLN 90 CO 0.01 0.59 0.74 -1.58 -0.55 0.00 0.00 175.29 174.50 1s9i s HIS 91 N -0.71 3.84 0.03 1.67 5.65 -1.08 -2.53 115.29 122.16 1s9i s HIS 91 Ca 0.11 1.54 -0.24 0.00 0.25 0.00 0.00 55.06 56.72 1s9i s HIS 91 Cb -0.10 -2.70 -0.13 0.00 -1.18 0.00 0.00 32.58 28.46 1s9i s HIS 91 CO 0.00 0.49 1.21 -0.09 -0.65 0.00 0.00 174.74 175.71 1s9i h ARG 92 N 4.18 -0.83 -0.77 2.88 1.12 -1.04 -3.34 114.38 116.58 1s9i h ARG 92 Ca -0.48 0.06 0.10 0.00 -1.11 0.00 0.00 59.98 58.55 1s9i h ARG 92 Cb 1.20 0.19 -0.07 0.00 -0.01 0.00 0.00 29.97 31.28 1s9i h ARG 92 CO 0.65 -0.55 0.41 -1.35 -3.11 0.00 0.00 179.97 176.02 1s9i h PRO 93 N -0.96 0.66 -4.52 0.20 0.11 -1.96 -3.39 132.00 122.14 1s9i h PRO 93 Ca -0.09 -0.04 -0.52 0.00 0.11 0.00 0.00 66.00 65.46 1s9i h PRO 93 Cb 0.66 -0.15 -0.34 0.00 0.11 0.00 0.00 31.00 31.28 1s9i h PRO 93 CO 0.14 0.44 -0.81 -1.12 -0.21 0.00 0.00 178.00 176.44 1s9i s SER 94 N -5.53 1.85 -0.71 -2.05 0.01 -1.25 -5.04 113.70 100.98 1s9i s SER 94 Ca -0.12 -0.30 -0.08 0.00 1.31 0.00 0.00 55.95 56.75 1s9i s SER 94 Cb 0.19 -0.84 -0.07 0.00 0.21 0.00 0.00 66.02 65.51 1s9i s SER 94 CO 0.77 0.01 1.87 0.61 0.41 0.00 0.00 173.24 176.91 1s9i n GLY 95 N 3.97 2.70 3.51 3.44 0.00 -1.26 -3.99 105.19 113.56 1s9i n GLY 95 Ca -0.22 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 1s9i n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s9i s LEU 96 N 0.23 3.48 -0.37 0.99 1.43 -1.26 -4.94 118.68 118.23 1s9i s LEU 96 Ca 0.36 -0.11 -0.29 0.00 -1.03 0.00 0.00 54.13 53.05 1s9i s LEU 96 Cb 0.09 -1.90 0.01 0.00 0.03 0.00 0.00 46.19 44.43 1s9i s LEU 96 CO 0.01 0.07 1.22 -0.63 0.23 0.00 0.00 176.35 177.24 1s9i s ILE 97 N 0.96 4.21 0.01 -0.59 1.09 -1.26 -2.65 121.20 122.98 1s9i s ILE 97 Ca 0.03 1.32 0.05 0.00 -1.10 0.00 0.00 60.65 60.95 1s9i s ILE 97 Cb -0.14 -4.36 -0.02 0.00 -1.06 0.00 0.00 42.46 36.88 1s9i s ILE 97 CO 0.02 -0.68 -0.16 0.00 -0.10 0.00 0.00 174.94 174.03 1s9i s MET 98 N 4.25 1.17 0.10 2.79 0.23 -0.51 -3.95 119.30 123.37 1s9i s MET 98 Ca 0.52 -0.68 -0.30 0.00 -1.03 0.00 0.00 55.69 54.20 1s9i s MET 98 Cb -0.12 -1.17 -0.06 0.00 -1.53 0.00 0.00 34.83 31.95 1s9i s MET 98 CO 0.25 0.31 1.05 0.00 -2.03 0.00 0.00 175.02 174.60 1s9i s ALA 99 N -0.59 3.29 -0.24 3.16 0.00 -0.45 -1.95 121.76 124.98 1s9i s ALA 99 Ca 0.05 0.69 -0.07 0.00 0.00 0.00 0.00 51.96 52.63 1s9i s ALA 99 Cb -0.07 -3.35 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 1s9i s ALA 99 CO 0.00 -0.20 0.06 0.50 0.00 0.00 0.00 175.76 176.12 1s9i s ARG 100 N 0.32 3.67 -0.47 0.00 3.52 0.14 -0.86 118.95 125.28 1s9i s ARG 100 Ca 0.51 -0.47 -0.12 0.00 -0.13 0.00 0.00 55.73 55.52 1s9i s ARG 100 Cb -0.26 -3.28 0.10 0.00 -1.56 0.00 0.00 34.95 29.96 1s9i s ARG 100 CO 0.31 -0.12 0.37 0.21 -0.81 0.00 0.00 175.30 175.26 1s9i s LYS 101 N 1.42 2.74 -0.18 5.12 2.20 0.93 -0.68 119.74 131.28 1s9i s LYS 101 Ca 0.05 -1.58 -0.27 0.00 -0.36 0.00 0.00 55.97 53.81 1s9i s LYS 101 Cb -0.15 -4.02 -0.00 0.00 -1.51 0.00 0.00 37.83 32.15 1s9i s LYS 101 CO 0.03 -1.12 0.94 -0.51 -0.36 0.00 0.00 175.35 174.33 1s9i s LEU 102 N 1.49 4.16 -0.36 5.43 2.01 0.66 -0.80 118.68 131.27 1s9i s LEU 102 Ca 0.04 1.32 0.01 0.00 0.01 0.00 0.00 54.13 55.50 1s9i s LEU 102 Cb -0.26 -3.41 0.10 0.00 0.01 0.00 0.00 46.19 42.63 1s9i s LEU 102 CO 0.02 -0.51 0.09 -0.63 1.01 0.00 0.00 176.35 176.34 1s9i s ILE 103 N 2.53 2.72 -0.24 -0.59 1.09 -0.56 -1.20 121.20 124.95 1s9i s ILE 103 Ca 0.42 -2.11 -0.29 0.00 -1.10 0.00 0.00 60.65 57.57 1s9i s ILE 103 Cb -0.16 -2.88 -0.01 0.00 -1.06 0.00 0.00 42.46 38.34 1s9i s ILE 103 CO 0.11 -0.56 1.39 -1.38 -0.10 0.00 0.00 174.94 174.40 1s9i s HIS 104 N 1.03 2.53 0.14 3.97 -3.43 -1.26 -2.20 115.29 116.07 1s9i s HIS 104 Ca 0.07 0.78 -0.11 0.00 -0.80 0.00 0.00 55.06 55.00 1s9i s HIS 104 Cb -0.21 -3.85 0.01 0.00 -1.43 0.00 0.00 32.58 27.10 1s9i s HIS 104 CO -0.06 -2.11 0.31 -1.17 -2.00 0.00 0.00 174.74 169.71 1s9i s LEU 105 N 4.42 0.86 -0.26 5.38 2.96 -1.24 -4.92 118.68 125.87 1s9i s LEU 105 Ca 0.61 -0.64 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 1s9i s LEU 105 Cb -0.20 1.41 0.08 0.00 0.50 0.00 0.00 46.19 47.98 1s9i s LEU 105 CO 0.23 -0.86 0.04 -0.70 -1.32 0.00 0.00 176.35 173.75 1s9i s GLU 106 N -3.89 0.97 -0.04 1.98 2.12 -1.26 -4.76 118.70 113.82 1s9i s GLU 106 Ca 0.09 -0.93 -0.11 0.00 0.36 0.00 0.00 54.97 54.38 1s9i s GLU 106 Cb 0.03 -2.25 0.02 0.00 0.26 0.00 0.00 34.13 32.18 1s9i s GLU 106 CO -0.06 -0.80 0.25 0.42 -0.54 0.00 0.00 175.26 174.53 1s9i s ILE 107 N 1.58 0.04 0.31 -3.70 -1.09 -1.26 -5.15 121.20 111.93 1s9i s ILE 107 Ca 0.03 -0.34 -0.26 0.00 -2.23 0.00 0.00 60.65 57.85 1s9i s ILE 107 Cb -0.18 -0.47 -0.14 0.00 -1.58 0.00 0.00 42.46 40.09 1s9i s ILE 107 CO -0.15 -0.19 0.77 1.17 -1.23 0.00 0.00 174.94 175.31 1s9i n LYS 108 N 1.99 0.82 -1.35 2.79 4.81 -1.26 -4.79 118.16 121.17 1s9i n LYS 108 Ca -0.18 0.29 -0.32 0.00 -0.87 0.00 0.00 58.31 57.23 1s9i n LYS 108 Cb 0.57 -1.56 -0.09 0.00 0.02 0.00 0.00 35.03 33.97 1s9i n LYS 108 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1s9i n PRO 109 N 0.73 0.79 0.06 1.64 -0.04 -1.26 -3.19 135.00 133.73 1s9i n PRO 109 Ca 0.12 -1.77 0.00 0.00 -0.04 0.00 0.00 63.50 61.81 1s9i n PRO 109 Cb 0.33 -3.31 0.00 0.00 -0.04 0.00 0.00 33.50 30.47 1s9i n PRO 109 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1s9i n ALA 110 N 13.08 0.00 0.86 0.55 0.00 -1.26 -4.96 120.51 128.78 1s9i n ALA 110 Ca 0.45 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.99 1s9i n ALA 110 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1s9i n ALA 110 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1s9i n ILE 111 N -2.71 0.00 0.05 0.00 -5.35 -1.19 -3.93 119.36 106.22 1s9i n ILE 111 Ca 0.00 -0.31 -0.01 0.00 -0.27 0.00 0.00 62.75 62.16 1s9i n ILE 111 Cb 0.00 1.24 0.28 0.00 -1.74 0.00 0.00 39.64 39.42 1s9i n ILE 111 CO 0.00 0.00 0.00 0.08 -1.76 0.00 0.00 176.55 174.87 1s9i h ARG 112 N 2.30 0.40 -0.23 6.28 0.11 -1.86 0.81 114.38 122.19 1s9i h ARG 112 Ca 0.00 -0.12 -0.04 0.00 0.10 0.00 0.00 59.98 59.92 1s9i h ARG 112 Cb 0.67 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.71 1s9i h ARG 112 CO 0.00 0.57 -0.01 -0.97 0.10 0.00 0.00 179.97 179.66 1s9i h ASN 113 N 0.37 0.41 0.13 0.08 -1.24 -1.88 -2.28 115.58 111.16 1s9i h ASN 113 Ca 0.07 -0.32 -0.02 0.00 0.71 0.00 0.00 56.30 56.74 1s9i h ASN 113 Cb 0.52 -0.11 -0.00 0.00 0.73 0.00 0.00 38.32 39.46 1s9i h ASN 113 CO 0.03 0.62 -0.10 1.56 -1.29 0.00 0.00 177.43 178.26 1s9i h GLN 114 N 0.18 0.00 -0.09 6.67 1.08 -1.43 0.67 115.11 122.19 1s9i h GLN 114 Ca 0.06 0.00 -0.24 0.00 -1.45 0.00 0.00 58.65 57.02 1s9i h GLN 114 Cb 0.42 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.86 1s9i h GLN 114 CO 0.01 0.10 -0.88 0.82 -0.95 0.00 0.00 178.83 177.93 1s9i h ILE 115 N 0.00 1.28 -0.43 2.54 5.03 0.64 -2.53 117.51 124.03 1s9i h ILE 115 Ca -0.00 -2.07 -0.08 0.00 -0.12 0.00 0.00 64.86 62.59 1s9i h ILE 115 Cb 0.19 2.14 -0.02 0.00 -3.03 0.00 0.00 36.82 36.10 1s9i h ILE 115 CO 0.01 0.65 -0.03 0.40 -0.68 0.00 0.00 178.15 178.51 1s9i h ILE 116 N 0.48 1.27 -0.68 -0.67 5.03 -0.64 -2.22 117.51 120.07 1s9i h ILE 116 Ca -0.08 -1.08 0.04 0.00 -0.12 0.00 0.00 64.86 63.62 1s9i h ILE 116 Cb 1.52 1.10 -0.05 0.00 -3.03 0.00 0.00 36.82 36.36 1s9i h ILE 116 CO 0.18 0.37 0.41 0.03 -0.68 0.00 0.00 178.15 178.46 1s9i h ARG 117 N 0.62 0.76 0.00 2.37 3.08 0.26 -1.90 114.38 119.57 1s9i h ARG 117 Ca 0.12 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.04 1s9i h ARG 117 Cb 0.53 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 1s9i h ARG 117 CO 0.03 0.50 -0.40 0.93 -1.07 0.00 0.00 179.97 179.96 1s9i h GLU 118 N 0.78 0.00 0.00 0.04 5.08 -1.41 -2.75 114.58 116.32 1s9i h GLU 118 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1s9i h GLU 118 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1s9i h GLU 118 CO -0.14 0.40 0.00 1.28 -1.00 0.00 0.00 179.01 179.55 1s9i n LEU 119 N -3.42 0.00 0.19 1.33 4.77 -0.77 -3.67 117.00 115.43 1s9i n LEU 119 Ca 0.00 0.46 0.14 0.00 -0.03 0.00 0.00 56.01 56.58 1s9i n LEU 119 Cb 0.57 -0.46 0.42 0.00 -2.33 0.00 0.00 43.42 41.62 1s9i n LEU 119 CO 0.37 -0.04 0.88 1.56 -1.33 0.00 0.00 177.39 178.83 1s9i h GLN 120 N 0.00 0.00 0.00 3.23 1.08 -1.09 -2.88 115.11 115.45 1s9i h GLN 120 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1s9i h GLN 120 Cb 0.41 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 1s9i h GLN 120 CO 0.00 0.00 0.00 1.33 -0.95 0.00 0.00 178.83 179.21 1s9i n VAL 121 N -2.72 0.78 0.19 -0.54 0.24 -1.24 -2.18 118.33 112.85 1s9i n VAL 121 Ca 0.03 0.19 0.04 0.00 -2.04 0.00 0.00 64.34 62.56 1s9i n VAL 121 Cb 0.39 -0.91 0.38 0.00 -1.47 0.00 0.00 33.84 32.23 1s9i n VAL 121 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1s9i h LEU 122 N 0.00 0.00 -2.06 1.34 3.38 -1.78 -1.05 115.31 115.14 1s9i h LEU 122 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1s9i h LEU 122 Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1s9i h LEU 122 CO 0.00 0.37 -0.02 0.45 0.09 0.00 0.00 178.44 179.33 1s9i h HIS 123 N 0.00 0.00 -0.00 1.13 3.86 -1.66 -0.80 115.15 117.67 1s9i h HIS 123 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1s9i h HIS 123 Cb 0.71 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.18 1s9i h HIS 123 CO 0.00 0.02 -0.19 0.39 0.86 0.00 0.00 177.93 179.01 1s9i n GLU 124 N -4.35 0.14 -3.00 2.45 1.02 -0.41 -4.72 120.64 111.76 1s9i n GLU 124 Ca -0.03 -0.04 -0.44 0.00 -0.02 0.00 0.00 57.16 56.63 1s9i n GLU 124 Cb 0.11 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.98 1s9i n GLU 124 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1s9i s ASN 126 N 3.12 3.16 -0.14 0.00 0.01 -1.26 -4.75 114.94 115.08 1s9i s ASN 126 Ca 0.20 -0.97 -0.18 0.00 -0.71 0.00 0.00 52.86 51.19 1s9i s ASN 126 Cb -0.18 -0.67 0.05 0.00 0.41 0.00 0.00 41.25 40.85 1s9i s ASN 126 CO 0.12 -0.32 0.48 -0.55 -1.51 0.00 0.00 177.10 175.32 1s9i s SER 127 N 1.80 -0.47 0.00 -1.22 0.15 -1.26 -5.02 113.70 107.68 1s9i s SER 127 Ca 0.00 0.79 0.01 0.00 0.70 0.00 0.00 55.95 57.46 1s9i s SER 127 Cb -0.17 0.82 0.07 0.00 -1.71 0.00 0.00 66.02 65.03 1s9i s SER 127 CO -0.11 -0.27 0.47 -0.81 1.20 0.00 0.00 173.24 173.72 1s9i n PRO 128 N 2.33 0.05 -0.00 5.44 -0.04 -1.26 -1.25 135.00 140.26 1s9i n PRO 128 Ca -0.15 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.31 1s9i n PRO 128 Cb 0.57 -1.40 -0.01 0.00 -0.04 0.00 0.00 33.50 32.62 1s9i n PRO 128 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1s9i n TYR 129 N -0.90 0.00 -3.96 0.54 4.02 -1.26 -4.74 117.16 110.87 1s9i n TYR 129 Ca 0.01 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.55 1s9i n TYR 129 Cb 0.00 -0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.24 1s9i n TYR 129 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1s9i s ILE 130 N -1.23 5.04 0.30 -0.72 -1.09 -0.38 0.12 121.20 123.23 1s9i s ILE 130 Ca 0.01 0.05 -0.30 0.00 -2.23 0.00 0.00 60.65 58.18 1s9i s ILE 130 Cb 0.01 -3.25 -0.11 0.00 -1.58 0.00 0.00 42.46 37.54 1s9i s ILE 130 CO 0.07 0.51 1.57 -0.69 -1.23 0.00 0.00 174.94 175.18 1s9i s VAL 131 N -0.10 2.09 0.30 2.92 1.01 -0.36 -4.44 120.40 121.82 1s9i s VAL 131 Ca 0.08 0.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.85 1s9i s VAL 131 Cb -0.12 -3.05 -0.11 0.00 0.00 0.00 0.00 36.38 33.10 1s9i s VAL 131 CO 0.01 0.01 1.45 -0.83 0.00 0.00 0.00 175.10 175.74 1s9i s GLY 132 N 0.41 2.54 -0.26 4.51 0.00 -1.26 -4.87 107.32 108.39 1s9i s GLY 132 Ca 0.62 1.41 -0.03 0.00 0.00 0.00 0.00 44.72 46.72 1s9i s GLY 132 CO 0.49 2.25 -0.03 -0.12 0.00 0.00 0.00 173.10 175.70 1s9i s PHE 133 N -0.46 3.08 -0.09 1.90 2.19 -1.26 0.39 117.98 123.73 1s9i s PHE 133 Ca 0.57 -1.42 -0.03 0.00 0.33 0.00 0.00 56.93 56.38 1s9i s PHE 133 Cb -0.43 -2.10 -0.02 0.00 -1.31 0.00 0.00 43.02 39.15 1s9i s PHE 133 CO 0.50 -0.69 0.11 1.88 1.83 0.00 0.00 175.22 178.85 1s9i h TYR 134 N 8.06 -0.06 -1.46 10.12 0.05 -1.09 -3.44 116.97 129.15 1s9i h TYR 134 Ca -0.33 -0.00 0.27 0.00 0.05 0.00 0.00 58.73 58.72 1s9i h TYR 134 Cb 1.11 0.02 -0.18 0.00 1.01 0.00 0.00 36.73 38.69 1s9i h TYR 134 CO 0.59 0.01 0.82 0.20 -1.05 0.00 0.00 178.16 178.72 1s9i s GLY 135 N -3.51 -0.31 0.00 3.88 0.00 -0.85 -5.01 107.32 101.53 1s9i s GLY 135 Ca -0.02 1.47 0.01 0.00 0.00 0.00 0.00 44.72 46.18 1s9i s GLY 135 CO 0.06 0.47 -0.03 0.00 0.00 0.00 0.00 173.10 173.59 1s9i s ALA 136 N -2.41 0.28 0.23 3.20 0.00 -1.26 -0.20 121.76 121.59 1s9i s ALA 136 Ca 0.10 -0.20 -0.14 0.00 0.00 0.00 0.00 51.96 51.73 1s9i s ALA 136 Cb -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.07 1s9i s ALA 136 CO -0.04 0.05 0.48 -0.59 0.00 0.00 0.00 175.76 175.65 1s9i s PHE 137 N -0.21 0.24 -0.21 0.00 -0.71 -1.05 -5.02 117.98 111.02 1s9i s PHE 137 Ca -0.00 -0.61 -0.14 0.00 -1.04 0.00 0.00 56.93 55.14 1s9i s PHE 137 Cb -0.02 0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.98 1s9i s PHE 137 CO -0.00 -0.96 0.33 -0.47 -1.34 0.00 0.00 175.22 172.78 1s9i s TYR 138 N -3.98 3.36 0.26 3.49 6.14 -1.26 -2.02 117.35 123.34 1s9i s TYR 138 Ca 0.19 0.51 0.10 0.00 0.64 0.00 0.00 57.07 58.51 1s9i s TYR 138 Cb -0.01 -2.45 -0.05 0.00 0.42 0.00 0.00 41.96 39.88 1s9i s TYR 138 CO 0.06 0.02 -0.08 0.45 0.64 0.00 0.00 175.55 176.63 1s9i s SER 139 N 1.04 4.18 -0.98 4.32 0.15 0.42 -5.00 113.70 117.82 1s9i s SER 139 Ca 0.16 -0.77 -0.25 0.00 0.70 0.00 0.00 55.95 55.79 1s9i s SER 139 Cb -0.14 -0.64 -0.13 0.00 -1.71 0.00 0.00 66.02 63.40 1s9i s SER 139 CO 0.07 0.03 2.11 -1.81 1.20 0.00 0.00 173.24 174.84 1s9i s ASP 140 N -3.52 4.34 0.00 5.45 1.01 -1.26 -2.02 116.67 120.66 1s9i s ASP 140 Ca 0.30 -0.78 0.00 0.00 0.71 0.00 0.00 52.55 52.78 1s9i s ASP 140 Cb -0.06 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.29 1s9i s ASP 140 CO 0.18 -3.65 0.00 0.61 0.21 0.00 0.00 175.17 172.52 1s9i n GLY 141 N 6.43 3.64 3.22 0.21 0.00 -1.26 -5.11 105.19 112.32 1s9i n GLY 141 Ca 0.43 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.52 1s9i n GLY 141 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1s9i s GLU 142 N 0.00 0.87 -0.23 1.61 -1.05 -0.86 -3.64 118.70 115.40 1s9i s GLU 142 Ca 0.00 -0.95 -0.10 0.00 -0.15 0.00 0.00 54.97 53.77 1s9i s GLU 142 Cb 0.00 0.35 -0.05 0.00 -0.44 0.00 0.00 34.13 34.00 1s9i s GLU 142 CO 0.00 -0.28 0.14 0.96 0.95 0.00 0.00 175.26 177.02 1s9i s ILE 143 N -3.86 5.15 0.03 1.83 -4.36 -0.94 -0.44 121.20 118.61 1s9i s ILE 143 Ca 0.05 0.11 -0.07 0.00 -0.26 0.00 0.00 60.65 60.48 1s9i s ILE 143 Cb 0.05 -3.39 -0.05 0.00 1.25 0.00 0.00 42.46 40.31 1s9i s ILE 143 CO -0.11 0.36 0.30 -0.44 0.24 0.00 0.00 174.94 175.30 1s9i s SER 144 N 1.04 6.53 -0.18 4.36 0.01 -0.86 -1.50 113.70 123.10 1s9i s SER 144 Ca 0.07 0.61 0.00 0.00 1.31 0.00 0.00 55.95 57.94 1s9i s SER 144 Cb -0.14 -2.11 0.04 0.00 0.21 0.00 0.00 66.02 64.03 1s9i s SER 144 CO 0.04 0.23 -0.07 -0.63 0.41 0.00 0.00 173.24 173.22 1s9i s ILE 145 N -1.33 1.34 -0.24 1.44 1.01 0.02 -2.54 121.20 120.89 1s9i s ILE 145 Ca 0.29 -0.81 -0.13 0.00 0.00 0.00 0.00 60.65 60.00 1s9i s ILE 145 Cb -0.13 -1.48 -0.05 0.00 0.01 0.00 0.00 42.46 40.81 1s9i s ILE 145 CO 0.17 0.12 0.25 0.00 0.00 0.00 0.00 174.94 175.49 1s9i s MET 147 N 1.31 1.38 0.11 0.00 0.23 -0.04 -0.48 119.30 121.82 1s9i s MET 147 Ca 0.11 -1.72 -0.36 0.00 -1.03 0.00 0.00 55.69 52.70 1s9i s MET 147 Cb -0.14 -0.54 -0.16 0.00 -1.53 0.00 0.00 34.83 32.46 1s9i s MET 147 CO 0.07 -0.16 1.36 -1.91 -2.03 0.00 0.00 175.02 172.35 1s9i n GLU 148 N -0.45 1.33 -2.72 3.16 2.13 0.16 -1.34 120.64 122.91 1s9i n GLU 148 Ca -0.04 0.48 -0.43 0.00 0.66 0.00 0.00 57.16 57.83 1s9i n GLU 148 Cb 0.65 -2.12 -0.03 0.00 0.27 0.00 0.00 31.44 30.20 1s9i n GLU 148 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1s9i s HIS 149 N 0.45 2.99 -0.42 4.31 5.65 -1.25 -4.46 115.29 122.55 1s9i s HIS 149 Ca 0.82 0.76 -0.19 0.00 0.25 0.00 0.00 55.06 56.70 1s9i s HIS 149 Cb -0.89 -3.93 0.02 0.00 -1.18 0.00 0.00 32.58 26.60 1s9i s HIS 149 CO 0.46 -0.99 0.53 -1.64 -0.65 0.00 0.00 174.74 172.45 1s9i s MET 150 N 3.82 3.22 0.05 2.88 1.00 -1.26 -4.95 119.30 124.06 1s9i s MET 150 Ca 0.42 -0.54 0.24 0.00 0.00 0.00 0.00 55.69 55.80 1s9i s MET 150 Cb -0.10 -3.95 0.96 0.00 0.00 0.00 0.00 34.83 31.75 1s9i s MET 150 CO 0.23 -0.90 1.74 -0.40 0.00 0.00 0.00 175.02 175.69 1s9i n ASP 151 N 5.89 0.17 -0.28 3.03 5.68 -1.25 -2.12 116.55 127.67 1s9i n ASP 151 Ca -0.05 0.53 0.13 0.00 -0.50 0.00 0.00 54.79 54.90 1s9i n ASP 151 Cb 0.48 -0.57 0.44 0.00 -1.14 0.00 0.00 41.12 40.33 1s9i n ASP 151 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1s9i n GLY 152 N 0.86 -0.52 7.00 6.12 0.00 -0.43 -4.86 105.19 113.36 1s9i n GLY 152 Ca 0.05 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1s9i n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s9i n GLY 153 N 1.30 2.86 3.99 -0.02 0.00 -0.90 -4.62 105.19 107.79 1s9i n GLY 153 Ca 0.14 -0.37 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 1s9i n GLY 153 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1s9i s SER 154 N -4.00 6.04 0.30 1.61 0.01 -1.26 -1.69 113.70 114.72 1s9i s SER 154 Ca 0.00 -0.11 0.13 0.00 1.31 0.00 0.00 55.95 57.28 1s9i s SER 154 Cb 0.00 -1.38 0.44 0.00 0.21 0.00 0.00 66.02 65.29 1s9i s SER 154 CO 0.00 -0.36 1.64 -0.07 0.41 0.00 0.00 173.24 174.85 1s9i h LEU 155 N 0.93 0.00 -0.12 2.44 3.38 -0.50 -2.11 115.31 119.33 1s9i h LEU 155 Ca -0.47 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.33 1s9i h LEU 155 Cb 1.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 1s9i h LEU 155 CO 0.55 0.54 -0.82 -2.24 0.09 0.00 0.00 178.44 176.56 1s9i h ASP 156 N 0.00 0.00 0.08 -0.43 -0.00 -1.87 -1.26 116.42 112.94 1s9i h ASP 156 Ca -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 57.03 57.04 1s9i h ASP 156 Cb 1.06 0.00 -0.02 0.00 -0.00 0.00 0.00 39.33 40.37 1s9i h ASP 156 CO 0.07 0.82 -0.15 1.56 -0.00 0.00 0.00 179.24 181.53 1s9i h GLN 157 N 0.00 -0.29 0.00 4.15 4.20 -1.79 0.62 115.11 122.00 1s9i h GLN 157 Ca -0.01 0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 1s9i h GLN 157 Cb 1.57 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.41 1s9i h GLN 157 CO 0.11 -0.19 -0.24 -0.39 -0.67 0.00 0.00 178.83 177.45 1s9i h VAL 158 N -0.30 0.68 0.00 -0.54 -1.51 -1.39 -1.24 116.25 111.95 1s9i h VAL 158 Ca 0.03 -1.04 -0.12 0.00 -1.23 0.00 0.00 66.70 64.33 1s9i h VAL 158 Cb 0.32 1.67 -0.02 0.00 -2.13 0.00 0.00 31.29 31.13 1s9i h VAL 158 CO -0.09 0.23 -0.59 0.25 -1.23 0.00 0.00 177.57 176.14 1s9i h LEU 159 N 0.00 0.00 -1.06 4.19 5.85 -0.59 -0.08 115.31 123.62 1s9i h LEU 159 Ca -0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1s9i h LEU 159 Cb 0.65 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1s9i h LEU 159 CO 0.03 0.59 0.09 0.11 -0.34 0.00 0.00 178.44 178.92 1s9i h LYS 160 N 0.00 0.76 0.00 1.25 1.57 0.15 -3.32 116.57 116.98 1s9i h LYS 160 Ca -0.01 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1s9i h LYS 160 Cb 1.12 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1s9i h LYS 160 CO 0.08 0.71 -0.00 0.93 -0.57 0.00 0.00 179.45 180.60 1s9i h GLU 161 N 0.73 -0.00 -6.33 3.15 4.39 -1.35 -3.44 114.58 111.74 1s9i h GLU 161 Ca 0.16 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.29 1s9i h GLU 161 Cb 0.32 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.92 1s9i h GLU 161 CO 0.00 -0.00 1.02 0.00 -1.16 0.00 0.00 179.01 178.87 1s9i s ALA 162 N -2.90 3.33 0.26 3.43 0.00 -0.06 -4.91 121.76 120.91 1s9i s ALA 162 Ca -0.00 0.22 -0.03 0.00 0.00 0.00 0.00 51.96 52.15 1s9i s ALA 162 Cb 0.00 -3.80 0.53 0.00 0.00 0.00 0.00 23.12 19.85 1s9i s ALA 162 CO 0.00 -1.83 1.66 0.87 0.00 0.00 0.00 175.76 176.46 1s9i h LYS 163 N 9.76 0.21 -5.01 0.00 1.57 -1.85 -3.39 116.57 117.85 1s9i h LYS 163 Ca -0.29 -0.01 -0.38 0.00 -1.87 0.00 0.00 60.65 58.10 1s9i h LYS 163 Cb 1.12 -0.05 -0.14 0.00 0.08 0.00 0.00 32.23 33.24 1s9i h LYS 163 CO 1.02 0.14 -0.62 -0.98 -0.57 0.00 0.00 179.45 178.44 1s9i s ARG 164 N -6.03 1.44 -0.14 3.15 1.70 -1.26 -4.59 118.95 113.21 1s9i s ARG 164 Ca -0.13 -1.77 -0.00 0.00 -0.47 0.00 0.00 55.73 53.36 1s9i s ARG 164 Cb 0.23 -0.49 -0.01 0.00 -0.57 0.00 0.00 34.95 34.11 1s9i s ARG 164 CO 0.76 -0.22 -0.13 0.42 -1.08 0.00 0.00 175.30 175.06 1s9i s ILE 165 N -3.57 3.03 0.51 4.99 1.01 -0.02 -5.02 121.20 122.13 1s9i s ILE 165 Ca 0.35 -0.66 -0.20 0.00 0.00 0.00 0.00 60.65 60.14 1s9i s ILE 165 Cb 0.08 -2.28 -0.07 0.00 0.01 0.00 0.00 42.46 40.19 1s9i s ILE 165 CO 0.13 0.52 1.05 -2.84 0.00 0.00 0.00 174.94 173.80 1s9i s PRO 166 N 0.50 3.67 0.18 2.79 0.02 -1.26 -4.46 135.00 136.44 1s9i s PRO 166 Ca -0.09 1.38 -0.19 0.00 0.02 0.00 0.00 61.00 62.12 1s9i s PRO 166 Cb -0.16 -2.07 0.12 0.00 0.02 0.00 0.00 34.50 32.41 1s9i s PRO 166 CO 0.04 -0.54 1.62 1.49 -0.33 0.00 0.00 177.00 179.28 1s9i h GLU 167 N 1.36 -0.12 -0.84 5.54 4.81 -1.97 -0.13 114.58 123.22 1s9i h GLU 167 Ca -0.49 0.01 0.20 0.00 -0.13 0.00 0.00 59.36 58.95 1s9i h GLU 167 Cb 1.23 0.03 -0.15 0.00 0.63 0.00 0.00 28.75 30.49 1s9i h GLU 167 CO 0.58 -0.08 0.01 0.93 -0.73 0.00 0.00 179.01 179.72 1s9i h GLU 168 N -0.13 0.08 -0.26 1.92 5.08 -1.99 0.76 114.58 120.03 1s9i h GLU 168 Ca 0.22 -0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.49 1s9i h GLU 168 Cb 0.47 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 1s9i h GLU 168 CO -0.55 0.05 -0.15 0.82 -1.00 0.00 0.00 179.01 178.19 1s9i h ILE 169 N 0.08 1.30 -0.18 3.13 1.08 -1.46 -2.86 117.51 118.59 1s9i h ILE 169 Ca 0.48 -1.25 -0.02 0.00 -0.39 0.00 0.00 64.86 63.67 1s9i h ILE 169 Cb 0.88 1.55 -0.01 0.00 -3.07 0.00 0.00 36.82 36.17 1s9i h ILE 169 CO -0.75 0.39 0.02 -0.07 -0.69 0.00 0.00 178.15 177.05 1s9i h LEU 170 N 0.30 0.23 -0.42 1.44 3.38 0.12 0.64 115.31 121.00 1s9i h LEU 170 Ca 0.06 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1s9i h LEU 170 Cb 0.67 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1s9i h LEU 170 CO 0.04 0.26 0.26 1.23 0.09 0.00 0.00 178.44 180.33 1s9i h GLY 171 N 0.48 0.60 1.88 0.83 0.00 0.38 0.96 103.07 108.21 1s9i h GLY 171 Ca 0.06 -0.24 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 1s9i h GLY 171 CO 0.00 0.23 -0.27 0.50 0.00 0.00 0.00 176.54 177.00 1s9i h LYS 172 N 0.56 0.14 0.07 4.80 1.57 -0.84 -2.18 116.57 120.69 1s9i h LYS 172 Ca 0.15 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1s9i h LYS 172 Cb -0.03 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1s9i h LYS 172 CO -0.03 0.40 -0.03 0.28 -0.57 0.00 0.00 179.45 179.50 1s9i h VAL 173 N 0.13 1.21 -0.54 0.50 2.07 -0.65 -2.70 116.25 116.27 1s9i h VAL 173 Ca 0.02 -1.11 0.11 0.00 0.82 0.00 0.00 66.70 66.53 1s9i h VAL 173 Cb 0.55 1.92 -0.09 0.00 -1.52 0.00 0.00 31.29 32.15 1s9i h VAL 173 CO 0.04 0.27 0.03 0.28 0.02 0.00 0.00 177.57 178.20 1s9i h SER 174 N -0.61 -0.18 0.10 0.57 0.02 -0.68 -0.14 113.55 112.63 1s9i h SER 174 Ca -0.01 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1s9i h SER 174 Cb 0.52 0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 1s9i h SER 174 CO 0.02 -0.06 -0.26 0.40 -1.14 0.00 0.00 176.83 175.78 1s9i h ILE 175 N 0.14 0.00 -0.56 3.27 2.04 -1.47 0.92 117.51 121.85 1s9i h ILE 175 Ca 0.28 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.30 1s9i h ILE 175 Cb 0.42 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 1s9i h ILE 175 CO -0.43 0.00 0.40 0.00 0.00 0.00 0.00 178.15 178.12 1s9i h ALA 176 N -1.11 2.52 0.03 1.87 0.00 -1.00 0.82 119.26 122.40 1s9i h ALA 176 Ca -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1s9i h ALA 176 Cb 0.39 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1s9i h ALA 176 CO -0.12 -0.68 -0.01 0.28 0.00 0.00 0.00 179.25 178.72 1s9i h VAL 177 N 0.01 1.33 -0.98 0.00 2.07 -0.90 -2.10 116.25 115.68 1s9i h VAL 177 Ca 0.27 -1.81 0.16 0.00 0.82 0.00 0.00 66.70 66.14 1s9i h VAL 177 Cb 1.06 2.43 -0.10 0.00 -1.52 0.00 0.00 31.29 33.16 1s9i h VAL 177 CO -0.00 0.42 0.59 -0.07 0.02 0.00 0.00 177.57 178.52 1s9i h LEU 178 N -0.92 0.78 -0.07 2.57 3.38 0.79 0.64 115.31 122.48 1s9i h LEU 178 Ca -0.00 0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1s9i h LEU 178 Cb 0.72 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1s9i h LEU 178 CO 0.01 0.32 -0.27 0.03 0.09 0.00 0.00 178.44 178.61 1s9i h ARG 179 N 0.80 0.30 -0.57 1.13 2.47 -1.02 -1.62 114.38 115.87 1s9i h ARG 179 Ca 0.54 -0.24 0.07 0.00 -1.26 0.00 0.00 59.98 59.09 1s9i h ARG 179 Cb 0.75 0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 29.06 1s9i h ARG 179 CO -0.35 0.87 0.26 0.78 0.56 0.00 0.00 179.97 182.10 1s9i h GLY 180 N -0.20 0.81 0.69 0.04 0.00 -0.56 0.21 103.07 104.06 1s9i h GLY 180 Ca -0.02 -0.17 0.03 0.00 0.00 0.00 0.00 47.33 47.18 1s9i h GLY 180 CO 0.06 0.07 -0.03 1.41 0.00 0.00 0.00 176.54 178.04 1s9i h LEU 181 N 0.49 -0.13 -1.38 3.11 4.07 0.23 -2.71 115.31 118.99 1s9i h LEU 181 Ca 0.27 0.05 -0.01 0.00 0.08 0.00 0.00 57.88 58.27 1s9i h LEU 181 Cb 0.24 0.09 -0.03 0.00 1.08 0.00 0.00 40.66 42.05 1s9i h LEU 181 CO -0.22 -0.05 0.32 0.00 -1.08 0.00 0.00 178.44 177.42 1s9i h ALA 182 N 1.16 1.53 0.71 1.53 0.00 -0.45 -2.62 119.26 121.12 1s9i h ALA 182 Ca 0.08 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1s9i h ALA 182 Cb 0.11 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1s9i h ALA 182 CO -0.16 0.40 -0.37 -0.92 0.00 0.00 0.00 179.25 178.21 1s9i h TYR 183 N 0.76 -0.96 0.00 0.00 3.20 -0.30 0.18 116.97 119.85 1s9i h TYR 183 Ca 0.20 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 1s9i h TYR 183 Cb -0.01 0.33 -0.00 0.00 1.54 0.00 0.00 36.73 38.58 1s9i h TYR 183 CO 0.00 -0.58 -0.05 -0.07 -1.64 0.00 0.00 178.16 175.82 1s9i h LEU 184 N -0.99 0.00 0.02 2.82 3.38 -1.36 0.24 115.31 119.42 1s9i h LEU 184 Ca -0.09 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 1s9i h LEU 184 Cb 0.77 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1s9i h LEU 184 CO 0.14 0.05 -0.39 -0.09 0.09 0.00 0.00 178.44 178.24 1s9i h ARG 185 N 0.00 0.03 -0.03 1.13 2.43 -1.22 0.11 114.38 116.83 1s9i h ARG 185 Ca -0.00 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1s9i h ARG 185 Cb 0.12 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1s9i h ARG 185 CO 0.01 1.03 -0.04 0.93 -1.51 0.00 0.00 179.97 180.38 1s9i h GLU 186 N -0.92 0.08 0.00 0.20 5.08 -0.46 -2.95 114.58 115.61 1s9i h GLU 186 Ca -0.10 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1s9i h GLU 186 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1s9i h GLU 186 CO -0.03 0.61 -0.85 1.63 -1.00 0.00 0.00 179.01 179.36 1s9i n LYS 187 N -4.76 0.06 0.00 2.33 5.02 0.84 -4.49 118.16 117.16 1s9i n LYS 187 Ca -0.08 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1s9i n LYS 187 Cb 0.31 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 1s9i n LYS 187 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1s9i n HIS 188 N -1.58 0.00 -3.62 2.13 8.25 -1.07 -5.02 115.22 114.31 1s9i n HIS 188 Ca 0.04 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.26 1s9i n HIS 188 Cb 0.35 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.54 1s9i n HIS 188 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1s9i n GLN 189 N 0.00 -7.68 -3.85 -0.41 3.00 0.15 -4.94 117.38 103.65 1s9i n GLN 189 Ca 0.00 0.81 -0.12 0.00 -0.01 0.00 0.00 57.00 57.68 1s9i n GLN 189 Cb 0.09 -5.85 -0.13 0.00 0.00 0.00 0.00 30.24 24.35 1s9i n GLN 189 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.06 178.02 1s9i s ILE 190 N -3.32 0.00 0.36 5.09 -5.25 0.10 -4.96 121.20 113.21 1s9i s ILE 190 Ca 0.56 -0.00 -0.08 0.00 -0.99 0.00 0.00 60.65 60.14 1s9i s ILE 190 Cb -0.25 -0.09 -0.06 0.00 2.95 0.00 0.00 42.46 45.00 1s9i s ILE 190 CO 0.74 -0.00 0.69 0.00 -1.79 0.00 0.00 174.94 174.57 1s9i s MET 191 N 0.03 3.72 -1.19 0.37 0.23 -1.26 -3.62 119.30 117.58 1s9i s MET 191 Ca -0.00 0.29 -0.12 0.00 -1.03 0.00 0.00 55.69 54.83 1s9i s MET 191 Cb -0.00 -2.49 0.20 0.00 -1.53 0.00 0.00 34.83 31.01 1s9i s MET 191 CO 0.00 0.06 1.39 1.58 -2.03 0.00 0.00 175.02 176.02 1s9i n HIS 192 N -1.15 4.88 0.66 3.16 -0.00 -1.26 -4.38 115.22 117.12 1s9i n HIS 192 Ca 0.01 -3.45 0.00 0.00 0.46 0.00 0.00 57.72 54.74 1s9i n HIS 192 Cb 0.54 -2.04 0.00 0.00 -0.12 0.00 0.00 29.99 28.37 1s9i n HIS 192 CO 0.00 0.00 0.00 2.89 0.46 0.00 0.00 176.34 179.69 1s9i n ARG 193 N 4.70 0.43 -2.96 1.57 1.85 -1.26 -3.29 116.66 117.70 1s9i n ARG 193 Ca 0.34 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 57.04 1s9i n ARG 193 Cb 0.41 -1.10 0.01 0.00 -1.05 0.00 0.00 32.46 30.73 1s9i n ARG 193 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1s9i n ASP 194 N -0.13 -1.04 -4.69 2.89 4.64 -1.26 -5.04 116.55 111.92 1s9i n ASP 194 Ca 0.00 -3.19 -0.40 0.00 -1.38 0.00 0.00 54.79 49.82 1s9i n ASP 194 Cb 0.05 0.63 -0.05 0.00 -1.04 0.00 0.00 41.12 40.71 1s9i n ASP 194 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1s9i s VAL 195 N -0.69 5.02 0.12 5.18 1.01 -1.21 -4.83 120.40 125.00 1s9i s VAL 195 Ca 0.32 1.34 -0.25 0.00 0.00 0.00 0.00 61.98 63.39 1s9i s VAL 195 Cb 0.26 -4.00 0.07 0.00 0.00 0.00 0.00 36.38 32.71 1s9i s VAL 195 CO -0.12 0.16 0.83 -1.59 0.00 0.00 0.00 175.10 174.38 1s9i s LYS 196 N 1.48 1.17 0.44 2.72 -2.85 -1.26 -4.66 119.74 116.79 1s9i s LYS 196 Ca 0.33 -0.55 0.21 0.00 -1.00 0.00 0.00 55.97 54.96 1s9i s LYS 196 Cb -0.17 0.46 1.18 0.00 -2.06 0.00 0.00 37.83 37.24 1s9i s LYS 196 CO 0.13 -0.53 1.86 -1.35 0.10 0.00 0.00 175.35 175.57 1s9i h PRO 197 N 2.00 0.30 0.00 1.78 0.11 -1.94 0.30 132.00 134.56 1s9i h PRO 197 Ca -0.25 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1s9i h PRO 197 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1s9i h PRO 197 CO 0.29 0.20 0.00 -1.13 -0.21 0.00 0.00 178.00 177.15 1s9i n SER 198 N -4.47 0.00 -0.50 -2.05 3.41 -1.26 -1.51 113.62 107.24 1s9i n SER 198 Ca 0.19 0.48 0.05 0.00 -0.26 0.00 0.00 58.87 59.33 1s9i n SER 198 Cb 0.76 -0.49 0.13 0.00 -0.26 0.00 0.00 64.21 64.36 1s9i n SER 198 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1s9i n ASN 199 N -1.49 2.82 -4.19 4.04 4.13 0.11 -4.84 115.26 115.84 1s9i n ASN 199 Ca 0.05 -2.19 -0.36 0.00 1.68 0.00 0.00 54.58 53.76 1s9i n ASN 199 Cb 0.23 -0.23 -0.13 0.00 -1.54 0.00 0.00 39.78 38.11 1s9i n ASN 199 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1s9i s ILE 200 N -1.34 3.29 -0.16 2.41 1.01 -1.13 -1.08 121.20 124.21 1s9i s ILE 200 Ca 0.21 -1.46 -0.10 0.00 0.00 0.00 0.00 60.65 59.29 1s9i s ILE 200 Cb 0.13 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.59 1s9i s ILE 200 CO 0.11 -0.26 0.18 -0.76 0.00 0.00 0.00 174.94 174.20 1s9i s LEU 201 N 1.27 4.27 0.34 2.97 1.02 0.19 -1.85 118.68 126.90 1s9i s LEU 201 Ca -0.01 0.38 0.09 0.00 0.02 0.00 0.00 54.13 54.60 1s9i s LEU 201 Cb -0.20 -2.17 -0.05 0.00 0.02 0.00 0.00 46.19 43.79 1s9i s LEU 201 CO -0.01 0.22 0.05 0.68 0.02 0.00 0.00 176.35 177.32 1s9i s VAL 202 N -0.01 2.69 0.18 -1.59 -7.23 -0.68 0.38 120.40 114.14 1s9i s VAL 202 Ca 0.12 -1.90 -0.11 0.00 -1.81 0.00 0.00 61.98 58.29 1s9i s VAL 202 Cb -0.12 -2.85 -0.00 0.00 0.56 0.00 0.00 36.38 33.97 1s9i s VAL 202 CO 0.01 -0.18 0.36 0.54 -0.31 0.00 0.00 175.10 175.52 1s9i s ASN 203 N -3.75 -0.03 0.45 4.85 2.20 -0.79 -1.32 114.94 116.54 1s9i s ASN 203 Ca 0.36 -0.82 0.30 0.00 -0.94 0.00 0.00 52.86 51.76 1s9i s ASN 203 Cb -0.00 0.48 1.62 0.00 -2.00 0.00 0.00 41.25 41.35 1s9i s ASN 203 CO 0.20 -0.96 1.91 0.77 -2.94 0.00 0.00 177.10 176.08 1s9i h SER 204 N 2.43 0.00 0.81 3.54 4.64 -1.90 0.61 113.55 123.68 1s9i h SER 204 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1s9i h SER 204 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1s9i h SER 204 CO 0.44 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.94 1s9i n ARG 205 N -2.55 0.18 0.00 4.77 1.74 -1.26 -4.74 116.66 114.80 1s9i n ARG 205 Ca -0.02 0.37 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 1s9i n ARG 205 Cb 0.05 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 29.67 1s9i n ARG 205 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s9i n GLY 206 N 0.20 0.90 3.81 -0.13 0.00 0.20 -4.86 105.19 105.31 1s9i n GLY 206 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 1s9i n GLY 206 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s9i s GLU 207 N -0.99 4.16 -0.20 1.61 2.02 -1.22 -4.73 118.70 119.35 1s9i s GLU 207 Ca 0.00 0.67 -0.02 0.00 0.02 0.00 0.00 54.97 55.64 1s9i s GLU 207 Cb 0.00 -3.25 0.00 0.00 0.10 0.00 0.00 34.13 30.98 1s9i s GLU 207 CO 0.00 0.61 -0.11 0.42 0.02 0.00 0.00 175.26 176.19 1s9i s ILE 208 N -0.96 2.78 0.06 -1.63 1.01 -1.26 -1.88 121.20 119.32 1s9i s ILE 208 Ca 0.28 -0.69 0.05 0.00 0.00 0.00 0.00 60.65 60.29 1s9i s ILE 208 Cb -0.19 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.03 1s9i s ILE 208 CO 0.17 0.48 -0.15 -0.54 0.00 0.00 0.00 174.94 174.90 1s9i s LYS 209 N 1.39 0.92 0.26 2.79 1.02 0.16 -4.64 119.74 121.64 1s9i s LYS 209 Ca 0.05 -0.88 -0.14 0.00 0.02 0.00 0.00 55.97 55.02 1s9i s LYS 209 Cb -0.14 -0.95 -0.08 0.00 -0.52 0.00 0.00 37.83 36.14 1s9i s LYS 209 CO -0.08 0.22 0.67 -0.51 -0.92 0.00 0.00 175.35 174.74 1s9i s LEU 210 N -1.46 4.17 0.08 3.17 1.43 0.32 0.57 118.68 126.96 1s9i s LEU 210 Ca 0.01 1.19 -0.01 0.00 -1.03 0.00 0.00 54.13 54.29 1s9i s LEU 210 Cb -0.09 -3.81 -0.04 0.00 0.03 0.00 0.00 46.19 42.28 1s9i s LEU 210 CO 0.02 -0.10 -0.01 0.00 0.23 0.00 0.00 176.35 176.49 1s9i n ASP 212 N 0.02 -6.26 -4.75 0.00 8.00 -1.26 -4.84 116.55 107.46 1s9i n ASP 212 Ca -0.11 -0.79 -0.30 0.00 0.71 0.00 0.00 54.79 54.30 1s9i n ASP 212 Cb 0.62 -4.60 -0.07 0.00 -0.02 0.00 0.00 41.12 37.05 1s9i n ASP 212 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1s9i s PHE 213 N -3.40 3.13 -1.31 1.24 -0.12 -1.26 -4.63 117.98 111.64 1s9i s PHE 213 Ca 0.45 0.05 -0.18 0.00 -0.05 0.00 0.00 56.93 57.20 1s9i s PHE 213 Cb -0.09 -1.59 0.04 0.00 -0.63 0.00 0.00 43.02 40.75 1s9i s PHE 213 CO 0.78 0.51 1.88 0.41 -0.05 0.00 0.00 175.22 178.75 1s9i n GLY 214 N 0.46 2.92 0.17 1.99 0.00 -1.26 -4.66 105.19 104.81 1s9i n GLY 214 Ca -0.09 -1.43 -0.10 0.00 0.00 0.00 0.00 46.02 44.40 1s9i n GLY 214 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1s9i h VAL 215 N 5.19 1.38 -3.57 1.61 -1.51 -1.92 -3.42 116.25 114.01 1s9i h VAL 215 Ca 0.46 -2.17 -0.67 0.00 -1.23 0.00 0.00 66.70 63.08 1s9i h VAL 215 Cb 0.81 2.14 -0.17 0.00 -2.13 0.00 0.00 31.29 31.95 1s9i h VAL 215 CO 1.56 0.65 -0.08 -0.55 -1.23 0.00 0.00 177.57 177.93 1s9i s SER 216 N -6.98 6.25 0.30 4.19 0.15 -1.26 -4.92 113.70 111.42 1s9i s SER 216 Ca -0.06 -0.48 -0.02 0.00 0.70 0.00 0.00 55.95 56.09 1s9i s SER 216 Cb 0.10 -2.26 0.44 0.00 -1.71 0.00 0.00 66.02 62.59 1s9i s SER 216 CO 0.84 -0.63 1.96 1.23 1.20 0.00 0.00 173.24 177.84 1s9i h GLY 217 N 9.28 1.15 0.39 9.45 0.00 -1.92 -2.78 103.07 118.63 1s9i h GLY 217 Ca -0.26 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.62 1s9i h GLY 217 CO 0.82 0.43 -0.12 -0.18 0.00 0.00 0.00 176.54 177.50 1s9i n GLN 218 N -4.40 0.99 0.08 4.80 -0.06 -1.26 -2.80 117.38 114.73 1s9i n GLN 218 Ca 0.09 -0.46 -0.22 0.00 -2.00 0.00 0.00 57.00 54.41 1s9i n GLN 218 Cb 0.04 -1.49 -0.14 0.00 -4.06 0.00 0.00 30.24 24.59 1s9i n GLN 218 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 1s9i h LEU 219 N 1.13 0.73 -0.12 1.69 6.46 -1.86 -2.86 115.31 120.48 1s9i h LEU 219 Ca 0.00 -0.87 0.03 0.00 -0.12 0.00 0.00 57.88 56.92 1s9i h LEU 219 Cb 0.41 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 40.08 1s9i h LEU 219 CO 0.00 1.53 -0.04 0.40 -0.62 0.00 0.00 178.44 179.71 1s9i h ILE 220 N 0.04 0.86 -0.64 4.05 2.04 -1.48 -2.54 117.51 119.84 1s9i h ILE 220 Ca -0.18 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 1s9i h ILE 220 Cb 1.81 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 38.72 1s9i h ILE 220 CO 0.21 0.00 0.27 0.44 0.00 0.00 0.00 178.15 179.07 1s9i h ASP 221 N -0.01 0.85 0.00 1.72 3.32 -1.64 -1.60 116.42 119.06 1s9i h ASP 221 Ca 0.06 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1s9i h ASP 221 Cb 0.11 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1s9i h ASP 221 CO -0.14 0.75 0.00 -0.24 -1.72 0.00 0.00 179.24 177.89 1s9i n SER 222 N -4.32 0.00 -1.13 6.45 2.88 -1.08 -5.11 113.62 111.32 1s9i n SER 222 Ca 0.06 -1.26 0.00 0.00 -1.33 0.00 0.00 58.87 56.33 1s9i n SER 222 Cb 0.16 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 1s9i n SER 222 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1s9i n MET 223 N -0.81 1.78 -0.07 -1.46 2.81 -0.61 -4.97 117.12 113.79 1s9i n MET 223 Ca 0.14 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 56.08 1s9i n MET 223 Cb 0.06 0.00 0.09 0.00 -0.71 0.00 0.00 33.22 32.67 1s9i n MET 223 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1s9i n THR 230 N 0.00 -0.02 -4.38 2.03 -2.24 -1.26 -4.97 114.28 103.44 1s9i n THR 230 Ca 0.00 0.21 -0.25 0.00 -2.27 0.00 0.00 64.05 61.74 1s9i n THR 230 Cb 0.00 -0.35 -0.10 0.00 -2.10 0.00 0.00 70.33 67.78 1s9i n THR 230 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1s9i s ARG 231 N -3.61 1.88 -0.07 -0.78 0.52 -1.26 -5.06 118.95 110.56 1s9i s ARG 231 Ca -0.01 -1.51 -0.04 0.00 -0.52 0.00 0.00 55.73 53.65 1s9i s ARG 231 Cb 0.04 -1.97 0.03 0.00 0.52 0.00 0.00 34.95 33.57 1s9i s ARG 231 CO 0.11 0.38 0.16 0.45 0.02 0.00 0.00 175.30 176.42 1s9i s SER 232 N -3.19 -0.15 0.00 0.23 0.15 -1.26 -5.03 113.70 104.46 1s9i s SER 232 Ca 0.27 0.34 0.12 0.00 0.70 0.00 0.00 55.95 57.38 1s9i s SER 232 Cb -0.07 0.26 0.12 0.00 -1.71 0.00 0.00 66.02 64.62 1s9i s SER 232 CO 0.15 -0.12 0.92 -1.22 1.20 0.00 0.00 173.24 174.17 1s9i n TYR 233 N 3.87 0.05 -1.89 3.44 4.01 -1.26 -5.03 117.16 120.34 1s9i n TYR 233 Ca -0.22 -0.05 -0.35 0.00 -0.16 0.00 0.00 57.90 57.12 1s9i n TYR 233 Cb 0.54 -0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.61 1s9i n TYR 233 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1s9i s MET 234 N -1.02 2.81 0.45 -0.72 -1.94 -1.26 -4.09 119.30 113.53 1s9i s MET 234 Ca 0.15 1.79 -0.12 0.00 -1.71 0.00 0.00 55.69 55.80 1s9i s MET 234 Cb 0.11 -1.91 -0.07 0.00 2.01 0.00 0.00 34.83 34.97 1s9i s MET 234 CO 0.16 -1.33 0.85 0.00 -0.01 0.00 0.00 175.02 174.69 1s9i s ALA 235 N -1.70 3.25 0.20 3.03 0.00 -1.26 -4.95 121.76 120.33 1s9i s ALA 235 Ca 0.76 -0.08 -0.16 0.00 0.00 0.00 0.00 51.96 52.48 1s9i s ALA 235 Cb -0.30 -2.85 0.20 0.00 0.00 0.00 0.00 23.12 20.17 1s9i s ALA 235 CO 0.36 -0.12 1.61 -1.35 0.00 0.00 0.00 175.76 176.25 1s9i h PRO 236 N 1.04 -0.07 0.00 0.00 0.11 -1.86 -0.88 132.00 130.34 1s9i h PRO 236 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1s9i h PRO 236 Cb 1.19 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1s9i h PRO 236 CO 0.63 -0.05 -0.07 1.05 -0.21 0.00 0.00 178.00 179.35 1s9i h GLU 237 N -0.07 0.00 0.00 1.05 9.09 -1.88 0.17 114.58 122.93 1s9i h GLU 237 Ca 0.28 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.58 1s9i h GLU 237 Cb 0.51 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.60 1s9i h GLU 237 CO -0.67 0.07 -0.56 0.00 0.05 0.00 0.00 179.01 177.89 1s9i h ARG 238 N 0.00 0.00 0.09 1.06 3.08 -1.46 -3.23 114.38 113.92 1s9i h ARG 238 Ca -0.00 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.69 1s9i h ARG 238 Cb 0.26 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 1s9i h ARG 238 CO 0.01 0.52 -2.02 1.28 -1.07 0.00 0.00 179.97 178.69 1s9i n LEU 239 N -3.22 2.60 0.07 3.04 4.77 -0.68 -4.44 117.00 119.14 1s9i n LEU 239 Ca 0.01 0.18 0.02 0.00 -0.03 0.00 0.00 56.01 56.19 1s9i n LEU 239 Cb 0.75 -1.06 0.37 0.00 -2.33 0.00 0.00 43.42 41.15 1s9i n LEU 239 CO 0.41 0.80 0.95 1.56 -1.33 0.00 0.00 177.39 179.79 1s9i h GLN 240 N -0.08 0.37 0.00 3.23 1.08 -1.12 -3.49 115.11 115.11 1s9i h GLN 240 Ca -0.45 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 56.68 1s9i h GLN 240 Cb 1.93 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 29.30 1s9i h GLN 240 CO 0.01 0.42 0.00 0.41 -0.95 0.00 0.00 178.83 178.72 1s9i n GLY 241 N -0.99 -0.30 2.67 3.46 0.00 -1.22 -5.10 105.19 103.70 1s9i n GLY 241 Ca 0.00 0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 1s9i n GLY 241 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1s9i n THR 242 N 0.00 0.00 -2.93 2.61 -2.24 -1.26 -4.72 114.28 105.73 1s9i n THR 242 Ca 0.00 -0.91 -0.10 0.00 -2.27 0.00 0.00 64.05 60.77 1s9i n THR 242 Cb 0.00 -1.30 0.01 0.00 -2.10 0.00 0.00 70.33 66.94 1s9i n THR 242 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1s9i n HIS 243 N -2.76 -3.37 -3.70 4.78 -0.00 -1.26 -4.78 115.22 104.13 1s9i n HIS 243 Ca 0.11 1.35 -0.18 0.00 -0.00 0.00 0.00 57.72 59.01 1s9i n HIS 243 Cb 0.40 -3.92 -0.17 0.00 -0.00 0.00 0.00 29.99 26.31 1s9i n HIS 243 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 1s9i s TYR 244 N -2.57 -0.01 0.00 4.41 -0.85 -1.26 -4.76 117.35 112.30 1s9i s TYR 244 Ca 0.23 0.31 0.00 0.00 -0.52 0.00 0.00 57.07 57.09 1s9i s TYR 244 Cb -0.06 -0.35 0.00 0.00 0.38 0.00 0.00 41.96 41.93 1s9i s TYR 244 CO 0.78 -0.18 0.00 -1.13 -1.52 0.00 0.00 175.55 173.50 1s9i n SER 245 N 4.92 0.01 0.00 -0.18 3.41 -1.26 -5.01 113.62 115.52 1s9i n SER 245 Ca -0.12 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.56 1s9i n SER 245 Cb 0.50 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 64.80 1s9i n SER 245 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1s9i n VAL 246 N 0.00 0.49 0.19 -3.33 3.14 -1.26 -1.82 118.33 115.75 1s9i n VAL 246 Ca 0.00 0.12 0.07 0.00 -2.96 0.00 0.00 64.34 61.58 1s9i n VAL 246 Cb 0.00 -0.91 0.30 0.00 -1.06 0.00 0.00 33.84 32.18 1s9i n VAL 246 CO 0.00 0.00 0.00 1.56 -6.46 0.00 0.00 176.83 171.93 1s9i h GLN 247 N 0.00 0.00 -0.63 1.45 1.08 -1.94 -3.24 115.11 111.83 1s9i h GLN 247 Ca 0.00 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1s9i h GLN 247 Cb 0.09 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.50 1s9i h GLN 247 CO 0.00 0.32 0.16 0.77 -0.95 0.00 0.00 178.83 179.12 1s9i h SER 248 N 0.00 0.92 0.81 1.46 0.02 -1.76 -2.86 113.55 112.15 1s9i h SER 248 Ca -0.00 -0.18 -0.10 0.00 -0.84 0.00 0.00 61.79 60.66 1s9i h SER 248 Cb 0.96 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 1s9i h SER 248 CO 0.04 0.89 -0.49 0.44 -1.14 0.00 0.00 176.83 176.57 1s9i h ASP 249 N 0.94 0.00 0.22 3.07 3.32 -1.74 -1.95 116.42 120.27 1s9i h ASP 249 Ca 0.20 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 1s9i h ASP 249 Cb 0.33 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 1s9i h ASP 249 CO -0.00 0.49 -0.15 0.40 -1.72 0.00 0.00 179.24 178.26 1s9i h ILE 250 N 0.00 0.68 -0.23 0.35 1.08 -1.60 0.14 117.51 117.93 1s9i h ILE 250 Ca -0.00 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.52 1s9i h ILE 250 Cb 1.03 0.68 -0.07 0.00 -3.07 0.00 0.00 36.82 35.39 1s9i h ILE 250 CO 0.06 0.00 -0.22 -0.25 -0.69 0.00 0.00 178.15 177.05 1s9i h TRP 251 N -0.36 -0.59 -0.22 1.37 2.91 -1.39 0.17 115.95 117.84 1s9i h TRP 251 Ca -0.02 0.04 0.05 0.00 1.13 0.00 0.00 58.89 60.09 1s9i h TRP 251 Cb 0.31 0.29 -0.07 0.00 -0.51 0.00 0.00 29.16 29.19 1s9i h TRP 251 CO -0.10 -0.30 -0.41 0.77 -1.03 0.00 0.00 178.44 177.37 1s9i h SER 252 N -0.23 -1.31 -0.82 2.65 0.02 -1.07 -0.42 113.55 112.36 1s9i h SER 252 Ca 0.13 0.18 0.03 0.00 -0.84 0.00 0.00 61.79 61.30 1s9i h SER 252 Cb 0.44 0.55 -0.05 0.00 0.14 0.00 0.00 62.40 63.48 1s9i h SER 252 CO -0.37 -0.40 0.53 -0.03 -1.14 0.00 0.00 176.83 175.42 1s9i h MET 253 N -0.43 1.00 0.37 3.45 1.85 -0.27 -0.75 114.93 120.16 1s9i h MET 253 Ca 0.10 -0.06 -0.00 0.00 -0.61 0.00 0.00 59.70 59.12 1s9i h MET 253 Cb 0.60 -0.23 -0.02 0.00 0.43 0.00 0.00 31.60 32.39 1s9i h MET 253 CO -0.45 0.66 -0.34 0.78 -0.40 0.00 0.00 176.91 177.16 1s9i h GLY 254 N 1.03 -0.81 0.76 1.39 0.00 0.22 -0.97 103.07 104.69 1s9i h GLY 254 Ca 0.33 0.39 0.02 0.00 0.00 0.00 0.00 47.33 48.07 1s9i h GLY 254 CO -0.11 -0.29 -0.03 -2.00 0.00 0.00 0.00 176.54 174.10 1s9i h LEU 255 N -0.73 -0.11 -1.09 3.11 5.85 -0.86 -1.71 115.31 119.77 1s9i h LEU 255 Ca -0.03 0.04 0.21 0.00 0.84 0.00 0.00 57.88 58.94 1s9i h LEU 255 Cb 0.65 0.07 -0.10 0.00 0.37 0.00 0.00 40.66 41.65 1s9i h LEU 255 CO -0.05 -0.04 0.61 0.28 -0.34 0.00 0.00 178.44 178.91 1s9i h SER 256 N -0.00 0.69 -0.13 1.25 0.02 -0.98 0.23 113.55 114.63 1s9i h SER 256 Ca 0.06 0.10 -0.05 0.00 -0.84 0.00 0.00 61.79 61.06 1s9i h SER 256 Cb 0.09 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 62.60 1s9i h SER 256 CO -0.12 0.21 -0.10 -0.07 -1.14 0.00 0.00 176.83 175.61 1s9i h LEU 257 N 0.66 0.31 -1.81 5.07 3.38 -0.67 -2.60 115.31 119.64 1s9i h LEU 257 Ca 0.58 -0.46 0.02 0.00 0.09 0.00 0.00 57.88 58.11 1s9i h LEU 257 Cb 1.05 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1s9i h LEU 257 CO -0.37 0.71 0.17 0.58 0.09 0.00 0.00 178.44 179.61 1s9i h VAL 258 N -0.08 1.01 0.78 1.22 2.07 -0.29 0.85 116.25 121.80 1s9i h VAL 258 Ca 0.02 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 1s9i h VAL 258 Cb 0.61 0.74 0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1s9i h VAL 258 CO 0.03 0.05 -0.38 -0.08 0.02 0.00 0.00 177.57 177.21 1s9i h GLU 259 N 0.25 -1.01 0.00 1.57 4.81 -0.53 -1.98 114.58 117.69 1s9i h GLU 259 Ca 0.10 0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1s9i h GLU 259 Cb 0.09 0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 1s9i h GLU 259 CO -0.02 -0.66 -0.08 -0.07 -0.73 0.00 0.00 179.01 177.45 1s9i h LEU 260 N -1.21 0.00 0.52 1.64 3.38 -1.06 0.20 115.31 118.77 1s9i h LEU 260 Ca -0.11 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1s9i h LEU 260 Cb 0.82 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.57 1s9i h LEU 260 CO 0.18 0.08 -0.25 0.00 0.09 0.00 0.00 178.44 178.54 1s9i h ALA 261 N 1.92 -0.69 -0.09 1.53 0.00 -0.79 -0.02 119.26 121.11 1s9i h ALA 261 Ca -0.00 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 1s9i h ALA 261 Cb 0.24 0.27 0.01 0.00 0.00 0.00 0.00 17.79 18.31 1s9i h ALA 261 CO 0.01 -0.65 -0.49 0.28 0.00 0.00 0.00 179.25 178.41 1s9i h VAL 262 N -1.18 1.38 0.00 0.00 2.07 -1.18 -3.40 116.25 113.94 1s9i h VAL 262 Ca -0.07 -1.84 0.00 0.00 0.82 0.00 0.00 66.70 65.61 1s9i h VAL 262 Cb 0.54 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.57 1s9i h VAL 262 CO 0.12 0.55 0.00 0.61 0.02 0.00 0.00 177.57 178.86 1s9i n GLY 263 N 0.74 1.19 3.37 2.17 0.00 0.67 -4.87 105.19 108.47 1s9i n GLY 263 Ca -0.08 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.75 1s9i n GLY 263 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1s9i s ARG 264 N 0.00 1.56 -0.22 1.61 1.70 -1.20 -4.87 118.95 117.52 1s9i s ARG 264 Ca 0.00 -1.87 -0.33 0.00 -0.47 0.00 0.00 55.73 53.06 1s9i s ARG 264 Cb 0.00 -0.43 -0.10 0.00 -0.57 0.00 0.00 34.95 33.85 1s9i s ARG 264 CO 0.00 -0.31 2.08 0.98 -1.08 0.00 0.00 175.30 176.97 1s9i n TYR 265 N -0.59 1.96 0.10 5.89 9.36 -1.26 -4.41 117.16 128.22 1s9i n TYR 265 Ca -0.01 0.08 0.07 0.00 3.32 0.00 0.00 57.90 61.35 1s9i n TYR 265 Cb 0.66 -2.63 0.25 0.00 -0.63 0.00 0.00 39.34 36.99 1s9i n TYR 265 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1s9i n PRO 266 N 7.75 2.81 0.11 2.98 -0.04 -1.26 -4.47 135.00 142.88 1s9i n PRO 266 Ca 0.32 -1.96 -0.04 0.00 -0.04 0.00 0.00 63.50 61.78 1s9i n PRO 266 Cb 0.31 -1.66 0.11 0.00 -0.04 0.00 0.00 33.50 32.21 1s9i n PRO 266 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 1s9i h ILE 267 N 2.85 1.45 -2.24 0.52 1.08 -1.96 -2.98 117.51 116.22 1s9i h ILE 267 Ca 0.00 -2.24 -0.53 0.00 -0.39 0.00 0.00 64.86 61.70 1s9i h ILE 267 Cb 1.03 2.19 -0.07 0.00 -3.07 0.00 0.00 36.82 36.90 1s9i h ILE 267 CO 0.14 0.65 1.12 -2.84 -0.69 0.00 0.00 178.15 176.53 1s9i s PRO 268 N -3.54 3.11 -0.03 2.37 0.02 -1.26 -4.90 135.00 130.77 1s9i s PRO 268 Ca -0.02 -0.14 -0.30 0.00 0.02 0.00 0.00 61.00 60.55 1s9i s PRO 268 Cb 0.12 -4.26 -0.06 0.00 0.02 0.00 0.00 34.50 30.31 1s9i s PRO 268 CO 0.79 -2.25 1.72 -2.14 -0.33 0.00 0.00 177.00 174.79 1s9i s PRO 269 N 5.92 4.17 0.24 5.54 0.02 -1.13 -4.90 135.00 144.86 1s9i s PRO 269 Ca 0.41 2.28 -0.31 0.00 0.02 0.00 0.00 61.00 63.40 1s9i s PRO 269 Cb -0.08 -4.03 -0.14 0.00 0.02 0.00 0.00 34.50 30.27 1s9i s PRO 269 CO 0.15 -0.87 1.18 -2.30 -0.33 0.00 0.00 177.00 174.83 1s9i n PRO 270 N 7.23 1.51 -0.49 5.54 -0.02 -1.26 -4.98 135.00 142.53 1s9i n PRO 270 Ca 0.18 0.54 -0.08 0.00 -2.02 0.00 0.00 63.50 62.11 1s9i n PRO 270 Cb 0.42 -2.04 0.06 0.00 -0.02 0.00 0.00 33.50 31.93 1s9i n PRO 270 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1s9i n ASP 271 N 1.71 -0.27 0.12 2.55 5.68 -1.26 -4.86 116.55 120.22 1s9i n ASP 271 Ca 0.12 -1.04 0.18 0.00 -0.50 0.00 0.00 54.79 53.55 1s9i n ASP 271 Cb 0.29 -0.29 0.75 0.00 -1.14 0.00 0.00 41.12 40.73 1s9i n ASP 271 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1s9i h ALA 272 N -2.00 2.12 0.00 2.12 0.00 -2.01 -2.97 119.26 116.52 1s9i h ALA 272 Ca -0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1s9i h ALA 272 Cb 0.34 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1s9i h ALA 272 CO 0.08 -0.44 0.00 0.36 0.00 0.00 0.00 179.25 179.25 1s9i n LYS 273 N -4.08 -0.72 0.07 0.00 2.85 -1.26 -4.74 118.16 110.28 1s9i n LYS 273 Ca 0.05 -0.45 -0.13 0.00 -1.05 0.00 0.00 58.31 56.73 1s9i n LYS 273 Cb 0.44 -0.92 -0.08 0.00 -0.65 0.00 0.00 35.03 33.82 1s9i n LYS 273 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 1s9i h GLU 274 N 0.00 -0.12 0.00 -1.58 4.81 -1.85 -2.91 114.58 112.92 1s9i h GLU 274 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1s9i h GLU 274 Cb 0.10 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1s9i h GLU 274 CO 0.00 0.07 0.00 1.28 -0.73 0.00 0.00 179.01 179.63 1s9i n LEU 275 N -5.07 0.40 0.32 1.64 4.32 -1.26 -3.33 117.00 114.02 1s9i n LEU 275 Ca -0.08 0.57 0.19 0.00 -0.02 0.00 0.00 56.01 56.67 1s9i n LEU 275 Cb 0.15 -0.48 1.07 0.00 -1.62 0.00 0.00 43.42 42.53 1s9i n LEU 275 CO 0.33 -0.28 1.14 -0.08 -1.22 0.00 0.00 177.39 177.29 1s9i h GLU 276 N 0.00 0.00 0.00 3.23 4.81 -1.71 0.33 114.58 121.24 1s9i h GLU 276 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1s9i h GLU 276 Cb 0.45 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1s9i h GLU 276 CO 0.00 0.01 0.00 0.00 -0.73 0.00 0.00 179.01 178.29 1s9i n ALA 277 N -2.17 2.03 0.00 2.92 0.00 -1.21 -2.97 120.51 119.10 1s9i n ALA 277 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1s9i n ALA 277 Cb 0.10 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1s9i n ALA 277 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1s9i n ILE 278 N -0.54 0.00 -4.02 0.00 2.08 0.09 -5.14 119.36 111.84 1s9i n ILE 278 Ca 0.01 0.00 -0.09 0.00 0.56 0.00 0.00 62.75 63.23 1s9i n ILE 278 Cb 0.00 -0.51 -0.06 0.00 -0.75 0.00 0.00 39.64 38.32 1s9i n ILE 278 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 1s9i s PHE 279 N -1.55 0.45 -0.00 1.39 5.36 -1.16 -5.12 117.98 117.35 1s9i s PHE 279 Ca 0.00 -0.80 -0.16 0.00 -0.96 0.00 0.00 56.93 55.02 1s9i s PHE 279 Cb 0.00 0.11 -0.09 0.00 -0.34 0.00 0.00 43.02 42.70 1s9i s PHE 279 CO 0.00 -0.96 0.83 0.78 -1.46 0.00 0.00 175.22 174.41 1s9i h GLY 280 N 2.29 -0.59 -2.34 13.12 0.00 -1.92 -3.38 103.07 110.25 1s9i h GLY 280 Ca -0.27 0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1s9i h GLY 280 CO 0.37 -0.21 0.00 0.54 0.00 0.00 0.00 176.54 177.24 1s9i n ARG 281 N -4.30 0.66 0.00 4.80 3.00 -1.26 -4.95 116.66 114.60 1s9i n ARG 281 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.77 1s9i n ARG 281 Cb 0.22 -1.17 0.00 0.00 0.00 0.00 0.00 32.46 31.51 1s9i n ARG 281 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 1s9i n MET 316 N 0.93 0.00 -1.98 5.56 2.81 -1.26 -4.95 117.12 118.23 1s9i n MET 316 Ca 0.00 0.00 -0.32 0.00 -1.81 0.00 0.00 57.70 55.57 1s9i n MET 316 Cb 0.33 -0.01 0.01 0.00 -0.71 0.00 0.00 33.22 32.84 1s9i n MET 316 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1s9i s ALA 317 N -1.00 2.81 0.25 3.04 0.00 -1.26 -4.93 121.76 120.66 1s9i s ALA 317 Ca 0.00 0.24 0.10 0.00 0.00 0.00 0.00 51.96 52.30 1s9i s ALA 317 Cb 0.00 -3.19 0.26 0.00 0.00 0.00 0.00 23.12 20.19 1s9i s ALA 317 CO 0.00 -0.80 1.55 -0.84 0.00 0.00 0.00 175.76 175.68 1s9i h ILE 318 N 0.18 1.49 0.18 0.00 3.07 -1.99 -1.22 117.51 119.22 1s9i h ILE 318 Ca -0.46 -2.34 -0.30 0.00 1.55 0.00 0.00 64.86 63.31 1s9i h ILE 318 Cb 1.21 2.26 0.02 0.00 -0.27 0.00 0.00 36.82 40.04 1s9i h ILE 318 CO 0.58 0.67 -1.37 0.15 -1.05 0.00 0.00 178.15 177.14 1s9i h PHE 319 N 0.00 0.70 -0.61 0.16 3.57 -1.99 -2.98 116.94 115.79 1s9i h PHE 319 Ca -0.01 -0.51 0.00 0.00 3.53 0.00 0.00 57.97 60.99 1s9i h PHE 319 Cb 1.21 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.89 1s9i h PHE 319 CO 0.00 1.41 0.39 1.49 -2.23 0.00 0.00 178.31 179.37 1s9i h GLU 320 N 0.10 0.81 0.31 1.11 4.22 -1.93 -0.31 114.58 118.88 1s9i h GLU 320 Ca -0.19 -0.06 -0.01 0.00 0.08 0.00 0.00 59.36 59.18 1s9i h GLU 320 Cb 2.06 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 31.12 1s9i h GLU 320 CO 0.23 0.55 -0.33 1.25 -2.18 0.00 0.00 179.01 178.53 1s9i h LEU 321 N 0.82 -0.92 -1.64 1.64 7.12 -1.32 -1.13 115.31 119.89 1s9i h LEU 321 Ca 0.22 0.08 0.20 0.00 0.13 0.00 0.00 57.88 58.51 1s9i h LEU 321 Cb -0.07 0.31 -0.06 0.00 -0.53 0.00 0.00 40.66 40.31 1s9i h LEU 321 CO -0.05 -0.43 0.58 -0.07 -0.13 0.00 0.00 178.44 178.34 1s9i h LEU 322 N -0.64 0.31 -0.47 2.25 4.07 -1.36 0.19 115.31 119.66 1s9i h LEU 322 Ca -0.04 0.03 -0.11 0.00 0.08 0.00 0.00 57.88 57.84 1s9i h LEU 322 Cb 0.56 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.26 1s9i h LEU 322 CO -0.05 0.13 -0.15 -0.78 -1.08 0.00 0.00 178.44 176.50 1s9i h ASP 323 N 0.31 0.94 0.11 -0.43 3.58 -0.78 -2.57 116.42 117.57 1s9i h ASP 323 Ca 0.43 -0.38 -0.01 0.00 0.42 0.00 0.00 57.03 57.50 1s9i h ASP 323 Cb 1.21 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 42.00 1s9i h ASP 323 CO -0.13 1.10 -0.05 0.22 -2.88 0.00 0.00 179.24 177.50 1s9i h TYR 324 N 0.77 -0.13 -0.59 0.28 3.20 0.64 0.00 116.97 121.15 1s9i h TYR 324 Ca 0.11 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.06 1s9i h TYR 324 Cb 0.71 0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.96 1s9i h TYR 324 CO 0.05 0.08 0.24 0.82 -1.64 0.00 0.00 178.16 177.71 1s9i h ILE 325 N -0.33 0.82 -0.00 1.81 2.04 -1.39 0.12 117.51 120.59 1s9i h ILE 325 Ca -0.01 -0.15 -0.26 0.00 1.00 0.00 0.00 64.86 65.43 1s9i h ILE 325 Cb 0.27 0.34 0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1s9i h ILE 325 CO 0.02 0.08 -1.04 0.58 0.00 0.00 0.00 178.15 177.80 1s9i h VAL 326 N 0.45 1.29 0.00 1.67 2.07 -1.36 -3.40 116.25 116.96 1s9i h VAL 326 Ca 0.29 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.55 1s9i h VAL 326 Cb 0.31 2.38 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 1s9i h VAL 326 CO -0.26 0.70 -0.75 0.59 0.02 0.00 0.00 177.57 177.86 1s9i n ASN 327 N -3.84 1.82 -4.67 0.57 4.13 -0.02 -5.02 115.26 108.22 1s9i n ASN 327 Ca -0.11 -0.34 -0.28 0.00 1.68 0.00 0.00 54.58 55.53 1s9i n ASN 327 Cb 0.88 1.13 -0.08 0.00 -1.54 0.00 0.00 39.78 40.18 1s9i n ASN 327 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1s9i s GLU 328 N -1.98 2.46 0.51 3.52 8.01 0.40 -5.03 118.70 126.59 1s9i s GLU 328 Ca 0.00 -1.00 -0.19 0.00 0.01 0.00 0.00 54.97 53.79 1s9i s GLU 328 Cb 0.04 -2.43 -0.11 0.00 -4.31 0.00 0.00 34.13 27.32 1s9i s GLU 328 CO 0.26 0.49 0.40 -0.35 0.01 0.00 0.00 175.26 176.07 1s9i n PRO 329 N 0.16 0.43 -1.78 0.39 -0.04 -1.26 -4.69 135.00 128.22 1s9i n PRO 329 Ca -0.10 0.16 -0.31 0.00 -0.04 0.00 0.00 63.50 63.21 1s9i n PRO 329 Cb 0.54 -1.51 0.02 0.00 -0.04 0.00 0.00 33.50 32.52 1s9i n PRO 329 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1s9i s PRO 330 N -1.72 3.38 0.56 0.54 0.02 -1.26 -4.97 135.00 131.56 1s9i s PRO 330 Ca 0.65 0.81 -0.20 0.00 0.02 0.00 0.00 61.00 62.28 1s9i s PRO 330 Cb -0.50 -2.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.92 1s9i s PRO 330 CO 0.58 -0.74 1.22 -1.25 -0.33 0.00 0.00 177.00 176.48 1s9i s PRO 331 N -5.14 3.12 0.19 5.54 0.04 -1.26 -5.06 135.00 132.44 1s9i s PRO 331 Ca 0.56 1.88 0.09 0.00 0.04 0.00 0.00 61.00 63.57 1s9i s PRO 331 Cb -0.12 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 1s9i s PRO 331 CO 0.54 -1.10 -0.18 0.15 0.04 0.00 0.00 177.00 176.45 1s9i s LYS 332 N -3.17 1.37 -0.00 4.56 1.02 -1.26 -4.92 119.74 117.34 1s9i s LYS 332 Ca 0.74 -1.51 -0.28 0.00 0.02 0.00 0.00 55.97 54.95 1s9i s LYS 332 Cb -0.32 -1.40 -0.04 0.00 -0.52 0.00 0.00 37.83 35.56 1s9i s LYS 332 CO 0.35 0.27 0.88 -0.51 -0.92 0.00 0.00 175.35 175.43 1s9i s LEU 333 N -2.93 4.37 0.17 3.17 1.43 -1.26 -5.01 118.68 118.62 1s9i s LEU 333 Ca 0.20 1.52 -0.32 0.00 -1.03 0.00 0.00 54.13 54.50 1s9i s LEU 333 Cb -0.05 -3.40 -0.11 0.00 0.03 0.00 0.00 46.19 42.66 1s9i s LEU 333 CO 0.08 -0.18 1.65 -2.16 0.23 0.00 0.00 176.35 175.97 1s9i s PRO 334 N 0.76 4.18 -1.33 1.29 0.04 -1.26 -4.86 135.00 133.81 1s9i s PRO 334 Ca 0.46 2.47 -0.15 0.00 0.04 0.00 0.00 61.00 63.82 1s9i s PRO 334 Cb -0.20 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 1s9i s PRO 334 CO 0.25 -0.68 2.20 0.27 0.04 0.00 0.00 177.00 179.08 1s9i n ASN 335 N 4.19 3.84 0.00 6.66 6.94 -1.26 -4.13 115.26 131.49 1s9i n ASN 335 Ca 0.15 -2.79 0.00 0.00 -0.02 0.00 0.00 54.58 51.92 1s9i n ASN 335 Cb 0.37 -1.54 0.00 0.00 -2.36 0.00 0.00 39.78 36.25 1s9i n ASN 335 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1s9i n GLY 336 N 4.16 -0.18 0.18 4.83 0.00 -1.26 -4.96 105.19 107.96 1s9i n GLY 336 Ca 0.53 0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.64 1s9i n GLY 336 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1s9i h VAL 337 N 0.00 0.29 -2.88 1.61 3.04 -2.00 -3.46 116.25 112.86 1s9i h VAL 337 Ca 0.00 -1.43 -0.63 0.00 -1.01 0.00 0.00 66.70 63.64 1s9i h VAL 337 Cb 0.00 2.10 -0.04 0.00 -2.01 0.00 0.00 31.29 31.34 1s9i h VAL 337 CO 0.00 0.17 -0.48 -0.36 -1.01 0.00 0.00 177.57 175.88 1s9i s PHE 338 N -3.13 3.53 0.27 3.17 0.08 -1.26 -5.04 117.98 115.60 1s9i s PHE 338 Ca 0.05 0.32 -0.30 0.00 0.12 0.00 0.00 56.93 57.12 1s9i s PHE 338 Cb 0.06 -1.81 -0.09 0.00 -0.57 0.00 0.00 43.02 40.61 1s9i s PHE 338 CO 0.71 0.61 1.03 0.99 -0.10 0.00 0.00 175.22 178.46 1s9i s THR 339 N -1.44 3.74 0.52 0.64 2.01 -1.26 -4.81 115.64 115.04 1s9i s THR 339 Ca 0.32 1.74 0.47 0.00 0.31 0.00 0.00 61.69 64.53 1s9i s THR 339 Cb -0.13 -4.11 0.69 0.00 0.01 0.00 0.00 72.50 68.97 1s9i s THR 339 CO 0.24 0.41 1.48 -2.65 -0.69 0.00 0.00 174.62 173.41 1s9i n PRO 340 N 1.29 -0.00 0.10 4.92 -0.02 -1.26 -0.52 135.00 139.50 1s9i n PRO 340 Ca -0.01 1.04 -0.17 0.00 -2.02 0.00 0.00 63.50 62.34 1s9i n PRO 340 Cb 0.46 -2.38 -0.14 0.00 -0.02 0.00 0.00 33.50 31.42 1s9i n PRO 340 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1s9i h ASP 341 N 0.00 0.45 -0.24 2.55 3.45 -1.99 -1.56 116.42 119.08 1s9i h ASP 341 Ca 0.89 -0.52 -0.12 0.00 0.43 0.00 0.00 57.03 57.71 1s9i h ASP 341 Cb 3.53 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 42.15 1s9i h ASP 341 CO -0.05 1.41 -0.31 0.15 -1.57 0.00 0.00 179.24 178.87 1s9i h PHE 342 N 0.08 0.78 -0.65 4.55 3.57 -1.18 -1.78 116.94 122.31 1s9i h PHE 342 Ca -0.18 -0.25 0.11 0.00 3.53 0.00 0.00 57.97 61.18 1s9i h PHE 342 Cb 2.00 -0.16 -0.12 0.00 2.79 0.00 0.00 35.95 40.47 1s9i h PHE 342 CO 0.07 0.99 -0.34 0.37 -2.23 0.00 0.00 178.31 177.17 1s9i h GLN 343 N 0.35 -0.14 -0.38 1.11 4.15 -0.89 -2.20 115.11 117.12 1s9i h GLN 343 Ca 0.03 0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.35 1s9i h GLN 343 Cb 0.89 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.60 1s9i h GLN 343 CO 0.07 -0.09 -0.22 1.49 -1.93 0.00 0.00 178.83 178.15 1s9i h GLU 344 N -0.14 0.76 0.57 1.69 4.81 -1.23 -2.56 114.58 118.48 1s9i h GLU 344 Ca 0.25 -0.30 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 1s9i h GLU 344 Cb 0.56 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.88 1s9i h GLU 344 CO -0.72 0.91 -0.51 0.35 -0.73 0.00 0.00 179.01 178.31 1s9i h PHE 345 N 0.66 -1.41 -0.39 0.92 3.57 -0.72 -1.41 116.94 118.17 1s9i h PHE 345 Ca 0.09 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 1s9i h PHE 345 Cb 0.73 0.54 -0.02 0.00 2.79 0.00 0.00 35.95 39.99 1s9i h PHE 345 CO 0.04 -0.70 0.01 -0.39 -2.23 0.00 0.00 178.31 175.04 1s9i h VAL 346 N -1.06 1.21 0.00 1.41 -1.51 -1.49 -1.23 116.25 113.58 1s9i h VAL 346 Ca -0.07 -0.84 -0.00 0.00 -1.23 0.00 0.00 66.70 64.55 1s9i h VAL 346 Cb 0.91 0.90 -0.00 0.00 -2.13 0.00 0.00 31.29 30.97 1s9i h VAL 346 CO -0.03 0.29 -0.02 0.78 -1.23 0.00 0.00 177.57 177.36 1s9i h ASN 347 N 0.59 0.00 1.01 4.19 4.21 -1.29 -0.77 115.58 123.51 1s9i h ASN 347 Ca 0.12 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.52 1s9i h ASN 347 Cb 0.35 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.53 1s9i h ASN 347 CO 0.01 0.02 -1.05 0.11 -1.29 0.00 0.00 177.43 175.23 1s9i h LYS 348 N 0.00 0.00 0.00 0.81 1.57 -0.10 -3.33 116.57 115.52 1s9i h LYS 348 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1s9i h LYS 348 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1s9i h LYS 348 CO 0.00 0.29 -0.30 0.00 -0.57 0.00 0.00 179.45 178.87 1s9i n LEU 350 N -2.55 4.91 -4.69 0.00 4.77 -0.56 -3.27 117.00 115.60 1s9i n LEU 350 Ca 0.04 -4.59 -0.40 0.00 -0.03 0.00 0.00 56.01 51.03 1s9i n LEU 350 Cb 0.48 -0.43 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 1s9i n LEU 350 CO 0.34 1.95 0.39 -0.63 -1.33 0.00 0.00 177.39 178.12 1s9i s ILE 351 N -4.43 5.03 0.09 -0.08 1.01 -1.26 -4.69 121.20 116.87 1s9i s ILE 351 Ca 0.51 1.31 -0.26 0.00 0.00 0.00 0.00 60.65 62.21 1s9i s ILE 351 Cb 0.41 -3.99 -0.15 0.00 0.01 0.00 0.00 42.46 38.75 1s9i s ILE 351 CO 0.02 0.17 1.70 0.11 0.00 0.00 0.00 174.94 176.95 1s9i h LYS 352 N 7.13 -0.26 -6.16 2.79 1.57 -1.96 -3.40 116.57 116.28 1s9i h LYS 352 Ca -0.35 0.02 -0.57 0.00 -1.87 0.00 0.00 60.65 57.88 1s9i h LYS 352 Cb 1.16 0.06 0.01 0.00 0.08 0.00 0.00 32.23 33.54 1s9i h LYS 352 CO 0.77 -0.17 1.36 -1.71 -0.57 0.00 0.00 179.45 179.14 1s9i n ASN 353 N -5.22 3.63 -0.14 0.86 4.05 -1.26 -4.69 115.26 112.50 1s9i n ASN 353 Ca -0.08 0.55 0.06 0.00 0.45 0.00 0.00 54.58 55.56 1s9i n ASN 353 Cb 0.14 -1.53 0.38 0.00 1.23 0.00 0.00 39.78 40.00 1s9i n ASN 353 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1s9i h PRO 354 N 12.79 0.67 -0.34 1.20 0.13 -1.93 -0.03 132.00 144.49 1s9i h PRO 354 Ca -0.45 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 64.59 1s9i h PRO 354 Cb 1.24 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1s9i h PRO 354 CO 0.95 0.44 0.02 0.00 -0.23 0.00 0.00 178.00 179.19 1s9i h ALA 355 N 1.64 0.46 -0.54 -0.56 0.00 -1.93 -2.95 119.26 115.38 1s9i h ALA 355 Ca 0.28 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1s9i h ALA 355 Cb 0.22 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1s9i h ALA 355 CO -0.09 0.20 -0.07 0.93 0.00 0.00 0.00 179.25 180.22 1s9i h GLU 356 N 0.41 0.98 -6.61 0.00 5.08 -1.80 -3.44 114.58 109.19 1s9i h GLU 356 Ca 0.10 -0.33 -0.59 0.00 -1.00 0.00 0.00 59.36 57.54 1s9i h GLU 356 Cb 0.41 -0.08 0.11 0.00 0.50 0.00 0.00 28.75 29.70 1s9i h GLU 356 CO 0.01 1.00 0.28 -2.13 -1.00 0.00 0.00 179.01 177.18 1s9i n ARG 357 N -4.16 1.65 -1.82 2.33 0.63 -0.07 -4.93 116.66 110.28 1s9i n ARG 357 Ca 0.02 0.58 -0.37 0.00 -0.92 0.00 0.00 57.85 57.16 1s9i n ARG 357 Cb 0.37 -2.06 0.05 0.00 0.45 0.00 0.00 32.46 31.27 1s9i n ARG 357 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1s9i s ALA 358 N -1.11 2.55 0.50 5.13 0.00 -0.84 -4.96 121.76 123.02 1s9i s ALA 358 Ca 0.58 1.20 0.06 0.00 0.00 0.00 0.00 51.96 53.80 1s9i s ALA 358 Cb -0.62 -3.53 0.01 0.00 0.00 0.00 0.00 23.12 18.98 1s9i s ALA 358 CO 0.60 -1.42 0.37 0.16 0.00 0.00 0.00 175.76 175.47 1s9i s ASP 359 N -1.31 4.71 0.24 0.00 -4.77 -1.26 -4.89 116.67 109.39 1s9i s ASP 359 Ca 0.78 -1.10 -0.11 0.00 -3.30 0.00 0.00 52.55 48.82 1s9i s ASP 359 Cb -0.37 0.05 0.33 0.00 -1.09 0.00 0.00 42.92 41.84 1s9i s ASP 359 CO 0.40 -0.92 1.60 0.25 0.70 0.00 0.00 175.17 177.20 1s9i h LEU 360 N 0.90 -0.76 -0.22 2.11 5.85 -1.96 -1.60 115.31 119.62 1s9i h LEU 360 Ca -0.39 0.24 -0.06 0.00 0.84 0.00 0.00 57.88 58.51 1s9i h LEU 360 Cb 1.29 0.50 -0.01 0.00 0.37 0.00 0.00 40.66 42.81 1s9i h LEU 360 CO 0.59 -0.26 -0.10 0.50 -0.34 0.00 0.00 178.44 178.82 1s9i h LYS 361 N -0.01 0.46 -0.99 1.25 3.64 -1.98 -0.26 116.57 118.69 1s9i h LYS 361 Ca 0.38 -0.20 0.11 0.00 -1.27 0.00 0.00 60.65 59.67 1s9i h LYS 361 Cb 0.58 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.31 1s9i h LYS 361 CO -0.82 0.73 0.63 0.52 -2.27 0.00 0.00 179.45 178.24 1s9i h MET 362 N 0.17 0.99 -0.05 1.90 2.86 -1.74 -2.00 114.93 117.05 1s9i h MET 362 Ca 0.05 -0.06 -0.16 0.00 -2.06 0.00 0.00 59.70 57.47 1s9i h MET 362 Cb 0.59 -0.22 0.01 0.00 0.06 0.00 0.00 31.60 32.04 1s9i h MET 362 CO 0.03 0.65 -0.60 -0.07 1.06 0.00 0.00 176.91 177.99 1s9i h LEU 363 N 1.02 0.61 -1.99 1.22 3.38 -1.21 -2.62 115.31 115.73 1s9i h LEU 363 Ca 0.48 -0.70 0.00 0.00 0.09 0.00 0.00 57.88 57.75 1s9i h LEU 363 Cb 0.42 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1s9i h LEU 363 CO -0.25 1.23 0.00 0.00 0.09 0.00 0.00 178.44 179.51 1s9i h THR 364 N 0.05 0.00 -0.18 0.22 1.03 -0.60 -0.42 112.91 113.02 1s9i h THR 364 Ca -0.06 -0.24 0.00 0.00 -0.01 0.00 0.00 66.41 66.10 1s9i h THR 364 Cb 1.27 1.17 0.00 0.00 -1.07 0.00 0.00 68.15 69.53 1s9i h THR 364 CO 0.12 0.00 0.00 0.59 -0.01 0.00 0.00 175.52 176.22 1s9i n ASN 365 N -2.93 3.07 -4.78 0.00 4.13 -0.79 -4.72 115.26 109.23 1s9i n ASN 365 Ca -0.01 -2.71 -0.37 0.00 1.68 0.00 0.00 54.58 53.17 1s9i n ASN 365 Cb 0.18 -0.39 -0.03 0.00 -1.54 0.00 0.00 39.78 38.01 1s9i n ASN 365 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 1s9i s HIS 366 N -2.26 3.14 0.38 3.10 2.46 -0.17 -4.89 115.29 117.06 1s9i s HIS 366 Ca 0.31 1.61 0.08 0.00 0.47 0.00 0.00 55.06 57.52 1s9i s HIS 366 Cb 0.24 -3.21 0.82 0.00 -0.13 0.00 0.00 32.58 30.30 1s9i s HIS 366 CO 0.08 -0.91 1.98 0.00 -2.47 0.00 0.00 174.74 173.41 1s9i h THR 367 N 2.10 1.00 -0.45 0.89 1.03 -1.90 -1.23 112.91 114.36 1s9i h THR 367 Ca -0.49 -0.23 0.00 0.00 -0.01 0.00 0.00 66.41 65.69 1s9i h THR 367 Cb 1.22 0.29 -0.02 0.00 -1.07 0.00 0.00 68.15 68.57 1s9i h THR 367 CO 0.62 0.12 0.29 0.15 -0.01 0.00 0.00 175.52 176.69 1s9i h PHE 368 N 0.66 0.57 -0.41 0.00 3.04 -1.92 -0.20 116.94 118.68 1s9i h PHE 368 Ca 0.28 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.21 1s9i h PHE 368 Cb 0.28 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 38.58 1s9i h PHE 368 CO -0.00 0.37 0.11 0.82 -2.02 0.00 0.00 178.31 177.60 1s9i h ILE 369 N 0.61 1.23 -0.26 1.41 1.08 -1.52 -0.75 117.51 119.30 1s9i h ILE 369 Ca 0.16 -0.76 -0.01 0.00 -0.39 0.00 0.00 64.86 63.86 1s9i h ILE 369 Cb -0.05 0.94 -0.01 0.00 -3.07 0.00 0.00 36.82 34.62 1s9i h ILE 369 CO -0.03 0.27 0.11 0.11 -0.69 0.00 0.00 178.15 177.92 1s9i h LYS 370 N 0.53 0.39 -0.67 2.37 1.57 -1.19 0.20 116.57 119.77 1s9i h LYS 370 Ca 0.13 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1s9i h LYS 370 Cb 0.29 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1s9i h LYS 370 CO -0.00 0.41 0.42 -0.09 -0.57 0.00 0.00 179.45 179.62 1s9i h ARG 371 N 0.28 0.89 0.00 3.15 2.43 -0.98 -1.97 114.38 118.18 1s9i h ARG 371 Ca 0.09 -0.07 -0.14 0.00 -0.81 0.00 0.00 59.98 59.06 1s9i h ARG 371 Cb 0.16 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1s9i h ARG 371 CO -0.01 0.61 -0.66 0.77 -1.51 0.00 0.00 179.97 179.18 1s9i h SER 372 N 0.92 0.00 0.30 -3.80 0.02 -0.55 -3.11 113.55 107.33 1s9i h SER 372 Ca 0.24 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 61.12 1s9i h SER 372 Cb -0.07 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1s9i h SER 372 CO -0.05 0.66 -0.33 -0.33 -1.14 0.00 0.00 176.83 175.64 1s9i h GLU 373 N 0.00 0.05 -0.02 3.45 5.08 0.18 -2.92 114.58 120.41 1s9i h GLU 373 Ca -0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1s9i h GLU 373 Cb 1.23 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1s9i h GLU 373 CO 0.09 0.38 -0.28 1.33 -1.00 0.00 0.00 179.01 179.53 1s9i n VAL 374 N -4.13 0.00 -2.31 3.13 0.24 -1.18 -4.98 118.33 109.10 1s9i n VAL 374 Ca -0.02 -0.36 -0.38 0.00 -2.04 0.00 0.00 64.34 61.54 1s9i n VAL 374 Cb 0.38 1.25 -0.02 0.00 -1.47 0.00 0.00 33.84 33.99 1s9i n VAL 374 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1s9i s GLU 375 N -1.92 3.95 -0.40 7.34 2.02 -1.10 -5.01 118.70 123.58 1s9i s GLU 375 Ca 0.16 1.78 -0.13 0.00 0.02 0.00 0.00 54.97 56.80 1s9i s GLU 375 Cb 0.15 -2.55 0.03 0.00 0.10 0.00 0.00 34.13 31.85 1s9i s GLU 375 CO 0.39 -0.39 0.26 -1.83 0.02 0.00 0.00 175.26 173.71 1s9i s GLU 376 N -2.48 2.89 -0.06 1.61 4.04 -1.26 -5.04 118.70 118.40 1s9i s GLU 376 Ca 0.60 -1.07 -0.01 0.00 0.04 0.00 0.00 54.97 54.53 1s9i s GLU 376 Cb -0.29 -3.87 0.03 0.00 0.02 0.00 0.00 34.13 30.02 1s9i s GLU 376 CO 0.36 -0.74 -0.01 0.08 -1.84 0.00 0.00 175.26 173.11 1s9i s VAL 377 N 1.61 0.37 -1.23 1.83 1.01 -1.26 -5.05 120.40 117.69 1s9i s VAL 377 Ca 0.03 0.07 -0.14 0.00 0.00 0.00 0.00 61.98 61.94 1s9i s VAL 377 Cb -0.19 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.65 1s9i s VAL 377 CO 0.08 0.23 2.28 -0.67 0.00 0.00 0.00 175.10 177.02 1s9i n ASP 378 N 4.73 4.66 -0.23 3.32 -0.08 -1.26 -4.69 116.55 123.01 1s9i n ASP 378 Ca -0.14 -2.66 -0.04 0.00 -1.51 0.00 0.00 54.79 50.44 1s9i n ASP 378 Cb 0.50 -1.41 0.13 0.00 2.34 0.00 0.00 41.12 42.68 1s9i n ASP 378 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1s9i h PHE 379 N 6.35 1.06 -0.65 -0.67 3.04 -1.96 0.27 116.94 124.37 1s9i h PHE 379 Ca 0.58 -0.08 0.03 0.00 3.98 0.00 0.00 57.97 62.48 1s9i h PHE 379 Cb 0.50 -0.32 -0.04 0.00 2.56 0.00 0.00 35.95 38.65 1s9i h PHE 379 CO 1.57 0.82 0.43 0.00 -2.02 0.00 0.00 178.31 179.10 1s9i h ALA 380 N 1.27 1.62 0.01 2.41 0.00 -1.85 -0.94 119.26 121.78 1s9i h ALA 380 Ca 0.24 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1s9i h ALA 380 Cb 0.21 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1s9i h ALA 380 CO -0.02 0.32 -0.00 0.78 0.00 0.00 0.00 179.25 180.33 1s9i h GLY 381 N 0.80 -0.01 0.80 0.00 0.00 -1.26 -2.48 103.07 100.91 1s9i h GLY 381 Ca 0.26 0.01 0.09 0.00 0.00 0.00 0.00 47.33 47.68 1s9i h GLY 381 CO -0.07 -0.01 0.55 -0.25 0.00 0.00 0.00 176.54 176.77 1s9i h TRP 382 N -0.60 0.90 0.30 5.60 7.01 -0.51 0.40 115.95 129.06 1s9i h TRP 382 Ca -0.00 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.01 1s9i h TRP 382 Cb 0.58 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 27.35 1s9i h TRP 382 CO 0.13 0.43 -0.15 -0.07 -2.79 0.00 0.00 178.44 175.99 1s9i h LEU 383 N 0.85 -0.35 -1.30 0.65 3.38 -1.14 -2.90 115.31 114.50 1s9i h LEU 383 Ca 0.39 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.27 1s9i h LEU 383 Cb 0.38 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1s9i h LEU 383 CO -0.16 -0.21 -0.32 0.00 0.09 0.00 0.00 178.44 177.85 1s9i h LYS 385 N 0.00 0.00 0.00 0.00 2.10 -0.79 -2.33 116.57 115.55 1s9i h LYS 385 Ca -0.00 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.58 1s9i h LYS 385 Cb 0.66 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.98 1s9i h LYS 385 CO 0.04 0.13 -1.02 0.25 -2.00 0.00 0.00 179.45 176.85 1s9i n THR 386 N -3.79 1.40 0.30 0.07 -2.24 -0.86 -4.68 114.28 104.48 1s9i n THR 386 Ca -0.02 0.12 0.19 0.00 -2.27 0.00 0.00 64.05 62.07 1s9i n THR 386 Cb 0.23 -2.11 0.88 0.00 -2.10 0.00 0.00 70.33 67.23 1s9i n THR 386 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1s9i h LEU 387 N -0.77 0.00 -2.45 3.22 6.46 -0.83 -3.48 115.31 117.46 1s9i h LEU 387 Ca -0.09 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.63 1s9i h LEU 387 Cb 0.89 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.82 1s9i h LEU 387 CO -0.06 0.00 -0.30 0.54 -0.62 0.00 0.00 178.44 178.01 1s9i n ARG 388 N -3.05 -1.77 0.00 1.25 1.74 -0.88 -5.03 116.66 108.91 1s9i n ARG 388 Ca -0.01 1.71 0.00 0.00 -0.77 0.00 0.00 57.85 58.78 1s9i n ARG 388 Cb 0.21 -5.43 0.00 0.00 -1.02 0.00 0.00 32.46 26.22 1s9i n ARG 388 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00