#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r1m s GLN 69 N 0.00 4.29 0.24 0.54 -1.52 -1.26 -5.00 119.66 116.94 1r1m s GLN 69 Ca 0.00 0.52 0.12 0.00 -1.95 0.00 0.00 55.36 54.05 1r1m s GLN 69 Cb 0.00 -3.39 -0.05 0.00 -0.22 0.00 0.00 33.01 29.35 1r1m s GLN 69 CO 0.00 0.26 -0.21 0.71 -0.25 0.00 0.00 175.29 175.80 1r1m s TYR 70 N 0.27 2.32 -0.03 0.91 4.12 -1.26 0.55 117.35 124.22 1r1m s TYR 70 Ca 0.27 -0.34 0.02 0.00 0.02 0.00 0.00 57.07 57.04 1r1m s TYR 70 Cb -0.16 -1.08 0.01 0.00 -1.52 0.00 0.00 41.96 39.22 1r1m s TYR 70 CO 0.12 0.61 -0.06 0.08 0.02 0.00 0.00 175.55 176.32 1r1m s VAL 71 N -2.10 0.63 -0.11 0.71 1.01 -0.12 -4.81 120.40 115.61 1r1m s VAL 71 Ca 0.26 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.03 1r1m s VAL 71 Cb -0.06 -0.60 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 1r1m s VAL 71 CO 0.13 0.22 -0.16 -1.81 0.00 0.00 0.00 175.10 173.48 1r1m s ASP 72 N 0.54 3.78 0.06 3.32 1.01 -1.26 -1.32 116.67 122.80 1r1m s ASP 72 Ca -0.08 -0.36 0.09 0.00 0.71 0.00 0.00 52.55 52.90 1r1m s ASP 72 Cb -0.11 -1.41 -0.03 0.00 1.01 0.00 0.00 42.92 42.38 1r1m s ASP 72 CO 0.01 0.20 -0.24 -1.61 0.21 0.00 0.00 175.17 173.73 1r1m s GLU 73 N 0.16 1.57 -0.14 8.23 2.02 0.50 -4.98 118.70 126.06 1r1m s GLU 73 Ca -0.09 -1.08 -0.01 0.00 0.02 0.00 0.00 54.97 53.81 1r1m s GLU 73 Cb -0.15 -1.77 0.03 0.00 0.10 0.00 0.00 34.13 32.34 1r1m s GLU 73 CO 0.05 0.45 -0.05 0.99 0.02 0.00 0.00 175.26 176.72 1r1m s THR 74 N -0.85 1.01 -0.38 3.63 2.01 -1.26 -0.29 115.64 119.51 1r1m s THR 74 Ca 0.10 -0.44 -0.11 0.00 0.31 0.00 0.00 61.69 61.55 1r1m s THR 74 Cb -0.10 -1.13 0.03 0.00 0.01 0.00 0.00 72.50 71.31 1r1m s THR 74 CO 0.03 0.22 0.21 -0.63 -0.69 0.00 0.00 174.62 173.75 1r1m s ILE 75 N 1.69 4.61 -0.33 1.82 1.09 0.26 -4.92 121.20 125.41 1r1m s ILE 75 Ca 0.03 -0.85 -0.16 0.00 -1.10 0.00 0.00 60.65 58.56 1r1m s ILE 75 Cb -0.14 -3.57 -0.01 0.00 -1.06 0.00 0.00 42.46 37.67 1r1m s ILE 75 CO -0.08 -0.24 0.40 -0.44 -0.10 0.00 0.00 174.94 174.48 1r1m s SER 76 N 1.56 6.22 -0.23 3.58 0.01 -1.26 -0.75 113.70 122.83 1r1m s SER 76 Ca 0.02 -0.10 -0.02 0.00 1.31 0.00 0.00 55.95 57.16 1r1m s SER 76 Cb -0.19 -2.22 0.02 0.00 0.21 0.00 0.00 66.02 63.84 1r1m s SER 76 CO 0.07 -0.35 -0.08 -0.76 0.41 0.00 0.00 173.24 172.53 1r1m s LEU 77 N 2.12 2.95 0.61 2.44 1.43 -0.43 -5.00 118.68 122.80 1r1m s LEU 77 Ca 0.14 -0.72 -0.18 0.00 -1.03 0.00 0.00 54.13 52.34 1r1m s LEU 77 Cb -0.16 -1.65 -0.03 0.00 0.03 0.00 0.00 46.19 44.38 1r1m s LEU 77 CO 0.12 -0.08 1.23 -0.94 0.23 0.00 0.00 176.35 176.91 1r1m s SER 78 N 1.36 5.01 0.45 2.29 1.04 -1.26 -1.00 113.70 121.58 1r1m s SER 78 Ca 0.02 2.45 0.13 0.00 0.48 0.00 0.00 55.95 59.03 1r1m s SER 78 Cb -0.15 -2.60 1.00 0.00 0.10 0.00 0.00 66.02 64.36 1r1m s SER 78 CO -0.06 -1.72 2.02 0.00 0.98 0.00 0.00 173.24 174.46 1r1m h ALA 79 N 0.76 1.72 0.06 5.32 0.00 -1.46 -1.32 119.26 124.34 1r1m h ALA 79 Ca -0.50 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1r1m h ALA 79 Cb 1.31 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1r1m h ALA 79 CO 0.54 0.21 -0.05 -0.22 0.00 0.00 0.00 179.25 179.74 1r1m h LYS 80 N 0.11 -0.11 -0.53 0.00 1.63 -1.79 0.39 116.57 116.26 1r1m h LYS 80 Ca 0.02 0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.78 1r1m h LYS 80 Cb 0.23 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 1r1m h LYS 80 CO 0.01 -0.07 0.13 1.15 -3.45 0.00 0.00 179.45 177.22 1r1m h THR 81 N -0.11 1.24 0.07 1.00 2.02 -1.79 0.24 112.91 115.58 1r1m h THR 81 Ca -0.00 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.30 1r1m h THR 81 Cb 0.10 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 1r1m h THR 81 CO -0.01 0.32 -0.03 -0.07 0.37 0.00 0.00 175.52 176.10 1r1m h LEU 82 N 0.75 -0.08 -1.33 2.58 3.38 -1.04 -3.40 115.31 116.17 1r1m h LEU 82 Ca 0.17 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1r1m h LEU 82 Cb 0.34 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1r1m h LEU 82 CO 0.00 0.41 0.00 0.49 0.09 0.00 0.00 178.44 179.44 1r1m n PHE 83 N -4.90 0.01 0.00 1.13 3.72 0.13 -0.67 117.46 116.88 1r1m n PHE 83 Ca -0.09 -0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.25 1r1m n PHE 83 Cb 0.26 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 1r1m n PHE 83 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1r1m n GLY 84 N 0.03 3.56 0.42 1.37 0.00 0.85 -0.47 105.19 110.95 1r1m n GLY 84 Ca 0.01 0.23 0.09 0.00 0.00 0.00 0.00 46.02 46.35 1r1m n GLY 84 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1r1m n PHE 85 N 10.99 0.00 -2.11 1.61 3.72 -1.26 -4.52 117.46 125.90 1r1m n PHE 85 Ca 0.00 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.11 1r1m n PHE 85 Cb 0.00 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 38.56 1r1m n PHE 85 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1r1m s ASP 86 N -1.97 6.00 -0.00 4.37 1.01 0.38 -5.02 116.67 121.43 1r1m s ASP 86 Ca 0.15 1.17 -0.24 0.00 0.71 0.00 0.00 52.55 54.33 1r1m s ASP 86 Cb 0.14 -2.22 -0.17 0.00 1.01 0.00 0.00 42.92 41.68 1r1m s ASP 86 CO 0.42 -0.93 1.21 0.50 0.21 0.00 0.00 175.17 176.58 1r1m h LYS 87 N -0.25 -0.26 0.00 8.23 3.64 -1.95 -3.43 116.57 122.55 1r1m h LYS 87 Ca -0.45 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 1r1m h LYS 87 Cb 1.21 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1r1m h LYS 87 CO 0.62 0.10 -0.33 -0.40 -2.27 0.00 0.00 179.45 177.17 1r1m n ASP 88 N -5.03 0.00 -4.59 4.20 5.68 -1.26 -4.90 116.55 110.64 1r1m n ASP 88 Ca -0.09 -1.66 -0.41 0.00 -0.50 0.00 0.00 54.79 52.13 1r1m n ASP 88 Cb 0.25 -0.13 -0.06 0.00 -1.14 0.00 0.00 41.12 40.03 1r1m n ASP 88 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1r1m s SER 89 N -0.66 6.50 0.05 -1.12 0.01 -1.26 -5.01 113.70 112.20 1r1m s SER 89 Ca 0.00 0.37 -0.31 0.00 1.31 0.00 0.00 55.95 57.32 1r1m s SER 89 Cb 0.00 -2.34 -0.07 0.00 0.21 0.00 0.00 66.02 63.82 1r1m s SER 89 CO 0.00 -0.54 1.45 -0.76 0.41 0.00 0.00 173.24 173.80 1r1m s LEU 90 N 2.70 4.34 0.61 2.44 1.43 -1.26 -4.35 118.68 124.59 1r1m s LEU 90 Ca 0.26 2.26 -0.18 0.00 -1.03 0.00 0.00 54.13 55.44 1r1m s LEU 90 Cb -0.15 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.48 1r1m s LEU 90 CO 0.13 -0.73 1.19 -0.13 0.23 0.00 0.00 176.35 177.03 1r1m s ARG 91 N 2.05 2.92 0.21 1.70 0.52 0.15 -4.83 118.95 121.67 1r1m s ARG 91 Ca 0.66 1.75 -0.09 0.00 -0.52 0.00 0.00 55.73 57.53 1r1m s ARG 91 Cb -0.35 -1.93 0.26 0.00 0.52 0.00 0.00 34.95 33.45 1r1m s ARG 91 CO 0.29 -1.23 1.78 0.00 0.02 0.00 0.00 175.30 176.16 1r1m h ALA 92 N 0.73 0.84 -0.31 2.13 0.00 -1.94 -1.23 119.26 119.49 1r1m h ALA 92 Ca -0.50 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1r1m h ALA 92 Cb 1.29 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 1r1m h ALA 92 CO 0.55 -0.08 0.05 0.93 0.00 0.00 0.00 179.25 180.70 1r1m h GLU 93 N 0.54 0.46 -0.35 0.00 3.07 -1.93 -1.41 114.58 114.97 1r1m h GLU 93 Ca 0.30 -0.07 -0.06 0.00 -0.50 0.00 0.00 59.36 59.03 1r1m h GLU 93 Cb 0.29 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.11 1r1m h GLU 93 CO -0.24 0.44 -0.00 0.00 -1.40 0.00 0.00 179.01 177.81 1r1m h ALA 94 N 1.62 0.47 -0.84 3.43 0.00 -1.51 -2.35 119.26 120.08 1r1m h ALA 94 Ca 0.11 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1r1m h ALA 94 Cb 0.21 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1r1m h ALA 94 CO -0.00 0.24 0.55 1.96 0.00 0.00 0.00 179.25 181.99 1r1m h GLN 95 N 0.43 1.11 -0.37 0.00 4.20 -0.55 -0.82 115.11 119.10 1r1m h GLN 95 Ca 0.10 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1r1m h GLN 95 Cb 0.46 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1r1m h GLN 95 CO 0.02 0.74 0.15 -0.44 -0.67 0.00 0.00 178.83 178.62 1r1m h ASP 96 N 1.14 0.51 -0.68 1.46 3.32 -1.04 -0.58 116.42 120.55 1r1m h ASP 96 Ca 0.31 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 57.11 1r1m h ASP 96 Cb -0.12 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 1r1m h ASP 96 CO -0.06 0.54 0.13 -1.13 -1.72 0.00 0.00 179.24 177.00 1r1m h ASN 97 N 0.45 1.06 0.23 6.45 -0.73 -0.95 -2.38 115.58 119.71 1r1m h ASN 97 Ca 0.12 -0.24 -0.11 0.00 1.87 0.00 0.00 56.30 57.94 1r1m h ASN 97 Cb 0.19 -0.28 -0.01 0.00 0.27 0.00 0.00 38.32 38.49 1r1m h ASN 97 CO -0.01 1.04 -0.43 -0.07 -0.37 0.00 0.00 177.43 177.59 1r1m h LEU 98 N 1.05 0.27 -0.36 0.34 3.38 -1.01 -1.91 115.31 117.07 1r1m h LEU 98 Ca 0.21 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1r1m h LEU 98 Cb 0.41 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1r1m h LEU 98 CO 0.01 0.67 0.04 0.50 0.09 0.00 0.00 178.44 179.75 1r1m h LYS 99 N 0.21 0.60 -0.84 1.13 3.64 -0.80 0.58 116.57 121.10 1r1m h LYS 99 Ca 0.02 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1r1m h LYS 99 Cb 0.85 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.56 1r1m h LYS 99 CO 0.07 0.69 0.54 0.28 -2.27 0.00 0.00 179.45 178.75 1r1m h VAL 100 N 0.43 1.22 -0.10 2.00 2.07 -1.24 -0.40 116.25 120.23 1r1m h VAL 100 Ca 0.11 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1r1m h VAL 100 Cb 0.39 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1r1m h VAL 100 CO 0.01 0.22 0.05 0.25 0.02 0.00 0.00 177.57 178.12 1r1m h LEU 101 N 1.15 0.14 -0.81 2.57 5.85 -1.00 -1.62 115.31 121.58 1r1m h LEU 101 Ca 0.31 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.96 1r1m h LEU 101 Cb -0.10 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 1r1m h LEU 101 CO -0.06 0.23 0.49 0.00 -0.34 0.00 0.00 178.44 178.76 1r1m h ALA 102 N 0.91 1.11 -0.73 1.25 0.00 -0.47 -0.39 119.26 120.95 1r1m h ALA 102 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1r1m h ALA 102 Cb 0.13 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1r1m h ALA 102 CO -0.00 0.21 0.43 1.96 0.00 0.00 0.00 179.25 181.84 1r1m h GLN 103 N 0.89 1.00 -0.34 0.00 4.20 -0.78 -1.75 115.11 118.34 1r1m h GLN 103 Ca 0.36 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.95 1r1m h GLN 103 Cb 0.19 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1r1m h GLN 103 CO -0.18 0.72 0.12 -0.09 -0.67 0.00 0.00 178.83 178.74 1r1m h ARG 104 N 1.00 0.51 0.00 1.46 2.43 -0.43 -2.61 114.38 116.74 1r1m h ARG 104 Ca 0.26 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1r1m h ARG 104 Cb -0.01 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1r1m h ARG 104 CO -0.05 0.52 -0.04 -0.07 -1.51 0.00 0.00 179.97 178.82 1r1m h LEU 105 N 0.39 0.00 -0.06 3.80 3.38 -0.73 -0.01 115.31 122.07 1r1m h LEU 105 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1r1m h LEU 105 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1r1m h LEU 105 CO -0.01 0.04 0.00 -1.54 0.09 0.00 0.00 178.44 177.03 1r1m n SER 106 N -4.14 0.16 -0.59 -0.43 3.41 -0.69 -2.25 113.62 109.09 1r1m n SER 106 Ca -0.03 0.52 0.07 0.00 -0.26 0.00 0.00 58.87 59.17 1r1m n SER 106 Cb 0.13 -0.56 0.18 0.00 -0.26 0.00 0.00 64.21 63.69 1r1m n SER 106 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1r1m n ARG 107 N -1.66 2.71 -4.55 4.33 5.12 -0.05 -5.00 116.66 117.57 1r1m n ARG 107 Ca 0.05 -2.37 -0.30 0.00 -1.93 0.00 0.00 57.85 53.30 1r1m n ARG 107 Cb 0.29 -1.50 -0.13 0.00 -1.16 0.00 0.00 32.46 29.96 1r1m n ARG 107 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1r1m s THR 108 N -1.98 2.49 -1.45 0.55 2.01 -0.95 -5.03 115.64 111.27 1r1m s THR 108 Ca 0.29 -1.49 -0.13 0.00 0.31 0.00 0.00 61.69 60.67 1r1m s THR 108 Cb 0.22 -2.07 -0.00 0.00 0.01 0.00 0.00 72.50 70.65 1r1m s THR 108 CO 0.09 0.21 2.39 -3.20 -0.69 0.00 0.00 174.62 173.43 1r1m n ASN 109 N 1.22 5.02 -4.83 3.53 4.05 -1.26 -4.95 115.26 118.04 1r1m n ASN 109 Ca -0.17 -2.75 -0.32 0.00 0.45 0.00 0.00 54.58 51.79 1r1m n ASN 109 Cb 0.52 -1.59 -0.04 0.00 1.23 0.00 0.00 39.78 39.90 1r1m n ASN 109 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 1r1m s ILE 110 N 3.05 4.45 -0.07 -1.44 -4.36 -1.26 -1.05 121.20 120.52 1r1m s ILE 110 Ca 0.53 1.27 -0.04 0.00 -0.26 0.00 0.00 60.65 62.15 1r1m s ILE 110 Cb 0.15 -3.67 -0.03 0.00 1.25 0.00 0.00 42.46 40.16 1r1m s ILE 110 CO -0.07 -0.58 -0.09 1.67 0.24 0.00 0.00 174.94 176.11 1r1m n GLN 111 N -1.35 0.16 -3.87 0.37 7.27 0.43 -4.87 117.38 115.52 1r1m n GLN 111 Ca 0.07 0.07 -0.11 0.00 0.07 0.00 0.00 57.00 57.10 1r1m n GLN 111 Cb 0.54 -0.77 -0.10 0.00 2.41 0.00 0.00 30.24 32.33 1r1m n GLN 111 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 1r1m s SER 112 N -5.65 0.03 -0.33 1.69 1.04 -1.04 -4.81 113.70 104.62 1r1m s SER 112 Ca -0.10 -0.22 -0.00 0.00 0.48 0.00 0.00 55.95 56.11 1r1m s SER 112 Cb 0.04 0.20 0.11 0.00 0.10 0.00 0.00 66.02 66.47 1r1m s SER 112 CO 0.13 -0.37 0.12 -0.69 0.98 0.00 0.00 173.24 173.41 1r1m s VAL 113 N -1.40 0.97 -0.32 5.02 1.01 -0.48 -1.56 120.40 123.63 1r1m s VAL 113 Ca -0.15 -1.63 -0.10 0.00 0.00 0.00 0.00 61.98 60.10 1r1m s VAL 113 Cb -0.08 -1.72 -0.00 0.00 0.00 0.00 0.00 36.38 34.58 1r1m s VAL 113 CO 0.02 -0.72 0.17 -0.60 0.00 0.00 0.00 175.10 173.96 1r1m s ARG 114 N 1.37 3.30 -0.21 2.72 6.06 0.38 -1.72 118.95 130.85 1r1m s ARG 114 Ca 0.11 -0.75 -0.16 0.00 -2.50 0.00 0.00 55.73 52.44 1r1m s ARG 114 Cb -0.19 -3.61 -0.04 0.00 0.06 0.00 0.00 34.95 31.17 1r1m s ARG 114 CO -0.20 -0.45 0.40 0.08 -2.50 0.00 0.00 175.30 172.63 1r1m s VAL 115 N 1.62 5.19 -0.12 7.11 1.01 0.06 -0.40 120.40 134.88 1r1m s VAL 115 Ca 0.04 0.70 0.02 0.00 0.00 0.00 0.00 61.98 62.74 1r1m s VAL 115 Cb -0.17 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1r1m s VAL 115 CO 0.07 0.24 -0.17 -1.61 0.00 0.00 0.00 175.10 173.62 1r1m s GLU 116 N 1.41 3.23 -0.14 2.72 2.02 0.98 -1.04 118.70 127.88 1r1m s GLU 116 Ca 0.19 -0.76 -0.09 0.00 0.02 0.00 0.00 54.97 54.33 1r1m s GLU 116 Cb -0.15 -2.50 -0.05 0.00 0.10 0.00 0.00 34.13 31.54 1r1m s GLU 116 CO 0.08 0.22 0.16 0.20 0.02 0.00 0.00 175.26 175.94 1r1m s GLY 117 N 0.30 2.14 0.07 -1.39 0.00 -0.23 -0.37 107.32 107.84 1r1m s GLY 117 Ca -0.13 -0.62 0.06 0.00 0.00 0.00 0.00 44.72 44.03 1r1m s GLY 117 CO 0.07 -0.10 -0.17 0.30 0.00 0.00 0.00 173.10 173.20 1r1m s HIS 118 N -0.42 1.44 0.27 1.90 3.76 0.11 -0.92 115.29 121.44 1r1m s HIS 118 Ca 0.13 -0.41 0.02 0.00 -0.15 0.00 0.00 55.06 54.65 1r1m s HIS 118 Cb -0.12 -0.82 -0.05 0.00 1.11 0.00 0.00 32.58 32.70 1r1m s HIS 118 CO 0.02 0.10 0.08 0.95 -0.85 0.00 0.00 174.74 175.04 1r1m s THR 119 N -1.09 0.77 0.65 1.30 -4.23 -0.06 -2.26 115.64 110.71 1r1m s THR 119 Ca 0.02 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.47 1r1m s THR 119 Cb -0.09 -2.65 0.14 0.00 1.34 0.00 0.00 72.50 71.23 1r1m s THR 119 CO 0.02 -0.03 0.88 -0.90 -0.54 0.00 0.00 174.62 174.05 1r1m n ASP 120 N -0.52 0.55 0.00 3.99 3.85 -1.22 -4.15 116.55 119.05 1r1m n ASP 120 Ca -0.01 -1.61 0.14 0.00 -0.71 0.00 0.00 54.79 52.60 1r1m n ASP 120 Cb 0.66 -0.63 0.79 0.00 -1.35 0.00 0.00 41.12 40.60 1r1m n ASP 120 CO 0.00 0.00 0.00 2.22 -1.01 0.00 0.00 177.20 178.41 1r1m n PHE 121 N -2.94 0.00 -0.53 2.11 -0.00 -1.26 -4.45 117.46 110.38 1r1m n PHE 121 Ca 0.13 0.00 -0.06 0.00 -0.00 0.00 0.00 57.45 57.51 1r1m n PHE 121 Cb 0.44 -0.13 -0.09 0.00 -0.00 0.00 0.00 39.48 39.70 1r1m n PHE 121 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.76 175.43 1r1m n MET 122 N -1.13 1.07 -3.60 3.97 0.00 -1.26 -4.74 117.12 111.43 1r1m n MET 122 Ca 0.18 -0.51 -0.04 0.00 0.00 0.00 0.00 57.70 57.33 1r1m n MET 122 Cb 0.16 -1.72 -0.02 0.00 0.00 0.00 0.00 33.22 31.63 1r1m n MET 122 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1r1m s GLY 123 N 2.39 -0.28 0.82 3.03 0.00 -1.26 -5.05 107.32 106.98 1r1m s GLY 123 Ca 0.34 1.66 -0.11 0.00 0.00 0.00 0.00 44.72 46.61 1r1m s GLY 123 CO 0.00 0.57 1.09 -1.35 0.00 0.00 0.00 173.10 173.41 1r1m s SER 124 N -2.10 4.09 0.17 1.64 1.04 -1.26 -4.74 113.70 112.54 1r1m s SER 124 Ca 0.09 1.65 -0.15 0.00 0.48 0.00 0.00 55.95 58.02 1r1m s SER 124 Cb -0.01 -2.35 0.14 0.00 0.10 0.00 0.00 66.02 63.90 1r1m s SER 124 CO -0.05 -2.27 1.71 0.44 0.98 0.00 0.00 173.24 174.05 1r1m h ASP 125 N -1.29 -0.08 -0.07 7.02 5.19 -1.99 0.40 116.42 125.60 1r1m h ASP 125 Ca -0.46 0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 56.03 1r1m h ASP 125 Cb 1.25 0.14 -0.00 0.00 0.18 0.00 0.00 39.33 40.90 1r1m h ASP 125 CO 0.53 -0.01 0.04 0.50 -3.12 0.00 0.00 179.24 177.19 1r1m h LYS 126 N 0.16 0.09 -0.19 3.56 3.64 -1.99 -0.64 116.57 121.20 1r1m h LYS 126 Ca 0.21 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1r1m h LYS 126 Cb 0.29 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1r1m h LYS 126 CO -0.32 0.11 0.11 -0.92 -2.27 0.00 0.00 179.45 176.17 1r1m h TYR 127 N 0.05 0.25 -0.73 1.91 3.20 -1.84 -1.85 116.97 117.97 1r1m h TYR 127 Ca 0.02 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.84 1r1m h TYR 127 Cb 0.04 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 1r1m h TYR 127 CO -0.06 0.21 0.25 -0.91 -1.64 0.00 0.00 178.16 176.02 1r1m h ASN 128 N 0.22 1.04 -0.50 -2.11 2.35 -0.84 -1.44 115.58 114.29 1r1m h ASN 128 Ca 0.07 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.56 1r1m h ASN 128 Cb 0.03 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.12 1r1m h ASN 128 CO -0.01 0.95 0.06 -0.61 -1.65 0.00 0.00 177.43 176.17 1r1m h GLN 129 N 1.06 0.85 -0.28 0.81 -0.00 -0.99 -0.74 115.11 115.83 1r1m h GLN 129 Ca 0.24 -0.24 -0.06 0.00 -0.00 0.00 0.00 58.65 58.59 1r1m h GLN 129 Cb 0.27 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.65 1r1m h GLN 129 CO -0.01 0.86 -0.07 0.00 0.00 0.00 0.00 178.83 179.61 1r1m h ALA 130 N 0.96 0.38 -0.22 3.38 0.00 -1.20 -1.03 119.26 121.53 1r1m h ALA 130 Ca 0.15 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1r1m h ALA 130 Cb 0.43 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1r1m h ALA 130 CO 0.01 0.19 0.07 1.25 0.00 0.00 0.00 179.25 180.78 1r1m h LEU 131 N 0.29 0.32 -1.13 0.00 5.85 -1.23 -1.64 115.31 117.77 1r1m h LEU 131 Ca 0.07 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.52 1r1m h LEU 131 Cb 0.54 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1r1m h LEU 131 CO 0.03 0.44 -0.10 0.77 -0.34 0.00 0.00 178.44 179.24 1r1m h SER 132 N 0.19 0.47 -0.37 1.25 4.64 -1.12 -1.08 113.55 117.53 1r1m h SER 132 Ca 0.07 -0.11 -0.15 0.00 -0.47 0.00 0.00 61.79 61.13 1r1m h SER 132 Cb 0.23 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 1r1m h SER 132 CO -0.00 0.61 -0.34 -0.08 -0.87 0.00 0.00 176.83 176.15 1r1m h GLU 133 N 0.46 0.89 -0.36 4.77 4.81 -1.02 -0.77 114.58 123.37 1r1m h GLU 133 Ca 0.09 -0.46 -0.02 0.00 -0.13 0.00 0.00 59.36 58.84 1r1m h GLU 133 Cb 0.46 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 1r1m h GLU 133 CO 0.03 1.11 0.15 -0.09 -0.73 0.00 0.00 179.01 179.48 1r1m h ARG 134 N 0.70 0.53 -0.58 1.92 9.65 -1.00 0.83 114.38 126.43 1r1m h ARG 134 Ca 0.06 -0.09 -0.07 0.00 -1.10 0.00 0.00 59.98 58.79 1r1m h ARG 134 Cb 0.93 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.40 1r1m h ARG 134 CO 0.09 0.50 0.08 0.00 2.80 0.00 0.00 179.97 183.44 1r1m h ARG 135 N 0.43 0.93 -0.45 0.20 3.08 -1.13 -0.28 114.38 117.16 1r1m h ARG 135 Ca 0.12 -0.23 -0.09 0.00 0.07 0.00 0.00 59.98 59.85 1r1m h ARG 135 Cb 0.16 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1r1m h ARG 135 CO -0.01 0.87 -0.08 0.00 -1.07 0.00 0.00 179.97 179.68 1r1m h ALA 136 N 1.21 0.61 -0.55 0.04 0.00 -0.89 -2.53 119.26 117.14 1r1m h ALA 136 Ca 0.18 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1r1m h ALA 136 Cb 0.40 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1r1m h ALA 136 CO 0.01 0.48 0.33 -0.92 0.00 0.00 0.00 179.25 179.14 1r1m h TYR 137 N 0.68 0.74 -0.95 0.00 3.20 -0.43 0.40 116.97 120.60 1r1m h TYR 137 Ca 0.12 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 1r1m h TYR 137 Cb 0.61 -0.24 -0.05 0.00 1.54 0.00 0.00 36.73 38.59 1r1m h TYR 137 CO 0.05 0.51 0.58 0.28 -1.64 0.00 0.00 178.16 177.94 1r1m h VAL 138 N 0.74 1.26 -0.23 1.81 2.07 -0.94 0.40 116.25 121.36 1r1m h VAL 138 Ca 0.20 -0.55 -0.12 0.00 0.82 0.00 0.00 66.70 67.05 1r1m h VAL 138 Cb -0.00 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 29.68 1r1m h VAL 138 CO -0.04 0.27 -0.30 0.58 0.02 0.00 0.00 177.57 178.10 1r1m h VAL 139 N 1.31 1.32 -0.71 2.57 2.07 -1.12 -1.89 116.25 119.79 1r1m h VAL 139 Ca 0.34 -1.49 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 1r1m h VAL 139 Cb -0.07 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1r1m h VAL 139 CO -0.07 0.47 0.33 0.00 0.02 0.00 0.00 177.57 178.33 1r1m h ALA 140 N 0.65 0.91 -0.44 1.67 0.00 -0.51 -1.93 119.26 119.61 1r1m h ALA 140 Ca 0.03 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1r1m h ALA 140 Cb 0.88 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1r1m h ALA 140 CO 0.07 0.48 0.11 -0.97 0.00 0.00 0.00 179.25 178.94 1r1m h ASN 141 N 0.99 0.60 -0.43 0.00 -0.73 -0.14 -1.08 115.58 114.80 1r1m h ASN 141 Ca 0.24 -0.09 -0.06 0.00 1.87 0.00 0.00 56.30 58.26 1r1m h ASN 141 Cb 0.13 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 38.54 1r1m h ASN 141 CO -0.03 0.60 0.05 -1.13 -0.37 0.00 0.00 177.43 176.55 1r1m h ASN 142 N 0.64 0.70 -0.77 1.15 -0.73 -0.76 -0.37 115.58 115.44 1r1m h ASN 142 Ca 0.15 -0.27 -0.01 0.00 1.87 0.00 0.00 56.30 58.03 1r1m h ASN 142 Cb 0.24 -0.19 -0.04 0.00 0.27 0.00 0.00 38.32 38.60 1r1m h ASN 142 CO -0.00 0.80 0.44 -0.07 -0.37 0.00 0.00 177.43 178.23 1r1m h LEU 143 N 0.58 0.95 -0.68 0.34 3.38 -0.91 -1.33 115.31 117.65 1r1m h LEU 143 Ca 0.13 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1r1m h LEU 143 Cb 0.41 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1r1m h LEU 143 CO 0.01 0.76 0.21 0.58 0.09 0.00 0.00 178.44 180.10 1r1m h VAL 144 N 1.07 1.25 0.00 1.22 2.07 -1.01 -1.20 116.25 119.65 1r1m h VAL 144 Ca 0.27 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.92 1r1m h VAL 144 Cb 0.01 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1r1m h VAL 144 CO -0.05 0.34 0.00 0.77 0.02 0.00 0.00 177.57 178.65 1r1m h SER 145 N 0.99 0.00 -0.48 0.57 4.64 -0.35 -1.88 113.55 117.04 1r1m h SER 145 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1r1m h SER 145 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1r1m h SER 145 CO -0.01 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.54 1r1m n ASN 146 N -3.07 4.59 0.00 4.97 3.02 -0.57 -4.97 115.26 119.23 1r1m n ASN 146 Ca -0.01 -2.70 0.00 0.00 -0.03 0.00 0.00 54.58 51.83 1r1m n ASN 146 Cb 0.18 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 1r1m n ASN 146 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1r1m n GLY 147 N 0.44 2.42 3.69 7.41 0.00 -0.71 -4.43 105.19 114.01 1r1m n GLY 147 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1r1m n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r1m s VAL 148 N -2.31 3.07 0.15 1.61 1.01 -0.55 -4.91 120.40 118.47 1r1m s VAL 148 Ca 0.00 0.54 -0.33 0.00 0.00 0.00 0.00 61.98 62.19 1r1m s VAL 148 Cb 0.00 -3.34 -0.12 0.00 0.00 0.00 0.00 36.38 32.91 1r1m s VAL 148 CO 0.00 0.00 1.72 -2.65 0.00 0.00 0.00 175.10 174.17 1r1m n PRO 149 N 5.48 2.54 0.07 2.72 -0.02 -1.26 -4.24 135.00 140.30 1r1m n PRO 149 Ca 0.15 0.92 0.10 0.00 -2.02 0.00 0.00 63.50 62.65 1r1m n PRO 149 Cb 0.41 -2.76 0.56 0.00 -0.02 0.00 0.00 33.50 31.69 1r1m n PRO 149 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1r1m h VAL 150 N 4.08 0.96 -0.33 -1.45 2.07 -1.94 -2.19 116.25 117.46 1r1m h VAL 150 Ca -0.45 -0.08 0.09 0.00 0.82 0.00 0.00 66.70 67.08 1r1m h VAL 150 Cb 1.23 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1r1m h VAL 150 CO 0.93 0.04 0.24 0.77 0.02 0.00 0.00 177.57 179.57 1r1m h SER 151 N 0.24 0.02 -0.02 0.57 4.64 -2.02 -2.96 113.55 114.03 1r1m h SER 151 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1r1m h SER 151 Cb 0.26 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1r1m h SER 151 CO -0.03 0.01 -0.06 0.54 -0.87 0.00 0.00 176.83 176.42 1r1m n ARG 152 N -4.44 1.20 -4.00 4.77 1.74 -0.83 -5.02 116.66 110.07 1r1m n ARG 152 Ca 0.05 -1.22 -0.29 0.00 -0.77 0.00 0.00 57.85 55.61 1r1m n ARG 152 Cb 0.40 -1.26 -0.05 0.00 -1.02 0.00 0.00 32.46 30.53 1r1m n ARG 152 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1r1m s ILE 153 N -1.31 4.88 0.07 0.55 2.07 -1.12 -1.38 121.20 124.95 1r1m s ILE 153 Ca 0.16 -0.71 -0.09 0.00 -1.41 0.00 0.00 60.65 58.60 1r1m s ILE 153 Cb 0.12 -3.41 0.00 0.00 0.13 0.00 0.00 42.46 39.30 1r1m s ILE 153 CO 0.22 0.05 0.19 -0.94 -1.91 0.00 0.00 174.94 172.56 1r1m s SER 154 N -2.68 0.09 -0.07 4.50 1.04 -0.70 -4.97 113.70 110.91 1r1m s SER 154 Ca 0.32 -0.56 -0.02 0.00 0.48 0.00 0.00 55.95 56.17 1r1m s SER 154 Cb -0.12 0.33 0.03 0.00 0.10 0.00 0.00 66.02 66.36 1r1m s SER 154 CO 0.25 -0.68 0.04 0.00 0.98 0.00 0.00 173.24 173.83 1r1m s ALA 155 N -3.46 0.46 0.08 5.32 0.00 -1.26 -0.76 121.76 122.13 1r1m s ALA 155 Ca 0.02 -0.01 0.07 0.00 0.00 0.00 0.00 51.96 52.04 1r1m s ALA 155 Cb 0.03 -0.72 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 1r1m s ALA 155 CO -0.09 -0.56 -0.18 0.14 0.00 0.00 0.00 175.76 175.07 1r1m s VAL 156 N 2.08 1.46 -0.32 0.00 -7.23 -0.20 -4.83 120.40 111.36 1r1m s VAL 156 Ca 0.05 -1.37 -0.10 0.00 -1.81 0.00 0.00 61.98 58.75 1r1m s VAL 156 Cb -0.13 -1.34 0.00 0.00 0.56 0.00 0.00 36.38 35.48 1r1m s VAL 156 CO -0.05 -0.07 0.16 -0.83 -0.31 0.00 0.00 175.10 174.00 1r1m s GLY 157 N -1.68 1.87 0.00 2.32 0.00 -1.26 -1.06 107.32 107.51 1r1m s GLY 157 Ca 0.04 -1.47 0.24 0.00 0.00 0.00 0.00 44.72 43.53 1r1m s GLY 157 CO 0.03 0.72 1.40 1.04 0.00 0.00 0.00 173.10 176.30 1r1m n LEU 158 N 4.97 2.75 0.00 0.66 4.77 -0.10 -4.75 117.00 125.31 1r1m n LEU 158 Ca -0.13 -1.02 0.00 0.00 -0.03 0.00 0.00 56.01 54.83 1r1m n LEU 158 Cb 0.48 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 1r1m n LEU 158 CO 0.34 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 1r1m n GLY 159 N 1.34 2.68 1.14 -0.72 0.00 -1.21 -1.49 105.19 106.93 1r1m n GLY 159 Ca 0.16 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.16 1r1m n GLY 159 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1r1m n GLU 160 N 14.00 2.45 -0.02 1.61 0.00 -1.26 -0.88 120.64 136.54 1r1m n GLU 160 Ca 0.00 -2.24 0.23 0.00 0.00 0.00 0.00 57.16 55.16 1r1m n GLU 160 Cb 0.00 -1.50 0.72 0.00 0.00 0.00 0.00 31.44 30.67 1r1m n GLU 160 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1r1m h SER 161 N 3.81 0.00 0.00 -1.84 4.64 -1.58 -1.27 113.55 117.30 1r1m h SER 161 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1r1m h SER 161 Cb 0.86 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.94 1r1m h SER 161 CO 0.00 0.00 -0.21 0.00 -0.87 0.00 0.00 176.83 175.75 1r1m n GLN 162 N -4.02 1.30 -1.72 4.77 6.02 -1.26 -5.06 117.38 117.42 1r1m n GLN 162 Ca 0.12 -2.75 -0.43 0.00 -0.01 0.00 0.00 57.00 53.93 1r1m n GLN 162 Cb 0.75 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.53 1r1m n GLN 162 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1r1m n ALA 163 N -1.23 1.96 0.18 -1.58 0.00 -0.48 -4.92 120.51 114.44 1r1m n ALA 163 Ca 0.16 0.38 0.02 0.00 0.00 0.00 0.00 53.44 54.00 1r1m n ALA 163 Cb 0.67 -2.38 -0.02 0.00 0.00 0.00 0.00 19.45 17.72 1r1m n ALA 163 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1r1m n GLN 164 N 1.73 5.65 0.00 0.00 1.13 -1.26 -4.77 117.38 119.86 1r1m n GLN 164 Ca 0.08 -0.00 0.11 0.00 -1.94 0.00 0.00 57.00 55.25 1r1m n GLN 164 Cb 0.35 -0.69 0.04 0.00 0.11 0.00 0.00 30.24 30.05 1r1m n GLN 164 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 1r1m n MET 165 N -1.10 0.42 0.12 -1.09 2.81 -1.26 -4.64 117.12 112.37 1r1m n MET 165 Ca 0.01 -0.32 -0.13 0.00 -1.81 0.00 0.00 57.70 55.44 1r1m n MET 165 Cb 0.06 -1.49 -0.06 0.00 -0.71 0.00 0.00 33.22 31.02 1r1m n MET 165 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1r1m h THR 166 N 0.78 0.29 0.31 2.03 2.02 -1.96 -1.12 112.91 115.26 1r1m h THR 166 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1r1m h THR 166 Cb 0.57 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1r1m h THR 166 CO 0.00 0.00 -0.15 -0.61 0.37 0.00 0.00 175.52 175.13 1r1m h GLN 167 N -0.57 -0.40 -0.84 6.66 5.75 -1.97 -0.95 115.11 122.79 1r1m h GLN 167 Ca 0.03 0.03 0.13 0.00 -0.15 0.00 0.00 58.65 58.69 1r1m h GLN 167 Cb 0.60 0.09 -0.09 0.00 1.07 0.00 0.00 27.48 29.15 1r1m h GLN 167 CO -0.19 -0.09 0.44 -0.39 -2.65 0.00 0.00 178.83 175.95 1r1m h VAL 168 N -0.73 0.78 -0.13 2.39 -1.51 -1.83 -0.50 116.25 114.71 1r1m h VAL 168 Ca -0.04 -0.23 -0.11 0.00 -1.23 0.00 0.00 66.70 65.09 1r1m h VAL 168 Cb 0.50 0.06 0.00 0.00 -2.13 0.00 0.00 31.29 29.71 1r1m h VAL 168 CO 0.07 0.12 -0.36 0.00 -1.23 0.00 0.00 177.57 176.17 1r1m h GLU 170 N 0.08 1.14 0.00 0.00 4.39 -0.75 -0.14 114.58 119.30 1r1m h GLU 170 Ca -0.01 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 1r1m h GLU 170 Cb 0.97 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 1r1m h GLU 170 CO 0.08 0.76 -0.00 0.00 -1.16 0.00 0.00 179.01 178.68 1r1m h ALA 171 N 1.45 -0.00 -0.63 3.43 0.00 -1.03 -2.13 119.26 120.35 1r1m h ALA 171 Ca 0.35 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 55.17 1r1m h ALA 171 Cb -0.05 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 1r1m h ALA 171 CO -0.09 -0.32 0.25 1.49 0.00 0.00 0.00 179.25 180.58 1r1m h GLU 172 N -0.37 0.42 -0.05 0.00 4.81 -0.49 -2.26 114.58 116.64 1r1m h GLU 172 Ca -0.00 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1r1m h GLU 172 Cb 0.37 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1r1m h GLU 172 CO 0.00 0.28 -0.05 -0.24 -0.73 0.00 0.00 179.01 178.27 1r1m h VAL 173 N 0.43 1.38 -0.09 0.32 3.04 -1.04 -2.99 116.25 117.30 1r1m h VAL 173 Ca 0.32 -1.20 0.03 0.00 -1.01 0.00 0.00 66.70 64.84 1r1m h VAL 173 Cb 0.39 2.08 -0.00 0.00 -2.01 0.00 0.00 31.29 31.74 1r1m h VAL 173 CO -0.31 0.33 0.17 0.00 -1.01 0.00 0.00 177.57 176.75 1r1m h ALA 174 N 0.54 1.50 0.00 3.17 0.00 -1.24 -0.23 119.26 123.00 1r1m h ALA 174 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r1m h ALA 174 Cb 0.55 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1r1m h ALA 174 CO 0.01 -0.21 0.00 1.17 0.00 0.00 0.00 179.25 180.22 1r1m n LYS 175 N -3.46 0.59 -2.97 0.00 4.81 -0.86 -3.77 118.16 112.50 1r1m n LYS 175 Ca -0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.36 1r1m n LYS 175 Cb 0.26 -1.27 -0.02 0.00 0.02 0.00 0.00 35.03 34.02 1r1m n LYS 175 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1r1m s LEU 176 N -0.07 -0.91 -0.02 3.14 1.43 -0.10 -5.01 118.68 117.13 1r1m s LEU 176 Ca 0.00 -1.79 0.05 0.00 -1.03 0.00 0.00 54.13 51.36 1r1m s LEU 176 Cb 0.00 1.45 0.12 0.00 0.03 0.00 0.00 46.19 47.78 1r1m s LEU 176 CO 0.00 -0.10 1.09 0.61 0.23 0.00 0.00 176.35 178.17 1r1m n GLY 177 N 3.25 3.24 3.32 -3.19 0.00 -1.25 -4.63 105.19 105.93 1r1m n GLY 177 Ca 0.18 -0.26 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 1r1m n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r1m n ALA 178 N -0.42 2.60 -1.36 4.61 0.00 -1.26 -4.01 120.51 120.66 1r1m n ALA 178 Ca 0.05 -3.18 -0.13 0.00 0.00 0.00 0.00 53.44 50.19 1r1m n ALA 178 Cb 0.36 -3.57 -0.05 0.00 0.00 0.00 0.00 19.45 16.19 1r1m n ALA 178 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1r1m n LYS 179 N 7.60 -1.29 -0.60 0.00 5.02 -1.26 -4.76 118.16 122.87 1r1m n LYS 179 Ca 0.47 0.75 -0.43 0.00 -2.02 0.00 0.00 58.31 57.09 1r1m n LYS 179 Cb 0.43 -4.99 -0.10 0.00 -0.02 0.00 0.00 35.03 30.35 1r1m n LYS 179 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1r1m n VAL 180 N -1.84 0.35 0.00 -0.18 0.31 -1.26 -4.37 118.33 111.34 1r1m n VAL 180 Ca -0.13 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 63.91 1r1m n VAL 180 Cb 0.42 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 1r1m n VAL 180 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1r1m n SER 181 N 8.51 0.00 0.00 4.52 7.64 -1.26 -3.92 113.62 129.11 1r1m n SER 181 Ca 0.45 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.33 1r1m n SER 181 Cb 0.40 -0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 1r1m n SER 181 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1r1m n LYS 182 N -0.74 0.00 -0.10 1.43 5.02 -1.26 -4.07 118.16 118.44 1r1m n LYS 182 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 1r1m n LYS 182 Cb 0.00 -1.92 -0.15 0.00 -0.02 0.00 0.00 35.03 32.94 1r1m n LYS 182 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1r1m n ALA 183 N 0.33 1.47 0.24 7.82 0.00 -1.26 -4.05 120.51 125.06 1r1m n ALA 183 Ca 0.00 -1.23 0.12 0.00 0.00 0.00 0.00 53.44 52.32 1r1m n ALA 183 Cb 0.00 -0.22 0.49 0.00 0.00 0.00 0.00 19.45 19.72 1r1m n ALA 183 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1r1m h LYS 184 N 0.00 0.00 -0.50 0.00 3.64 -1.73 -2.17 116.57 115.81 1r1m h LYS 184 Ca -0.53 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.77 1r1m h LYS 184 Cb 2.16 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.95 1r1m h LYS 184 CO 0.01 0.16 -0.01 0.87 -2.27 0.00 0.00 179.45 178.21 1r1m h LYS 185 N 0.00 0.84 -0.08 1.90 1.57 -1.70 0.29 116.57 119.39 1r1m h LYS 185 Ca -0.00 -0.24 -0.23 0.00 -1.87 0.00 0.00 60.65 58.31 1r1m h LYS 185 Cb 0.71 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.94 1r1m h LYS 185 CO 0.02 0.85 -0.86 -0.09 -0.57 0.00 0.00 179.45 178.80 1r1m h ARG 186 N 0.78 0.65 -0.36 3.15 2.43 -1.59 -1.22 114.38 118.22 1r1m h ARG 186 Ca 0.15 -0.60 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1r1m h ARG 186 Cb 0.48 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.16 1r1m h ARG 186 CO 0.02 1.21 0.23 0.93 -1.51 0.00 0.00 179.97 180.85 1r1m h GLU 187 N 0.42 0.49 -0.79 0.20 5.08 -1.06 -0.74 114.58 118.18 1r1m h GLU 187 Ca -0.07 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1r1m h GLU 187 Cb 1.49 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.60 1r1m h GLU 187 CO 0.17 0.35 0.51 0.00 -1.00 0.00 0.00 179.01 179.04 1r1m h ALA 188 N 1.11 1.42 0.06 3.43 0.00 -0.36 -1.33 119.26 123.59 1r1m h ALA 188 Ca 0.13 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1r1m h ALA 188 Cb -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.45 1r1m h ALA 188 CO -0.03 0.53 -0.03 1.25 0.00 0.00 0.00 179.25 180.97 1r1m h LEU 189 N 1.07 -0.07 -1.18 0.00 5.85 -0.21 0.13 115.31 120.90 1r1m h LEU 189 Ca 0.29 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1r1m h LEU 189 Cb -0.11 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1r1m h LEU 189 CO -0.06 0.05 0.48 0.40 -0.34 0.00 0.00 178.44 178.97 1r1m h ILE 190 N -0.18 1.21 -0.31 4.05 2.04 -0.81 -1.23 117.51 122.29 1r1m h ILE 190 Ca -0.01 -0.44 -0.18 0.00 1.00 0.00 0.00 64.86 65.23 1r1m h ILE 190 Cb 0.16 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.35 1r1m h ILE 190 CO 0.01 0.21 -0.52 0.00 0.00 0.00 0.00 178.15 177.86 1r1m h ALA 191 N 1.47 0.48 -0.44 1.87 0.00 -1.04 -3.18 119.26 118.42 1r1m h ALA 191 Ca 0.28 -0.50 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1r1m h ALA 191 Cb -0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1r1m h ALA 191 CO -0.05 0.67 -0.00 0.00 0.00 0.00 0.00 179.25 179.87 1r1m n ILE 193 N -4.23 0.29 -0.29 0.00 -5.35 -0.52 -4.33 119.36 104.94 1r1m n ILE 193 Ca 0.02 -0.31 0.20 0.00 -0.27 0.00 0.00 62.75 62.40 1r1m n ILE 193 Cb 0.29 0.16 0.50 0.00 -1.74 0.00 0.00 39.64 38.84 1r1m n ILE 193 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1r1m h GLU 194 N 1.39 0.42 -0.07 6.28 4.22 -1.47 -1.31 114.58 124.03 1r1m h GLU 194 Ca 0.00 -0.02 0.02 0.00 0.08 0.00 0.00 59.36 59.43 1r1m h GLU 194 Cb 0.32 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1r1m h GLU 194 CO 0.00 0.27 0.09 -1.35 -2.18 0.00 0.00 179.01 175.84 1r1m h PRO 195 N 0.43 0.00 -0.00 0.92 0.11 -1.85 -0.69 132.00 130.92 1r1m h PRO 195 Ca 0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.64 1r1m h PRO 195 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1r1m h PRO 195 CO -0.24 0.00 -0.02 -0.25 -0.21 0.00 0.00 178.00 177.28 1r1m n ASP 196 N -3.68 0.08 -4.26 -2.05 8.00 -0.49 -4.51 116.55 109.64 1r1m n ASP 196 Ca -0.01 -0.19 -0.44 0.00 0.71 0.00 0.00 54.79 54.86 1r1m n ASP 196 Cb 0.18 -0.25 -0.06 0.00 -0.02 0.00 0.00 41.12 40.97 1r1m n ASP 196 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1r1m s ARG 197 N -2.57 2.89 0.17 -1.24 0.52 -0.27 -1.86 118.95 116.59 1r1m s ARG 197 Ca 0.28 -1.93 -0.23 0.00 -0.52 0.00 0.00 55.73 53.33 1r1m s ARG 197 Cb 0.20 -4.15 0.08 0.00 0.52 0.00 0.00 34.95 31.60 1r1m s ARG 197 CO 0.47 -1.26 1.04 -0.98 0.02 0.00 0.00 175.30 174.59 1r1m s ARG 198 N 1.12 1.24 -0.08 3.54 1.70 -0.96 -1.17 118.95 124.33 1r1m s ARG 198 Ca 0.08 -0.78 0.01 0.00 -0.47 0.00 0.00 55.73 54.58 1r1m s ARG 198 Cb -0.24 0.36 0.02 0.00 -0.57 0.00 0.00 34.95 34.51 1r1m s ARG 198 CO -0.01 -0.58 -0.11 0.08 -1.08 0.00 0.00 175.30 173.60 1r1m s VAL 199 N -2.37 1.12 -0.15 4.99 1.01 -0.17 -0.71 120.40 124.12 1r1m s VAL 199 Ca 0.20 -0.43 -0.05 0.00 0.00 0.00 0.00 61.98 61.69 1r1m s VAL 199 Cb -0.02 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 1r1m s VAL 199 CO 0.04 0.36 0.03 -1.81 0.00 0.00 0.00 175.10 173.73 1r1m s ASP 200 N 0.98 5.42 -0.33 3.32 1.01 0.50 -1.31 116.67 126.26 1r1m s ASP 200 Ca -0.09 0.08 -0.07 0.00 0.71 0.00 0.00 52.55 53.18 1r1m s ASP 200 Cb -0.15 -1.82 0.03 0.00 1.01 0.00 0.00 42.92 41.99 1r1m s ASP 200 CO -0.00 0.24 0.12 -0.69 0.21 0.00 0.00 175.17 175.05 1r1m s VAL 201 N -0.04 4.02 -0.31 -1.27 1.01 0.07 -0.02 120.40 123.86 1r1m s VAL 201 Ca 0.05 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.00 1r1m s VAL 201 Cb -0.12 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.03 1r1m s VAL 201 CO 0.01 -0.10 0.19 -0.54 0.00 0.00 0.00 175.10 174.66 1r1m s LYS 202 N 1.47 3.60 -0.14 2.72 1.02 0.47 -0.58 119.74 128.29 1r1m s LYS 202 Ca 0.01 -0.56 -0.01 0.00 0.02 0.00 0.00 55.97 55.43 1r1m s LYS 202 Cb -0.19 -3.66 -0.01 0.00 -0.52 0.00 0.00 37.83 33.45 1r1m s LYS 202 CO 0.04 -0.34 -0.12 0.42 -0.92 0.00 0.00 175.35 174.42 1r1m s ILE 203 N 1.70 3.04 -0.18 2.17 1.01 0.60 -0.47 121.20 129.07 1r1m s ILE 203 Ca 0.06 -0.65 -0.02 0.00 0.00 0.00 0.00 60.65 60.04 1r1m s ILE 203 Cb -0.17 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 40.00 1r1m s ILE 203 CO 0.09 0.51 -0.09 -0.60 0.00 0.00 0.00 174.94 174.85 1r1m s ARG 204 N 0.54 3.37 0.18 2.79 3.52 -0.60 -0.37 118.95 128.37 1r1m s ARG 204 Ca -0.08 -0.66 0.05 0.00 -0.13 0.00 0.00 55.73 54.91 1r1m s ARG 204 Cb -0.16 -2.81 -0.05 0.00 -1.56 0.00 0.00 34.95 30.37 1r1m s ARG 204 CO 0.04 0.00 -0.09 -1.54 -0.81 0.00 0.00 175.30 172.90 1r1m s SER 205 N 0.92 1.98 -0.01 -2.12 1.04 -0.43 -0.43 113.70 114.65 1r1m s SER 205 Ca -0.02 -1.06 -0.18 0.00 0.48 0.00 0.00 55.95 55.17 1r1m s SER 205 Cb -0.15 -0.04 -0.05 0.00 0.10 0.00 0.00 66.02 65.88 1r1m s SER 205 CO -0.00 -0.34 0.50 -0.63 0.98 0.00 0.00 173.24 173.75 1r1m s ILE 206 N -3.27 4.98 -2.23 -1.02 1.09 -0.21 -0.95 121.20 119.59 1r1m s ILE 206 Ca 0.21 1.04 0.30 0.00 -1.10 0.00 0.00 60.65 61.10 1r1m s ILE 206 Cb 0.03 -3.83 0.75 0.00 -1.06 0.00 0.00 42.46 38.35 1r1m s ILE 206 CO 0.04 0.48 2.01 0.52 -0.10 0.00 0.00 174.94 177.88