#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1g s ASN 37 N 0.00 1.80 -0.28 7.83 2.20 -1.26 -5.12 114.94 120.12 2k1g s ASN 37 Ca 0.00 -0.48 -0.29 0.00 -0.94 0.00 0.00 52.86 51.15 2k1g s ASN 37 Cb 0.00 0.23 -0.02 0.00 -2.00 0.00 0.00 41.25 39.46 2k1g s ASN 37 CO 0.00 -0.35 1.72 -0.69 -2.94 0.00 0.00 177.10 174.84 2k1g s VAL 38 N 2.28 3.56 0.19 3.54 1.01 -1.26 -5.00 120.40 124.72 2k1g s VAL 38 Ca 0.07 0.60 -0.07 0.00 0.00 0.00 0.00 61.98 62.58 2k1g s VAL 38 Cb -0.16 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.49 2k1g s VAL 38 CO -0.18 -0.36 0.47 1.51 0.00 0.00 0.00 175.10 176.54 2k1g s ASP 39 N 5.25 6.56 0.24 3.32 -4.77 -1.26 -5.01 116.67 120.99 2k1g s ASP 39 Ca 0.76 0.76 -0.05 0.00 -3.30 0.00 0.00 52.55 50.72 2k1g s ASP 39 Cb -0.24 -2.16 0.24 0.00 -1.09 0.00 0.00 42.92 39.68 2k1g s ASP 39 CO 0.32 -0.01 1.78 0.58 0.70 0.00 0.00 175.17 178.54 2k1g h VAL 40 N 2.01 1.25 0.46 2.11 2.07 -1.94 -3.26 116.25 118.95 2k1g h VAL 40 Ca -0.46 -0.86 -0.02 0.00 0.82 0.00 0.00 66.70 66.17 2k1g h VAL 40 Cb 1.17 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2k1g h VAL 40 CO 0.71 0.34 -0.22 0.50 0.02 0.00 0.00 177.57 178.91 2k1g h LYS 41 N 1.01 -0.59 -0.75 1.57 3.64 -1.89 -2.62 116.57 116.93 2k1g h LYS 41 Ca 0.22 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.69 2k1g h LYS 41 Cb 0.28 0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 2k1g h LYS 41 CO -0.01 -0.32 0.45 1.03 -2.27 0.00 0.00 179.45 178.33 2k1g h SER 42 N -0.77 0.70 -0.51 4.20 0.87 -1.99 -0.05 113.55 116.00 2k1g h SER 42 Ca -0.06 0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.53 2k1g h SER 42 Cb 0.54 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.34 2k1g h SER 42 CO 0.10 0.46 0.31 0.03 -0.53 0.00 0.00 176.83 177.21 2k1g h ARG 43 N 0.84 0.61 -0.23 2.24 2.47 -1.59 0.06 114.38 118.78 2k1g h ARG 43 Ca 0.32 -0.04 -0.08 0.00 -1.26 0.00 0.00 59.98 58.92 2k1g h ARG 43 Cb 0.13 -0.14 -0.00 0.00 -1.65 0.00 0.00 29.97 28.31 2k1g h ARG 43 CO -0.16 0.40 -0.18 0.82 0.56 0.00 0.00 179.97 181.42 2k1g h ILE 44 N 0.63 1.31 -0.19 2.04 2.04 -1.04 -2.68 117.51 119.63 2k1g h ILE 44 Ca 0.20 -1.30 -0.02 0.00 1.00 0.00 0.00 64.86 64.74 2k1g h ILE 44 Cb -0.01 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 2k1g h ILE 44 CO -0.08 0.40 0.04 0.24 0.00 0.00 0.00 178.15 178.76 2k1g h MET 45 N 0.23 0.26 0.32 2.37 2.86 -0.87 0.35 114.93 120.45 2k1g h MET 45 Ca 0.04 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2k1g h MET 45 Cb 0.71 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.32 2k1g h MET 45 CO 0.05 0.25 -0.15 0.22 1.06 0.00 0.00 176.91 178.33 2k1g h ASP 46 N 0.26 -0.36 -0.33 1.22 3.58 -0.84 -2.85 116.42 117.10 2k1g h ASP 46 Ca 0.06 0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.45 2k1g h ASP 46 Cb 0.11 0.09 -0.02 0.00 1.72 0.00 0.00 39.33 41.24 2k1g h ASP 46 CO -0.00 -0.25 -0.03 -0.61 -2.88 0.00 0.00 179.24 175.46 2k1g h GLN 47 N -0.43 0.71 -0.99 0.28 5.75 -1.07 -2.72 115.11 116.64 2k1g h GLN 47 Ca -0.04 -0.19 0.11 0.00 -0.15 0.00 0.00 58.65 58.37 2k1g h GLN 47 Cb 0.33 -0.08 -0.08 0.00 1.07 0.00 0.00 27.48 28.72 2k1g h GLN 47 CO 0.07 0.75 0.63 -0.92 -2.65 0.00 0.00 178.83 176.71 2k1g h TYR 48 N 0.66 1.13 0.00 3.99 3.20 -0.89 -0.78 116.97 124.28 2k1g h TYR 48 Ca 0.13 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2k1g h TYR 48 Cb 0.46 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.37 2k1g h TYR 48 CO 0.02 0.48 0.03 0.00 -1.64 0.00 0.00 178.16 177.05 2k1g h ALA 49 N 1.53 1.03 0.00 1.82 0.00 -1.24 -0.67 119.26 121.72 2k1g h ALA 49 Ca 0.48 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.31 2k1g h ALA 49 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2k1g h ALA 49 CO -0.24 -0.03 -1.41 -3.47 0.00 0.00 0.00 179.25 174.10 2k1g n ASP 50 N -2.81 0.65 -0.51 0.00 2.03 -0.31 -4.32 116.55 111.29 2k1g n ASP 50 Ca -0.02 0.27 0.05 0.00 0.52 0.00 0.00 54.79 55.61 2k1g n ASP 50 Cb 0.09 0.66 0.14 0.00 -0.72 0.00 0.00 41.12 41.29 2k1g n ASP 50 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 2k1g n TRP 51 N -2.68 0.43 -1.76 -0.67 7.02 -0.35 -5.00 117.44 114.43 2k1g n TRP 51 Ca -0.06 -0.62 -0.40 0.00 -1.02 0.00 0.00 57.50 55.39 2k1g n TRP 51 Cb 0.69 -0.10 -0.03 0.00 -2.42 0.00 0.00 31.31 29.45 2k1g n TRP 51 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2k1g s LYS 52 N -1.56 2.79 0.00 -0.99 1.02 -0.64 -2.67 119.74 117.70 2k1g s LYS 52 Ca 0.23 1.48 0.00 0.00 0.02 0.00 0.00 55.97 57.70 2k1g s LYS 52 Cb 0.16 -4.40 0.00 0.00 -0.52 0.00 0.00 37.83 33.07 2k1g s LYS 52 CO 0.10 -2.49 0.00 0.41 -0.92 0.00 0.00 175.35 172.45 2k1g n GLY 53 N 5.74 1.38 3.72 -3.33 0.00 -1.25 -5.10 105.19 106.35 2k1g n GLY 53 Ca 0.29 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.91 2k1g n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k1g s VAL 54 N -2.00 5.00 0.69 1.61 1.01 -1.09 -4.92 120.40 120.69 2k1g s VAL 54 Ca 0.00 1.56 -0.11 0.00 0.00 0.00 0.00 61.98 63.43 2k1g s VAL 54 Cb 0.00 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.29 2k1g s VAL 54 CO 0.00 0.24 1.08 0.00 0.00 0.00 0.00 175.10 176.42 2k1g s ARG 55 N 0.78 2.99 -0.11 2.72 1.70 -1.26 -0.90 118.95 124.87 2k1g s ARG 55 Ca 0.40 0.56 -0.28 0.00 -0.47 0.00 0.00 55.73 55.94 2k1g s ARG 55 Cb -0.18 -2.03 -0.01 0.00 -0.57 0.00 0.00 34.95 32.15 2k1g s ARG 55 CO 0.20 -0.97 0.95 -0.47 -1.08 0.00 0.00 175.30 173.94 2k1g s TYR 56 N -3.29 3.50 -0.17 5.89 5.04 -1.26 -1.28 117.35 125.79 2k1g s TYR 56 Ca 0.58 1.51 -0.03 0.00 -2.44 0.00 0.00 57.07 56.68 2k1g s TYR 56 Cb -0.11 -3.13 0.06 0.00 0.35 0.00 0.00 41.96 39.12 2k1g s TYR 56 CO 0.53 -0.20 0.05 0.50 -1.34 0.00 0.00 175.55 175.09 2k1g s ARG 57 N 1.94 0.39 -0.38 4.97 3.52 -0.69 -4.72 118.95 123.97 2k1g s ARG 57 Ca 0.46 -0.20 -0.19 0.00 -0.13 0.00 0.00 55.73 55.66 2k1g s ARG 57 Cb -0.18 -1.82 0.01 0.00 -1.56 0.00 0.00 34.95 31.40 2k1g s ARG 57 CO 0.17 -0.60 0.57 -0.48 -0.81 0.00 0.00 175.30 174.15 2k1g s LEU 58 N 1.99 4.42 0.00 -0.88 2.34 -1.26 -0.73 118.68 124.56 2k1g s LEU 58 Ca 0.01 -0.14 0.00 0.00 0.06 0.00 0.00 54.13 54.06 2k1g s LEU 58 Cb -0.16 -2.65 0.00 0.00 -0.56 0.00 0.00 46.19 42.82 2k1g s LEU 58 CO -0.08 -0.60 0.00 0.61 -1.06 0.00 0.00 176.35 175.22 2k1g n GLY 59 N 4.86 0.88 2.61 -3.48 0.00 -1.26 -5.03 105.19 103.77 2k1g n GLY 59 Ca -0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.73 2k1g n GLY 59 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2k1g s GLY 60 N -1.56 0.34 -0.54 -0.02 0.00 -1.25 -5.11 107.32 99.17 2k1g s GLY 60 Ca 0.00 -0.26 -0.20 0.00 0.00 0.00 0.00 44.72 44.26 2k1g s GLY 60 CO 0.00 1.70 0.73 -0.56 0.00 0.00 0.00 173.10 174.98 2k1g s SER 61 N 2.14 6.24 0.08 1.64 0.01 -1.26 -4.21 113.70 118.33 2k1g s SER 61 Ca 0.02 -0.88 -0.15 0.00 1.31 0.00 0.00 55.95 56.25 2k1g s SER 61 Cb -0.16 -2.33 0.03 0.00 0.21 0.00 0.00 66.02 63.77 2k1g s SER 61 CO -0.09 -1.05 0.36 0.28 0.41 0.00 0.00 173.24 173.16 2k1g s THR 62 N 3.05 0.08 -0.21 1.44 -1.32 -1.02 -5.02 115.64 112.64 2k1g s THR 62 Ca 0.18 -0.63 0.26 0.00 -1.21 0.00 0.00 61.69 60.29 2k1g s THR 62 Cb -0.18 -1.07 0.27 0.00 -1.51 0.00 0.00 72.50 70.01 2k1g s THR 62 CO 0.12 -0.35 1.79 0.11 -2.21 0.00 0.00 174.62 174.08 2k1g h LYS 63 N 2.81 0.00 -0.50 7.08 1.57 -1.99 -1.10 116.57 124.44 2k1g h LYS 63 Ca -0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2k1g h LYS 63 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2k1g h LYS 63 CO 0.47 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.98 2k1g n LYS 64 N -2.43 2.23 0.00 3.15 4.01 -1.26 -4.79 118.16 119.07 2k1g n LYS 64 Ca 0.00 -1.70 0.00 0.00 -0.51 0.00 0.00 58.31 56.10 2k1g n LYS 64 Cb 0.16 -1.43 0.00 0.00 -0.51 0.00 0.00 35.03 33.25 2k1g n LYS 64 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2k1g n GLY 65 N 1.14 2.63 3.26 0.72 0.00 -0.42 -4.78 105.19 107.74 2k1g n GLY 65 Ca 0.16 0.07 -0.13 0.00 0.00 0.00 0.00 46.02 46.12 2k1g n GLY 65 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2k1g s ILE 66 N 0.00 0.06 0.73 -0.61 2.07 -0.40 -2.42 121.20 120.63 2k1g s ILE 66 Ca 0.00 -0.53 -0.02 0.00 -1.41 0.00 0.00 60.65 58.69 2k1g s ILE 66 Cb 0.00 -0.75 0.13 0.00 0.13 0.00 0.00 42.46 41.97 2k1g s ILE 66 CO 0.00 -0.29 1.01 1.51 -1.91 0.00 0.00 174.94 175.26 2k1g s ASP 67 N -1.60 4.29 0.17 4.50 1.47 0.09 -1.70 116.67 123.89 2k1g s ASP 67 Ca -0.10 -0.30 -0.13 0.00 1.18 0.00 0.00 52.55 53.19 2k1g s ASP 67 Cb -0.03 -0.07 0.07 0.00 -0.34 0.00 0.00 42.92 42.55 2k1g s ASP 67 CO 0.02 -1.90 1.79 0.00 0.68 0.00 0.00 175.17 175.76 2k1g h SER 69 N 0.76 0.42 -0.40 0.00 0.87 -1.89 -2.03 113.55 111.28 2k1g h SER 69 Ca 0.20 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2k1g h SER 69 Cb 0.02 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 2k1g h SER 69 CO -0.03 0.37 0.25 1.23 -0.53 0.00 0.00 176.83 178.11 2k1g h GLY 70 N 0.45 0.58 0.93 5.77 0.00 -1.73 -1.47 103.07 107.59 2k1g h GLY 70 Ca 0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 2k1g h GLY 70 CO -0.02 0.23 -0.19 -2.75 0.00 0.00 0.00 176.54 173.81 2k1g h PHE 71 N 0.53 -0.49 -0.97 5.60 3.57 -0.96 0.59 116.94 124.81 2k1g h PHE 71 Ca 0.14 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.65 2k1g h PHE 71 Cb -0.01 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.85 2k1g h PHE 71 CO -0.04 -0.30 0.64 -0.24 -2.23 0.00 0.00 178.31 176.15 2k1g h VAL 72 N -0.49 1.23 -0.33 1.41 3.04 -1.39 -1.84 116.25 117.89 2k1g h VAL 72 Ca -0.04 -0.45 0.05 0.00 -1.01 0.00 0.00 66.70 65.26 2k1g h VAL 72 Cb 0.40 -0.18 -0.05 0.00 -2.01 0.00 0.00 31.29 29.45 2k1g h VAL 72 CO 0.04 0.24 0.04 -0.61 -1.01 0.00 0.00 177.57 176.27 2k1g h GLN 73 N 1.30 0.14 -0.09 4.17 4.15 -0.96 -2.78 115.11 121.04 2k1g h GLN 73 Ca 0.36 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.77 2k1g h GLN 73 Cb -0.13 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.53 2k1g h GLN 73 CO -0.09 0.09 0.06 0.00 -1.93 0.00 0.00 178.83 176.97 2k1g h ARG 74 N 0.15 0.13 0.27 1.69 2.47 -0.19 -2.42 114.38 116.48 2k1g h ARG 74 Ca 0.16 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.86 2k1g h ARG 74 Cb 0.19 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.47 2k1g h ARG 74 CO -0.23 0.12 -0.23 1.15 0.56 0.00 0.00 179.97 181.35 2k1g h THR 75 N 0.09 0.52 -0.30 2.04 2.02 -1.27 -0.48 112.91 115.54 2k1g h THR 75 Ca 0.03 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.16 2k1g h THR 75 Cb 0.03 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 2k1g h THR 75 CO -0.01 0.00 -0.03 -0.26 0.37 0.00 0.00 175.52 175.59 2k1g h PHE 76 N -0.51 0.48 0.00 3.16 -1.00 -1.52 -2.00 116.94 115.55 2k1g h PHE 76 Ca -0.01 -0.05 -0.15 0.00 2.81 0.00 0.00 57.97 60.56 2k1g h PHE 76 Cb 0.46 -0.14 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 2k1g h PHE 76 CO -0.14 0.50 -0.72 0.07 -1.61 0.00 0.00 178.31 176.42 2k1g h ARG 77 N 0.44 0.00 0.27 1.51 -0.00 -1.18 0.26 114.38 115.67 2k1g h ARG 77 Ca 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 59.98 60.06 2k1g h ARG 77 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.32 2k1g h ARG 77 CO 0.01 0.72 -0.13 0.93 -0.00 0.00 0.00 179.97 181.51 2k1g h GLU 78 N 0.00 -0.34 0.36 0.08 4.39 -0.66 -2.99 114.58 115.42 2k1g h GLU 78 Ca -0.01 0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 2k1g h GLU 78 Cb 1.34 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 2k1g h GLU 78 CO 0.09 -0.23 -0.17 1.96 -1.16 0.00 0.00 179.01 179.50 2k1g h GLN 79 N -0.69 -0.47 0.00 2.33 7.50 -1.51 -3.37 115.11 118.91 2k1g h GLN 79 Ca -0.04 0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2k1g h GLN 79 Cb 0.27 0.11 0.00 0.00 0.05 0.00 0.00 27.48 27.91 2k1g h GLN 79 CO 0.06 -0.27 -0.57 1.19 -1.50 0.00 0.00 178.83 177.74 2k1g n PHE 80 N -5.10 0.32 -2.37 2.96 3.72 -0.68 -4.95 117.46 111.36 2k1g n PHE 80 Ca -0.07 0.09 -0.14 0.00 -0.05 0.00 0.00 57.45 57.29 2k1g n PHE 80 Cb 0.21 -0.49 0.00 0.00 -0.94 0.00 0.00 39.48 38.26 2k1g n PHE 80 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2k1g n GLY 81 N 1.41 -0.17 3.74 1.37 0.00 0.71 -4.94 105.19 107.31 2k1g n GLY 81 Ca 0.04 -0.28 -0.38 0.00 0.00 0.00 0.00 46.02 45.40 2k1g n GLY 81 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2k1g s LEU 82 N -4.07 4.34 -0.08 0.99 2.96 -0.13 -4.85 118.68 117.84 2k1g s LEU 82 Ca 0.05 0.95 -0.20 0.00 -0.22 0.00 0.00 54.13 54.71 2k1g s LEU 82 Cb -0.02 -2.77 -0.04 0.00 0.50 0.00 0.00 46.19 43.85 2k1g s LEU 82 CO 0.06 0.05 0.56 -1.83 -1.32 0.00 0.00 176.35 173.87 2k1g s GLU 83 N 0.25 4.36 0.05 1.98 -1.05 -1.26 -2.97 118.70 120.05 2k1g s GLU 83 Ca 0.28 0.62 0.02 0.00 -0.15 0.00 0.00 54.97 55.74 2k1g s GLU 83 Cb -0.16 -3.42 -0.03 0.00 -0.44 0.00 0.00 34.13 30.08 2k1g s GLU 83 CO 0.13 0.18 -0.08 -0.51 0.95 0.00 0.00 175.26 175.93 2k1g s LEU 84 N 0.50 2.28 0.67 1.83 1.43 -1.26 -5.08 118.68 119.05 2k1g s LEU 84 Ca 0.30 -0.59 -0.13 0.00 -1.03 0.00 0.00 54.13 52.67 2k1g s LEU 84 Cb -0.16 -0.15 0.00 0.00 0.03 0.00 0.00 46.19 45.90 2k1g s LEU 84 CO 0.14 -0.23 1.08 -2.16 0.23 0.00 0.00 176.35 175.41 2k1g s PRO 85 N -1.80 2.86 0.00 1.29 0.04 -1.26 -4.95 135.00 131.19 2k1g s PRO 85 Ca -0.08 1.21 0.12 0.00 0.04 0.00 0.00 61.00 62.28 2k1g s PRO 85 Cb -0.09 -1.97 0.71 0.00 0.04 0.00 0.00 34.50 33.19 2k1g s PRO 85 CO -0.00 -1.18 1.43 0.54 0.04 0.00 0.00 177.00 177.84 2k1g n ARG 86 N -2.67 0.97 -4.36 4.56 1.74 -1.26 -4.73 116.66 110.92 2k1g n ARG 86 Ca 0.09 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.94 2k1g n ARG 86 Cb 0.53 -1.19 -0.16 0.00 -1.02 0.00 0.00 32.46 30.61 2k1g n ARG 86 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2k1g s SER 87 N -1.40 1.45 0.23 0.55 0.01 -1.26 -4.49 113.70 108.79 2k1g s SER 87 Ca 0.18 -0.22 -0.06 0.00 1.31 0.00 0.00 55.95 57.16 2k1g s SER 87 Cb 0.08 -0.66 0.37 0.00 0.21 0.00 0.00 66.02 66.01 2k1g s SER 87 CO 0.14 -0.02 1.79 0.74 0.41 0.00 0.00 173.24 176.30 2k1g h THR 88 N 6.06 0.86 -0.89 1.44 2.02 -1.85 -1.09 112.91 119.46 2k1g h THR 88 Ca -0.34 -0.23 0.23 0.00 0.77 0.00 0.00 66.41 66.85 2k1g h THR 88 Cb 1.17 0.14 -0.05 0.00 -1.74 0.00 0.00 68.15 67.66 2k1g h THR 88 CO 0.47 0.12 0.61 1.88 0.37 0.00 0.00 175.52 178.97 2k1g h TYR 89 N 0.67 0.26 0.15 3.16 -1.99 -1.96 -0.79 116.97 116.47 2k1g h TYR 89 Ca 0.37 0.01 -0.34 0.00 2.00 0.00 0.00 58.73 60.77 2k1g h TYR 89 Cb 0.38 -0.08 -0.00 0.00 2.00 0.00 0.00 36.73 39.03 2k1g h TYR 89 CO -0.09 0.06 -1.77 0.93 -0.00 0.00 0.00 178.16 177.29 2k1g h GLU 90 N 0.19 0.33 -0.37 4.88 4.39 -1.63 -3.35 114.58 119.02 2k1g h GLU 90 Ca 0.44 -0.56 0.10 0.00 0.34 0.00 0.00 59.36 59.69 2k1g h GLU 90 Cb 1.44 0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 30.28 2k1g h GLU 90 CO -0.09 1.27 0.27 1.96 -1.16 0.00 0.00 179.01 181.25 2k1g h GLN 91 N 0.01 0.02 -0.96 2.33 4.20 -0.31 -0.82 115.11 119.58 2k1g h GLN 91 Ca -0.37 -0.00 0.16 0.00 0.06 0.00 0.00 58.65 58.51 2k1g h GLN 91 Cb 2.01 -0.00 -0.09 0.00 0.30 0.00 0.00 27.48 29.70 2k1g h GLN 91 CO 0.12 0.01 0.61 1.96 -0.67 0.00 0.00 178.83 180.87 2k1g h GLN 92 N 0.02 0.73 -0.76 1.46 4.20 -1.33 -2.08 115.11 117.35 2k1g h GLN 92 Ca 0.18 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.72 2k1g h GLN 92 Cb 0.68 -0.16 -0.08 0.00 0.30 0.00 0.00 27.48 28.22 2k1g h GLN 92 CO -0.01 0.48 0.16 0.39 -0.67 0.00 0.00 178.83 179.19 2k1g n GLU 93 N -4.63 3.58 -0.10 1.46 1.02 -0.31 -4.28 120.64 117.38 2k1g n GLU 93 Ca 0.20 -2.57 -0.15 0.00 -0.02 0.00 0.00 57.16 54.63 2k1g n GLU 93 Cb 0.51 -2.09 -0.14 0.00 -0.02 0.00 0.00 31.44 29.70 2k1g n GLU 93 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2k1g n MET 94 N 0.11 0.67 -3.54 3.49 2.81 -0.78 -5.06 117.12 114.82 2k1g n MET 94 Ca 0.31 0.11 -0.17 0.00 -1.81 0.00 0.00 57.70 56.14 2k1g n MET 94 Cb 1.17 -1.56 -0.04 0.00 -0.71 0.00 0.00 33.22 32.07 2k1g n MET 94 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2k1g n GLY 95 N 1.99 3.65 3.85 3.03 0.00 -1.26 -4.88 105.19 111.56 2k1g n GLY 95 Ca -0.37 -2.13 -0.33 0.00 0.00 0.00 0.00 46.02 43.18 2k1g n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k1g s LYS 96 N -3.02 4.03 0.30 1.61 -0.14 -0.24 -4.72 119.74 117.56 2k1g s LYS 96 Ca 0.08 0.67 -0.08 0.00 -1.36 0.00 0.00 55.97 55.29 2k1g s LYS 96 Cb 0.00 -2.52 -0.06 0.00 -1.68 0.00 0.00 37.83 33.57 2k1g s LYS 96 CO 0.06 0.21 0.61 -1.54 -0.76 0.00 0.00 175.35 173.93 2k1g s SER 97 N -2.17 6.52 0.06 2.83 1.04 -1.26 -0.00 113.70 120.72 2k1g s SER 97 Ca 0.52 0.88 -0.00 0.00 0.48 0.00 0.00 55.95 57.83 2k1g s SER 97 Cb -0.11 -2.21 -0.04 0.00 0.10 0.00 0.00 66.02 63.75 2k1g s SER 97 CO 0.18 -0.21 -0.04 0.68 0.98 0.00 0.00 173.24 174.84 2k1g s VAL 98 N -2.07 0.33 0.43 5.02 -7.23 0.58 -4.92 120.40 112.54 2k1g s VAL 98 Ca 0.47 -1.82 -0.07 0.00 -1.81 0.00 0.00 61.98 58.75 2k1g s VAL 98 Cb -0.11 -1.53 -0.05 0.00 0.56 0.00 0.00 36.38 35.26 2k1g s VAL 98 CO 0.27 -0.96 0.75 -0.55 -0.31 0.00 0.00 175.10 174.30 2k1g s SER 99 N -2.91 6.37 0.47 4.85 0.15 -1.26 -3.79 113.70 117.58 2k1g s SER 99 Ca 0.08 0.96 0.23 0.00 0.70 0.00 0.00 55.95 57.91 2k1g s SER 99 Cb 0.07 -2.25 1.25 0.00 -1.71 0.00 0.00 66.02 63.37 2k1g s SER 99 CO -0.09 -0.47 1.89 -0.09 1.20 0.00 0.00 173.24 175.68 2k1g h ARG 100 N 0.72 0.22 0.00 5.44 9.65 -1.98 0.19 114.38 128.62 2k1g h ARG 100 Ca -0.47 -0.01 -0.14 0.00 -1.10 0.00 0.00 59.98 58.26 2k1g h ARG 100 Cb 1.20 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.71 2k1g h ARG 100 CO 0.63 0.14 -0.65 0.66 2.80 0.00 0.00 179.97 183.55 2k1g h SER 101 N 0.22 0.00 -0.01 -3.80 4.64 -2.06 -3.30 113.55 109.25 2k1g h SER 101 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2k1g h SER 101 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2k1g h SER 101 CO -0.10 0.65 -0.07 0.59 -0.87 0.00 0.00 176.83 177.03 2k1g n ASN 102 N -3.61 2.27 -4.68 4.97 4.13 0.60 -4.96 115.26 113.98 2k1g n ASN 102 Ca -0.00 -1.71 -0.42 0.00 1.68 0.00 0.00 54.58 54.13 2k1g n ASN 102 Cb 0.68 0.06 -0.03 0.00 -1.54 0.00 0.00 39.78 38.95 2k1g n ASN 102 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2k1g n LEU 103 N 0.68 4.12 0.00 3.41 4.77 -0.85 -4.85 117.00 124.29 2k1g n LEU 103 Ca 0.15 0.96 -0.25 0.00 -0.03 0.00 0.00 56.01 56.84 2k1g n LEU 103 Cb 0.49 -1.55 -0.07 0.00 -2.33 0.00 0.00 43.42 39.97 2k1g n LEU 103 CO 0.18 0.20 -0.17 0.54 -1.33 0.00 0.00 177.39 176.81 2k1g n ARG 104 N 6.31 0.67 -1.81 3.23 1.74 -1.26 -4.93 116.66 120.60 2k1g n ARG 104 Ca 0.19 -3.26 -0.42 0.00 -0.77 0.00 0.00 57.85 53.59 2k1g n ARG 104 Cb 0.39 1.54 -0.03 0.00 -1.02 0.00 0.00 32.46 33.34 2k1g n ARG 104 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2k1g s THR 105 N -2.91 3.24 0.00 0.55 2.01 -1.26 -2.61 115.64 114.66 2k1g s THR 105 Ca 0.15 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.38 2k1g s THR 105 Cb 0.01 -3.36 0.00 0.00 0.01 0.00 0.00 72.50 69.16 2k1g s THR 105 CO 0.10 -0.26 0.00 0.61 -0.69 0.00 0.00 174.62 174.39 2k1g n GLY 106 N 5.64 1.48 3.71 4.40 0.00 -0.36 -4.84 105.19 115.22 2k1g n GLY 106 Ca 0.27 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 2k1g n GLY 106 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k1g s ASP 107 N -0.93 7.07 -0.34 1.61 1.01 -1.07 -4.54 116.67 119.49 2k1g s ASP 107 Ca 0.00 2.01 -0.25 0.00 0.71 0.00 0.00 52.55 55.02 2k1g s ASP 107 Cb 0.00 -2.58 0.01 0.00 1.01 0.00 0.00 42.92 41.36 2k1g s ASP 107 CO 0.00 -0.48 0.86 -0.76 0.21 0.00 0.00 175.17 175.00 2k1g s LEU 108 N 1.13 4.05 -0.17 1.23 1.43 -0.72 -1.70 118.68 123.93 2k1g s LEU 108 Ca 0.59 0.63 -0.14 0.00 -1.03 0.00 0.00 54.13 54.17 2k1g s LEU 108 Cb -0.29 -3.17 -0.04 0.00 0.03 0.00 0.00 46.19 42.71 2k1g s LEU 108 CO 0.29 -0.74 0.32 0.68 0.23 0.00 0.00 176.35 177.14 2k1g s VAL 109 N 3.21 5.28 -0.18 -1.59 -7.23 0.08 -0.49 120.40 119.47 2k1g s VAL 109 Ca 0.35 0.59 -0.12 0.00 -1.81 0.00 0.00 61.98 60.99 2k1g s VAL 109 Cb -0.13 -3.66 -0.05 0.00 0.56 0.00 0.00 36.38 33.10 2k1g s VAL 109 CO 0.15 0.35 0.23 -0.76 -0.31 0.00 0.00 175.10 174.77 2k1g s LEU 110 N 0.72 4.21 -0.03 1.32 1.43 0.09 -0.92 118.68 125.51 2k1g s LEU 110 Ca 0.17 0.38 0.06 0.00 -1.03 0.00 0.00 54.13 53.71 2k1g s LEU 110 Cb -0.14 -2.26 -0.02 0.00 0.03 0.00 0.00 46.19 43.80 2k1g s LEU 110 CO 0.05 0.11 -0.20 -0.36 0.23 0.00 0.00 176.35 176.18 2k1g s PHE 111 N 0.56 2.51 -0.69 0.29 0.08 0.27 -1.23 117.98 119.77 2k1g s PHE 111 Ca 0.13 -0.30 -0.25 0.00 0.12 0.00 0.00 56.93 56.63 2k1g s PHE 111 Cb -0.12 -1.56 0.05 0.00 -0.57 0.00 0.00 43.02 40.82 2k1g s PHE 111 CO 0.02 0.08 1.12 1.03 -0.10 0.00 0.00 175.22 177.38 2k1g s ARG 112 N -0.72 3.17 0.04 0.44 0.52 -0.39 -2.20 118.95 119.81 2k1g s ARG 112 Ca 0.11 -0.50 0.02 0.00 -0.52 0.00 0.00 55.73 54.83 2k1g s ARG 112 Cb -0.10 -4.19 -0.04 0.00 0.52 0.00 0.00 34.95 31.13 2k1g s ARG 112 CO 0.00 -1.96 0.07 0.00 0.02 0.00 0.00 175.30 173.43 2k1g s ALA 113 N 4.89 3.55 0.00 2.13 0.00 -1.14 -4.89 121.76 126.29 2k1g s ALA 113 Ca 0.29 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.29 2k1g s ALA 113 Cb -0.12 -1.47 0.00 0.00 0.00 0.00 0.00 23.12 21.52 2k1g s ALA 113 CO 0.13 0.72 0.00 0.41 0.00 0.00 0.00 175.76 177.02 2k1g n GLY 114 N 0.79 0.35 2.01 0.00 0.00 -1.26 -3.62 105.19 103.46 2k1g n GLY 114 Ca -0.11 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.60 2k1g n GLY 114 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k1g n SER 115 N 7.12 -0.24 -3.97 1.61 7.64 -1.26 -4.99 113.62 119.54 2k1g n SER 115 Ca 0.00 0.06 -0.32 0.00 1.01 0.00 0.00 58.87 59.62 2k1g n SER 115 Cb 0.00 0.54 -0.09 0.00 -1.01 0.00 0.00 64.21 63.65 2k1g n SER 115 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2k1g n THR 116 N -2.58 2.39 -3.53 0.44 -2.24 -1.26 -5.02 114.28 102.48 2k1g n THR 116 Ca 0.00 -5.03 0.00 0.00 -2.27 0.00 0.00 64.05 56.75 2k1g n THR 116 Cb 0.00 -2.27 -0.04 0.00 -2.10 0.00 0.00 70.33 65.92 2k1g n THR 116 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2k1g s GLY 117 N -0.97 -0.49 -0.44 3.38 0.00 -1.24 -5.08 107.32 102.49 2k1g s GLY 117 Ca 0.27 2.66 -0.17 0.00 0.00 0.00 0.00 44.72 47.49 2k1g s GLY 117 CO -0.14 3.15 0.43 0.50 0.00 0.00 0.00 173.10 177.05 2k1g s ARG 118 N 2.70 3.05 0.05 2.90 1.81 -1.26 -2.87 118.95 125.33 2k1g s ARG 118 Ca -0.04 -0.93 -0.03 0.00 -1.72 0.00 0.00 55.73 53.00 2k1g s ARG 118 Cb -0.09 -4.02 -0.04 0.00 -0.45 0.00 0.00 34.95 30.34 2k1g s ARG 118 CO -0.18 -0.92 0.25 -1.58 -0.68 0.00 0.00 175.30 172.19 2k1g s HIS 119 N 2.04 3.53 0.00 -0.53 5.65 -0.94 -4.75 115.29 120.30 2k1g s HIS 119 Ca 0.10 0.41 0.02 0.00 0.25 0.00 0.00 55.06 55.83 2k1g s HIS 119 Cb -0.19 -1.88 -0.01 0.00 -1.18 0.00 0.00 32.58 29.33 2k1g s HIS 119 CO 0.11 0.57 -0.06 0.54 -0.65 0.00 0.00 174.74 175.25 2k1g s VAL 120 N -1.46 0.49 0.09 0.89 0.11 -1.26 -0.56 120.40 118.70 2k1g s VAL 120 Ca 0.33 -0.41 0.03 0.00 -2.93 0.00 0.00 61.98 59.00 2k1g s VAL 120 Cb -0.13 -0.44 -0.04 0.00 -1.53 0.00 0.00 36.38 34.25 2k1g s VAL 120 CO 0.23 0.04 -0.09 -0.83 -3.33 0.00 0.00 175.10 171.11 2k1g s GLY 121 N -0.41 0.81 -0.49 6.54 0.00 -0.10 -4.64 107.32 109.03 2k1g s GLY 121 Ca 0.00 -1.18 -0.18 0.00 0.00 0.00 0.00 44.72 43.36 2k1g s GLY 121 CO -0.00 -1.26 0.57 -0.42 0.00 0.00 0.00 173.10 171.99 2k1g s ILE 122 N -2.53 4.95 -0.19 0.90 1.01 -0.13 -0.74 121.20 124.47 2k1g s ILE 122 Ca 0.05 -0.52 -0.29 0.00 0.00 0.00 0.00 60.65 59.89 2k1g s ILE 122 Cb -0.02 -4.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 2k1g s ILE 122 CO -0.01 -0.71 1.91 -0.47 0.00 0.00 0.00 174.94 175.66 2k1g s TYR 123 N 2.43 1.59 -0.15 3.97 6.14 -0.69 -1.72 117.35 128.92 2k1g s TYR 123 Ca 0.13 0.36 0.18 0.00 0.64 0.00 0.00 57.07 58.39 2k1g s TYR 123 Cb -0.19 -4.04 -0.26 0.00 0.42 0.00 0.00 41.96 37.89 2k1g s TYR 123 CO 0.12 -3.83 0.27 0.44 0.64 0.00 0.00 175.55 173.19 2k1g n ILE 124 N 6.85 1.09 0.00 3.14 -5.35 -0.40 -1.22 119.36 123.47 2k1g n ILE 124 Ca 0.23 -0.76 0.00 0.00 -0.27 0.00 0.00 62.75 61.95 2k1g n ILE 124 Cb 0.45 -0.43 0.00 0.00 -1.74 0.00 0.00 39.64 37.92 2k1g n ILE 124 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2k1g n GLY 125 N 1.60 4.13 3.71 3.28 0.00 -0.91 -4.49 105.19 112.51 2k1g n GLY 125 Ca -0.24 -0.62 -0.24 0.00 0.00 0.00 0.00 46.02 44.92 2k1g n GLY 125 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k1g n ASN 126 N 0.00 -2.49 0.00 1.61 4.13 -1.26 -0.86 115.26 116.40 2k1g n ASN 126 Ca 0.00 -0.90 0.00 0.00 1.68 0.00 0.00 54.58 55.36 2k1g n ASN 126 Cb 0.00 -3.77 0.00 0.00 -1.54 0.00 0.00 39.78 34.47 2k1g n ASN 126 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2k1g n ASN 127 N -2.96 0.00 -4.82 6.41 3.02 -1.26 -4.90 115.26 110.75 2k1g n ASN 127 Ca -0.23 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 53.95 2k1g n ASN 127 Cb 0.65 -1.31 -0.06 0.00 -0.61 0.00 0.00 39.78 38.46 2k1g n ASN 127 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2k1g s GLN 128 N -0.33 4.18 -0.06 3.52 -0.21 -0.04 -0.50 119.66 126.23 2k1g s GLN 128 Ca 0.00 0.76 -0.25 0.00 0.02 0.00 0.00 55.36 55.89 2k1g s GLN 128 Cb 0.00 -2.97 0.05 0.00 1.00 0.00 0.00 33.01 31.10 2k1g s GLN 128 CO 0.00 0.46 0.55 -0.59 -2.12 0.00 0.00 175.29 173.60 2k1g s PHE 129 N -1.42 -0.51 -0.13 0.91 -0.71 -0.75 -1.27 117.98 114.10 2k1g s PHE 129 Ca 0.39 0.90 -0.06 0.00 -1.04 0.00 0.00 56.93 57.12 2k1g s PHE 129 Cb -0.17 0.29 -0.04 0.00 -1.21 0.00 0.00 43.02 41.89 2k1g s PHE 129 CO 0.20 -0.51 0.09 0.54 -1.34 0.00 0.00 175.22 174.21 2k1g s VAL 130 N -1.08 5.08 0.05 -2.49 0.11 -0.70 -2.04 120.40 119.33 2k1g s VAL 130 Ca -0.11 0.05 -0.27 0.00 -2.93 0.00 0.00 61.98 58.72 2k1g s VAL 130 Cb -0.02 -3.22 0.09 0.00 -1.53 0.00 0.00 36.38 31.70 2k1g s VAL 130 CO 0.07 0.58 0.88 -1.38 -3.33 0.00 0.00 175.10 171.92 2k1g s HIS 131 N -0.65 -0.31 -1.02 1.54 -3.43 -0.40 -0.96 115.29 110.06 2k1g s HIS 131 Ca 0.12 0.13 -0.18 0.00 -0.80 0.00 0.00 55.06 54.34 2k1g s HIS 131 Cb -0.12 0.56 0.14 0.00 -1.43 0.00 0.00 32.58 31.73 2k1g s HIS 131 CO 0.02 -0.64 1.25 0.00 -2.00 0.00 0.00 174.74 173.37 2k1g s ALA 132 N -3.21 3.51 0.27 -1.38 0.00 -1.26 -0.62 121.76 119.06 2k1g s ALA 132 Ca 0.06 -2.91 -0.30 0.00 0.00 0.00 0.00 51.96 48.81 2k1g s ALA 132 Cb -0.01 -4.11 -0.12 0.00 0.00 0.00 0.00 23.12 18.87 2k1g s ALA 132 CO -0.07 -2.97 1.55 0.45 0.00 0.00 0.00 175.76 174.73 2k1g n SER 133 N 6.47 3.55 -0.16 0.00 2.88 0.15 -3.88 113.62 122.63 2k1g n SER 133 Ca 0.29 1.14 0.08 0.00 -1.33 0.00 0.00 58.87 59.05 2k1g n SER 133 Cb 0.47 -1.54 0.39 0.00 -0.75 0.00 0.00 64.21 62.78 2k1g n SER 133 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 2k1g h THR 134 N 3.29 0.99 0.00 2.46 1.35 -1.95 0.19 112.91 119.23 2k1g h THR 134 Ca -0.46 -0.23 -0.13 0.00 -0.55 0.00 0.00 66.41 65.04 2k1g h THR 134 Cb 1.24 0.26 -0.02 0.00 -1.73 0.00 0.00 68.15 67.90 2k1g h THR 134 CO 0.79 0.12 -0.73 -1.28 -0.25 0.00 0.00 175.52 174.18 2k1g h SER 135 N 0.67 0.00 0.04 5.36 0.87 -2.00 -3.43 113.55 115.05 2k1g h SER 135 Ca 0.31 -0.65 -0.37 0.00 -1.23 0.00 0.00 61.79 59.84 2k1g h SER 135 Cb 0.34 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.23 2k1g h SER 135 CO -0.10 1.25 -2.37 -1.20 -0.53 0.00 0.00 176.83 173.88 2k1g n SER 136 N -4.52 0.98 0.00 6.23 7.64 -1.21 -4.99 113.62 117.75 2k1g n SER 136 Ca -0.22 -0.02 0.00 0.00 1.01 0.00 0.00 58.87 59.64 2k1g n SER 136 Cb 0.57 0.26 0.00 0.00 -1.01 0.00 0.00 64.21 64.03 2k1g n SER 136 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k1g n GLY 137 N 1.96 -0.62 3.56 0.23 0.00 0.65 -4.76 105.19 106.22 2k1g n GLY 137 Ca -0.37 -2.12 -0.38 0.00 0.00 0.00 0.00 46.02 43.15 2k1g n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k1g s VAL 138 N 0.00 3.13 0.30 1.61 1.01 -0.07 0.34 120.40 126.72 2k1g s VAL 138 Ca 0.00 0.09 0.05 0.00 0.00 0.00 0.00 61.98 62.13 2k1g s VAL 138 Cb 0.00 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.08 2k1g s VAL 138 CO 0.00 -0.25 0.30 2.30 0.00 0.00 0.00 175.10 177.44 2k1g n ILE 139 N 7.73 0.00 -4.03 2.22 -5.35 0.20 -3.92 119.36 116.21 2k1g n ILE 139 Ca 0.31 -2.09 -0.32 0.00 -0.27 0.00 0.00 62.75 60.38 2k1g n ILE 139 Cb 0.52 1.08 -0.15 0.00 -1.74 0.00 0.00 39.64 39.35 2k1g n ILE 139 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2k1g s ILE 140 N -3.13 2.02 0.08 7.28 1.01 -1.26 -1.27 121.20 125.93 2k1g s ILE 140 Ca 0.34 -1.59 0.01 0.00 0.00 0.00 0.00 60.65 59.41 2k1g s ILE 140 Cb 0.01 -2.19 0.01 0.00 0.01 0.00 0.00 42.46 40.30 2k1g s ILE 140 CO 0.24 -0.09 0.07 -1.54 0.00 0.00 0.00 174.94 173.62 2k1g n SER 141 N 4.48 1.07 -3.77 3.58 3.41 -0.86 -4.90 113.62 116.62 2k1g n SER 141 Ca -0.12 -1.27 -0.13 0.00 -0.26 0.00 0.00 58.87 57.09 2k1g n SER 141 Cb 0.42 -0.02 -0.12 0.00 -0.26 0.00 0.00 64.21 64.24 2k1g n SER 141 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2k1g s SER 142 N -1.50 -0.26 0.00 4.04 0.01 -1.26 -1.80 113.70 112.92 2k1g s SER 142 Ca 0.06 0.51 0.18 0.00 1.31 0.00 0.00 55.95 58.01 2k1g s SER 142 Cb -0.00 0.48 1.06 0.00 0.21 0.00 0.00 66.02 67.76 2k1g s SER 142 CO 0.04 -0.11 1.62 0.23 0.41 0.00 0.00 173.24 175.42 2k1g n MET 143 N 3.39 0.91 0.05 12.44 2.81 0.34 -2.09 117.12 134.98 2k1g n MET 143 Ca -0.17 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 55.85 2k1g n MET 143 Cb 0.56 -1.30 0.39 0.00 -0.71 0.00 0.00 33.22 32.16 2k1g n MET 143 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2k1g n ASN 144 N -0.80 0.52 -4.75 7.83 6.94 -1.26 -3.20 115.26 120.54 2k1g n ASN 144 Ca 0.13 0.34 -0.41 0.00 -0.02 0.00 0.00 54.58 54.63 2k1g n ASN 144 Cb 0.06 -0.36 -0.03 0.00 -2.36 0.00 0.00 39.78 37.08 2k1g n ASN 144 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2k1g s GLU 145 N -3.07 4.49 0.25 -3.83 0.41 -0.89 -4.88 118.70 111.17 2k1g s GLU 145 Ca 0.11 1.95 -0.03 0.00 -0.41 0.00 0.00 54.97 56.59 2k1g s GLU 145 Cb 0.15 -3.19 0.47 0.00 -1.78 0.00 0.00 34.13 29.78 2k1g s GLU 145 CO 0.62 -0.06 1.77 -1.00 -0.49 0.00 0.00 175.26 176.09 2k1g h PRO 146 N 4.62 0.60 -0.26 0.39 0.13 -1.89 0.18 132.00 135.77 2k1g h PRO 146 Ca -0.46 -0.04 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2k1g h PRO 146 Cb 1.22 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.19 2k1g h PRO 146 CO 0.72 0.40 0.15 -0.92 -0.23 0.00 0.00 178.00 178.12 2k1g h TYR 147 N 0.62 0.28 0.07 1.56 3.20 -1.94 -2.83 116.97 117.93 2k1g h TYR 147 Ca 0.43 0.01 -0.24 0.00 3.14 0.00 0.00 58.73 62.06 2k1g h TYR 147 Cb 0.56 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 2k1g h TYR 147 CO -0.10 0.17 -1.10 -1.49 -1.64 0.00 0.00 178.16 174.00 2k1g h TRP 148 N 0.31 0.37 -0.90 -3.82 4.06 -1.66 -2.35 115.95 111.96 2k1g h TRP 148 Ca 0.10 -0.25 0.08 0.00 2.06 0.00 0.00 58.89 60.88 2k1g h TRP 148 Cb -0.01 -0.02 -0.06 0.00 -1.00 0.00 0.00 29.16 28.07 2k1g h TRP 148 CO -0.08 1.16 0.58 -0.22 -3.56 0.00 0.00 178.44 176.32 2k1g h LYS 149 N 0.08 0.94 0.00 0.49 3.64 -0.60 -1.14 116.57 119.98 2k1g h LYS 149 Ca -0.09 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 2k1g h LYS 149 Cb 1.81 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.42 2k1g h LYS 149 CO 0.17 0.62 -0.83 0.36 -2.27 0.00 0.00 179.45 177.50 2k1g n LYS 150 N -4.51 0.14 0.08 1.90 2.85 -1.07 -4.13 118.16 113.43 2k1g n LYS 150 Ca 0.14 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.30 2k1g n LYS 150 Cb 0.24 -1.55 -0.11 0.00 -0.65 0.00 0.00 35.03 32.96 2k1g n LYS 150 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 177.40 177.26 2k1g h ARG 151 N 0.00 0.14 -6.50 -1.58 9.65 -0.70 -3.46 114.38 111.92 2k1g h ARG 151 Ca 0.00 -0.23 -0.55 0.00 -1.10 0.00 0.00 59.98 58.10 2k1g h ARG 151 Cb 0.62 0.08 0.05 0.00 -1.39 0.00 0.00 29.97 29.32 2k1g h ARG 151 CO 0.00 1.08 1.01 0.98 2.80 0.00 0.00 179.97 185.85 2k1g n TYR 152 N -3.48 2.52 -0.05 2.20 9.36 -0.53 -1.26 117.16 125.92 2k1g n TYR 152 Ca -0.04 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.13 2k1g n TYR 152 Cb 0.95 -2.67 -0.02 0.00 -0.63 0.00 0.00 39.34 36.98 2k1g n TYR 152 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 2k1g n ASN 153 N 4.93 1.15 -3.65 2.98 5.15 -0.37 -4.93 115.26 120.52 2k1g n ASN 153 Ca 0.18 0.19 -0.08 0.00 -0.60 0.00 0.00 54.58 54.27 2k1g n ASN 153 Cb 0.34 -0.62 -0.02 0.00 -0.53 0.00 0.00 39.78 38.95 2k1g n ASN 153 CO 0.00 0.00 0.00 -1.83 1.40 0.00 0.00 177.26 176.83 2k1g s GLU 154 N -2.13 1.84 0.03 1.20 -1.05 -1.25 -5.03 118.70 112.31 2k1g s GLU 154 Ca -0.16 -1.20 0.04 0.00 -0.15 0.00 0.00 54.97 53.50 2k1g s GLU 154 Cb 0.02 0.57 -0.02 0.00 -0.44 0.00 0.00 34.13 34.26 2k1g s GLU 154 CO 0.24 -0.83 -0.13 0.00 0.95 0.00 0.00 175.26 175.50 2k1g s ALA 155 N -3.54 1.04 -0.04 -0.84 0.00 -1.25 -0.73 121.76 116.41 2k1g s ALA 155 Ca 0.16 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.34 2k1g s ALA 155 Cb -0.04 -0.15 0.03 0.00 0.00 0.00 0.00 23.12 22.96 2k1g s ALA 155 CO 0.09 0.18 0.06 1.03 0.00 0.00 0.00 175.76 177.13 2k1g s ARG 156 N -1.09 -0.04 -0.12 0.00 0.52 0.35 -0.31 118.95 118.27 2k1g s ARG 156 Ca 0.00 0.32 -0.10 0.00 -0.52 0.00 0.00 55.73 55.43 2k1g s ARG 156 Cb -0.08 -0.35 -0.05 0.00 0.52 0.00 0.00 34.95 34.99 2k1g s ARG 156 CO 0.01 -0.25 0.21 -0.98 0.02 0.00 0.00 175.30 174.31 2k1g s ARG 157 N 1.65 3.75 -0.09 3.54 3.03 0.99 -1.76 118.95 130.06 2k1g s ARG 157 Ca -0.02 -0.02 0.16 0.00 2.03 0.00 0.00 55.73 57.89 2k1g s ARG 157 Cb -0.12 -3.26 0.59 0.00 -1.03 0.00 0.00 34.95 31.12 2k1g s ARG 157 CO -0.03 0.62 1.50 1.33 -1.13 0.00 0.00 175.30 177.59 2k1g n VAL 158 N 2.39 1.67 -3.18 4.99 0.24 -1.26 -1.08 118.33 122.10 2k1g n VAL 158 Ca -0.17 -1.26 -0.29 0.00 -2.04 0.00 0.00 64.34 60.57 2k1g n VAL 158 Cb 0.54 0.17 -0.03 0.00 -1.47 0.00 0.00 33.84 33.05 2k1g n VAL 158 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2k1g s LEU 159 N -1.77 3.98 -0.03 1.34 1.43 -1.26 -4.93 118.68 117.44 2k1g s LEU 159 Ca 0.43 0.84 -0.01 0.00 -1.03 0.00 0.00 54.13 54.36 2k1g s LEU 159 Cb 0.28 -3.68 0.03 0.00 0.03 0.00 0.00 46.19 42.85 2k1g s LEU 159 CO 0.20 -0.26 0.04 -0.44 0.23 0.00 0.00 176.35 176.12 2k1g s SER 160 N -3.19 0.56 0.14 2.29 0.01 -1.26 -4.99 113.70 107.27 2k1g s SER 160 Ca 0.46 0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.78 2k1g s SER 160 Cb -0.11 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.02 2k1g s SER 160 CO 0.31 -0.18 0.01 -2.11 0.41 0.00 0.00 173.24 171.67 2k1g n ARG 161 N 4.68 1.63 -4.34 12.44 -4.01 -1.26 -5.17 116.66 120.64 2k1g n ARG 161 Ca -0.17 -1.00 -0.20 0.00 -1.04 0.00 0.00 57.85 55.44 2k1g n ARG 161 Cb 0.50 0.26 -0.11 0.00 -3.04 0.00 0.00 32.46 30.07 2k1g n ARG 161 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 2k1g s SER 162 N -1.77 2.64 0.31 2.89 0.15 -1.26 -5.16 113.70 111.50 2k1g s SER 162 Ca 0.01 -0.93 -0.05 0.00 0.70 0.00 0.00 55.95 55.68 2k1g s SER 162 Cb -0.00 -0.15 -0.05 0.00 -1.71 0.00 0.00 66.02 64.11 2k1g s SER 162 CO 0.00 -0.09 0.59 -0.76 1.20 0.00 0.00 173.24 174.18 2k1g s LEU 163 N -2.95 4.01 0.00 3.45 1.02 -1.26 -5.34 118.68 117.61 2k1g s LEU 163 Ca 0.19 0.75 0.16 0.00 0.02 0.00 0.00 54.13 55.25 2k1g s LEU 163 Cb -0.04 -3.58 0.97 0.00 0.02 0.00 0.00 46.19 43.56 2k1g s LEU 163 CO 0.07 -0.24 1.37 -0.62 0.02 0.00 0.00 176.35 176.95