#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k1g n ASN 37 N 0.00 3.75 -4.37 7.83 6.94 -1.26 -4.95 115.26 123.20 2k1g n ASN 37 Ca 0.00 1.02 -0.45 0.00 -0.02 0.00 0.00 54.58 55.13 2k1g n ASN 37 Cb 0.00 -1.50 -0.05 0.00 -2.36 0.00 0.00 39.78 35.87 2k1g n ASN 37 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2k1g s VAL 38 N 2.19 4.93 -0.37 3.53 1.01 -1.26 -5.03 120.40 125.40 2k1g s VAL 38 Ca 0.81 -1.03 -0.21 0.00 0.00 0.00 0.00 61.98 61.55 2k1g s VAL 38 Cb -0.56 -4.41 0.01 0.00 0.00 0.00 0.00 36.38 31.42 2k1g s VAL 38 CO 0.38 -1.00 0.68 -1.81 0.00 0.00 0.00 175.10 173.36 2k1g s ASP 39 N 3.42 6.45 0.24 3.32 1.01 -1.26 -4.96 116.67 124.90 2k1g s ASP 39 Ca 0.10 0.16 -0.08 0.00 0.71 0.00 0.00 52.55 53.43 2k1g s ASP 39 Cb -0.25 -2.35 0.40 0.00 1.01 0.00 0.00 42.92 41.73 2k1g s ASP 39 CO 0.06 -0.66 1.63 0.58 0.21 0.00 0.00 175.17 177.00 2k1g h VAL 40 N 5.72 0.35 -0.48 -1.27 2.07 -1.96 -0.36 116.25 120.33 2k1g h VAL 40 Ca -0.26 -0.03 0.07 0.00 0.82 0.00 0.00 66.70 67.30 2k1g h VAL 40 Cb 1.10 0.26 -0.06 0.00 -1.52 0.00 0.00 31.29 31.07 2k1g h VAL 40 CO 0.87 0.02 0.15 0.50 0.02 0.00 0.00 177.57 179.12 2k1g h LYS 41 N 0.09 0.31 -0.52 1.57 3.64 -1.90 -1.87 116.57 117.89 2k1g h LYS 41 Ca 0.39 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.78 2k1g h LYS 41 Cb 0.67 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.38 2k1g h LYS 41 CO -0.66 0.20 0.31 1.03 -2.27 0.00 0.00 179.45 178.06 2k1g h SER 42 N 0.32 0.50 -0.75 4.20 0.87 -1.49 -0.09 113.55 117.10 2k1g h SER 42 Ca 0.23 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.76 2k1g h SER 42 Cb 0.26 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.09 2k1g h SER 42 CO -0.25 0.35 0.33 0.03 -0.53 0.00 0.00 176.83 176.76 2k1g h ARG 43 N 0.61 1.11 -0.20 2.24 2.47 -1.04 -0.48 114.38 119.10 2k1g h ARG 43 Ca 0.21 -0.18 -0.03 0.00 -1.26 0.00 0.00 59.98 58.72 2k1g h ARG 43 Cb 0.03 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.15 2k1g h ARG 43 CO -0.10 0.88 -0.01 0.82 0.56 0.00 0.00 179.97 182.13 2k1g h ILE 44 N 1.10 1.26 -0.69 2.04 2.04 -0.82 -2.20 117.51 120.24 2k1g h ILE 44 Ca 0.26 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 2k1g h ILE 44 Cb 0.16 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 2k1g h ILE 44 CO -0.03 0.27 0.32 0.24 0.00 0.00 0.00 178.15 178.95 2k1g h MET 45 N 0.11 0.99 -0.48 2.37 2.86 -0.84 -0.78 114.93 119.16 2k1g h MET 45 Ca 0.06 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2k1g h MET 45 Cb 0.40 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 2k1g h MET 45 CO 0.01 0.77 0.31 0.22 1.06 0.00 0.00 176.91 179.28 2k1g h ASP 46 N 0.98 0.55 -0.28 1.22 3.58 -1.00 -0.36 116.42 121.10 2k1g h ASP 46 Ca 0.24 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 2k1g h ASP 46 Cb 0.12 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.02 2k1g h ASP 46 CO -0.03 0.40 0.15 -0.61 -2.88 0.00 0.00 179.24 176.27 2k1g h GLN 47 N 0.64 0.40 -0.84 0.28 5.75 -0.89 -2.65 115.11 117.80 2k1g h GLN 47 Ca 0.17 -0.05 0.05 0.00 -0.15 0.00 0.00 58.65 58.67 2k1g h GLN 47 Cb -0.07 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 28.36 2k1g h GLN 47 CO -0.04 0.37 0.55 -0.92 -2.65 0.00 0.00 178.83 176.14 2k1g h TYR 48 N 0.33 0.98 -0.79 3.99 3.20 -0.94 -1.38 116.97 122.36 2k1g h TYR 48 Ca 0.10 0.02 0.19 0.00 3.14 0.00 0.00 58.73 62.18 2k1g h TYR 48 Cb 0.09 -0.32 -0.05 0.00 1.54 0.00 0.00 36.73 37.99 2k1g h TYR 48 CO -0.03 0.54 0.54 0.00 -1.64 0.00 0.00 178.16 177.58 2k1g h ALA 49 N 1.53 2.38 -0.11 1.82 0.00 -0.69 0.22 119.26 124.41 2k1g h ALA 49 Ca 0.35 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 55.07 2k1g h ALA 49 Cb 0.12 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.92 2k1g h ALA 49 CO -0.11 -0.61 -0.64 0.22 0.00 0.00 0.00 179.25 178.10 2k1g h ASP 50 N 0.24 0.76 -0.22 0.00 3.58 -1.22 -3.28 116.42 116.28 2k1g h ASP 50 Ca 0.39 -0.65 0.00 0.00 0.42 0.00 0.00 57.03 57.19 2k1g h ASP 50 Cb 1.17 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 42.00 2k1g h ASP 50 CO -0.09 1.28 0.00 0.79 -2.88 0.00 0.00 179.24 178.35 2k1g n TRP 51 N -4.10 0.28 -1.54 0.28 7.02 -0.35 -4.90 117.44 114.13 2k1g n TRP 51 Ca -0.08 -0.14 -0.48 0.00 -1.02 0.00 0.00 57.50 55.78 2k1g n TRP 51 Cb 0.67 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 29.51 2k1g n TRP 51 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2k1g n LYS 52 N 0.61 1.55 0.00 -0.99 5.02 0.65 -1.90 118.16 123.09 2k1g n LYS 52 Ca 0.17 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.92 2k1g n LYS 52 Cb 0.39 -2.72 0.00 0.00 -0.02 0.00 0.00 35.03 32.69 2k1g n LYS 52 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k1g n GLY 53 N 5.87 0.57 3.74 0.72 0.00 -1.26 -5.07 105.19 109.76 2k1g n GLY 53 Ca 0.34 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.95 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 4.01 0.82 1.61 1.01 -0.80 -4.94 120.40 120.11 2k1g s VAL 54 Ca 0.00 1.84 -0.12 0.00 0.00 0.00 0.00 61.98 63.70 2k1g s VAL 54 Cb 0.00 -4.17 0.09 0.00 0.00 0.00 0.00 36.38 32.29 2k1g s VAL 54 CO 0.00 0.36 1.12 0.00 0.00 0.00 0.00 175.10 176.58 2k1g s ARG 55 N -0.68 1.86 0.04 2.72 1.70 -1.26 -2.94 118.95 120.39 2k1g s ARG 55 Ca 0.46 0.46 -0.17 0.00 -0.47 0.00 0.00 55.73 56.00 2k1g s ARG 55 Cb -0.27 -1.91 -0.06 0.00 -0.57 0.00 0.00 34.95 32.14 2k1g s ARG 55 CO 0.34 -1.73 0.49 -0.47 -1.08 0.00 0.00 175.30 172.84 2k1g s TYR 56 N -3.26 3.77 0.38 5.89 5.04 -1.26 -0.83 117.35 127.08 2k1g s TYR 56 Ca 0.62 1.13 0.04 0.00 -2.44 0.00 0.00 57.07 56.42 2k1g s TYR 56 Cb -0.14 -2.39 -0.03 0.00 0.35 0.00 0.00 41.96 39.75 2k1g s TYR 56 CO 0.53 0.62 0.14 0.50 -1.34 0.00 0.00 175.55 176.00 2k1g s ARG 57 N -1.10 1.84 -0.38 4.97 3.52 0.07 -4.60 118.95 123.27 2k1g s ARG 57 Ca 0.26 -2.10 0.01 0.00 -0.13 0.00 0.00 55.73 53.78 2k1g s ARG 57 Cb -0.18 -0.47 0.12 0.00 -1.56 0.00 0.00 34.95 32.85 2k1g s ARG 57 CO 0.16 -0.46 0.16 -0.51 -0.81 0.00 0.00 175.30 173.84 2k1g s LEU 58 N -3.54 2.75 0.00 -0.88 1.43 -1.26 -3.37 118.68 113.81 2k1g s LEU 58 Ca 0.28 -2.19 0.00 0.00 -1.03 0.00 0.00 54.13 51.19 2k1g s LEU 58 Cb 0.03 -1.04 0.00 0.00 0.03 0.00 0.00 46.19 45.22 2k1g s LEU 58 CO 0.16 -0.34 0.00 0.61 0.23 0.00 0.00 176.35 177.01 2k1g n GLY 59 N 4.13 0.69 3.15 -3.19 0.00 -1.26 -5.04 105.19 103.67 2k1g n GLY 59 Ca 0.04 -0.39 0.06 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 -2.60 -0.55 -0.34 -0.02 0.00 -1.26 -5.09 107.32 97.47 2k1g s GLY 60 Ca 0.00 2.63 -0.29 0.00 0.00 0.00 0.00 44.72 47.06 2k1g s GLY 60 CO 0.00 4.07 1.16 -1.35 0.00 0.00 0.00 173.10 176.98 2k1g s SER 61 N 2.98 6.80 -0.06 1.64 1.04 -1.26 -4.30 113.70 120.55 2k1g s SER 61 Ca 0.14 1.02 -0.31 0.00 0.48 0.00 0.00 55.95 57.28 2k1g s SER 61 Cb -0.04 -2.54 0.11 0.00 0.10 0.00 0.00 66.02 63.65 2k1g s SER 61 CO -0.16 -1.00 1.01 0.28 0.98 0.00 0.00 173.24 174.35 2k1g s THR 62 N 4.00 0.00 -1.30 2.02 -1.32 -0.99 -5.00 115.64 113.05 2k1g s THR 62 Ca 0.49 -0.04 0.17 0.00 -1.21 0.00 0.00 61.69 61.10 2k1g s THR 62 Cb -0.13 -1.09 0.25 0.00 -1.51 0.00 0.00 72.50 70.03 2k1g s THR 62 CO 0.20 0.00 1.51 0.29 -2.21 0.00 0.00 174.62 174.42 2k1g n LYS 63 N -0.22 0.17 0.01 7.08 4.01 -1.26 -1.28 118.16 126.68 2k1g n LYS 63 Ca -0.06 0.15 0.14 0.00 -0.51 0.00 0.00 58.31 58.03 2k1g n LYS 63 Cb 0.61 -1.50 0.53 0.00 -0.51 0.00 0.00 35.03 34.16 2k1g n LYS 63 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2k1g n LYS 64 N -1.35 0.04 0.00 1.97 4.76 -1.26 -4.66 118.16 117.66 2k1g n LYS 64 Ca 0.07 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 2k1g n LYS 64 Cb 0.15 -1.54 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 2k1g n LYS 64 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k1g n GLY 65 N 1.47 3.89 2.95 0.72 0.00 -0.40 -4.72 105.19 109.10 2k1g n GLY 65 Ca 0.07 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.17 0.04 0.47 -0.61 1.10 -0.01 -2.35 121.20 118.67 2k1g s ILE 66 Ca 0.00 -0.29 0.01 0.00 -0.51 0.00 0.00 60.65 59.86 2k1g s ILE 66 Cb 0.00 -0.16 0.01 0.00 0.15 0.00 0.00 42.46 42.46 2k1g s ILE 66 CO 0.00 -0.16 0.69 1.51 -2.11 0.00 0.00 174.94 174.87 2k1g s ASP 67 N -0.48 5.65 0.14 4.50 -4.77 -1.22 -0.75 116.67 119.75 2k1g s ASP 67 Ca -0.05 0.13 -0.25 0.00 -3.30 0.00 0.00 52.55 49.08 2k1g s ASP 67 Cb -0.03 -1.27 -0.01 0.00 -1.09 0.00 0.00 42.92 40.52 2k1g s ASP 67 CO -0.00 -0.83 1.62 0.00 0.70 0.00 0.00 175.17 176.66 2k1g h SER 69 N -0.35 0.53 -1.00 0.00 4.64 -1.88 -3.16 113.55 112.33 2k1g h SER 69 Ca 0.11 -0.37 0.16 0.00 -0.47 0.00 0.00 61.79 61.21 2k1g h SER 69 Cb 0.51 -0.14 -0.10 0.00 -0.31 0.00 0.00 62.40 62.36 2k1g h SER 69 CO -0.35 0.78 0.62 1.23 -0.87 0.00 0.00 176.83 178.24 2k1g h GLY 70 N 0.27 1.73 0.96 -0.77 0.00 -1.71 -0.12 103.07 103.43 2k1g h GLY 70 Ca 0.07 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 46.97 2k1g h GLY 70 CO 0.03 0.04 -0.36 -2.75 0.00 0.00 0.00 176.54 173.50 2k1g h PHE 71 N 0.87 -0.93 -0.67 5.60 3.57 -1.11 -1.59 116.94 122.68 2k1g h PHE 71 Ca 0.54 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 62.04 2k1g h PHE 71 Cb 0.71 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.72 2k1g h PHE 71 CO -0.00 -0.57 0.44 -0.24 -2.23 0.00 0.00 178.31 175.71 2k1g h VAL 72 N -1.06 1.14 0.51 1.41 3.04 -1.49 -1.57 116.25 118.24 2k1g h VAL 72 Ca -0.10 -0.30 -0.02 0.00 -1.01 0.00 0.00 66.70 65.27 2k1g h VAL 72 Cb 0.78 0.20 -0.02 0.00 -2.01 0.00 0.00 31.29 30.25 2k1g h VAL 72 CO 0.17 0.16 -0.45 1.56 -1.01 0.00 0.00 177.57 178.00 2k1g h GLN 73 N 0.87 -0.91 -0.55 4.17 4.20 -0.90 -2.73 115.11 119.25 2k1g h GLN 73 Ca 0.25 0.06 0.01 0.00 0.06 0.00 0.00 58.65 59.03 2k1g h GLN 73 Cb -0.04 0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.92 2k1g h GLN 73 CO -0.06 -0.61 0.36 0.00 -0.67 0.00 0.00 178.83 177.85 2k1g h ARG 74 N -0.95 0.73 0.21 1.46 3.08 -1.06 -2.46 114.38 115.38 2k1g h ARG 74 Ca -0.07 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 59.95 2k1g h ARG 74 Cb 0.81 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.67 2k1g h ARG 74 CO -0.02 0.48 -0.27 1.15 -1.07 0.00 0.00 179.97 180.24 2k1g h THR 75 N 0.75 0.41 -0.01 2.04 2.02 -1.16 -1.89 112.91 115.08 2k1g h THR 75 Ca 0.20 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.21 2k1g h THR 75 Cb -0.09 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.72 2k1g h THR 75 CO -0.04 0.00 -0.78 -0.26 0.37 0.00 0.00 175.52 174.81 2k1g h PHE 76 N -0.54 0.13 0.01 3.16 -1.00 -1.30 -2.39 116.94 115.01 2k1g h PHE 76 Ca 0.01 -0.07 -0.16 0.00 2.81 0.00 0.00 57.97 60.56 2k1g h PHE 76 Cb 0.52 -0.02 0.01 0.00 3.61 0.00 0.00 35.95 40.08 2k1g h PHE 76 CO -0.21 0.83 -0.65 0.07 -1.61 0.00 0.00 178.31 176.74 2k1g h ARG 77 N 0.06 0.43 0.00 1.51 0.11 -1.41 0.29 114.38 115.37 2k1g h ARG 77 Ca -0.02 -0.47 -0.20 0.00 0.10 0.00 0.00 59.98 59.39 2k1g h ARG 77 Cb 1.36 0.13 -0.01 0.00 1.11 0.00 0.00 29.97 32.57 2k1g h ARG 77 CO 0.11 1.13 -0.89 0.93 0.10 0.00 0.00 179.97 181.35 2k1g h GLU 78 N -0.08 0.24 0.00 0.08 3.07 -1.44 -2.45 114.58 114.01 2k1g h GLU 78 Ca -0.08 -0.26 -0.06 0.00 -0.50 0.00 0.00 59.36 58.45 2k1g h GLU 78 Cb 1.36 0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 29.34 2k1g h GLU 78 CO 0.13 0.98 -0.57 1.96 -1.40 0.00 0.00 179.01 180.11 2k1g h GLN 79 N 0.13 0.00 0.00 2.33 1.08 -1.54 -3.42 115.11 113.70 2k1g h GLN 79 Ca -0.05 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2k1g h GLN 79 Cb 1.52 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.95 2k1g h GLN 79 CO 0.14 0.36 -1.57 1.19 -0.95 0.00 0.00 178.83 178.00 2k1g n PHE 80 N -4.60 0.00 -2.39 2.96 3.72 -0.24 -5.01 117.46 111.91 2k1g n PHE 80 Ca -0.13 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.23 2k1g n PHE 80 Cb 0.35 -0.28 0.02 0.00 -0.94 0.00 0.00 39.48 38.62 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 1.36 0.36 3.71 1.37 0.00 0.87 -4.96 105.19 107.91 2k1g n GLY 81 Ca -0.01 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.75 3.79 -0.33 0.99 2.96 -0.59 -4.91 118.68 117.85 2k1g s LEU 82 Ca 0.03 0.19 -0.24 0.00 -0.22 0.00 0.00 54.13 53.89 2k1g s LEU 82 Cb -0.01 -1.90 0.01 0.00 0.50 0.00 0.00 46.19 44.78 2k1g s LEU 82 CO 0.15 0.34 0.81 -1.83 -1.32 0.00 0.00 176.35 174.50 2k1g s GLU 83 N -0.63 3.88 0.10 1.98 -1.05 -1.26 -3.72 118.70 118.00 2k1g s GLU 83 Ca 0.11 0.51 0.07 0.00 -0.15 0.00 0.00 54.97 55.51 2k1g s GLU 83 Cb -0.12 -3.77 -0.03 0.00 -0.44 0.00 0.00 34.13 29.77 2k1g s GLU 83 CO 0.02 -0.78 -0.18 -0.51 0.95 0.00 0.00 175.26 174.77 2k1g s LEU 84 N 3.10 2.33 0.00 1.83 1.43 -1.26 -5.11 118.68 121.00 2k1g s LEU 84 Ca 0.33 -0.71 0.00 0.00 -1.03 0.00 0.00 54.13 52.72 2k1g s LEU 84 Cb -0.13 -0.72 0.00 0.00 0.03 0.00 0.00 46.19 45.37 2k1g s LEU 84 CO 0.15 -0.02 0.00 -0.81 0.23 0.00 0.00 176.35 175.89 2k1g n PRO 85 N 0.95 1.81 -0.03 1.29 -0.04 -1.26 -5.04 135.00 132.68 2k1g n PRO 85 Ca -0.19 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.27 2k1g n PRO 85 Cb 0.55 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.93 2k1g n PRO 85 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2k1g n ARG 86 N 0.00 1.54 -4.49 0.54 0.63 -1.26 -4.96 116.66 108.65 2k1g n ARG 86 Ca 0.00 -0.04 -0.29 0.00 -0.92 0.00 0.00 57.85 56.60 2k1g n ARG 86 Cb 0.00 -1.26 -0.13 0.00 0.45 0.00 0.00 32.46 31.52 2k1g n ARG 86 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 2k1g s SER 87 N -3.84 3.17 0.21 6.15 0.01 -1.26 -4.51 113.70 113.64 2k1g s SER 87 Ca -0.05 -0.70 -0.09 0.00 1.31 0.00 0.00 55.95 56.42 2k1g s SER 87 Cb 0.05 -0.22 0.30 0.00 0.21 0.00 0.00 66.02 66.35 2k1g s SER 87 CO 0.43 0.18 1.72 0.74 0.41 0.00 0.00 173.24 176.72 2k1g h THR 88 N 3.99 0.69 -0.84 1.44 2.02 -1.94 -0.86 112.91 117.42 2k1g h THR 88 Ca -0.49 -0.11 0.21 0.00 0.77 0.00 0.00 66.41 66.79 2k1g h THR 88 Cb 1.16 0.33 -0.05 0.00 -1.74 0.00 0.00 68.15 67.86 2k1g h THR 88 CO 0.40 0.06 0.58 1.88 0.37 0.00 0.00 175.52 178.81 2k1g h TYR 89 N 0.33 0.26 0.18 3.16 -1.99 -1.97 0.22 116.97 117.16 2k1g h TYR 89 Ca 0.32 0.01 -0.31 0.00 2.00 0.00 0.00 58.73 60.75 2k1g h TYR 89 Cb 0.45 -0.08 0.02 0.00 2.00 0.00 0.00 36.73 39.12 2k1g h TYR 89 CO -0.21 0.07 -1.43 0.93 -0.00 0.00 0.00 178.16 177.52 2k1g h GLU 90 N 0.20 0.38 -0.24 4.88 5.08 -1.60 -3.32 114.58 119.96 2k1g h GLU 90 Ca 0.42 -0.65 -0.02 0.00 -1.00 0.00 0.00 59.36 58.11 2k1g h GLU 90 Cb 1.33 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.81 2k1g h GLU 90 CO -0.09 1.30 0.07 1.96 -1.00 0.00 0.00 179.01 181.25 2k1g h GLN 91 N 0.10 0.33 -0.90 2.33 4.20 -0.35 -2.42 115.11 118.41 2k1g h GLN 91 Ca -0.22 -0.04 0.15 0.00 0.06 0.00 0.00 58.65 58.60 2k1g h GLN 91 Cb 2.07 -0.06 -0.09 0.00 0.30 0.00 0.00 27.48 29.69 2k1g h GLN 91 CO 0.22 0.30 0.51 1.96 -0.67 0.00 0.00 178.83 181.15 2k1g h GLN 92 N 0.33 0.71 0.00 1.46 4.20 -1.48 -0.85 115.11 119.48 2k1g h GLN 92 Ca 0.08 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2k1g h GLN 92 Cb 0.11 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.73 2k1g h GLN 92 CO -0.01 0.47 0.00 0.39 -0.67 0.00 0.00 178.83 179.01 2k1g n GLU 93 N -4.80 0.07 0.00 1.46 1.02 -0.91 -3.48 120.64 114.01 2k1g n GLU 93 Ca 0.18 0.12 0.15 0.00 -0.02 0.00 0.00 57.16 57.59 2k1g n GLU 93 Cb 0.43 -1.59 0.76 0.00 -0.02 0.00 0.00 31.44 31.02 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 -1.72 0.57 -3.79 3.49 2.81 -0.32 -4.87 117.12 113.28 2k1g n MET 94 Ca 0.06 -0.05 -0.10 0.00 -1.81 0.00 0.00 57.70 55.80 2k1g n MET 94 Cb 0.33 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 31.28 2k1g n MET 94 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2k1g s GLY 95 N -2.47 0.06 0.73 3.03 0.00 -1.23 -4.71 107.32 102.73 2k1g s GLY 95 Ca 0.32 -0.43 -0.06 0.00 0.00 0.00 0.00 44.72 44.55 2k1g s GLY 95 CO 0.45 -0.51 1.04 0.54 0.00 0.00 0.00 173.10 174.62 2k1g s LYS 96 N -3.88 1.93 -0.01 2.90 1.02 -1.25 -4.79 119.74 115.65 2k1g s LYS 96 Ca 0.10 -0.44 -0.11 0.00 0.02 0.00 0.00 55.97 55.53 2k1g s LYS 96 Cb 0.02 -2.17 -0.05 0.00 -0.52 0.00 0.00 37.83 35.10 2k1g s LYS 96 CO -0.05 -1.40 0.32 -1.54 -0.92 0.00 0.00 175.35 171.77 2k1g s SER 97 N -4.60 6.64 0.13 2.83 1.04 -1.26 -2.28 113.70 116.21 2k1g s SER 97 Ca 0.63 0.77 0.04 0.00 0.48 0.00 0.00 55.95 57.87 2k1g s SER 97 Cb -0.09 -2.17 -0.04 0.00 0.10 0.00 0.00 66.02 63.82 2k1g s SER 97 CO 0.45 0.31 -0.10 0.68 0.98 0.00 0.00 173.24 175.56 2k1g s VAL 98 N -1.15 1.10 0.54 5.02 -7.23 -1.03 -4.95 120.40 112.70 2k1g s VAL 98 Ca 0.24 -1.90 0.09 0.00 -1.81 0.00 0.00 61.98 58.60 2k1g s VAL 98 Cb -0.15 -1.67 0.07 0.00 0.56 0.00 0.00 36.38 35.19 2k1g s VAL 98 CO 0.12 -0.67 0.74 -0.55 -0.31 0.00 0.00 175.10 174.43 2k1g s SER 99 N -2.89 5.23 0.23 4.85 0.15 -1.26 -3.90 113.70 116.11 2k1g s SER 99 Ca 0.12 -0.75 -0.09 0.00 0.70 0.00 0.00 55.95 55.93 2k1g s SER 99 Cb 0.00 0.07 0.36 0.00 -1.71 0.00 0.00 66.02 64.74 2k1g s SER 99 CO 0.00 -1.20 1.64 0.03 1.20 0.00 0.00 173.24 174.91 2k1g h ARG 100 N 0.29 0.09 0.00 5.44 2.47 -2.02 0.14 114.38 120.80 2k1g h ARG 100 Ca -0.32 -0.01 -0.08 0.00 -1.26 0.00 0.00 59.98 58.31 2k1g h ARG 100 Cb 1.29 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.58 2k1g h ARG 100 CO 0.42 0.06 -0.39 0.77 0.56 0.00 0.00 179.97 181.39 2k1g h SER 101 N 0.09 0.00 0.90 7.04 0.02 -2.07 -3.02 113.55 116.51 2k1g h SER 101 Ca 0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.31 2k1g h SER 101 Cb 0.61 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.15 2k1g h SER 101 CO -0.62 0.39 -0.49 0.59 -1.14 0.00 0.00 176.83 175.56 2k1g n ASN 102 N -3.86 0.64 -4.64 3.07 4.13 0.34 -4.91 115.26 110.02 2k1g n ASN 102 Ca -0.01 0.15 -0.50 0.00 1.68 0.00 0.00 54.58 55.90 2k1g n ASN 102 Cb 0.45 0.01 -0.05 0.00 -1.54 0.00 0.00 39.78 38.65 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 -2.00 2.52 -4.47 3.41 4.77 -0.24 -4.85 117.00 116.13 2k1g n LEU 103 Ca 0.04 1.08 -0.23 0.00 -0.03 0.00 0.00 56.01 56.87 2k1g n LEU 103 Cb 0.42 -1.31 -0.10 0.00 -2.33 0.00 0.00 43.42 40.11 2k1g n LEU 103 CO 0.35 -0.56 -0.24 -0.13 -1.33 0.00 0.00 177.39 175.48 2k1g s ARG 104 N 1.34 1.75 -0.04 3.23 0.52 -1.26 -4.99 118.95 119.50 2k1g s ARG 104 Ca 0.84 -2.02 -0.30 0.00 -0.52 0.00 0.00 55.73 53.74 2k1g s ARG 104 Cb -0.82 -0.75 -0.05 0.00 0.52 0.00 0.00 34.95 33.85 2k1g s ARG 104 CO 0.45 -0.31 1.50 0.99 0.02 0.00 0.00 175.30 177.95 2k1g s THR 105 N -3.29 3.70 0.00 0.02 2.01 -1.26 -2.73 115.64 114.09 2k1g s THR 105 Ca 0.31 0.97 0.00 0.00 0.31 0.00 0.00 61.69 63.28 2k1g s THR 105 Cb 0.06 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.95 2k1g s THR 105 CO 0.15 -0.05 0.00 0.61 -0.69 0.00 0.00 174.62 174.64 2k1g n GLY 106 N 3.86 0.93 3.86 4.40 0.00 -0.10 -4.88 105.19 113.26 2k1g n GLY 106 Ca 0.15 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2k1g n GLY 106 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k1g s ASP 107 N -2.02 6.65 -0.52 1.61 -1.08 -1.10 -4.72 116.67 115.48 2k1g s ASP 107 Ca 0.00 1.30 -0.18 0.00 -0.52 0.00 0.00 52.55 53.15 2k1g s ASP 107 Cb 0.00 -2.39 0.08 0.00 -1.46 0.00 0.00 42.92 39.15 2k1g s ASP 107 CO 0.00 -0.37 0.58 -0.76 0.52 0.00 0.00 175.17 175.14 2k1g s LEU 108 N -3.57 5.36 -0.24 -1.34 1.43 -0.42 -1.33 118.68 118.58 2k1g s LEU 108 Ca 0.54 -1.23 -0.15 0.00 -1.03 0.00 0.00 54.13 52.26 2k1g s LEU 108 Cb -0.10 -2.32 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 2k1g s LEU 108 CO 0.25 -0.88 0.36 0.68 0.23 0.00 0.00 176.35 176.99 2k1g s VAL 109 N 2.29 5.20 -0.27 -1.59 -7.23 -0.64 -0.26 120.40 117.91 2k1g s VAL 109 Ca 0.10 0.59 -0.14 0.00 -1.81 0.00 0.00 61.98 60.72 2k1g s VAL 109 Cb -0.23 -3.69 -0.04 0.00 0.56 0.00 0.00 36.38 32.98 2k1g s VAL 109 CO 0.08 0.22 0.33 -0.76 -0.31 0.00 0.00 175.10 174.66 2k1g s LEU 110 N 1.63 4.04 0.15 1.32 1.43 0.37 -1.33 118.68 126.28 2k1g s LEU 110 Ca 0.16 0.23 0.08 0.00 -1.03 0.00 0.00 54.13 53.57 2k1g s LEU 110 Cb -0.15 -2.35 -0.04 0.00 0.03 0.00 0.00 46.19 43.68 2k1g s LEU 110 CO 0.08 -0.14 -0.11 -0.36 0.23 0.00 0.00 176.35 176.05 2k1g s PHE 111 N 1.94 2.66 -0.50 0.29 0.08 0.77 -1.01 117.98 122.20 2k1g s PHE 111 Ca 0.13 -0.21 -0.21 0.00 0.12 0.00 0.00 56.93 56.77 2k1g s PHE 111 Cb -0.16 -1.35 0.05 0.00 -0.57 0.00 0.00 43.02 40.99 2k1g s PHE 111 CO 0.10 0.46 0.73 1.03 -0.10 0.00 0.00 175.22 177.44 2k1g s ARG 112 N -2.52 3.22 -0.11 0.44 0.52 -0.17 -1.09 118.95 119.24 2k1g s ARG 112 Ca 0.23 -0.58 -0.05 0.00 -0.52 0.00 0.00 55.73 54.81 2k1g s ARG 112 Cb -0.10 -4.05 -0.04 0.00 0.52 0.00 0.00 34.95 31.28 2k1g s ARG 112 CO 0.14 -1.26 0.07 0.00 0.02 0.00 0.00 175.30 174.27 2k1g s ALA 113 N 3.08 3.57 0.26 2.13 0.00 0.13 -4.84 121.76 126.11 2k1g s ALA 113 Ca 0.22 -0.72 0.30 0.00 0.00 0.00 0.00 51.96 51.75 2k1g s ALA 113 Cb -0.16 -1.74 1.36 0.00 0.00 0.00 0.00 23.12 22.58 2k1g s ALA 113 CO 0.16 0.57 2.00 0.78 0.00 0.00 0.00 175.76 179.27 2k1g h GLY 114 N 5.19 0.00 0.00 0.00 0.00 -1.97 -1.16 103.07 105.13 2k1g h GLY 114 Ca -0.52 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.81 2k1g h GLY 114 CO 0.57 0.00 0.00 -1.26 0.00 0.00 0.00 176.54 175.85 2k1g n SER 115 N -3.36 0.00 0.04 0.19 2.88 -1.26 -4.70 113.62 107.41 2k1g n SER 115 Ca -0.01 0.19 -0.11 0.00 -1.33 0.00 0.00 58.87 57.61 2k1g n SER 115 Cb 0.30 -0.29 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 2k1g n SER 115 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 2k1g h THR 116 N 0.00 1.37 0.00 2.46 1.35 -2.00 -3.49 112.91 112.60 2k1g h THR 116 Ca 0.00 -2.17 0.00 0.00 -0.55 0.00 0.00 66.41 63.69 2k1g h THR 116 Cb 0.00 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 2k1g h THR 116 CO 0.00 0.66 0.00 0.61 -0.25 0.00 0.00 175.52 176.54 2k1g n GLY 117 N 0.64 0.57 3.42 5.82 0.00 -0.44 -4.84 105.19 110.38 2k1g n GLY 117 Ca -0.05 -0.68 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 2k1g n GLY 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k1g s ARG 118 N 0.00 3.38 -0.07 1.61 3.00 -1.26 -0.69 118.95 124.93 2k1g s ARG 118 Ca 0.00 -1.54 -0.08 0.00 0.00 0.00 0.00 55.73 54.11 2k1g s ARG 118 Cb 0.00 -4.59 -0.04 0.00 0.00 0.00 0.00 34.95 30.31 2k1g s ARG 118 CO 0.00 -1.69 0.22 -1.58 0.00 0.00 0.00 175.30 172.25 2k1g s HIS 119 N 2.74 3.62 -0.02 -0.53 2.46 -0.25 -4.76 115.29 118.54 2k1g s HIS 119 Ca 0.25 0.63 0.08 0.00 0.47 0.00 0.00 55.06 56.48 2k1g s HIS 119 Cb -0.12 -2.02 -0.02 0.00 -0.13 0.00 0.00 32.58 30.30 2k1g s HIS 119 CO -0.02 0.69 -0.25 0.54 -2.47 0.00 0.00 174.74 173.23 2k1g s VAL 120 N -1.10 2.14 0.08 0.89 0.11 -1.26 -0.17 120.40 121.09 2k1g s VAL 120 Ca 0.20 -1.07 0.05 0.00 -2.93 0.00 0.00 61.98 58.22 2k1g s VAL 120 Cb -0.13 -1.75 -0.03 0.00 -1.53 0.00 0.00 36.38 32.94 2k1g s VAL 120 CO 0.09 0.58 -0.13 -0.83 -3.33 0.00 0.00 175.10 171.48 2k1g s GLY 121 N -0.60 0.87 -0.50 6.54 0.00 -0.44 -4.68 107.32 108.51 2k1g s GLY 121 Ca 0.10 -1.07 -0.23 0.00 0.00 0.00 0.00 44.72 43.52 2k1g s GLY 121 CO -0.01 -1.11 0.83 -0.42 0.00 0.00 0.00 173.10 172.39 2k1g s ILE 122 N -1.64 4.56 -0.40 0.90 1.01 0.11 -1.62 121.20 124.11 2k1g s ILE 122 Ca 0.01 0.25 -0.27 0.00 0.00 0.00 0.00 60.65 60.63 2k1g s ILE 122 Cb -0.08 -4.41 -0.04 0.00 0.01 0.00 0.00 42.46 37.94 2k1g s ILE 122 CO 0.02 -0.90 2.02 -0.47 0.00 0.00 0.00 174.94 175.61 2k1g s TYR 123 N 3.49 1.50 -0.11 3.97 5.04 -0.44 -1.53 117.35 129.27 2k1g s TYR 123 Ca 0.28 0.84 0.16 0.00 -2.44 0.00 0.00 57.07 55.91 2k1g s TYR 123 Cb -0.13 -3.97 -0.17 0.00 0.35 0.00 0.00 41.96 38.04 2k1g s TYR 123 CO 0.20 -2.95 0.71 0.44 -1.34 0.00 0.00 175.55 172.61 2k1g n ILE 124 N 7.56 1.22 0.00 3.14 -5.35 -0.61 -0.92 119.36 124.40 2k1g n ILE 124 Ca 0.27 -0.72 0.00 0.00 -0.27 0.00 0.00 62.75 62.03 2k1g n ILE 124 Cb 0.49 -0.73 0.00 0.00 -1.74 0.00 0.00 39.64 37.66 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 1.45 2.60 3.27 3.28 0.00 -1.06 -4.79 105.19 109.94 2k1g n GLY 125 Ca -0.13 0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 2k1g n GLY 125 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2k1g n ASN 126 N 0.00 -6.37 0.00 1.61 2.85 -1.26 -2.24 115.26 109.85 2k1g n ASN 126 Ca 0.00 0.17 0.00 0.00 -0.11 0.00 0.00 54.58 54.64 2k1g n ASN 126 Cb 0.00 -2.73 0.00 0.00 1.24 0.00 0.00 39.78 38.29 2k1g n ASN 126 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2k1g n ASN 127 N 0.04 0.00 -4.80 1.20 4.13 -1.26 -4.94 115.26 109.63 2k1g n ASN 127 Ca -0.02 0.00 -0.38 0.00 1.68 0.00 0.00 54.58 55.86 2k1g n ASN 127 Cb 0.57 -0.34 -0.06 0.00 -1.54 0.00 0.00 39.78 38.40 2k1g n ASN 127 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2k1g s GLN 128 N 0.00 4.33 -0.02 3.52 -0.21 -0.95 -0.64 119.66 125.69 2k1g s GLN 128 Ca 0.00 0.91 -0.23 0.00 0.02 0.00 0.00 55.36 56.06 2k1g s GLN 128 Cb 0.00 -3.14 0.05 0.00 1.00 0.00 0.00 33.01 30.92 2k1g s GLN 128 CO 0.00 0.54 0.50 -0.59 -2.12 0.00 0.00 175.29 173.62 2k1g s PHE 129 N -1.25 -0.42 -0.10 0.91 -0.71 -0.43 -1.58 117.98 114.41 2k1g s PHE 129 Ca 0.35 0.66 -0.02 0.00 -1.04 0.00 0.00 56.93 56.88 2k1g s PHE 129 Cb -0.20 0.27 -0.03 0.00 -1.21 0.00 0.00 43.02 41.85 2k1g s PHE 129 CO 0.22 -0.52 0.01 0.54 -1.34 0.00 0.00 175.22 174.12 2k1g s VAL 130 N -1.46 4.35 0.31 -2.49 0.11 -0.58 -0.60 120.40 120.05 2k1g s VAL 130 Ca -0.11 -0.23 -0.16 0.00 -2.93 0.00 0.00 61.98 58.55 2k1g s VAL 130 Cb -0.02 -2.84 0.02 0.00 -1.53 0.00 0.00 36.38 32.01 2k1g s VAL 130 CO 0.06 0.59 0.67 -1.38 -3.33 0.00 0.00 175.10 171.71 2k1g s HIS 131 N -0.71 0.14 -0.24 1.54 -3.43 -0.06 -0.72 115.29 111.81 2k1g s HIS 131 Ca 0.11 -0.62 -0.08 0.00 -0.80 0.00 0.00 55.06 53.67 2k1g s HIS 131 Cb -0.12 0.57 -0.04 0.00 -1.43 0.00 0.00 32.58 31.57 2k1g s HIS 131 CO 0.02 -1.29 0.10 0.00 -2.00 0.00 0.00 174.74 171.58 2k1g s ALA 132 N -3.35 3.34 0.26 -1.38 0.00 -1.26 -0.67 121.76 118.71 2k1g s ALA 132 Ca 0.16 -1.00 0.10 0.00 0.00 0.00 0.00 51.96 51.22 2k1g s ALA 132 Cb -0.04 -2.15 -0.04 0.00 0.00 0.00 0.00 23.12 20.89 2k1g s ALA 132 CO 0.10 -0.31 -0.05 0.45 0.00 0.00 0.00 175.76 175.95 2k1g s SER 133 N 1.29 4.33 0.04 0.00 0.15 0.20 -4.25 113.70 115.47 2k1g s SER 133 Ca 0.06 -0.72 -0.15 0.00 0.70 0.00 0.00 55.95 55.84 2k1g s SER 133 Cb -0.15 -0.73 -0.07 0.00 -1.71 0.00 0.00 66.02 63.37 2k1g s SER 133 CO 0.05 0.02 1.23 0.71 1.20 0.00 0.00 173.24 176.45 2k1g h THR 134 N 2.02 0.00 0.11 6.45 1.35 -1.98 -0.57 112.91 120.30 2k1g h THR 134 Ca -0.44 0.00 -0.33 0.00 -0.55 0.00 0.00 66.41 65.10 2k1g h THR 134 Cb 1.25 0.00 -0.01 0.00 -1.73 0.00 0.00 68.15 67.65 2k1g h THR 134 CO 0.60 0.00 -1.72 -1.28 -0.25 0.00 0.00 175.52 172.87 2k1g h SER 135 N -0.38 0.36 0.80 5.36 0.87 -1.98 -3.36 113.55 115.22 2k1g h SER 135 Ca -0.02 -0.61 0.00 0.00 -1.23 0.00 0.00 61.79 59.93 2k1g h SER 135 Cb 0.35 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 2k1g h SER 135 CO -0.07 1.53 0.00 -1.20 -0.53 0.00 0.00 176.83 176.56 2k1g n SER 136 N -3.41 0.00 0.00 6.23 7.64 -1.24 -4.87 113.62 117.97 2k1g n SER 136 Ca -0.22 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.02 2k1g n SER 136 Cb 1.05 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 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 1.14 1.79 2.77 0.23 0.00 -0.22 -4.56 105.19 106.34 2k1g n GLY 137 Ca 0.08 0.09 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 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 0.60 0.27 1.61 1.01 -1.15 0.63 120.40 123.37 2k1g s VAL 138 Ca 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 61.59 2k1g s VAL 138 Cb 0.00 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2k1g s VAL 138 CO 0.00 -0.03 0.17 0.27 0.00 0.00 0.00 175.10 175.51 2k1g s ILE 139 N 1.84 0.14 -0.19 2.22 -4.36 0.16 -4.48 121.20 116.53 2k1g s ILE 139 Ca 0.01 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.34 2k1g s ILE 139 Cb -0.16 -2.51 -0.03 0.00 1.25 0.00 0.00 42.46 41.01 2k1g s ILE 139 CO -0.07 0.00 0.01 -0.63 0.24 0.00 0.00 174.94 174.48 2k1g s ILE 140 N -3.79 4.14 0.51 8.37 1.01 -1.26 -0.88 121.20 129.30 2k1g s ILE 140 Ca 0.38 -0.26 0.02 0.00 0.00 0.00 0.00 60.65 60.79 2k1g s ILE 140 Cb 0.05 -2.86 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 2k1g s ILE 140 CO 0.18 0.45 0.04 -0.44 0.00 0.00 0.00 174.94 175.16 2k1g s SER 141 N 0.71 4.17 -0.06 3.58 0.01 0.24 -4.96 113.70 117.38 2k1g s SER 141 Ca 0.00 -1.61 -0.05 0.00 1.31 0.00 0.00 55.95 55.60 2k1g s SER 141 Cb -0.14 0.49 0.02 0.00 0.21 0.00 0.00 66.02 66.60 2k1g s SER 141 CO 0.02 -0.86 0.16 -0.44 0.41 0.00 0.00 173.24 172.53 2k1g s SER 142 N -3.91 -0.17 0.00 2.44 0.01 -1.26 -1.31 113.70 109.51 2k1g s SER 142 Ca 0.09 0.33 0.09 0.00 1.31 0.00 0.00 55.95 57.77 2k1g s SER 142 Cb 0.01 0.32 0.55 0.00 0.21 0.00 0.00 66.02 67.12 2k1g s SER 142 CO 0.05 -0.06 0.98 0.23 0.41 0.00 0.00 173.24 174.85 2k1g n MET 143 N 3.09 0.46 0.15 12.44 2.81 0.19 -1.25 117.12 135.00 2k1g n MET 143 Ca -0.14 0.00 0.01 0.00 -1.81 0.00 0.00 57.70 55.76 2k1g n MET 143 Cb 0.58 -1.32 0.22 0.00 -0.71 0.00 0.00 33.22 32.00 2k1g n MET 143 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2k1g h ASN 144 N 0.00 0.00 -3.03 7.83 -0.26 -1.95 -3.29 115.58 114.89 2k1g h ASN 144 Ca 0.00 0.00 -0.54 0.00 -0.56 0.00 0.00 56.30 55.20 2k1g h ASN 144 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 2k1g h ASN 144 CO 0.00 0.54 0.72 -1.61 -1.06 0.00 0.00 177.43 176.02 2k1g s GLU 145 N -3.62 4.34 0.31 0.81 2.02 -0.38 -4.87 118.70 117.30 2k1g s GLU 145 Ca -0.01 1.92 0.07 0.00 0.02 0.00 0.00 54.97 56.97 2k1g s GLU 145 Cb 0.12 -3.42 0.83 0.00 0.10 0.00 0.00 34.13 31.76 2k1g s GLU 145 CO 0.74 -0.44 1.71 -1.00 0.02 0.00 0.00 175.26 176.28 2k1g h PRO 146 N 7.24 0.45 -0.06 0.39 0.13 -1.88 0.62 132.00 138.89 2k1g h PRO 146 Ca -0.40 -0.03 0.04 0.00 -0.87 0.00 0.00 66.00 64.74 2k1g h PRO 146 Cb 1.19 -0.10 -0.05 0.00 0.13 0.00 0.00 31.00 32.17 2k1g h PRO 146 CO 0.87 0.30 -0.25 -0.92 -0.23 0.00 0.00 178.00 177.77 2k1g h TYR 147 N 0.47 -0.66 0.00 1.56 3.20 -1.94 -2.66 116.97 116.94 2k1g h TYR 147 Ca 0.61 0.03 -0.22 0.00 3.14 0.00 0.00 58.73 62.29 2k1g h TYR 147 Cb 1.19 0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.76 2k1g h TYR 147 CO -0.07 -0.33 -0.93 -1.49 -1.64 0.00 0.00 178.16 173.69 2k1g h TRP 148 N -0.35 0.56 -0.55 -3.82 4.06 -1.50 -3.09 115.95 111.27 2k1g h TRP 148 Ca 0.08 -0.31 0.11 0.00 2.06 0.00 0.00 58.89 60.83 2k1g h TRP 148 Cb 0.46 -0.06 -0.03 0.00 -1.00 0.00 0.00 29.16 28.53 2k1g h TRP 148 CO -0.31 1.13 0.38 -0.22 -3.56 0.00 0.00 178.44 175.85 2k1g h LYS 149 N 0.21 0.28 -0.00 0.49 3.64 -0.79 -1.34 116.57 119.07 2k1g h LYS 149 Ca -0.07 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2k1g h LYS 149 Cb 1.57 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.33 2k1g h LYS 149 CO 0.16 0.19 -0.79 0.36 -2.27 0.00 0.00 179.45 177.10 2k1g n LYS 150 N -4.46 0.20 0.00 1.90 2.85 -1.02 -4.32 118.16 113.31 2k1g n LYS 150 Ca 0.09 -0.16 0.09 0.00 -1.05 0.00 0.00 58.31 57.29 2k1g n LYS 150 Cb 0.42 -1.50 0.03 0.00 -0.65 0.00 0.00 35.03 33.33 2k1g n LYS 150 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2k1g n ARG 151 N -1.26 1.59 -1.54 -1.58 5.12 -0.54 -4.93 116.66 113.51 2k1g n ARG 151 Ca 0.05 -1.16 -0.44 0.00 -1.93 0.00 0.00 57.85 54.38 2k1g n ARG 151 Cb 0.35 -1.35 -0.05 0.00 -1.16 0.00 0.00 32.46 30.25 2k1g n ARG 151 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2k1g n TYR 152 N 0.34 1.67 -0.02 -1.55 9.36 -0.96 -1.00 117.16 125.00 2k1g n TYR 152 Ca 0.09 0.07 -0.01 0.00 3.32 0.00 0.00 57.90 61.37 2k1g n TYR 152 Cb 0.42 -2.64 -0.00 0.00 -0.63 0.00 0.00 39.34 36.49 2k1g n TYR 152 CO 0.00 0.00 0.00 -0.97 0.22 0.00 0.00 176.86 176.11 2k1g h ASN 153 N 15.21 0.00 -2.09 2.98 -1.24 -1.42 -3.48 115.58 125.54 2k1g h ASN 153 Ca -0.31 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.69 2k1g h ASN 153 Cb 1.27 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.33 2k1g h ASN 153 CO 1.04 0.23 0.18 -1.84 -1.29 0.00 0.00 177.43 175.75 2k1g n GLU 154 N -3.03 0.62 -4.05 6.67 0.28 -1.18 -5.03 120.64 114.92 2k1g n GLU 154 Ca -0.02 -1.23 -0.08 0.00 -0.16 0.00 0.00 57.16 55.68 2k1g n GLU 154 Cb 0.06 1.55 -0.10 0.00 1.43 0.00 0.00 31.44 34.37 2k1g n GLU 154 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2k1g s ALA 155 N -1.61 0.38 -0.18 -1.84 0.00 -1.25 -0.48 121.76 116.77 2k1g s ALA 155 Ca 0.09 -1.02 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 2k1g s ALA 155 Cb -0.03 0.24 0.06 0.00 0.00 0.00 0.00 23.12 23.40 2k1g s ALA 155 CO 0.06 -0.32 0.09 1.03 0.00 0.00 0.00 175.76 176.63 2k1g s ARG 156 N -3.23 0.11 -0.57 0.00 1.81 0.64 -2.46 118.95 115.26 2k1g s ARG 156 Ca 0.01 -0.13 -0.22 0.00 -1.72 0.00 0.00 55.73 53.66 2k1g s ARG 156 Cb 0.03 -1.82 0.05 0.00 -0.45 0.00 0.00 34.95 32.76 2k1g s ARG 156 CO -0.07 -0.68 0.86 -0.98 -0.68 0.00 0.00 175.30 173.74 2k1g s ARG 157 N 2.11 3.22 0.04 3.54 3.03 -0.96 -1.30 118.95 128.64 2k1g s ARG 157 Ca 0.02 -0.58 0.22 0.00 2.03 0.00 0.00 55.73 57.43 2k1g s ARG 157 Cb -0.16 -4.11 -0.08 0.00 -1.03 0.00 0.00 34.95 29.57 2k1g s ARG 157 CO -0.10 -1.50 0.89 1.33 -1.13 0.00 0.00 175.30 174.79 2k1g n VAL 158 N 5.97 0.16 -2.10 4.99 0.24 -1.26 -3.91 118.33 122.42 2k1g n VAL 158 Ca -0.02 -0.31 -0.42 0.00 -2.04 0.00 0.00 64.34 61.55 2k1g n VAL 158 Cb 0.46 0.18 -0.03 0.00 -1.47 0.00 0.00 33.84 32.98 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 -4.13 4.36 -0.01 1.34 1.43 -1.26 -4.98 118.68 115.42 2k1g s LEU 159 Ca 0.01 2.36 -0.30 0.00 -1.03 0.00 0.00 54.13 55.17 2k1g s LEU 159 Cb 0.14 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.75 2k1g s LEU 159 CO 0.83 -0.73 1.02 -0.94 0.23 0.00 0.00 176.35 176.77 2k1g s SER 160 N 1.44 7.29 0.38 2.29 1.04 -1.26 -5.03 113.70 119.85 2k1g s SER 160 Ca 0.67 1.69 -0.25 0.00 0.48 0.00 0.00 55.95 58.54 2k1g s SER 160 Cb -0.37 -2.57 -0.09 0.00 0.10 0.00 0.00 66.02 63.09 2k1g s SER 160 CO 0.30 -0.34 1.03 -0.60 0.98 0.00 0.00 173.24 174.61 2k1g s ARG 161 N 1.26 4.28 0.00 4.02 3.52 -1.26 -5.07 118.95 125.69 2k1g s ARG 161 Ca 0.52 1.49 0.00 0.00 -0.13 0.00 0.00 55.73 57.61 2k1g s ARG 161 Cb -0.22 -2.62 0.00 0.00 -1.56 0.00 0.00 34.95 30.55 2k1g s ARG 161 CO 0.26 -0.04 0.00 0.43 -0.81 0.00 0.00 175.30 175.14 2k1g n SER 162 N 0.11 0.99 -4.60 -2.12 7.64 -1.26 -5.08 113.62 109.30 2k1g n SER 162 Ca 0.04 -0.82 -0.43 0.00 1.01 0.00 0.00 58.87 58.67 2k1g n SER 162 Cb 0.49 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.67 2k1g n SER 162 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2k1g s LEU 163 N 0.00 3.47 0.00 -3.43 2.96 -1.26 -5.34 118.68 115.08 2k1g s LEU 163 Ca 0.00 1.79 0.31 0.00 -0.22 0.00 0.00 54.13 56.01 2k1g s LEU 163 Cb 0.00 -3.51 1.84 0.00 0.50 0.00 0.00 46.19 45.01 2k1g s LEU 163 CO 0.00 -1.89 2.16 -0.62 -1.32 0.00 0.00 176.35 174.68