#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ekd h SER 3 N 0.00 -0.98 1.02 1.20 0.87 -1.93 -0.42 113.55 113.32 2ekd h SER 3 Ca 0.00 0.22 -0.01 0.00 -1.23 0.00 0.00 61.79 60.77 2ekd h SER 3 Cb 0.00 0.53 -0.00 0.00 -0.44 0.00 0.00 62.40 62.49 2ekd h SER 3 CO 0.00 -0.28 -0.05 1.05 -0.53 0.00 0.00 176.83 177.02 2ekd h GLU 4 N -0.10 0.00 -0.37 2.24 4.11 -1.97 -2.40 114.58 116.09 2ekd h GLU 4 Ca 0.28 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.59 2ekd h GLU 4 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2ekd h GLU 4 CO -0.71 0.05 -0.25 0.87 0.07 0.00 0.00 179.01 179.05 2ekd h LYS 5 N 0.00 0.76 -0.27 1.06 1.79 -1.53 -2.76 116.57 115.62 2ekd h LYS 5 Ca -0.00 -0.32 -0.01 0.00 -2.18 0.00 0.00 60.65 58.14 2ekd h LYS 5 Cb 0.58 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.19 2ekd h LYS 5 CO 0.01 0.93 0.12 0.35 -1.08 0.00 0.00 179.45 179.77 2ekd h PHE 6 N 0.66 0.41 0.00 -1.35 3.57 -1.04 -2.60 116.94 116.59 2ekd h PHE 6 Ca 0.09 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 2ekd h PHE 6 Cb 0.76 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 2ekd h PHE 6 CO 0.04 0.40 -0.03 0.74 -2.23 0.00 0.00 178.31 177.23 2ekd h PHE 7 N 0.29 0.00 0.00 0.41 0.04 -1.44 -1.65 116.94 114.60 2ekd h PHE 7 Ca 0.09 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.86 2ekd h PHE 7 Cb 0.16 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.31 2ekd h PHE 7 CO -0.01 0.03 0.00 1.63 -0.60 0.00 0.00 178.31 179.36 2ekd n LYS 8 N -3.54 0.14 0.07 1.51 4.76 -0.98 -1.42 118.16 118.70 2ekd n LYS 8 Ca -0.02 0.47 0.11 0.00 -2.87 0.00 0.00 58.31 56.00 2ekd n LYS 8 Cb 0.14 -1.82 0.45 0.00 -1.84 0.00 0.00 35.03 31.96 2ekd n LYS 8 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2ekd n LEU 9 N -2.08 0.41 -4.34 -0.35 4.77 -0.62 -4.81 117.00 109.98 2ekd n LEU 9 Ca 0.01 0.57 -0.19 0.00 -0.03 0.00 0.00 56.01 56.37 2ekd n LEU 9 Cb 0.14 -0.48 -0.10 0.00 -2.33 0.00 0.00 43.42 40.65 2ekd n LEU 9 CO 0.14 -0.28 -0.45 -0.36 -1.33 0.00 0.00 177.39 175.10 2ekd s PHE 10 N -3.13 1.73 0.17 -1.77 0.08 -0.51 -4.87 117.98 109.70 2ekd s PHE 10 Ca 0.08 -0.54 0.05 0.00 0.12 0.00 0.00 56.93 56.65 2ekd s PHE 10 Cb 0.12 -0.83 -0.04 0.00 -0.57 0.00 0.00 43.02 41.71 2ekd s PHE 10 CO 0.44 0.35 0.14 1.03 -0.10 0.00 0.00 175.22 177.07 2ekd s ARG 11 N -3.34 2.90 0.36 0.44 0.52 -1.26 -5.00 118.95 113.57 2ekd s ARG 11 Ca 0.20 -0.89 -0.28 0.00 -0.52 0.00 0.00 55.73 54.24 2ekd s ARG 11 Cb -0.03 -2.64 -0.11 0.00 0.52 0.00 0.00 34.95 32.70 2ekd s ARG 11 CO 0.07 0.48 1.43 0.14 0.02 0.00 0.00 175.30 177.43 2ekd s VAL 12 N -1.78 2.27 0.00 3.52 -7.23 -1.26 -1.91 120.40 114.01 2ekd s VAL 12 Ca 0.31 0.27 0.00 0.00 -1.81 0.00 0.00 61.98 60.75 2ekd s VAL 12 Cb -0.10 -3.17 0.00 0.00 0.56 0.00 0.00 36.38 33.67 2ekd s VAL 12 CO 0.23 0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.70 2ekd n GLY 13 N 0.57 2.84 3.77 2.32 0.00 0.26 -4.75 105.19 110.19 2ekd n GLY 13 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2ekd n GLY 13 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ekd s GLU 14 N -0.94 2.66 -0.21 1.61 2.02 -0.80 0.10 118.70 123.15 2ekd s GLU 14 Ca 0.00 1.31 0.01 0.00 0.02 0.00 0.00 54.97 56.32 2ekd s GLU 14 Cb 0.00 -1.94 0.04 0.00 0.10 0.00 0.00 34.13 32.34 2ekd s GLU 14 CO 0.00 -1.35 -0.12 0.99 0.02 0.00 0.00 175.26 174.80 2ekd s THR 15 N -2.52 1.82 -0.22 3.63 2.01 -1.26 -1.89 115.64 117.21 2ekd s THR 15 Ca 0.65 -1.13 -0.07 0.00 0.31 0.00 0.00 61.69 61.45 2ekd s THR 15 Cb -0.19 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.43 2ekd s THR 15 CO 0.46 0.19 0.07 -0.69 -0.69 0.00 0.00 174.62 173.95 2ekd s VAL 16 N 1.32 4.53 -0.32 3.82 1.01 0.19 -2.04 120.40 128.91 2ekd s VAL 16 Ca -0.02 -0.11 -0.17 0.00 0.00 0.00 0.00 61.98 61.68 2ekd s VAL 16 Cb -0.16 -3.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.12 2ekd s VAL 16 CO -0.08 0.39 0.47 -0.22 0.00 0.00 0.00 175.10 175.66 2ekd s LEU 17 N 1.05 4.24 -0.44 3.92 2.96 -0.35 0.52 118.68 130.58 2ekd s LEU 17 Ca 0.04 0.12 -0.12 0.00 -0.22 0.00 0.00 54.13 53.95 2ekd s LEU 17 Cb -0.14 -2.54 0.08 0.00 0.50 0.00 0.00 46.19 44.08 2ekd s LEU 17 CO 0.03 -0.37 0.31 -0.69 -1.32 0.00 0.00 176.35 174.32 2ekd s VAL 18 N 2.27 4.62 -0.09 1.68 1.01 0.35 -0.06 120.40 130.20 2ekd s VAL 18 Ca 0.18 -1.27 -0.16 0.00 0.00 0.00 0.00 61.98 60.72 2ekd s VAL 18 Cb -0.16 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 2ekd s VAL 18 CO 0.12 -0.54 0.43 -1.61 0.00 0.00 0.00 175.10 173.49 2ekd s GLU 19 N 1.51 4.20 0.27 2.72 2.02 0.48 -0.63 118.70 129.27 2ekd s GLU 19 Ca 0.03 0.38 -0.06 0.00 0.02 0.00 0.00 54.97 55.35 2ekd s GLU 19 Cb -0.24 -3.36 -0.01 0.00 0.10 0.00 0.00 34.13 30.62 2ekd s GLU 19 CO 0.04 0.34 0.39 1.52 0.02 0.00 0.00 175.26 177.57 2ekd s TYR 20 N 0.04 0.81 0.48 1.61 -0.85 -0.67 -1.18 117.35 117.59 2ekd s TYR 20 Ca 0.24 -1.09 0.02 0.00 -0.52 0.00 0.00 57.07 55.72 2ekd s TYR 20 Cb -0.15 -0.10 -0.01 0.00 0.38 0.00 0.00 41.96 42.07 2ekd s TYR 20 CO 0.10 -0.95 0.07 -1.54 -1.52 0.00 0.00 175.55 171.71 2ekd s SER 21 N -3.13 3.60 0.47 -0.18 1.04 -1.26 -0.62 113.70 113.61 2ekd s SER 21 Ca 0.29 -1.72 0.18 0.00 0.48 0.00 0.00 55.95 55.19 2ekd s SER 21 Cb 0.01 0.63 1.14 0.00 0.10 0.00 0.00 66.02 67.90 2ekd s SER 21 CO 0.14 -0.95 2.02 1.23 0.98 0.00 0.00 173.24 176.66 2ekd h GLY 22 N 1.49 0.00 0.51 7.32 0.00 -2.00 -2.63 103.07 107.76 2ekd h GLY 22 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2ekd h GLY 22 CO 0.64 0.00 -0.25 -1.30 0.00 0.00 0.00 176.54 175.64 2ekd n THR 23 N -4.14 0.00 0.21 4.70 -2.24 -1.26 -4.26 114.28 107.29 2ekd n THR 23 Ca -0.02 -0.10 0.08 0.00 -2.27 0.00 0.00 64.05 61.74 2ekd n THR 23 Cb 0.24 0.25 0.46 0.00 -2.10 0.00 0.00 70.33 69.18 2ekd n THR 23 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2ekd h SER 24 N 0.90 0.00 -5.51 3.42 0.02 -1.83 -3.47 113.55 107.07 2ekd h SER 24 Ca 0.00 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.64 2ekd h SER 24 Cb 0.47 0.00 0.17 0.00 0.14 0.00 0.00 62.40 63.18 2ekd h SER 24 CO 0.00 0.27 -0.75 0.54 -1.14 0.00 0.00 176.83 175.75 2ekd n ARG 25 N -3.55 -5.97 0.17 3.45 1.74 -1.26 -4.86 116.66 106.38 2ekd n ARG 25 Ca -0.01 0.82 0.18 0.00 -0.77 0.00 0.00 57.85 58.08 2ekd n ARG 25 Cb 0.42 -5.75 0.80 0.00 -1.02 0.00 0.00 32.46 26.91 2ekd n ARG 25 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ekd h ALA 26 N 0.77 1.89 -0.03 7.54 0.00 -1.92 -1.79 119.26 125.72 2ekd h ALA 26 Ca -0.57 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.34 2ekd h ALA 26 Cb 1.33 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 2ekd h ALA 26 CO 0.48 -0.40 0.06 1.05 0.00 0.00 0.00 179.25 180.44 2ekd h GLU 27 N 0.00 0.00 -0.38 0.00 9.09 -1.93 -1.50 114.58 119.87 2ekd h GLU 27 Ca 0.12 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.43 2ekd h GLU 27 Cb 0.65 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.74 2ekd h GLU 27 CO -0.00 0.00 -0.13 -0.07 0.05 0.00 0.00 179.01 178.86 2ekd h LEU 28 N 0.00 0.77 -0.51 3.06 3.38 -1.68 -0.57 115.31 119.76 2ekd h LEU 28 Ca 0.02 -0.38 -0.13 0.00 0.09 0.00 0.00 57.88 57.48 2ekd h LEU 28 Cb 0.13 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2ekd h LEU 28 CO -0.00 0.97 -0.18 0.25 0.09 0.00 0.00 178.44 179.57 2ekd h LEU 29 N 0.55 1.04 -0.81 1.67 5.85 -1.47 -1.10 115.31 121.04 2ekd h LEU 29 Ca 0.09 -0.38 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 2ekd h LEU 29 Cb 0.66 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 2ekd h LEU 29 CO 0.04 1.18 0.48 0.25 -0.34 0.00 0.00 178.44 180.06 2ekd h LEU 30 N 0.89 0.98 -0.13 2.25 5.85 -1.31 -0.67 115.31 123.17 2ekd h LEU 30 Ca 0.12 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2ekd h LEU 30 Cb 0.76 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2ekd h LEU 30 CO 0.06 0.76 0.06 0.22 -0.34 0.00 0.00 178.44 179.21 2ekd h TYR 31 N 1.11 0.18 -0.99 1.25 3.20 -0.85 -1.23 116.97 119.64 2ekd h TYR 31 Ca 0.29 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.29 2ekd h TYR 31 Cb -0.03 -0.06 -0.09 0.00 1.54 0.00 0.00 36.73 38.09 2ekd h TYR 31 CO -0.00 0.22 0.62 -0.92 -1.64 0.00 0.00 178.16 176.43 2ekd h TYR 32 N 0.09 1.07 -0.22 -3.82 3.20 -0.75 0.32 116.97 116.85 2ekd h TYR 32 Ca 0.04 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.76 2ekd h TYR 32 Cb 0.10 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.04 2ekd h TYR 32 CO -0.03 0.37 -0.60 0.82 -1.64 0.00 0.00 178.16 177.08 2ekd h ILE 33 N 0.88 1.29 0.18 1.81 2.04 -0.70 -3.33 117.51 119.69 2ekd h ILE 33 Ca 0.51 -1.82 -0.32 0.00 1.00 0.00 0.00 64.86 64.23 2ekd h ILE 33 Cb 0.63 1.76 0.01 0.00 -0.74 0.00 0.00 36.82 38.49 2ekd h ILE 33 CO -0.28 0.58 -1.50 0.58 0.00 0.00 0.00 178.15 177.53 2ekd h VAL 34 N 0.55 1.22 -2.56 1.67 2.07 -0.46 -3.41 116.25 115.34 2ekd h VAL 34 Ca -0.00 -2.77 -0.53 0.00 0.82 0.00 0.00 66.70 64.22 2ekd h VAL 34 Cb 1.19 2.89 0.03 0.00 -1.52 0.00 0.00 31.29 33.89 2ekd h VAL 34 CO 0.12 0.84 1.09 0.21 0.02 0.00 0.00 177.57 179.86 2ekd s ASN 35 N -7.28 6.46 -1.38 0.57 2.47 0.10 -2.89 114.94 112.99 2ekd s ASN 35 Ca -0.09 2.70 -0.11 0.00 0.42 0.00 0.00 52.86 55.78 2ekd s ASN 35 Cb 0.06 -2.56 0.08 0.00 -1.45 0.00 0.00 41.25 37.37 2ekd s ASN 35 CO 0.89 -0.98 0.60 0.59 -3.72 0.00 0.00 177.10 174.47 2ekd n ASN 36 N 5.72 -4.02 -4.75 -4.21 3.02 -1.26 -4.91 115.26 104.85 2ekd n ASN 36 Ca 0.17 -0.50 -0.41 0.00 -0.03 0.00 0.00 54.58 53.82 2ekd n ASN 36 Cb 0.39 -3.30 -0.03 0.00 -0.61 0.00 0.00 39.78 36.23 2ekd n ASN 36 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2ekd s SER 37 N -2.85 6.86 0.28 6.41 0.15 -1.14 -4.93 113.70 118.48 2ekd s SER 37 Ca 0.46 2.51 0.14 0.00 0.70 0.00 0.00 55.95 59.76 2ekd s SER 37 Cb -0.24 -2.62 0.27 0.00 -1.71 0.00 0.00 66.02 61.72 2ekd s SER 37 CO 0.57 -0.52 1.54 0.11 1.20 0.00 0.00 173.24 176.14 2ekd h LYS 38 N 4.63 0.00 -6.18 5.44 6.56 -1.93 -3.45 116.57 121.64 2ekd h LYS 38 Ca -0.46 0.00 -0.52 0.00 -1.06 0.00 0.00 60.65 58.61 2ekd h LYS 38 Cb 1.22 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.83 2ekd h LYS 38 CO 0.73 0.59 -0.52 -0.51 -2.06 0.00 0.00 179.45 177.68 2ekd s LEU 39 N -6.94 3.94 0.36 2.94 1.43 -1.26 -5.07 118.68 114.08 2ekd s LEU 39 Ca 0.01 -0.13 -0.28 0.00 -1.03 0.00 0.00 54.13 52.70 2ekd s LEU 39 Cb 0.10 -2.50 -0.11 0.00 0.03 0.00 0.00 46.19 43.72 2ekd s LEU 39 CO 0.74 -0.01 1.43 -2.84 0.23 0.00 0.00 176.35 175.91 2ekd s PRO 40 N -3.62 4.17 -0.17 1.29 0.02 -1.26 -4.75 135.00 130.68 2ekd s PRO 40 Ca 0.33 2.46 -0.06 0.00 0.02 0.00 0.00 61.00 63.74 2ekd s PRO 40 Cb -0.09 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.40 2ekd s PRO 40 CO 0.25 -0.43 0.03 0.42 -0.33 0.00 0.00 177.00 176.94 2ekd s ILE 41 N -1.13 4.49 -0.13 2.83 -1.09 -1.26 -1.48 121.20 123.43 2ekd s ILE 41 Ca 0.52 -0.14 -0.00 0.00 -2.23 0.00 0.00 60.65 58.79 2ekd s ILE 41 Cb -0.44 -3.01 0.03 0.00 -1.58 0.00 0.00 42.46 37.46 2ekd s ILE 41 CO 0.60 0.47 -0.08 -0.69 -1.23 0.00 0.00 174.94 174.01 2ekd s VAL 42 N 0.37 1.09 -0.25 2.92 1.01 -0.83 -2.85 120.40 121.86 2ekd s VAL 42 Ca 0.01 -0.38 -0.09 0.00 0.00 0.00 0.00 61.98 61.52 2ekd s VAL 42 Cb -0.13 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 2ekd s VAL 42 CO 0.01 0.33 0.13 -0.69 0.00 0.00 0.00 175.10 174.88 2ekd s VAL 43 N 1.68 4.95 -0.41 2.92 1.01 -0.33 -2.78 120.40 127.43 2ekd s VAL 43 Ca 0.04 0.04 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 2ekd s VAL 43 Cb -0.13 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 32.95 2ekd s VAL 43 CO -0.08 0.33 0.69 -1.81 0.00 0.00 0.00 175.10 174.22 2ekd s ASP 44 N 1.35 6.39 -0.47 3.32 1.01 -0.06 -0.71 116.67 127.50 2ekd s ASP 44 Ca 0.06 -0.10 -0.13 0.00 0.71 0.00 0.00 52.55 53.09 2ekd s ASP 44 Cb -0.15 -2.34 0.09 0.00 1.01 0.00 0.00 42.92 41.53 2ekd s ASP 44 CO 0.06 -0.76 0.37 -0.62 0.21 0.00 0.00 175.17 174.42 2ekd s ASP 45 N 1.97 5.95 -0.16 0.27 2.15 -0.57 -1.59 116.67 124.68 2ekd s ASP 45 Ca 0.26 -1.52 -0.18 0.00 0.43 0.00 0.00 52.55 51.53 2ekd s ASP 45 Cb -0.14 -2.11 -0.04 0.00 -0.30 0.00 0.00 42.92 40.34 2ekd s ASP 45 CO 0.19 -0.65 0.47 -0.63 -0.17 0.00 0.00 175.17 174.38 2ekd s ILE 46 N 1.54 5.17 -1.37 4.11 1.01 -0.53 -4.41 121.20 126.71 2ekd s ILE 46 Ca 0.04 0.90 -0.07 0.00 0.00 0.00 0.00 60.65 61.52 2ekd s ILE 46 Cb -0.25 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.42 2ekd s ILE 46 CO 0.04 0.26 0.43 0.18 0.00 0.00 0.00 174.94 175.85 2ekd n LEU 47 N 4.18 -1.87 -3.30 2.97 4.77 -1.26 -1.95 117.00 120.54 2ekd n LEU 47 Ca -0.07 -1.09 -0.23 0.00 -0.03 0.00 0.00 56.01 54.59 2ekd n LEU 47 Cb 0.51 -2.06 0.00 0.00 -2.33 0.00 0.00 43.42 39.54 2ekd n LEU 47 CO 0.42 0.49 -0.03 0.47 -1.33 0.00 0.00 177.39 177.41 2ekd n ASP 48 N -2.83 -4.11 0.11 -1.43 8.00 -1.26 -4.86 116.55 110.18 2ekd n ASP 48 Ca -0.26 -0.37 -0.02 0.00 0.71 0.00 0.00 54.79 54.86 2ekd n ASP 48 Cb 0.66 -3.38 -0.01 0.00 -0.02 0.00 0.00 41.12 38.37 2ekd n ASP 48 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2ekd h THR 49 N -1.03 1.28 -0.53 -3.53 2.02 -1.68 -3.18 112.91 106.25 2ekd h THR 49 Ca -0.44 -2.71 -0.08 0.00 0.77 0.00 0.00 66.41 63.94 2ekd h THR 49 Cb 1.30 2.57 -0.02 0.00 -1.74 0.00 0.00 68.15 70.26 2ekd h THR 49 CO 0.54 0.71 0.01 0.22 0.37 0.00 0.00 175.52 177.37 2ekd h TYR 50 N 0.00 0.96 -0.66 3.16 3.20 -1.87 -2.09 116.97 119.66 2ekd h TYR 50 Ca -0.01 -0.14 0.01 0.00 3.14 0.00 0.00 58.73 61.73 2ekd h TYR 50 Cb 1.51 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 39.49 2ekd h TYR 50 CO 0.00 0.86 0.43 -0.92 -1.64 0.00 0.00 178.16 176.90 2ekd h TYR 51 N 0.83 0.84 -0.35 -3.82 3.20 -1.84 -0.15 116.97 115.68 2ekd h TYR 51 Ca 0.16 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.96 2ekd h TYR 51 Cb 0.48 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 2ekd h TYR 51 CO 0.03 0.53 -0.12 0.93 -1.64 0.00 0.00 178.16 177.89 2ekd h GLU 52 N 0.90 0.70 -0.41 1.82 5.08 -1.42 -1.06 114.58 120.20 2ekd h GLU 52 Ca 0.24 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 2ekd h GLU 52 Cb -0.10 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 2ekd h GLU 52 CO -0.05 0.88 0.13 0.74 -1.00 0.00 0.00 179.01 179.71 2ekd h PHE 53 N 0.49 0.65 0.13 4.33 -1.00 -0.98 -2.44 116.94 118.11 2ekd h PHE 53 Ca 0.08 -0.06 0.01 0.00 2.81 0.00 0.00 57.97 60.81 2ekd h PHE 53 Cb 0.64 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 39.99 2ekd h PHE 53 CO 0.05 0.60 -0.21 -0.92 -1.61 0.00 0.00 178.31 176.23 2ekd h TYR 54 N 0.51 -0.55 -0.50 -0.55 3.20 -0.92 -1.31 116.97 116.85 2ekd h TYR 54 Ca 0.13 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.98 2ekd h TYR 54 Cb 0.25 0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 2ekd h TYR 54 CO 0.01 -0.30 0.18 1.79 -1.64 0.00 0.00 178.16 178.20 2ekd h THR 55 N -0.40 1.19 -0.41 1.81 1.35 -1.17 0.30 112.91 115.58 2ekd h THR 55 Ca 0.02 -0.63 -0.08 0.00 -0.55 0.00 0.00 66.41 65.16 2ekd h THR 55 Cb 0.41 0.62 -0.01 0.00 -1.73 0.00 0.00 68.15 67.44 2ekd h THR 55 CO -0.10 0.24 -0.07 0.03 -0.25 0.00 0.00 175.52 175.37 2ekd h ARG 56 N 0.72 0.77 -0.41 4.72 3.08 -1.18 -1.39 114.38 120.70 2ekd h ARG 56 Ca 0.17 -0.28 -0.11 0.00 0.07 0.00 0.00 59.98 59.83 2ekd h ARG 56 Cb 0.18 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 2ekd h ARG 56 CO -0.01 0.89 -0.19 -0.07 -1.07 0.00 0.00 179.97 179.52 2ekd h LEU 57 N 0.59 0.79 -0.20 3.04 3.38 -0.88 -1.84 115.31 120.18 2ekd h LEU 57 Ca 0.11 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2ekd h LEU 57 Cb 0.59 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2ekd h LEU 57 CO 0.04 0.96 0.07 0.50 0.09 0.00 0.00 178.44 180.10 2ekd h LYS 58 N 0.69 0.30 -0.51 1.13 3.64 -0.75 -1.80 116.57 119.27 2ekd h LYS 58 Ca 0.10 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2ekd h LYS 58 Cb 0.69 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.44 2ekd h LYS 58 CO 0.05 0.38 0.18 0.28 -2.27 0.00 0.00 179.45 178.07 2ekd h VAL 59 N 0.16 1.20 0.00 2.00 2.07 -1.19 -0.76 116.25 119.72 2ekd h VAL 59 Ca 0.07 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2ekd h VAL 59 Cb 0.19 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 2ekd h VAL 59 CO -0.00 0.25 0.00 0.00 0.02 0.00 0.00 177.57 177.83 2ekd n ALA 60 N -2.46 1.49 -0.20 1.67 0.00 -0.70 -4.83 120.51 115.48 2ekd n ALA 60 Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ekd n ALA 60 Cb 0.17 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2ekd n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ekd n GLY 61 N -0.55 0.83 3.78 0.00 0.00 -0.29 -5.07 105.19 103.89 2ekd n GLY 61 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 2ekd n GLY 61 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ekd s PHE 62 N -2.09 2.71 -0.51 1.61 0.40 -0.72 -4.96 117.98 114.41 2ekd s PHE 62 Ca 0.00 1.41 -0.22 0.00 -0.60 0.00 0.00 56.93 57.52 2ekd s PHE 62 Cb 0.00 -3.04 0.05 0.00 0.51 0.00 0.00 43.02 40.54 2ekd s PHE 62 CO 0.00 -1.76 0.76 0.34 0.70 0.00 0.00 175.22 175.27 2ekd s ASP 63 N -3.58 6.29 0.00 1.36 2.15 -1.26 -4.67 116.67 116.96 2ekd s ASP 63 Ca 0.61 -0.57 0.22 0.00 0.43 0.00 0.00 52.55 53.24 2ekd s ASP 63 Cb -0.16 -2.36 0.97 0.00 -0.30 0.00 0.00 42.92 41.07 2ekd s ASP 63 CO 0.56 -1.01 1.67 1.33 -0.17 0.00 0.00 175.17 177.54 2ekd n VAL 64 N 5.91 0.11 -0.26 1.11 0.24 -1.26 -4.24 118.33 119.94 2ekd n VAL 64 Ca -0.02 -0.23 0.06 0.00 -2.04 0.00 0.00 64.34 62.11 2ekd n VAL 64 Cb 0.47 0.19 0.20 0.00 -1.47 0.00 0.00 33.84 33.23 2ekd n VAL 64 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ekd h ALA 65 N 4.00 1.09 -0.18 2.33 0.00 -1.99 0.71 119.26 125.22 2ekd h ALA 65 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2ekd h ALA 65 Cb 0.35 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2ekd h ALA 65 CO 0.00 -0.25 0.11 -1.35 0.00 0.00 0.00 179.25 177.76 2ekd h PRO 66 N 0.41 0.23 -0.02 0.00 0.11 -1.97 -0.99 132.00 129.77 2ekd h PRO 66 Ca 0.43 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.38 2ekd h PRO 66 Cb 0.70 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.74 2ekd h PRO 66 CO -0.44 0.16 -0.66 -0.07 -0.21 0.00 0.00 178.00 176.78 2ekd h LEU 67 N 0.24 0.09 -0.39 2.35 3.38 -1.18 -3.03 115.31 116.77 2ekd h LEU 67 Ca 0.06 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2ekd h LEU 67 Cb -0.02 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2ekd h LEU 67 CO -0.01 0.72 -0.26 -0.33 0.09 0.00 0.00 178.44 178.65 2ekd h GLU 68 N 0.05 0.00 0.00 1.13 5.08 -0.52 -3.30 114.58 117.03 2ekd h GLU 68 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2ekd h GLU 68 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2ekd h GLU 68 CO 0.09 0.26 -0.57 -0.91 -1.00 0.00 0.00 179.01 176.89 2ekd h ASN 69 N 0.00 0.00 -4.28 1.42 -0.26 -1.24 -3.17 115.58 108.05 2ekd h ASN 69 Ca -0.00 -0.18 -0.50 0.00 -0.56 0.00 0.00 56.30 55.05 2ekd h ASN 69 Cb 1.06 0.00 0.07 0.00 -1.06 0.00 0.00 38.32 38.39 2ekd h ASN 69 CO 0.03 0.09 0.38 0.68 -1.06 0.00 0.00 177.43 177.55 2ekd s VAL 70 N -3.17 4.10 0.25 2.81 -7.23 -1.19 -4.65 120.40 111.31 2ekd s VAL 70 Ca 0.06 0.81 -0.20 0.00 -1.81 0.00 0.00 61.98 60.85 2ekd s VAL 70 Cb 0.13 -3.48 -0.09 0.00 0.56 0.00 0.00 36.38 33.50 2ekd s VAL 70 CO 0.71 -0.77 0.75 -1.10 -0.31 0.00 0.00 175.10 174.38 2ekd s GLN 71 N -4.66 4.25 0.04 4.82 -0.21 -1.13 -0.71 119.66 122.05 2ekd s GLN 71 Ca 0.59 0.89 0.04 0.00 0.02 0.00 0.00 55.36 56.91 2ekd s GLN 71 Cb -0.14 -2.79 -0.02 0.00 1.00 0.00 0.00 33.01 31.06 2ekd s GLN 71 CO 0.47 0.34 -0.13 0.08 -2.12 0.00 0.00 175.29 173.93 2ekd s VAL 72 N -1.61 0.98 -0.32 1.09 1.01 -0.16 -1.19 120.40 120.20 2ekd s VAL 72 Ca 0.46 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.53 2ekd s VAL 72 Cb -0.16 -0.90 0.09 0.00 0.00 0.00 0.00 36.38 35.41 2ekd s VAL 72 CO 0.21 -0.03 0.02 -0.63 0.00 0.00 0.00 175.10 174.66 2ekd s ILE 73 N -0.86 2.18 0.00 2.22 1.01 0.11 -0.73 121.20 125.14 2ekd s ILE 73 Ca 0.00 -2.14 0.00 0.00 0.00 0.00 0.00 60.65 58.51 2ekd s ILE 73 Cb -0.08 -2.54 0.00 0.00 0.01 0.00 0.00 42.46 39.85 2ekd s ILE 73 CO 0.01 -0.47 0.00 0.29 0.00 0.00 0.00 174.94 174.77 2ekd n LYS 74 N 4.32 0.34 0.00 2.79 5.02 -0.44 -1.52 118.16 128.68 2ekd n LYS 74 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2ekd n LYS 74 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.43 2ekd n LYS 74 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ekd n GLY 76 N 4.83 0.00 0.00 0.72 0.00 -0.73 -0.19 105.19 109.82 2ekd n GLY 76 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ekd n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ekd n GLY 77 N 0.00 -1.82 0.00 -0.02 0.00 -1.26 -4.41 105.19 97.68 2ekd n GLY 77 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.49 2ekd n GLY 77 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ekd n THR 78 N -1.88 0.10 -3.80 2.61 -2.24 -1.26 -4.94 114.28 102.88 2ekd n THR 78 Ca 0.00 -0.10 -0.36 0.00 -2.27 0.00 0.00 64.05 61.32 2ekd n THR 78 Cb 0.00 1.00 -0.12 0.00 -2.10 0.00 0.00 70.33 69.11 2ekd n THR 78 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ekd s LYS 79 N -0.10 2.17 -0.24 -0.78 1.02 -1.26 -5.08 119.74 115.48 2ekd s LYS 79 Ca 0.00 -1.63 -0.27 0.00 0.02 0.00 0.00 55.97 54.09 2ekd s LYS 79 Cb 0.00 -3.49 0.01 0.00 -0.52 0.00 0.00 37.83 33.82 2ekd s LYS 79 CO 0.00 -0.93 0.97 -0.51 -0.92 0.00 0.00 175.35 173.96 2ekd s ASP 80 N 1.67 7.01 -0.06 2.83 1.01 -1.26 -4.73 116.67 123.14 2ekd s ASP 80 Ca 0.04 1.25 0.03 0.00 0.71 0.00 0.00 52.55 54.59 2ekd s ASP 80 Cb -0.22 -2.50 0.01 0.00 1.01 0.00 0.00 42.92 41.21 2ekd s ASP 80 CO -0.03 -0.62 -0.15 -0.63 0.21 0.00 0.00 175.17 173.95 2ekd s ILE 81 N 3.09 1.34 0.00 0.77 -1.09 -1.26 -5.07 121.20 118.98 2ekd s ILE 81 Ca 0.41 -0.62 0.00 0.00 -2.23 0.00 0.00 60.65 58.21 2ekd s ILE 81 Cb -0.15 -1.18 0.00 0.00 -1.58 0.00 0.00 42.46 39.55 2ekd s ILE 81 CO 0.07 0.40 0.00 0.61 -1.23 0.00 0.00 174.94 174.78 2ekd n GLY 82 N 3.53 -2.81 3.56 6.18 0.00 -1.26 -4.64 105.19 109.75 2ekd n GLY 82 Ca -0.21 -1.71 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 2ekd n GLY 82 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ekd s ARG 83 N -0.87 3.62 0.06 1.61 0.52 0.12 -4.87 118.95 119.14 2ekd s ARG 83 Ca 0.00 -1.23 -0.31 0.00 -0.52 0.00 0.00 55.73 53.68 2ekd s ARG 83 Cb 0.00 -5.38 -0.08 0.00 0.52 0.00 0.00 34.95 30.01 2ekd s ARG 83 CO 0.00 -2.25 1.60 0.08 0.02 0.00 0.00 175.30 174.75 2ekd s VAL 84 N 5.02 3.15 -0.41 3.52 1.01 -1.26 -0.99 120.40 130.44 2ekd s VAL 84 Ca 0.48 0.60 0.04 0.00 0.00 0.00 0.00 61.98 63.09 2ekd s VAL 84 Cb 0.00 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 33.02 2ekd s VAL 84 CO -0.07 -0.00 0.53 2.30 0.00 0.00 0.00 175.10 177.86 2ekd n ILE 85 N 4.68 0.00 -3.52 2.22 -5.35 0.09 -4.88 119.36 112.61 2ekd n ILE 85 Ca 0.15 -0.49 -0.14 0.00 -0.27 0.00 0.00 62.75 62.01 2ekd n ILE 85 Cb 0.41 1.06 -0.05 0.00 -1.74 0.00 0.00 39.64 39.33 2ekd n ILE 85 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2ekd s GLY 86 N -0.50 -0.49 -0.30 3.28 0.00 -1.22 -5.02 107.32 103.08 2ekd s GLY 86 Ca 0.04 1.35 -0.03 0.00 0.00 0.00 0.00 44.72 46.08 2ekd s GLY 86 CO 0.06 0.78 0.15 0.50 0.00 0.00 0.00 173.10 174.60 2ekd s ARG 87 N -1.78 0.24 0.14 2.90 0.52 -1.26 -1.32 118.95 118.39 2ekd s ARG 87 Ca -0.05 -0.60 -0.04 0.00 -0.52 0.00 0.00 55.73 54.52 2ekd s ARG 87 Cb -0.00 -1.14 -0.05 0.00 0.52 0.00 0.00 34.95 34.27 2ekd s ARG 87 CO 0.02 -1.04 0.36 -0.51 0.02 0.00 0.00 175.30 174.14 2ekd s LEU 88 N 1.99 4.27 0.31 2.53 1.43 0.73 -4.99 118.68 124.96 2ekd s LEU 88 Ca 0.10 0.53 -0.00 0.00 -1.03 0.00 0.00 54.13 53.73 2ekd s LEU 88 Cb -0.17 -3.26 -0.04 0.00 0.03 0.00 0.00 46.19 42.76 2ekd s LEU 88 CO -0.32 0.06 0.51 0.20 0.23 0.00 0.00 176.35 177.03 2ekd s ASN 89 N -2.50 6.33 -0.38 2.29 0.02 -1.26 -1.77 114.94 117.67 2ekd s ASN 89 Ca 0.40 0.45 0.00 0.00 -1.02 0.00 0.00 52.86 52.69 2ekd s ASN 89 Cb -0.12 -2.03 0.10 0.00 0.02 0.00 0.00 41.25 39.22 2ekd s ASN 89 CO 0.25 -0.22 0.13 -0.63 0.02 0.00 0.00 177.10 176.66 2ekd s ILE 90 N -2.18 2.86 -0.20 0.60 1.01 -1.26 -4.48 121.20 117.54 2ekd s ILE 90 Ca 0.40 -2.16 -0.06 0.00 0.00 0.00 0.00 60.65 58.84 2ekd s ILE 90 Cb -0.10 -3.00 -0.03 0.00 0.01 0.00 0.00 42.46 39.34 2ekd s ILE 90 CO 0.33 -0.63 0.01 -0.94 0.00 0.00 0.00 174.94 173.72 2ekd s SER 91 N 1.43 4.98 -1.49 3.58 1.04 -0.98 -4.27 113.70 117.99 2ekd s SER 91 Ca 0.09 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2ekd s SER 91 Cb -0.21 -1.85 0.00 0.00 0.10 0.00 0.00 66.02 64.05 2ekd s SER 91 CO -0.06 0.08 0.00 0.29 0.98 0.00 0.00 173.24 174.53 2ekd n LYS 92 N 4.17 -1.36 -2.83 4.02 4.76 -1.26 -2.62 118.16 123.04 2ekd n LYS 92 Ca -0.17 0.85 -0.22 0.00 -2.87 0.00 0.00 58.31 55.90 2ekd n LYS 92 Cb 0.52 -5.29 0.02 0.00 -1.84 0.00 0.00 35.03 28.44 2ekd n LYS 92 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2ekd n TYR 93 N -3.92 -1.68 -3.84 2.13 4.01 -1.26 -4.85 117.16 107.74 2ekd n TYR 93 Ca -0.20 0.37 -0.12 0.00 -0.16 0.00 0.00 57.90 57.79 2ekd n TYR 93 Cb 0.65 -4.37 -0.10 0.00 -0.31 0.00 0.00 39.34 35.21 2ekd n TYR 93 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2ekd s VAL 94 N -3.15 0.07 0.55 -0.72 -7.23 -1.08 -4.72 120.40 104.13 2ekd s VAL 94 Ca 0.21 -0.60 0.02 0.00 -1.81 0.00 0.00 61.98 59.81 2ekd s VAL 94 Cb -0.09 -0.48 0.04 0.00 0.56 0.00 0.00 36.38 36.41 2ekd s VAL 94 CO 0.26 -0.33 0.77 0.27 -0.31 0.00 0.00 175.10 175.76 2ekd s ILE 95 N -1.30 2.63 -0.39 -0.62 -4.36 -1.26 -2.32 121.20 113.58 2ekd s ILE 95 Ca -0.14 -0.72 -0.19 0.00 -0.26 0.00 0.00 60.65 59.35 2ekd s ILE 95 Cb -0.07 -2.91 0.01 0.00 1.25 0.00 0.00 42.46 40.74 2ekd s ILE 95 CO 0.02 0.00 0.53 -0.55 0.24 0.00 0.00 174.94 175.18 2ekd s SER 96 N -4.46 6.29 0.53 4.36 0.15 -1.26 -4.92 113.70 114.39 2ekd s SER 96 Ca 0.58 -0.25 0.21 0.00 0.70 0.00 0.00 55.95 57.19 2ekd s SER 96 Cb -0.10 -2.27 1.38 0.00 -1.71 0.00 0.00 66.02 63.32 2ekd s SER 96 CO 0.38 -0.58 2.11 -0.08 1.20 0.00 0.00 173.24 176.27 2ekd h GLU 97 N 8.62 0.00 0.10 5.44 4.81 -1.98 0.76 114.58 132.33 2ekd h GLU 97 Ca -0.27 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.96 2ekd h GLU 97 Cb 1.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2ekd h GLU 97 CO 0.81 0.00 -0.05 1.96 -0.73 0.00 0.00 179.01 181.00 2ekd h GLN 98 N 0.00 -0.12 -0.44 1.92 7.50 -2.06 -3.24 115.11 118.68 2ekd h GLN 98 Ca 0.08 0.01 -0.07 0.00 0.50 0.00 0.00 58.65 59.17 2ekd h GLN 98 Cb 0.35 0.03 -0.02 0.00 0.05 0.00 0.00 27.48 27.89 2ekd h GLN 98 CO -0.00 0.21 -0.02 0.93 -1.50 0.00 0.00 178.83 178.45 2ekd h GLU 99 N -0.46 0.78 -0.50 1.46 5.08 -1.76 -2.81 114.58 116.37 2ekd h GLU 99 Ca -0.01 -0.26 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2ekd h GLU 99 Cb 0.39 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2ekd h GLU 99 CO 0.02 0.86 0.00 0.98 -1.00 0.00 0.00 179.01 179.87 2ekd n TYR 100 N -4.38 0.00 0.00 4.33 9.36 0.18 -1.95 117.16 124.70 2ekd n TYR 100 Ca -0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2ekd n TYR 100 Cb 0.31 -0.02 0.00 0.00 -0.63 0.00 0.00 39.34 39.00 2ekd n TYR 100 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 2ekd n GLU 102 N 0.57 0.00 0.03 2.98 2.13 -1.06 -2.18 120.64 123.11 2ekd n GLU 102 Ca 0.00 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.60 2ekd n GLU 102 Cb 0.00 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 31.57 2ekd n GLU 102 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 2ekd h ILE 103 N 0.00 0.93 0.00 6.31 2.04 -1.69 -3.34 117.51 121.76 2ekd h ILE 103 Ca 0.00 -2.43 0.00 0.00 1.00 0.00 0.00 64.86 63.43 2ekd h ILE 103 Cb 0.00 2.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.77 2ekd h ILE 103 CO 0.00 0.78 0.00 1.33 0.00 0.00 0.00 178.15 180.26 2ekd n VAL 104 N -3.75 0.80 0.25 1.67 0.24 -0.93 -2.76 118.33 113.86 2ekd n VAL 104 Ca -0.26 0.17 0.08 0.00 -2.04 0.00 0.00 64.34 62.28 2ekd n VAL 104 Cb 0.98 -1.04 0.61 0.00 -1.47 0.00 0.00 33.84 32.92 2ekd n VAL 104 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2ekd h SER 105 N 0.00 0.00 0.44 -1.34 4.64 -1.85 0.11 113.55 115.55 2ekd h SER 105 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ekd h SER 105 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2ekd h SER 105 CO 0.00 0.07 0.00 0.00 -0.87 0.00 0.00 176.83 176.03 2ekd n GLN 106 N -4.39 0.18 -3.28 4.77 10.64 -1.11 -4.68 117.38 119.50 2ekd n GLN 106 Ca -0.03 0.14 -0.39 0.00 -1.83 0.00 0.00 57.00 54.89 2ekd n GLN 106 Cb 0.15 -1.50 -0.06 0.00 -0.86 0.00 0.00 30.24 27.97 2ekd n GLN 106 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2ekd s LEU 107 N -2.72 4.52 0.00 2.61 1.43 0.37 -4.96 118.68 119.94 2ekd s LEU 107 Ca 0.15 1.24 0.00 0.00 -1.03 0.00 0.00 54.13 54.49 2ekd s LEU 107 Cb 0.12 -2.88 0.00 0.00 0.03 0.00 0.00 46.19 43.46 2ekd s LEU 107 CO 0.30 0.27 0.36 2.29 0.23 0.00 0.00 176.35 179.80 2ekd n LYS 108 N 1.76 0.00 -0.46 1.70 2.85 -1.26 -4.86 118.16 117.89 2ekd n LYS 108 Ca -0.10 -0.35 0.08 0.00 -1.05 0.00 0.00 58.31 56.89 2ekd n LYS 108 Cb 0.51 -0.33 0.28 0.00 -0.65 0.00 0.00 35.03 34.84 2ekd n LYS 108 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 2ekd n ASP 109 N 0.00 3.76 -4.26 -5.58 5.68 -1.26 -5.01 116.55 109.88 2ekd n ASP 109 Ca 0.00 -2.28 -0.38 0.00 -0.50 0.00 0.00 54.79 51.63 2ekd n ASP 109 Cb 0.51 -0.49 0.03 0.00 -1.14 0.00 0.00 41.12 40.02 2ekd n ASP 109 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2ekd n TYR 110 N 0.95 -2.76 -2.42 2.11 4.01 -1.26 -4.70 117.16 113.09 2ekd n TYR 110 Ca 0.21 0.35 -0.32 0.00 -0.16 0.00 0.00 57.90 57.98 2ekd n TYR 110 Cb 0.69 -1.70 -0.03 0.00 -0.31 0.00 0.00 39.34 37.98 2ekd n TYR 110 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2ekd s PRO 111 N -1.56 3.95 0.16 -0.72 0.04 -1.26 -5.09 135.00 130.51 2ekd s PRO 111 Ca 0.56 0.94 0.08 0.00 0.04 0.00 0.00 61.00 62.63 2ekd s PRO 111 Cb -0.41 -2.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.94 2ekd s PRO 111 CO 0.67 -0.26 -0.18 0.14 0.04 0.00 0.00 177.00 177.40 2ekd s VAL 112 N -2.61 1.79 -0.32 -0.36 -7.23 -0.48 -4.27 120.40 106.92 2ekd s VAL 112 Ca 0.59 -1.89 -0.17 0.00 -1.81 0.00 0.00 61.98 58.70 2ekd s VAL 112 Cb -0.10 -1.81 -0.01 0.00 0.56 0.00 0.00 36.38 35.01 2ekd s VAL 112 CO 0.31 -0.31 0.48 -0.63 -0.31 0.00 0.00 175.10 174.65 2ekd s ILE 113 N -2.00 5.06 -0.60 -0.62 -1.09 -0.55 -1.68 121.20 119.72 2ekd s ILE 113 Ca 0.15 0.47 -0.03 0.00 -2.23 0.00 0.00 60.65 59.01 2ekd s ILE 113 Cb -0.06 -3.89 0.15 0.00 -1.58 0.00 0.00 42.46 37.09 2ekd s ILE 113 CO 0.06 -0.09 0.41 0.21 -1.23 0.00 0.00 174.94 174.30 2ekd s ASN 114 N 1.70 5.21 0.13 3.58 3.04 0.15 -1.96 114.94 126.79 2ekd s ASN 114 Ca 0.18 -2.77 -0.30 0.00 0.04 0.00 0.00 52.86 50.01 2ekd s ASN 114 Cb -0.16 -1.84 -0.06 0.00 -1.54 0.00 0.00 41.25 37.65 2ekd s ASN 114 CO 0.12 -0.38 1.00 -2.84 -3.04 0.00 0.00 177.10 171.95 2ekd s PRO 115 N 0.06 4.67 -0.21 0.43 0.02 -1.12 -0.69 135.00 138.17 2ekd s PRO 115 Ca 0.16 1.52 0.01 0.00 0.02 0.00 0.00 61.00 62.71 2ekd s PRO 115 Cb -0.21 -3.35 0.03 0.00 0.02 0.00 0.00 34.50 30.99 2ekd s PRO 115 CO -0.03 0.18 -0.15 0.08 -0.33 0.00 0.00 177.00 176.75 2ekd s VAL 116 N -0.07 2.32 -0.06 3.83 1.01 0.93 -0.89 120.40 127.47 2ekd s VAL 116 Ca 0.48 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 61.41 2ekd s VAL 116 Cb -0.25 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 2ekd s VAL 116 CO 0.31 0.36 -0.11 -0.76 0.00 0.00 0.00 175.10 174.90 2ekd s LEU 117 N 1.27 2.91 0.00 3.92 1.43 -0.62 -1.20 118.68 126.39 2ekd s LEU 117 Ca 0.01 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 2ekd s LEU 117 Cb -0.15 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.45 2ekd s LEU 117 CO -0.09 0.34 0.00 0.61 0.23 0.00 0.00 176.35 177.43 2ekd n GLY 118 N 2.39 0.79 0.37 -3.19 0.00 -1.25 -1.46 105.19 102.85 2ekd n GLY 118 Ca -0.18 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.94 2ekd n GLY 118 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2ekd h LEU 119 N 0.00 0.78 -2.26 0.99 5.85 -1.85 -0.17 115.31 118.66 2ekd h LEU 119 Ca 0.00 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 2ekd h LEU 119 Cb 0.00 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 2ekd h LEU 119 CO 0.00 0.42 -0.03 1.12 -0.34 0.00 0.00 178.44 179.62 2ekd h HIS 120 N 0.84 0.00 -0.06 1.25 2.07 -1.92 -2.28 115.15 115.05 2ekd h HIS 120 Ca 0.46 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.97 2ekd h HIS 120 Cb 0.56 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.54 2ekd h HIS 120 CO -0.00 0.03 0.02 0.87 -3.07 0.00 0.00 177.93 175.77 2ekd h LYS 121 N 0.00 0.09 -0.79 5.12 1.57 -1.43 -1.48 116.57 119.66 2ekd h LYS 121 Ca -0.00 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.81 2ekd h LYS 121 Cb 0.06 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.31 2ekd h LYS 121 CO 0.00 0.27 0.52 -0.07 -0.57 0.00 0.00 179.45 179.60 2ekd h LEU 122 N -0.10 0.80 -0.32 2.94 3.38 -1.46 -2.17 115.31 118.39 2ekd h LEU 122 Ca 0.02 -0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.80 2ekd h LEU 122 Cb 0.21 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2ekd h LEU 122 CO -0.00 0.54 -0.52 0.40 0.09 0.00 0.00 178.44 178.95 2ekd h ILE 123 N 0.92 1.27 -0.46 1.22 2.04 -1.31 -2.78 117.51 118.42 2ekd h ILE 123 Ca 0.32 -1.70 -0.06 0.00 1.00 0.00 0.00 64.86 64.43 2ekd h ILE 123 Cb 0.12 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 2ekd h ILE 123 CO -0.10 0.56 0.05 0.25 0.00 0.00 0.00 178.15 178.91 2ekd h LEU 124 N 0.69 0.68 -0.81 1.44 5.85 -0.85 -3.01 115.31 119.30 2ekd h LEU 124 Ca 0.02 -0.13 -0.12 0.00 0.84 0.00 0.00 57.88 58.49 2ekd h LEU 124 Cb 1.12 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 2ekd h LEU 124 CO 0.12 0.71 -0.56 -0.07 -0.34 0.00 0.00 178.44 178.30 2ekd h LEU 125 N 0.69 0.00-10.34 2.25 3.38 -1.33 -3.47 115.31 106.49 2ekd h LEU 125 Ca 0.15 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.64 2ekd h LEU 125 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2ekd h LEU 125 CO 0.01 0.56 -0.30 -0.83 0.09 0.00 0.00 178.44 177.97 2ekd s GLY 126 N -4.44 2.04 0.79 0.83 0.00 -1.06 -5.09 107.32 100.40 2ekd s GLY 126 Ca -0.01 -1.79 -0.04 0.00 0.00 0.00 0.00 44.72 42.88 2ekd s GLY 126 CO 0.75 -1.64 1.09 1.16 0.00 0.00 0.00 173.10 174.45 2ekd n ASN 127 N -1.75 1.09 -0.16 1.64 0.23 -1.26 -4.77 115.26 110.28 2ekd n ASN 127 Ca 0.06 -2.01 -0.02 0.00 -0.53 0.00 0.00 54.58 52.08 2ekd n ASN 127 Cb 0.61 -0.74 0.06 0.00 -2.08 0.00 0.00 39.78 37.63 2ekd n ASN 127 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2ekd h THR 128 N -0.87 0.59 -0.45 5.53 2.02 -1.98 0.23 112.91 117.98 2ekd h THR 128 Ca -0.36 -0.03 0.03 0.00 0.77 0.00 0.00 66.41 66.82 2ekd h THR 128 Cb 1.23 0.48 -0.04 0.00 -1.74 0.00 0.00 68.15 68.08 2ekd h THR 128 CO 0.35 0.02 0.24 0.15 0.37 0.00 0.00 175.52 176.64 2ekd h PHE 129 N 0.10 0.44 0.00 3.16 3.57 -1.99 0.52 116.94 122.73 2ekd h PHE 129 Ca 0.25 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.65 2ekd h PHE 129 Cb 0.38 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 2ekd h PHE 129 CO -0.33 0.23 -0.57 0.93 -2.23 0.00 0.00 178.31 176.34 2ekd h GLU 130 N 0.47 0.00 -0.43 1.11 5.08 -1.71 -2.69 114.58 116.42 2ekd h GLU 130 Ca 0.19 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.42 2ekd h GLU 130 Cb 0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2ekd h GLU 130 CO -0.12 0.57 -0.26 -0.91 -1.00 0.00 0.00 179.01 177.29 2ekd h ASN 131 N 0.00 0.93 -0.57 1.42 -0.26 0.07 -2.19 115.58 114.98 2ekd h ASN 131 Ca -0.01 -0.36 -0.06 0.00 -0.56 0.00 0.00 56.30 55.31 2ekd h ASN 131 Cb 1.04 -0.26 -0.03 0.00 -1.06 0.00 0.00 38.32 38.01 2ekd h ASN 131 CO 0.07 1.13 0.15 0.40 -1.06 0.00 0.00 177.43 178.13 2ekd h ILE 132 N 0.77 1.24 0.00 2.81 2.04 -0.73 -2.02 117.51 121.61 2ekd h ILE 132 Ca 0.09 -0.87 -0.10 0.00 1.00 0.00 0.00 64.86 64.99 2ekd h ILE 132 Cb 0.82 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 2ekd h ILE 132 CO 0.07 0.33 -0.46 0.78 0.00 0.00 0.00 178.15 178.87 2ekd h ASN 133 N 0.91 0.00 -0.30 1.72 2.35 -1.27 -1.12 115.58 117.87 2ekd h ASN 133 Ca 0.20 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.83 2ekd h ASN 133 Cb 0.32 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 2ekd h ASN 133 CO -0.00 0.46 -0.21 0.58 -1.65 0.00 0.00 177.43 176.60 2ekd h VAL 134 N 0.00 1.27 -0.27 2.81 2.07 -0.78 -2.98 116.25 118.37 2ekd h VAL 134 Ca -0.00 -1.32 -0.14 0.00 0.82 0.00 0.00 66.70 66.05 2ekd h VAL 134 Cb 0.82 1.19 -0.00 0.00 -1.52 0.00 0.00 31.29 31.78 2ekd h VAL 134 CO 0.06 0.44 -0.38 0.58 0.02 0.00 0.00 177.57 178.29 2ekd h VAL 135 N 0.68 1.30 0.00 2.57 2.07 -1.03 -2.44 116.25 119.40 2ekd h VAL 135 Ca 0.10 -1.57 0.00 0.00 0.82 0.00 0.00 66.70 66.04 2ekd h VAL 135 Cb 0.72 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.15 2ekd h VAL 135 CO 0.06 0.50 0.00 1.17 0.02 0.00 0.00 177.57 179.32 2ekd n LYS 136 N -4.19 0.00 0.00 1.57 4.81 -0.45 -0.60 118.16 119.29 2ekd n LYS 136 Ca -0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.40 2ekd n LYS 136 Cb 0.53 -1.28 0.00 0.00 0.02 0.00 0.00 35.03 34.30 2ekd n LYS 136 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2ekd n VAL 138 N 1.18 0.00 0.26 3.15 0.31 -0.92 -0.58 118.33 121.74 2ekd n VAL 138 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.47 2ekd n VAL 138 Cb 0.00 0.00 0.69 0.00 -0.91 0.00 0.00 33.84 33.62 2ekd n VAL 138 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2ekd h SER 139 N 0.00 0.00 0.35 4.52 4.64 -1.16 -2.67 113.55 119.22 2ekd h SER 139 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2ekd h SER 139 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2ekd h SER 139 CO 0.00 0.12 -0.06 0.78 -0.87 0.00 0.00 176.83 176.80 2ekd h ASN 140 N 0.00 0.00 0.00 4.97 4.21 -1.08 -3.05 115.58 120.62 2ekd h ASN 140 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2ekd h ASN 140 Cb 0.45 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.65 2ekd h ASN 140 CO 0.02 0.06 -0.84 -1.22 -1.29 0.00 0.00 177.43 174.16 2ekd n TYR 141 N -3.42 0.00 -1.67 1.19 4.01 -1.01 -4.97 117.16 111.29 2ekd n TYR 141 Ca -0.02 0.00 -0.46 0.00 -0.16 0.00 0.00 57.90 57.27 2ekd n TYR 141 Cb 0.19 -0.04 -0.04 0.00 -0.31 0.00 0.00 39.34 39.14 2ekd n TYR 141 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2ekd n VAL 142 N -1.44 0.18 0.00 -0.72 0.31 -1.16 -2.11 118.33 113.40 2ekd n VAL 142 Ca 0.02 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 2ekd n VAL 142 Cb 0.26 -1.54 0.00 0.00 -0.91 0.00 0.00 33.84 31.65 2ekd n VAL 142 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ekd n GLY 143 N 3.18 2.34 3.57 2.92 0.00 0.12 -5.01 105.19 112.30 2ekd n GLY 143 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2ekd n GLY 143 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ekd s ARG 144 N -0.84 3.00 0.00 1.61 1.70 -0.90 -4.65 118.95 118.87 2ekd s ARG 144 Ca 0.00 0.92 0.01 0.00 -0.47 0.00 0.00 55.73 56.19 2ekd s ARG 144 Cb 0.00 -4.27 0.08 0.00 -0.57 0.00 0.00 34.95 30.19 2ekd s ARG 144 CO 0.00 -2.28 0.67 0.39 -1.08 0.00 0.00 175.30 173.01 2ekd n GLU 145 N 8.79 0.04 0.26 3.89 1.02 -1.26 -2.36 120.64 131.01 2ekd n GLU 145 Ca 0.20 0.10 0.17 0.00 -0.02 0.00 0.00 57.16 57.61 2ekd n GLU 145 Cb 0.50 -1.50 0.86 0.00 -0.02 0.00 0.00 31.44 31.28 2ekd n GLU 145 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2ekd h GLU 146 N 0.00 0.00 -2.84 3.49 3.07 -1.95 -3.41 114.58 112.95 2ekd h GLU 146 Ca 0.00 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 58.92 2ekd h GLU 146 Cb 0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.89 2ekd h GLU 146 CO 0.00 0.00 0.35 -0.98 -1.40 0.00 0.00 179.01 176.98 2ekd s ARG 147 N -3.79 1.84 -0.22 2.33 3.03 -1.00 -1.38 118.95 119.76 2ekd s ARG 147 Ca -0.02 -1.14 0.01 0.00 2.03 0.00 0.00 55.73 56.62 2ekd s ARG 147 Cb 0.10 0.55 0.05 0.00 -1.03 0.00 0.00 34.95 34.62 2ekd s ARG 147 CO 0.38 -0.86 -0.10 0.42 -1.13 0.00 0.00 175.30 174.02 2ekd s ILE 148 N -2.76 1.75 0.00 4.99 1.01 -0.68 -0.58 121.20 124.93 2ekd s ILE 148 Ca 0.15 -1.21 -0.14 0.00 0.00 0.00 0.00 60.65 59.45 2ekd s ILE 148 Cb -0.04 -1.88 -0.06 0.00 0.01 0.00 0.00 42.46 40.49 2ekd s ILE 148 CO 0.08 0.07 0.40 0.00 0.00 0.00 0.00 174.94 175.49 2ekd s ALA 149 N 1.32 3.71 -0.30 9.38 0.00 -0.79 -0.68 121.76 134.40 2ekd s ALA 149 Ca -0.04 -0.25 0.03 0.00 0.00 0.00 0.00 51.96 51.70 2ekd s ALA 149 Cb -0.18 -2.36 0.08 0.00 0.00 0.00 0.00 23.12 20.67 2ekd s ALA 149 CO -0.07 0.49 -0.01 -0.06 0.00 0.00 0.00 175.76 176.12 2ekd s PHE 150 N -1.10 3.26 -0.61 0.00 0.08 0.14 0.53 117.98 120.28 2ekd s PHE 150 Ca 0.24 -2.53 -0.21 0.00 0.12 0.00 0.00 56.93 54.55 2ekd s PHE 150 Cb -0.16 -2.35 0.08 0.00 -0.57 0.00 0.00 43.02 40.01 2ekd s PHE 150 CO 0.13 -0.90 0.83 0.71 -0.10 0.00 0.00 175.22 175.89 2ekd s TYR 151 N 1.09 2.84 -0.39 0.36 1.51 0.18 -0.05 117.35 122.90 2ekd s TYR 151 Ca 0.03 -0.66 -0.29 0.00 -1.01 0.00 0.00 57.07 55.14 2ekd s TYR 151 Cb -0.19 -4.09 0.02 0.00 -0.11 0.00 0.00 41.96 37.59 2ekd s TYR 151 CO -0.08 -1.43 1.23 -0.06 -1.11 0.00 0.00 175.55 174.10 2ekd s PHE 152 N 3.38 2.74 -0.02 2.71 0.40 -0.34 -0.49 117.98 126.35 2ekd s PHE 152 Ca 0.18 0.83 0.04 0.00 -0.60 0.00 0.00 56.93 57.38 2ekd s PHE 152 Cb -0.20 -4.15 -0.01 0.00 0.51 0.00 0.00 43.02 39.18 2ekd s PHE 152 CO 0.10 -1.46 -0.14 0.14 0.70 0.00 0.00 175.22 174.55 2ekd s VAL 153 N 4.53 1.16 -0.69 -0.44 -7.23 0.20 -3.86 120.40 114.07 2ekd s VAL 153 Ca 0.53 -0.60 -0.27 0.00 -1.81 0.00 0.00 61.98 59.82 2ekd s VAL 153 Cb -0.12 -0.99 0.02 0.00 0.56 0.00 0.00 36.38 35.85 2ekd s VAL 153 CO 0.27 0.34 1.43 0.21 -0.31 0.00 0.00 175.10 177.04 2ekd s ASN 154 N -0.16 5.95 0.18 4.85 3.84 -1.26 -1.68 114.94 126.66 2ekd s ASN 154 Ca 0.02 -0.18 -0.22 0.00 0.21 0.00 0.00 52.86 52.69 2ekd s ASN 154 Cb -0.08 -2.55 0.09 0.00 -0.55 0.00 0.00 41.25 38.17 2ekd s ASN 154 CO 0.00 -1.95 1.58 -0.09 -2.79 0.00 0.00 177.10 173.85 2ekd h ARG 155 N 11.31 -0.19 -0.99 0.43 2.43 -1.22 -2.33 114.38 123.83 2ekd h ARG 155 Ca -0.27 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.01 2ekd h ARG 155 Cb 1.08 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 30.60 2ekd h ARG 155 CO 1.25 -0.13 0.63 -0.91 -1.51 0.00 0.00 179.97 179.31 2ekd h ASN 156 N -0.20 0.95 -0.52 -3.80 2.35 -1.90 -0.42 115.58 112.04 2ekd h ASN 156 Ca 0.21 0.03 0.06 0.00 -0.55 0.00 0.00 56.30 56.05 2ekd h ASN 156 Cb 0.55 -0.17 -0.05 0.00 0.05 0.00 0.00 38.32 38.71 2ekd h ASN 156 CO -0.66 0.55 0.24 0.58 -1.65 0.00 0.00 177.43 176.49 2ekd h VAL 157 N 1.04 0.90 -0.03 2.81 2.07 -1.78 -0.98 116.25 120.28 2ekd h VAL 157 Ca 0.46 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.79 2ekd h VAL 157 Cb 0.36 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2ekd h VAL 157 CO -0.22 0.08 -0.11 0.40 0.02 0.00 0.00 177.57 177.75 2ekd h ILE 158 N 0.45 1.47 -0.33 4.57 2.04 -1.33 -2.51 117.51 121.88 2ekd h ILE 158 Ca 0.24 -1.54 0.07 0.00 1.00 0.00 0.00 64.86 64.63 2ekd h ILE 158 Cb 0.20 2.40 -0.07 0.00 -0.74 0.00 0.00 36.82 38.61 2ekd h ILE 158 CO -0.20 0.42 -0.11 -0.08 0.00 0.00 0.00 178.15 178.18 2ekd h GLU 159 N -0.43 -0.04 0.00 2.37 4.22 -0.96 0.15 114.58 119.88 2ekd h GLU 159 Ca -0.00 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.31 2ekd h GLU 159 Cb 0.74 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 2ekd h GLU 159 CO 0.02 -0.03 -0.61 0.87 -2.18 0.00 0.00 179.01 177.08 2ekd h LYS 160 N -0.04 0.00 0.04 1.92 1.57 -1.27 -2.23 116.57 116.55 2ekd h LYS 160 Ca 0.16 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2ekd h LYS 160 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2ekd h LYS 160 CO -0.37 0.61 -0.02 1.25 -0.57 0.00 0.00 179.45 180.36 2ekd h HIS 161 N 0.00 -0.05 -1.73 -1.35 2.76 -1.06 -3.44 115.15 110.27 2ekd h HIS 161 Ca -0.01 -0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 57.94 2ekd h HIS 161 Cb 1.13 0.02 -0.29 0.00 1.55 0.00 0.00 27.41 29.82 2ekd h HIS 161 CO 0.00 0.60 -0.57 0.45 -1.30 0.00 0.00 177.93 177.12 2ekd s SER 162 N -5.87 0.49 0.35 3.26 0.15 0.48 -5.03 113.70 107.54 2ekd s SER 162 Ca -0.14 -0.66 0.04 0.00 0.70 0.00 0.00 55.95 55.88 2ekd s SER 162 Cb -0.01 1.02 0.67 0.00 -1.71 0.00 0.00 66.02 65.99 2ekd s SER 162 CO 0.53 -0.33 1.98 -1.28 1.20 0.00 0.00 173.24 175.35 2ekd h SER 163 N 7.89 0.71 -0.28 5.45 0.87 -1.50 -2.22 113.55 124.47 2ekd h SER 163 Ca -0.05 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.46 2ekd h SER 163 Cb 1.11 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.89 2ekd h SER 163 CO 0.25 0.49 0.05 -0.65 -0.53 0.00 0.00 176.83 176.44 2ekd h PRO 164 N 0.83 0.56 -0.07 2.24 0.11 -1.91 -2.68 132.00 131.07 2ekd h PRO 164 Ca 0.28 -0.10 -0.10 0.00 0.11 0.00 0.00 66.00 66.19 2ekd h PRO 164 Cb 0.07 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 2ekd h PRO 164 CO -0.08 0.54 -0.40 0.82 -0.21 0.00 0.00 178.00 178.67 2ekd h ILE 165 N 0.54 1.30 -0.39 4.15 1.08 -1.75 -1.97 117.51 120.47 2ekd h ILE 165 Ca 0.12 -1.45 -0.15 0.00 -0.39 0.00 0.00 64.86 62.99 2ekd h ILE 165 Cb 0.27 1.69 -0.01 0.00 -3.07 0.00 0.00 36.82 35.70 2ekd h ILE 165 CO 0.00 0.43 -0.35 0.25 -0.69 0.00 0.00 178.15 177.79 2ekd h LEU 166 N 0.13 0.95 -0.70 1.44 5.85 -1.40 -1.66 115.31 119.91 2ekd h LEU 166 Ca 0.01 -0.42 -0.08 0.00 0.84 0.00 0.00 57.88 58.24 2ekd h LEU 166 Cb 0.76 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 2ekd h LEU 166 CO 0.06 1.20 0.14 0.44 -0.34 0.00 0.00 178.44 179.93 2ekd h ASP 167 N 0.74 1.08 -0.70 1.25 3.32 -1.28 -0.90 116.42 119.93 2ekd h ASP 167 Ca 0.07 -0.25 -0.07 0.00 0.02 0.00 0.00 57.03 56.80 2ekd h ASP 167 Cb 0.93 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 2ekd h ASP 167 CO 0.09 1.05 0.17 -0.07 -1.72 0.00 0.00 179.24 178.76 2ekd h LEU 168 N 1.06 1.06 -0.46 1.55 3.38 -1.23 -2.23 115.31 118.44 2ekd h LEU 168 Ca 0.21 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2ekd h LEU 168 Cb 0.42 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2ekd h LEU 168 CO 0.01 1.02 0.20 0.25 0.09 0.00 0.00 178.44 180.01 2ekd h LEU 169 N 1.06 0.62 -1.46 1.67 6.46 -0.92 -2.29 115.31 120.45 2ekd h LEU 169 Ca 0.22 -0.16 -0.03 0.00 -0.12 0.00 0.00 57.88 57.80 2ekd h LEU 169 Cb 0.37 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.14 2ekd h LEU 169 CO 0.00 0.61 -0.13 -0.33 -0.62 0.00 0.00 178.44 177.97 2ekd h GLU 170 N 0.60 0.00 -0.06 1.25 5.08 -1.04 -3.08 114.58 117.33 2ekd h GLU 170 Ca 0.15 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.31 2ekd h GLU 170 Cb 0.17 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.43 2ekd h GLU 170 CO -0.01 0.13 -0.75 1.49 -1.00 0.00 0.00 179.01 178.87 2ekd h GLU 171 N 0.00 0.61 0.00 2.33 4.81 -0.86 -3.33 114.58 118.13 2ekd h GLU 171 Ca -0.00 -0.58 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 2ekd h GLU 171 Cb 0.56 0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.09 2ekd h GLU 171 CO 0.02 1.19 0.00 -0.39 -0.73 0.00 0.00 179.01 179.10 2ekd h VAL 172 N 0.23 0.00 -3.96 0.32 -1.51 -1.36 -3.45 116.25 106.52 2ekd h VAL 172 Ca -0.08 -0.77 -0.49 0.00 -1.23 0.00 0.00 66.70 64.14 2ekd h VAL 172 Cb 1.41 1.75 0.06 0.00 -2.13 0.00 0.00 31.29 32.38 2ekd h VAL 172 CO 0.15 0.00 0.26 0.68 -1.23 0.00 0.00 177.57 177.43 2ekd s VAL 173 N -3.25 3.94 -0.12 7.19 -7.23 -1.18 -4.87 120.40 114.88 2ekd s VAL 173 Ca 0.07 0.28 0.18 0.00 -1.81 0.00 0.00 61.98 60.70 2ekd s VAL 173 Cb 0.08 -3.58 -0.21 0.00 0.56 0.00 0.00 36.38 33.23 2ekd s VAL 173 CO 0.62 -0.66 0.54 0.35 -0.31 0.00 0.00 175.10 175.64 2ekd n THR 174 N -2.67 1.04 -3.98 5.32 -2.24 -0.87 -4.96 114.28 105.93 2ekd n THR 174 Ca 0.05 -0.71 -0.09 0.00 -2.27 0.00 0.00 64.05 61.03 2ekd n THR 174 Cb 0.57 -0.53 -0.11 0.00 -2.10 0.00 0.00 70.33 68.15 2ekd n THR 174 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2ekd s SER 175 N -5.47 0.24 -0.04 3.42 0.01 -1.16 -3.79 113.70 106.90 2ekd s SER 175 Ca -0.06 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 56.69 2ekd s SER 175 Cb 0.09 0.12 0.03 0.00 0.21 0.00 0.00 66.02 66.46 2ekd s SER 175 CO 0.84 -0.33 -0.01 -0.63 0.41 0.00 0.00 173.24 173.51 2ekd s ILE 176 N -1.67 0.30 0.06 1.44 1.01 -0.51 -1.21 121.20 120.62 2ekd s ILE 176 Ca -0.14 0.05 0.07 0.00 0.00 0.00 0.00 60.65 60.63 2ekd s ILE 176 Cb -0.08 -0.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.96 2ekd s ILE 176 CO -0.02 0.19 -0.18 -0.76 0.00 0.00 0.00 174.94 174.18 2ekd s LEU 177 N 1.20 2.65 -0.13 2.97 1.43 0.92 -0.93 118.68 126.79 2ekd s LEU 177 Ca -0.07 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.57 2ekd s LEU 177 Cb -0.13 -1.54 0.04 0.00 0.03 0.00 0.00 46.19 44.58 2ekd s LEU 177 CO -0.02 0.24 -0.03 -0.70 0.23 0.00 0.00 176.35 176.07 2ekd s GLU 178 N -1.60 1.09 -0.23 1.70 2.12 0.15 -0.38 118.70 121.56 2ekd s GLU 178 Ca 0.15 -0.23 -0.29 0.00 0.36 0.00 0.00 54.97 54.96 2ekd s GLU 178 Cb -0.11 -1.58 0.00 0.00 0.26 0.00 0.00 34.13 32.71 2ekd s GLU 178 CO 0.06 -0.37 1.12 0.42 -0.54 0.00 0.00 175.26 175.95 2ekd s ILE 179 N 1.79 4.53 0.39 -3.70 1.01 -0.33 -0.77 121.20 124.12 2ekd s ILE 179 Ca 0.03 1.83 0.04 0.00 0.00 0.00 0.00 60.65 62.55 2ekd s ILE 179 Cb -0.14 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 38.06 2ekd s ILE 179 CO -0.07 -0.22 0.08 0.42 0.00 0.00 0.00 174.94 175.14 2ekd s THR 180 N 3.39 0.98 0.33 2.92 -4.23 -0.36 -4.71 115.64 113.97 2ekd s THR 180 Ca 0.48 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.00 2ekd s THR 180 Cb -0.16 -2.53 0.23 0.00 1.34 0.00 0.00 72.50 71.38 2ekd s THR 180 CO 0.10 0.00 1.95 0.44 -0.54 0.00 0.00 174.62 176.57 2ekd h ASP 181 N 1.85 0.75 0.40 3.99 3.32 -1.98 -2.64 116.42 122.11 2ekd h ASP 181 Ca -0.39 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2ekd h ASP 181 Cb 1.27 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.63 2ekd h ASP 181 CO 0.66 0.61 -0.24 -1.54 -1.72 0.00 0.00 179.24 177.00 2ekd n SER 182 N -4.39 0.64 0.00 6.45 3.41 -1.26 -5.03 113.62 113.44 2ekd n SER 182 Ca 0.06 -0.53 0.00 0.00 -0.26 0.00 0.00 58.87 58.14 2ekd n SER 182 Cb 0.10 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 2ekd n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ekd n GLY 183 N 1.37 0.46 3.56 5.00 0.00 -1.00 -4.89 105.19 109.70 2ekd n GLY 183 Ca 0.11 -1.76 -0.40 0.00 0.00 0.00 0.00 46.02 43.97 2ekd n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ekd s ILE 184 N -2.22 5.18 -0.06 -0.61 1.01 0.34 -1.22 121.20 123.62 2ekd s ILE 184 Ca 0.00 0.17 -0.25 0.00 0.00 0.00 0.00 60.65 60.57 2ekd s ILE 184 Cb 0.00 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 2ekd s ILE 184 CO 0.00 -0.01 0.76 -0.63 0.00 0.00 0.00 174.94 175.06 2ekd s ILE 185 N 2.00 5.01 -0.79 2.92 1.01 0.05 -1.32 121.20 130.08 2ekd s ILE 185 Ca 0.12 1.56 -0.18 0.00 0.00 0.00 0.00 60.65 62.15 2ekd s ILE 185 Cb -0.16 -4.10 0.13 0.00 0.01 0.00 0.00 42.46 38.34 2ekd s ILE 185 CO 0.11 0.23 0.93 -0.63 0.00 0.00 0.00 174.94 175.59 2ekd s ILE 186 N 0.86 4.85 0.17 2.92 1.01 -0.32 -0.67 121.20 130.02 2ekd s ILE 186 Ca 0.40 -1.42 -0.05 0.00 0.00 0.00 0.00 60.65 59.59 2ekd s ILE 186 Cb -0.18 -4.64 -0.07 0.00 0.01 0.00 0.00 42.46 37.58 2ekd s ILE 186 CO 0.20 -1.32 1.47 0.11 0.00 0.00 0.00 174.94 175.40 2ekd h LYS 187 N 8.84 0.61 -3.54 2.79 1.57 -1.35 0.15 116.57 125.64 2ekd h LYS 187 Ca -0.03 -0.40 -0.16 0.00 -1.87 0.00 0.00 60.65 58.19 2ekd h LYS 187 Cb 1.05 0.05 -0.22 0.00 0.08 0.00 0.00 32.23 33.19 2ekd h LYS 187 CO 1.05 1.02 -0.54 0.21 -0.57 0.00 0.00 179.45 180.63 2ekd s LYS 188 N -3.97 0.38 0.08 3.15 2.20 -1.15 -4.58 119.74 115.85 2ekd s LYS 188 Ca -0.08 -0.27 -0.26 0.00 -0.36 0.00 0.00 55.97 55.00 2ekd s LYS 188 Cb 0.11 0.16 0.08 0.00 -1.51 0.00 0.00 37.83 36.66 2ekd s LYS 188 CO 0.85 -0.08 0.67 0.45 -0.36 0.00 0.00 175.35 176.88 2ekd s SER 189 N -1.01 -0.55 0.25 1.43 0.15 -1.26 -1.42 113.70 111.29 2ekd s SER 189 Ca -0.11 0.16 0.12 0.00 0.70 0.00 0.00 55.95 56.82 2ekd s SER 189 Cb -0.06 0.55 0.17 0.00 -1.71 0.00 0.00 66.02 64.97 2ekd s SER 189 CO 0.01 -0.82 1.49 0.40 1.20 0.00 0.00 173.24 175.52 2ekd h ILE 190 N 2.22 1.28 -3.44 6.45 2.04 -1.92 -3.40 117.51 120.74 2ekd h ILE 190 Ca -0.30 -2.44 -0.68 0.00 1.00 0.00 0.00 64.86 62.43 2ekd h ILE 190 Cb 1.26 2.39 -0.18 0.00 -0.74 0.00 0.00 36.82 39.55 2ekd h ILE 190 CO 0.37 0.65 -0.05 -0.54 0.00 0.00 0.00 178.15 178.58 2ekd s LYS 191 N -3.17 3.14 0.08 2.37 1.02 -1.26 -4.91 119.74 117.02 2ekd s LYS 191 Ca 0.01 -0.74 0.11 0.00 0.02 0.00 0.00 55.97 55.38 2ekd s LYS 191 Cb 0.10 -4.01 0.52 0.00 -0.52 0.00 0.00 37.83 33.92 2ekd s LYS 191 CO 0.76 -1.02 1.35 -0.25 -0.92 0.00 0.00 175.35 175.27 2ekd n ASP 192 N 5.93 0.18 0.25 2.83 9.92 -1.26 -2.09 116.55 132.31 2ekd n ASP 192 Ca -0.06 0.56 0.16 0.00 -0.53 0.00 0.00 54.79 54.93 2ekd n ASP 192 Cb 0.47 -0.59 0.60 0.00 -0.64 0.00 0.00 41.12 40.95 2ekd n ASP 192 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 2ekd h GLU 193 N 0.00 0.00 -0.00 -1.24 4.81 -1.95 -3.25 114.58 112.95 2ekd h GLU 193 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2ekd h GLU 193 Cb 0.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.51 2ekd h GLU 193 CO 0.00 0.00 -0.07 0.44 -0.73 0.00 0.00 179.01 178.65 2ekd n ILE 194 N -2.99 0.00 -1.78 2.32 -5.35 -0.89 -4.97 119.36 105.71 2ekd n ILE 194 Ca 0.01 -0.47 -0.42 0.00 -0.27 0.00 0.00 62.75 61.61 2ekd n ILE 194 Cb 0.33 1.02 -0.03 0.00 -1.74 0.00 0.00 39.64 39.22 2ekd n ILE 194 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2ekd s ALA 195 N -0.84 3.85 0.00 -1.28 0.00 -1.22 -1.61 121.76 120.66 2ekd s ALA 195 Ca 0.02 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.46 2ekd s ALA 195 Cb 0.02 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2ekd s ALA 195 CO 0.07 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.26 2ekd n GLY 196 N 4.00 1.35 3.90 0.00 0.00 0.53 -5.04 105.19 109.93 2ekd n GLY 196 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 2ekd n GLY 196 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ekd s LYS 197 N -0.36 3.62 -0.12 1.61 -0.14 -0.63 -4.81 119.74 118.91 2ekd s LYS 197 Ca 0.00 0.15 0.01 0.00 -1.36 0.00 0.00 55.97 54.78 2ekd s LYS 197 Cb 0.00 -2.49 -0.01 0.00 -1.68 0.00 0.00 37.83 33.65 2ekd s LYS 197 CO 0.00 -0.00 -0.17 0.42 -0.76 0.00 0.00 175.35 174.84 2ekd s ILE 198 N -2.41 2.70 0.18 2.17 1.01 -1.26 -1.18 121.20 122.42 2ekd s ILE 198 Ca 0.47 -0.79 0.11 0.00 0.00 0.00 0.00 60.65 60.44 2ekd s ILE 198 Cb -0.10 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2ekd s ILE 198 CO 0.36 0.54 -0.23 0.68 0.00 0.00 0.00 174.94 176.29 2ekd s VAL 199 N 0.36 2.21 -0.53 2.92 -7.23 -0.44 -4.92 120.40 112.78 2ekd s VAL 199 Ca -0.13 -1.99 0.07 0.00 -1.81 0.00 0.00 61.98 58.12 2ekd s VAL 199 Cb -0.17 -2.04 0.25 0.00 0.56 0.00 0.00 36.38 34.98 2ekd s VAL 199 CO 0.07 -0.15 0.64 -1.20 -0.31 0.00 0.00 175.10 174.14 2ekd n SER 200 N 0.31 2.15 0.24 4.85 7.64 -1.26 -0.51 113.62 127.05 2ekd n SER 200 Ca -0.13 -3.10 0.16 0.00 1.01 0.00 0.00 58.87 56.81 2ekd n SER 200 Cb 0.56 -0.66 0.86 0.00 -1.01 0.00 0.00 64.21 63.96 2ekd n SER 200 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2ekd h PRO 201 N 4.18 0.00 0.00 1.43 0.13 -1.98 -2.74 132.00 133.02 2ekd h PRO 201 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2ekd h PRO 201 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2ekd h PRO 201 CO 0.67 0.00 0.00 -0.07 -0.23 0.00 0.00 178.00 178.37 2ekd h LEU 202 N 0.00 0.00 0.00 1.56 4.07 -1.99 -3.44 115.31 115.51 2ekd h LEU 202 Ca 0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2ekd h LEU 202 Cb 0.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 2ekd h LEU 202 CO -0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 177.54