#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ksn n LEU 15 N 0.00 7.54 -1.18 -3.43 4.32 -1.26 -4.43 117.00 118.56 2ksn n LEU 15 Ca 0.00 -4.15 -0.03 0.00 -0.02 0.00 0.00 56.01 51.81 2ksn n LEU 15 Cb 0.00 -0.98 0.13 0.00 -1.62 0.00 0.00 43.42 40.95 2ksn n LEU 15 CO 0.00 1.42 0.26 0.59 -1.22 0.00 0.00 177.39 178.45 2ksn n ASN 16 N -0.80 2.50 -2.66 -1.43 4.13 -1.26 -4.87 115.26 110.87 2ksn n ASN 16 Ca 0.59 -3.59 -0.28 0.00 1.68 0.00 0.00 54.58 52.99 2ksn n ASN 16 Cb 0.69 -0.45 -0.07 0.00 -1.54 0.00 0.00 39.78 38.42 2ksn n ASN 16 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2ksn n GLU 17 N -0.82 2.88 -0.09 3.52 -0.58 -1.26 -4.62 120.64 119.67 2ksn n GLU 17 Ca 0.24 -2.33 0.01 0.00 -0.42 0.00 0.00 57.16 54.67 2ksn n GLU 17 Cb 0.82 -2.26 0.05 0.00 -0.57 0.00 0.00 31.44 29.47 2ksn n GLU 17 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2ksn n ASN 18 N 1.53 1.15 -0.21 1.62 3.02 -1.26 -2.27 115.26 118.83 2ksn n ASN 18 Ca 0.53 -2.07 0.02 0.00 -0.03 0.00 0.00 54.58 53.03 2ksn n ASN 18 Cb 0.53 -0.32 0.04 0.00 -0.61 0.00 0.00 39.78 39.43 2ksn n ASN 18 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2ksn n SER 19 N -0.05 2.07 -0.14 6.41 7.64 -1.26 -4.69 113.62 123.59 2ksn n SER 19 Ca 0.04 -1.78 0.00 0.00 1.01 0.00 0.00 58.87 58.14 2ksn n SER 19 Cb 0.25 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 2ksn n SER 19 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2ksn n GLU 20 N -0.04 0.92 -0.01 1.43 2.13 -0.96 -3.32 120.64 120.78 2ksn n GLU 20 Ca 0.04 0.00 0.06 0.00 0.66 0.00 0.00 57.16 57.92 2ksn n GLU 20 Cb 0.26 -1.13 0.46 0.00 0.27 0.00 0.00 31.44 31.29 2ksn n GLU 20 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2ksn h GLY 21 N 5.26 0.55 -1.80 8.31 0.00 -1.85 -0.63 103.07 112.91 2ksn h GLY 21 Ca 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 2ksn h GLY 21 CO 0.00 0.17 0.00 -0.37 0.00 0.00 0.00 176.54 176.34 2ksn n THR 22 N -4.48 2.40 -3.27 4.70 5.66 -1.21 -4.96 114.28 113.12 2ksn n THR 22 Ca 0.04 -2.13 -0.15 0.00 -3.05 0.00 0.00 64.05 58.76 2ksn n THR 22 Cb 0.14 -0.28 0.08 0.00 -1.55 0.00 0.00 70.33 68.72 2ksn n THR 22 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2ksn n GLY 23 N -0.72 -0.33 2.80 1.09 0.00 -0.24 -5.02 105.19 102.78 2ksn n GLY 23 Ca 0.26 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 46.18 2ksn n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ksn s VAL 24 N -3.33 -0.24 0.00 1.61 1.01 -1.23 -4.95 120.40 113.27 2ksn s VAL 24 Ca 0.03 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.30 2ksn s VAL 24 Cb -0.00 -0.33 0.00 0.00 0.00 0.00 0.00 36.38 36.05 2ksn s VAL 24 CO 0.66 0.10 0.33 0.00 0.00 0.00 0.00 175.10 176.19 2ksn n ALA 25 N 5.32 -0.16 0.04 5.51 0.00 -1.26 -2.81 120.51 127.14 2ksn n ALA 25 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.42 2ksn n ALA 25 Cb 0.50 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.91 2ksn n ALA 25 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2ksn n LEU 26 N -1.98 0.04 0.00 0.00 -0.00 -1.26 -4.55 117.00 109.25 2ksn n LEU 26 Ca 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 56.01 55.92 2ksn n LEU 26 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2ksn n LEU 26 CO 0.00 0.01 0.00 0.61 -0.00 0.00 0.00 177.39 178.01 2ksn n GLY 27 N 2.02 0.68 0.25 1.47 0.00 -1.26 -5.02 105.19 103.33 2ksn n GLY 27 Ca -0.01 0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.11 2ksn n GLY 27 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2ksn h ARG 28 N 0.00 0.09 -6.18 1.61 3.08 -1.86 -3.22 114.38 107.90 2ksn h ARG 28 Ca 0.00 -0.01 -0.53 0.00 0.07 0.00 0.00 59.98 59.51 2ksn h ARG 28 Cb 0.00 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 29.96 2ksn h ARG 28 CO 0.00 0.17 -0.56 0.54 -1.07 0.00 0.00 179.97 179.04 2ksn s ASN 29 N -6.98 4.97 -0.49 7.04 2.20 -1.24 -0.17 114.94 120.27 2ksn s ASN 29 Ca -0.05 -0.52 -0.29 0.00 -0.94 0.00 0.00 52.86 51.06 2ksn s ASN 29 Cb 0.16 -1.02 0.03 0.00 -2.00 0.00 0.00 41.25 38.42 2ksn s ASN 29 CO 0.70 -0.11 1.17 -1.58 -2.94 0.00 0.00 177.10 174.34 2ksn s GLN 30 N -3.80 3.67 0.00 3.55 0.74 -1.25 -4.66 119.66 117.92 2ksn s GLN 30 Ca 0.34 0.53 0.00 0.00 0.05 0.00 0.00 55.36 56.28 2ksn s GLN 30 Cb -0.06 -3.94 0.00 0.00 1.10 0.00 0.00 33.01 30.11 2ksn s GLN 30 CO 0.23 -1.46 0.00 -0.35 -0.55 0.00 0.00 175.29 173.16 2ksn n PRO 31 N 7.98 0.29 -1.56 1.67 -0.04 -1.26 -4.90 135.00 137.18 2ksn n PRO 31 Ca 0.12 0.00 -0.46 0.00 -0.04 0.00 0.00 63.50 63.11 2ksn n PRO 31 Cb 0.49 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.92 2ksn n PRO 31 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2ksn n LEU 32 N 0.00 1.37 -4.56 1.53 7.94 -1.26 -4.80 117.00 117.22 2ksn n LEU 32 Ca 0.00 1.16 -0.38 0.00 -1.11 0.00 0.00 56.01 55.68 2ksn n LEU 32 Cb 0.00 -1.23 -0.03 0.00 0.53 0.00 0.00 43.42 42.69 2ksn n LEU 32 CO 0.00 -1.54 1.38 -0.54 -1.11 0.00 0.00 177.39 175.58 2ksn s LYS 33 N -1.09 3.17 -0.25 1.96 3.01 -1.26 -4.76 119.74 120.52 2ksn s LYS 33 Ca 0.64 -0.50 -0.03 0.00 -1.01 0.00 0.00 55.97 55.07 2ksn s LYS 33 Cb -0.78 -4.84 -0.17 0.00 -1.01 0.00 0.00 37.83 31.03 2ksn s LYS 33 CO 0.57 -2.47 -0.18 1.63 0.51 0.00 0.00 175.35 175.41 2ksn n LYS 34 N 9.06 0.65 -1.55 1.68 4.76 -1.26 -4.96 118.16 126.53 2ksn n LYS 34 Ca 0.24 0.20 -0.33 0.00 -2.87 0.00 0.00 58.31 55.55 2ksn n LYS 34 Cb 0.50 -1.54 0.07 0.00 -1.84 0.00 0.00 35.03 32.22 2ksn n LYS 34 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2ksn s GLU 35 N -2.52 2.52 0.35 1.97 2.56 -1.26 -5.04 118.70 117.27 2ksn s GLU 35 Ca -0.34 1.37 0.01 0.00 0.00 0.00 0.00 54.97 56.01 2ksn s GLU 35 Cb 0.10 -1.92 -0.03 0.00 2.00 0.00 0.00 34.13 34.29 2ksn s GLU 35 CO 0.60 -1.47 0.54 0.15 -0.56 0.00 0.00 175.26 174.52 2ksn s LYS 36 N -4.31 3.40 0.30 4.30 -0.14 -1.26 -4.70 119.74 117.33 2ksn s LYS 36 Ca 0.66 -0.44 -0.29 0.00 -1.36 0.00 0.00 55.97 54.54 2ksn s LYS 36 Cb -0.21 -2.68 -0.10 0.00 -1.68 0.00 0.00 37.83 33.16 2ksn s LYS 36 CO 0.46 0.11 1.35 -2.14 -0.76 0.00 0.00 175.35 174.37 2ksn s PRO 37 N -4.31 4.33 0.08 -1.68 0.02 -1.26 -4.80 135.00 127.37 2ksn s PRO 37 Ca 0.41 2.24 0.05 0.00 0.02 0.00 0.00 61.00 63.72 2ksn s PRO 37 Cb -0.10 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 2ksn s PRO 37 CO 0.35 -0.26 -0.05 0.15 -0.33 0.00 0.00 177.00 176.86 2ksn s LYS 38 N -1.34 2.38 0.00 5.54 1.02 -1.12 -4.53 119.74 121.70 2ksn s LYS 38 Ca 0.52 -0.89 0.00 0.00 0.02 0.00 0.00 55.97 55.62 2ksn s LYS 38 Cb -0.40 -2.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.47 2ksn s LYS 38 CO 0.50 0.54 0.00 -2.67 -0.92 0.00 0.00 175.35 172.80 2ksn n TRP 39 N 0.79 0.00 -4.31 3.18 4.27 -1.26 -3.77 117.44 116.34 2ksn n TRP 39 Ca -0.13 0.00 -0.28 0.00 -3.89 0.00 0.00 57.50 53.20 2ksn n TRP 39 Cb 0.52 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 30.37 2ksn n TRP 39 CO 0.00 0.00 0.00 0.21 -2.29 0.00 0.00 177.69 175.61 2ksn s LYS 40 N 0.00 1.86 0.57 -2.67 2.36 -1.26 -4.74 119.74 115.86 2ksn s LYS 40 Ca 0.00 -1.24 -0.20 0.00 -2.55 0.00 0.00 55.97 51.98 2ksn s LYS 40 Cb 0.00 -2.11 -0.04 0.00 -1.05 0.00 0.00 37.83 34.63 2ksn s LYS 40 CO 0.00 0.46 1.23 -1.12 1.55 0.00 0.00 175.35 177.46 2ksn s SER 41 N -2.43 5.30 0.12 1.43 0.01 -1.26 -4.94 113.70 111.93 2ksn s SER 41 Ca 0.21 2.44 -0.22 0.00 1.31 0.00 0.00 55.95 59.69 2ksn s SER 41 Cb -0.10 -2.61 -0.06 0.00 0.21 0.00 0.00 66.02 63.47 2ksn s SER 41 CO 0.12 -1.52 1.70 0.44 0.41 0.00 0.00 173.24 174.39 2ksn h ASP 42 N 1.09 -0.21 -2.89 2.44 3.32 -2.02 -3.38 116.42 114.77 2ksn h ASP 42 Ca -0.50 0.05 -0.52 0.00 0.02 0.00 0.00 57.03 56.08 2ksn h ASP 42 Cb 1.29 0.12 -0.40 0.00 0.22 0.00 0.00 39.33 40.56 2ksn h ASP 42 CO 0.56 -0.09 -0.77 -0.47 -1.72 0.00 0.00 179.24 176.75 2ksn s TYR 43 N -6.18 0.42 0.16 4.55 5.04 -1.26 -5.12 117.35 114.95 2ksn s TYR 43 Ca -0.14 -0.81 -0.31 0.00 -2.44 0.00 0.00 57.07 53.37 2ksn s TYR 43 Cb 0.09 -0.92 -0.09 0.00 0.35 0.00 0.00 41.96 41.40 2ksn s TYR 43 CO 0.67 -0.75 1.41 -2.14 -1.34 0.00 0.00 175.55 173.40 2ksn s PRO 44 N 2.07 4.31 0.00 4.97 0.02 -1.26 -4.98 135.00 140.12 2ksn s PRO 44 Ca 0.07 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.24 2ksn s PRO 44 Cb -0.16 -3.20 0.00 0.00 0.02 0.00 0.00 34.50 31.16 2ksn s PRO 44 CO -0.29 -0.42 0.00 -0.12 -0.33 0.00 0.00 177.00 175.84 2ksn n MET 45 N 3.45 0.00 -3.20 5.54 1.56 -1.26 -4.90 117.12 118.31 2ksn n MET 45 Ca 0.10 0.00 -0.17 0.00 -0.27 0.00 0.00 57.70 57.36 2ksn n MET 45 Cb 0.41 -0.18 -0.02 0.00 2.15 0.00 0.00 33.22 35.59 2ksn n MET 45 CO 0.00 0.00 0.00 0.25 -0.73 0.00 0.00 175.97 175.49 2ksn n THR 46 N -0.95 0.00 -0.05 1.12 -2.24 -1.26 -4.36 114.28 106.55 2ksn n THR 46 Ca 0.00 -1.31 -0.07 0.00 -2.27 0.00 0.00 64.05 60.40 2ksn n THR 46 Cb 0.00 0.03 0.12 0.00 -2.10 0.00 0.00 70.33 68.38 2ksn n THR 46 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2ksn h ASP 47 N 0.55 0.68 -0.64 3.42 3.58 -1.97 -0.41 116.42 121.62 2ksn h ASP 47 Ca -0.22 -0.26 -0.03 0.00 0.42 0.00 0.00 57.03 56.94 2ksn h ASP 47 Cb 0.73 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.56 2ksn h ASP 47 CO 0.36 0.92 0.27 1.23 -2.88 0.00 0.00 179.24 179.14 2ksn h GLY 48 N 0.99 1.02 1.32 -0.78 0.00 -1.99 0.26 103.07 103.89 2ksn h GLY 48 Ca 0.07 -0.55 -0.12 0.00 0.00 0.00 0.00 47.33 46.73 2ksn h GLY 48 CO 0.06 0.52 -0.26 1.46 0.00 0.00 0.00 176.54 178.32 2ksn h GLN 49 N 0.90 0.78 0.50 4.80 1.08 -1.93 -2.49 115.11 118.75 2ksn h GLN 49 Ca 0.21 -0.33 -0.02 0.00 -1.45 0.00 0.00 58.65 57.06 2ksn h GLN 49 Cb 0.19 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 2ksn h GLN 49 CO -0.02 0.95 -0.27 1.25 -0.95 0.00 0.00 178.83 179.80 2ksn h LEU 50 N 0.67 -0.64 -0.35 1.46 6.46 -0.42 0.20 115.31 122.69 2ksn h LEU 50 Ca 0.09 0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.90 2ksn h LEU 50 Cb 0.78 0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 40.86 2ksn h LEU 50 CO 0.06 -0.44 0.19 0.08 -0.62 0.00 0.00 178.44 177.71 2ksn h ARG 51 N -0.71 0.37 0.13 1.25 0.11 -0.49 0.50 114.38 115.55 2ksn h ARG 51 Ca -0.06 -0.02 -0.01 0.00 0.10 0.00 0.00 59.98 59.99 2ksn h ARG 51 Cb 0.56 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 31.56 2ksn h ARG 51 CO 0.09 0.25 -0.06 0.77 0.10 0.00 0.00 179.97 181.12 2ksn h SER 52 N 0.39 -0.15 0.09 0.08 0.02 -1.42 -2.67 113.55 109.89 2ksn h SER 52 Ca 0.14 -0.29 -0.08 0.00 -0.84 0.00 0.00 61.79 60.73 2ksn h SER 52 Cb 0.03 0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 2ksn h SER 52 CO -0.08 0.22 -0.26 0.11 -1.14 0.00 0.00 176.83 175.68 2ksn h LYS 53 N -0.55 0.29 -0.36 3.45 6.56 -0.87 -1.86 116.57 123.23 2ksn h LYS 53 Ca -0.02 -0.10 0.06 0.00 -1.06 0.00 0.00 60.65 59.53 2ksn h LYS 53 Cb 0.43 -0.02 -0.05 0.00 -0.57 0.00 0.00 32.23 32.02 2ksn h LYS 53 CO 0.03 0.53 0.06 -0.09 -2.06 0.00 0.00 179.45 177.92 2ksn h ARG 54 N 0.26 0.17 -0.15 3.15 2.43 0.06 0.21 114.38 120.51 2ksn h ARG 54 Ca 0.04 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 2ksn h ARG 54 Cb 0.60 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 2ksn h ARG 54 CO 0.04 0.12 0.04 0.22 -1.51 0.00 0.00 179.97 178.88 2ksn h ASP 55 N 0.18 0.22 -0.47 -3.80 3.58 -1.10 0.29 116.42 115.32 2ksn h ASP 55 Ca 0.17 -0.21 0.09 0.00 0.42 0.00 0.00 57.03 57.50 2ksn h ASP 55 Cb 0.21 -0.06 -0.07 0.00 1.72 0.00 0.00 39.33 41.12 2ksn h ASP 55 CO -0.24 0.37 0.02 -0.33 -2.88 0.00 0.00 179.24 176.18 2ksn h GLU 56 N 0.05 0.13 -0.60 0.28 5.08 -0.96 -1.58 114.58 116.98 2ksn h GLU 56 Ca 0.05 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 2ksn h GLU 56 Cb 0.24 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2ksn h GLU 56 CO -0.00 0.08 0.01 0.74 -1.00 0.00 0.00 179.01 178.84 2ksn h PHE 57 N 0.13 1.15 -0.65 4.33 0.04 -0.39 -2.83 116.94 118.72 2ksn h PHE 57 Ca 0.23 -0.20 0.17 0.00 2.80 0.00 0.00 57.97 60.97 2ksn h PHE 57 Cb 0.34 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 2ksn h PHE 57 CO -0.28 1.01 0.45 -1.49 -0.60 0.00 0.00 178.31 177.40 2ksn h TRP 58 N 0.95 0.15 0.00 -0.55 -0.00 0.52 0.60 115.95 117.63 2ksn h TRP 58 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.07 2ksn h TRP 58 Cb 0.55 -0.05 0.00 0.00 -0.00 0.00 0.00 29.16 29.66 2ksn h TRP 58 CO 0.04 0.06 0.00 -0.44 -0.00 0.00 0.00 178.44 178.10 2ksn h ASP 59 N 0.13 0.00 0.00 -3.49 3.32 -1.11 -2.59 116.42 112.68 2ksn h ASP 59 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2ksn h ASP 59 Cb 1.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.60 2ksn h ASP 59 CO -0.04 0.00 -1.23 0.41 -1.72 0.00 0.00 179.24 176.66 2ksn n THR 60 N -2.94 0.00 -1.67 0.35 -1.04 0.15 -5.02 114.28 104.10 2ksn n THR 60 Ca -0.00 -0.26 -0.29 0.00 -2.04 0.00 0.00 64.05 61.46 2ksn n THR 60 Cb 0.22 0.49 0.11 0.00 -1.82 0.00 0.00 70.33 69.33 2ksn n THR 60 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ksn s ALA 61 N -2.64 2.13 0.09 2.41 0.00 0.16 -4.99 121.76 118.92 2ksn s ALA 61 Ca -0.01 -0.55 -0.24 0.00 0.00 0.00 0.00 51.96 51.16 2ksn s ALA 61 Cb 0.09 -3.01 -0.16 0.00 0.00 0.00 0.00 23.12 20.04 2ksn s ALA 61 CO 0.53 -2.02 1.72 -1.00 0.00 0.00 0.00 175.76 174.99 2ksn h PRO 62 N -1.30 -0.10 0.00 0.00 0.13 -1.83 -3.46 132.00 125.44 2ksn h PRO 62 Ca -0.49 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2ksn h PRO 62 Cb 1.33 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2ksn h PRO 62 CO 0.63 -0.06 0.00 0.00 -0.23 0.00 0.00 178.00 178.34 2ksn n ALA 63 N -2.14 0.00 0.44 -0.56 0.00 -1.26 -1.70 120.51 115.29 2ksn n ALA 63 Ca -0.08 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.42 2ksn n ALA 63 Cb 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.45 2ksn n ALA 63 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2ksn n PHE 64 N 0.00 0.00 -2.32 0.00 3.01 -1.26 -5.03 117.46 111.86 2ksn n PHE 64 Ca 0.00 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.13 2ksn n PHE 64 Cb 0.00 -0.06 -0.02 0.00 -0.01 0.00 0.00 39.48 39.39 2ksn n PHE 64 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 2ksn s GLU 65 N -2.29 3.60 0.00 -1.08 0.41 -0.69 -4.78 118.70 113.87 2ksn s GLU 65 Ca 0.03 1.28 0.00 0.00 -0.41 0.00 0.00 54.97 55.87 2ksn s GLU 65 Cb 0.09 -2.07 0.00 0.00 -1.78 0.00 0.00 34.13 30.37 2ksn s GLU 65 CO 0.50 -0.59 0.00 0.41 -0.49 0.00 0.00 175.26 175.09 2ksn n GLY 66 N -0.61 0.32 2.89 -1.39 0.00 -1.26 -4.98 105.19 100.15 2ksn n GLY 66 Ca 0.09 -1.44 -0.15 0.00 0.00 0.00 0.00 46.02 44.52 2ksn n GLY 66 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ksn s ARG 67 N 0.00 0.07 0.38 1.61 1.81 -1.26 -5.01 118.95 116.54 2ksn s ARG 67 Ca 0.00 0.43 0.18 0.00 -1.72 0.00 0.00 55.73 54.62 2ksn s ARG 67 Cb 0.00 -0.22 0.72 0.00 -0.45 0.00 0.00 34.95 35.00 2ksn s ARG 67 CO 0.00 -0.21 1.76 0.87 -0.68 0.00 0.00 175.30 177.04 2ksn h LYS 68 N 7.63 0.00 -0.67 3.54 1.79 -1.93 -2.94 116.57 123.98 2ksn h LYS 68 Ca -0.33 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.14 2ksn h LYS 68 Cb 1.13 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.75 2ksn h LYS 68 CO 0.33 0.38 0.42 0.93 -1.08 0.00 0.00 179.45 180.43 2ksn h GLU 69 N 0.00 0.90 0.00 3.15 3.07 -2.04 -2.76 114.58 116.91 2ksn h GLU 69 Ca -0.00 -0.07 -0.07 0.00 -0.50 0.00 0.00 59.36 58.71 2ksn h GLU 69 Cb 0.84 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 2ksn h GLU 69 CO 0.05 0.63 -0.41 0.97 -1.40 0.00 0.00 179.01 178.84 2ksn h ILE 70 N 0.92 0.57 -0.93 3.13 2.10 -1.97 -3.32 117.51 118.00 2ksn h ILE 70 Ca 0.24 -1.81 0.18 0.00 1.08 0.00 0.00 64.86 64.55 2ksn h ILE 70 Cb -0.06 2.25 -0.08 0.00 -1.09 0.00 0.00 36.82 37.84 2ksn h ILE 70 CO -0.05 0.32 0.60 -0.50 -1.08 0.00 0.00 178.15 177.44 2ksn h TRP 71 N 0.00 0.79 -0.63 2.19 4.06 -1.31 -0.33 115.95 120.72 2ksn h TRP 71 Ca -0.01 0.02 0.05 0.00 2.06 0.00 0.00 58.89 61.01 2ksn h TRP 71 Cb 1.27 -0.24 -0.04 0.00 -1.00 0.00 0.00 29.16 29.15 2ksn h TRP 71 CO 0.00 0.23 0.42 0.22 -3.56 0.00 0.00 178.44 175.74 2ksn h ASP 72 N 0.61 0.58 0.82 -3.49 1.82 -1.67 -0.82 116.42 114.27 2ksn h ASP 72 Ca 0.49 -0.00 -0.17 0.00 -0.39 0.00 0.00 57.03 56.96 2ksn h ASP 72 Cb 0.94 -0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.80 2ksn h ASP 72 CO -0.24 0.39 -0.80 0.00 -1.61 0.00 0.00 179.24 176.97 2ksn h ALA 73 N 1.65 0.66 0.21 -0.78 0.00 -1.30 -2.02 119.26 117.69 2ksn h ALA 73 Ca 0.26 -0.73 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2ksn h ALA 73 Cb 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2ksn h ALA 73 CO -0.08 1.00 -0.10 -0.07 0.00 0.00 0.00 179.25 180.00 2ksn h LEU 74 N 0.00 -0.24 -1.45 0.00 3.38 -1.03 -0.57 115.31 115.39 2ksn h LEU 74 Ca -0.01 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 2ksn h LEU 74 Cb 1.43 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.23 2ksn h LEU 74 CO 0.10 0.15 -0.24 0.07 0.09 0.00 0.00 178.44 178.61 2ksn h LYS 75 N -0.67 0.05 -0.27 1.13 2.10 -1.41 -1.54 116.57 115.96 2ksn h LYS 75 Ca -0.03 -0.01 -0.14 0.00 -2.00 0.00 0.00 60.65 58.46 2ksn h LYS 75 Cb 0.47 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.79 2ksn h LYS 75 CO 0.05 0.29 -0.42 0.00 -2.00 0.00 0.00 179.45 177.36 2ksn h ALA 76 N 1.71 0.76 0.02 0.07 0.00 -1.22 -0.15 119.26 120.44 2ksn h ALA 76 Ca 0.01 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 2ksn h ALA 76 Cb 0.45 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2ksn h ALA 76 CO 0.03 0.66 -0.01 0.00 0.00 0.00 0.00 179.25 179.93 2ksn h ALA 77 N 0.99 -0.03 -0.59 0.00 0.00 -0.60 -2.04 119.26 117.00 2ksn h ALA 77 Ca 0.04 -0.22 0.14 0.00 0.00 0.00 0.00 54.91 54.86 2ksn h ALA 77 Cb 0.95 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 2ksn h ALA 77 CO 0.09 -0.29 0.41 0.00 0.00 0.00 0.00 179.25 179.45 2ksn h ALA 78 N 0.48 2.28 -0.20 0.00 0.00 -1.31 0.28 119.26 120.79 2ksn h ALA 78 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2ksn h ALA 78 Cb 0.46 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2ksn h ALA 78 CO 0.00 -0.43 0.07 1.25 0.00 0.00 0.00 179.25 180.14 2ksn h HIS 79 N 0.20 0.32 0.11 0.00 6.17 -0.68 -0.17 115.15 121.10 2ksn h HIS 79 Ca 0.28 -0.03 -0.01 0.00 0.71 0.00 0.00 60.37 61.33 2ksn h HIS 79 Cb 0.83 -0.09 0.00 0.00 2.52 0.00 0.00 27.41 30.67 2ksn h HIS 79 CO -0.00 0.39 -0.05 0.00 0.71 0.00 0.00 177.93 178.97 2ksn h ALA 80 N 0.90 -0.15 -0.65 5.26 0.00 -0.58 -3.13 119.26 120.91 2ksn h ALA 80 Ca 0.07 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.81 2ksn h ALA 80 Cb 0.21 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 2ksn h ALA 80 CO -0.00 -0.31 0.43 0.35 0.00 0.00 0.00 179.25 179.72 2ksn h PHE 81 N -0.70 0.62 0.00 0.00 3.57 -0.27 0.27 116.94 120.44 2ksn h PHE 81 Ca -0.01 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 2ksn h PHE 81 Cb 0.53 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 2ksn h PHE 81 CO 0.09 0.32 -0.18 0.93 -2.23 0.00 0.00 178.31 177.24 2ksn h GLU 82 N 0.61 0.00 -0.75 1.11 4.39 -1.06 -1.01 114.58 117.86 2ksn h GLU 82 Ca 0.29 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.90 2ksn h GLU 82 Cb 0.34 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.94 2ksn h GLU 82 CO -0.09 0.18 0.10 0.43 -1.16 0.00 0.00 179.01 178.47 2ksn n SER 83 N -3.91 4.37 0.00 1.42 7.64 0.74 -4.86 113.62 119.02 2ksn n SER 83 Ca -0.02 -2.81 0.00 0.00 1.01 0.00 0.00 58.87 57.05 2ksn n SER 83 Cb 0.27 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 2ksn n SER 83 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2ksn n ASN 84 N 0.22 -0.33 -4.57 6.43 5.03 -0.38 -4.94 115.26 116.71 2ksn n ASN 84 Ca 0.26 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.33 2ksn n ASN 84 Cb 1.06 -0.43 -0.02 0.00 -1.02 0.00 0.00 39.78 39.36 2ksn n ASN 84 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2ksn s ASP 85 N -2.77 6.29 0.12 6.41 1.11 0.04 -4.73 116.67 123.15 2ksn s ASP 85 Ca 0.00 -1.82 -0.11 0.00 0.18 0.00 0.00 52.55 50.79 2ksn s ASP 85 Cb 0.00 -2.58 -0.09 0.00 1.07 0.00 0.00 42.92 41.32 2ksn s ASP 85 CO 0.00 -1.72 1.38 0.45 1.18 0.00 0.00 175.17 176.46 2ksn h HIS 86 N 9.00 1.07 -0.30 4.23 3.86 -1.85 -2.87 115.15 128.30 2ksn h HIS 86 Ca 0.30 -0.41 -0.15 0.00 -1.16 0.00 0.00 60.37 58.95 2ksn h HIS 86 Cb 0.94 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 29.21 2ksn h HIS 86 CO 1.33 1.24 -0.41 1.05 0.86 0.00 0.00 177.93 181.99 2ksn h GLU 87 N 0.62 0.73 0.11 2.45 4.11 -1.97 -2.52 114.58 118.11 2ksn h GLU 87 Ca -0.01 -0.39 -0.01 0.00 0.07 0.00 0.00 59.36 59.03 2ksn h GLU 87 Cb 1.23 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2ksn h GLU 87 CO 0.13 1.01 -0.05 1.25 0.07 0.00 0.00 179.01 181.42 2ksn h LEU 88 N 0.59 -0.12 -0.31 3.06 6.46 -1.95 -1.36 115.31 121.69 2ksn h LEU 88 Ca 0.05 -0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 57.67 2ksn h LEU 88 Cb 0.96 0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.91 2ksn h LEU 88 CO 0.09 0.05 0.15 0.00 -0.62 0.00 0.00 178.44 178.11 2ksn h ALA 89 N 0.59 0.40 -0.34 1.25 0.00 -1.53 0.48 119.26 120.10 2ksn h ALA 89 Ca -0.01 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2ksn h ALA 89 Cb 0.24 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2ksn h ALA 89 CO 0.02 -0.04 0.01 -0.56 0.00 0.00 0.00 179.25 178.68 2ksn h GLN 90 N 0.36 0.53 0.00 0.00 3.07 -1.46 -0.34 115.11 117.27 2ksn h GLN 90 Ca 0.11 -0.11 -0.08 0.00 0.09 0.00 0.00 58.65 58.65 2ksn h GLN 90 Cb 0.12 -0.08 -0.01 0.00 0.08 0.00 0.00 27.48 27.59 2ksn h GLN 90 CO -0.01 0.55 -0.40 0.00 0.09 0.00 0.00 178.83 179.05 2ksn h ALA 91 N 1.51 1.00 -0.07 0.06 0.00 -0.64 -1.22 119.26 119.90 2ksn h ALA 91 Ca 0.11 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 2ksn h ALA 91 Cb 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2ksn h ALA 91 CO 0.01 0.50 -0.18 0.82 0.00 0.00 0.00 179.25 180.40 2ksn h ILE 92 N 0.00 1.42 -0.01 0.00 2.04 0.08 0.25 117.51 121.29 2ksn h ILE 92 Ca -0.00 -1.53 0.02 0.00 1.00 0.00 0.00 64.86 64.35 2ksn h ILE 92 Cb 0.92 2.23 -0.05 0.00 -0.74 0.00 0.00 36.82 39.19 2ksn h ILE 92 CO 0.05 0.43 -0.44 0.40 0.00 0.00 0.00 178.15 178.59 2ksn h ILE 93 N -0.24 0.00 -0.32 -0.67 1.08 -0.89 -0.91 117.51 115.56 2ksn h ILE 93 Ca -0.00 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.42 2ksn h ILE 93 Cb 0.79 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.52 2ksn h ILE 93 CO 0.04 0.00 -0.02 -0.78 -0.69 0.00 0.00 178.15 176.70 2ksn h ASP 94 N -0.55 0.47 0.45 1.72 3.58 -1.28 -1.04 116.42 119.76 2ksn h ASP 94 Ca 0.01 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.35 2ksn h ASP 94 Cb 0.59 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 41.52 2ksn h ASP 94 CO -0.30 0.55 -0.11 1.23 -2.88 0.00 0.00 179.24 177.73 2ksn h GLY 95 N 0.83 0.00 -2.69 -0.78 0.00 -0.03 -1.72 103.07 98.68 2ksn h GLY 95 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2ksn h GLY 95 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.55 2ksn n ALA 96 N -2.24 2.39 -1.06 3.60 0.00 -0.39 -4.88 120.51 117.92 2ksn n ALA 96 Ca -0.01 -1.26 -0.02 0.00 0.00 0.00 0.00 53.44 52.14 2ksn n ALA 96 Cb 0.25 -0.93 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 2ksn n ALA 96 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ksn n ASN 97 N 1.66 -4.48 -4.78 0.00 5.15 -0.65 -4.83 115.26 107.34 2ksn n ASN 97 Ca 0.24 0.05 -0.39 0.00 -0.60 0.00 0.00 54.58 53.89 2ksn n ASN 97 Cb 0.63 -2.16 -0.06 0.00 -0.53 0.00 0.00 39.78 37.66 2ksn n ASN 97 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2ksn s ILE 98 N -1.67 4.37 0.24 -1.44 1.01 -0.46 -4.38 121.20 118.88 2ksn s ILE 98 Ca 0.00 1.67 0.01 0.00 0.00 0.00 0.00 60.65 62.33 2ksn s ILE 98 Cb 0.00 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.33 2ksn s ILE 98 CO 0.00 0.45 0.07 0.42 0.00 0.00 0.00 174.94 175.88 2ksn s THR 99 N -1.24 0.59 -0.26 2.92 -4.23 -0.81 -3.59 115.64 109.02 2ksn s THR 99 Ca 0.38 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.88 2ksn s THR 99 Cb -0.22 -2.51 0.13 0.00 1.34 0.00 0.00 72.50 71.24 2ksn s THR 99 CO 0.26 -0.12 0.36 -0.76 -0.54 0.00 0.00 174.62 173.81 2ksn s LEU 100 N -3.28 -0.55 0.52 4.79 1.43 0.76 -1.73 118.68 120.62 2ksn s LEU 100 Ca 0.34 -0.09 0.24 0.00 -1.03 0.00 0.00 54.13 53.60 2ksn s LEU 100 Cb 0.07 0.95 1.43 0.00 0.03 0.00 0.00 46.19 48.67 2ksn s LEU 100 CO 0.11 -0.33 2.10 1.55 0.23 0.00 0.00 176.35 180.02 2ksn h PRO 101 N 8.20 0.00 0.00 1.29 0.13 -1.53 -0.97 132.00 139.13 2ksn h PRO 101 Ca -0.16 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.95 2ksn h PRO 101 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2ksn h PRO 101 CO 0.28 0.10 -0.08 0.45 -0.23 0.00 0.00 178.00 178.52 2ksn h HIS 102 N 0.00 0.00 -5.65 1.56 3.86 -1.89 -3.42 115.15 109.61 2ksn h HIS 102 Ca -0.00 0.00 -0.43 0.00 -1.16 0.00 0.00 60.37 58.78 2ksn h HIS 102 Cb 0.23 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.73 2ksn h HIS 102 CO 0.00 0.08 -0.67 0.41 0.86 0.00 0.00 177.93 178.60 2ksn n GLY 103 N 0.81 -0.52 3.63 2.45 0.00 -0.37 -4.88 105.19 106.31 2ksn n GLY 103 Ca 0.03 0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 2ksn n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ksn s ALA 104 N -3.22 3.11 -0.15 4.61 0.00 -1.26 -4.19 121.76 120.65 2ksn s ALA 104 Ca 0.53 -1.16 0.17 0.00 0.00 0.00 0.00 51.96 51.50 2ksn s ALA 104 Cb -0.25 -1.05 0.20 0.00 0.00 0.00 0.00 23.12 22.02 2ksn s ALA 104 CO 0.65 0.66 1.51 1.25 0.00 0.00 0.00 175.76 179.84 2ksn h LEU 105 N 3.66 0.00 -2.25 0.00 7.12 -1.93 -3.22 115.31 118.69 2ksn h LEU 105 Ca -0.48 0.00 -0.09 0.00 0.13 0.00 0.00 57.88 57.43 2ksn h LEU 105 Cb 1.17 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 41.24 2ksn h LEU 105 CO 0.55 0.42 0.12 0.35 -0.13 0.00 0.00 178.44 179.75 2ksn n THR 106 N -3.24 1.31 -3.50 1.05 -2.24 -1.26 -4.72 114.28 101.66 2ksn n THR 106 Ca 0.02 -0.46 -0.10 0.00 -2.27 0.00 0.00 64.05 61.24 2ksn n THR 106 Cb 0.67 -0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 68.15 2ksn n THR 106 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2ksn s GLU 107 N -1.05 0.88 -0.22 -0.78 2.02 -1.22 0.21 118.70 118.55 2ksn s GLU 107 Ca 0.15 -0.18 -0.20 0.00 0.02 0.00 0.00 54.97 54.75 2ksn s GLU 107 Cb 0.12 0.41 0.06 0.00 0.10 0.00 0.00 34.13 34.82 2ksn s GLU 107 CO 0.03 -0.36 0.58 0.00 0.02 0.00 0.00 175.26 175.54 2ksn s TYR 109 N 0.33 2.82 0.40 0.00 2.02 -0.70 -0.37 117.35 121.85 2ksn s TYR 109 Ca -0.00 -1.27 -0.21 0.00 -0.37 0.00 0.00 57.07 55.22 2ksn s TYR 109 Cb -0.04 -1.95 -0.11 0.00 -0.40 0.00 0.00 41.96 39.46 2ksn s TYR 109 CO 0.01 -0.63 0.93 0.34 -1.57 0.00 0.00 175.55 174.63 2ksn s ASP 110 N 1.16 6.99 0.58 2.29 2.15 0.58 -1.93 116.67 128.49 2ksn s ASP 110 Ca 0.01 1.68 0.28 0.00 0.43 0.00 0.00 52.55 54.95 2ksn s ASP 110 Cb -0.14 -2.53 1.73 0.00 -0.30 0.00 0.00 42.92 41.68 2ksn s ASP 110 CO -0.06 -0.30 2.23 1.05 -0.17 0.00 0.00 175.17 177.92 2ksn h GLU 111 N 2.15 0.00 0.00 4.34 4.11 -1.87 0.28 114.58 123.58 2ksn h GLU 111 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2ksn h GLU 111 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2ksn h GLU 111 CO 0.62 0.00 0.00 1.28 0.07 0.00 0.00 179.01 180.98 2ksn n LEU 112 N -3.94 0.00 0.00 3.06 4.77 -1.26 -4.83 117.00 114.80 2ksn n LEU 112 Ca -0.02 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 2ksn n LEU 112 Cb 0.11 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 2ksn n LEU 112 CO 0.28 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 2ksn n GLY 113 N 0.71 1.73 3.89 -0.72 0.00 0.93 -5.11 105.19 106.62 2ksn n GLY 113 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 2ksn n GLY 113 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ksn s ASN 114 N -2.00 6.51 0.04 1.61 0.01 -0.86 -4.91 114.94 115.34 2ksn s ASN 114 Ca 0.00 0.64 0.08 0.00 -0.71 0.00 0.00 52.86 52.87 2ksn s ASN 114 Cb 0.00 -2.11 -0.03 0.00 0.41 0.00 0.00 41.25 39.52 2ksn s ASN 114 CO 0.00 0.02 -0.22 0.00 -1.51 0.00 0.00 177.10 175.39 2ksn s ARG 115 N -2.73 1.50 0.01 -0.60 1.70 -1.26 -0.30 118.95 117.27 2ksn s ARG 115 Ca 0.42 -0.99 0.02 0.00 -0.47 0.00 0.00 55.73 54.71 2ksn s ARG 115 Cb -0.12 -1.63 -0.01 0.00 -0.57 0.00 0.00 34.95 32.62 2ksn s ARG 115 CO 0.24 0.42 -0.06 0.71 -1.08 0.00 0.00 175.30 175.53 2ksn s TYR 116 N -0.80 0.52 -0.16 5.89 2.02 0.51 -4.88 117.35 120.43 2ksn s TYR 116 Ca 0.09 -0.19 0.01 0.00 -0.37 0.00 0.00 57.07 56.60 2ksn s TYR 116 Cb -0.09 -0.32 0.02 0.00 -0.40 0.00 0.00 41.96 41.17 2ksn s TYR 116 CO 0.02 -0.03 -0.17 -0.65 -1.57 0.00 0.00 175.55 173.15 2ksn s GLN 117 N -0.48 2.63 -0.41 -0.62 -0.21 -1.26 -1.25 119.66 118.06 2ksn s GLN 117 Ca -0.01 -0.70 -0.25 0.00 0.02 0.00 0.00 55.36 54.43 2ksn s GLN 117 Cb -0.04 -2.34 0.02 0.00 1.00 0.00 0.00 33.01 31.65 2ksn s GLN 117 CO -0.00 -0.23 0.88 -1.17 -2.12 0.00 0.00 175.29 172.65 2ksn s LEU 118 N 1.39 4.06 0.66 2.90 1.98 0.13 -4.50 118.68 125.30 2ksn s LEU 118 Ca 0.05 0.30 -0.15 0.00 -2.89 0.00 0.00 54.13 51.44 2ksn s LEU 118 Cb -0.13 -3.15 0.00 0.00 0.66 0.00 0.00 46.19 43.57 2ksn s LEU 118 CO -0.12 -0.90 1.12 -2.84 -1.89 0.00 0.00 176.35 171.72 2ksn s PRO 119 N 3.46 2.77 0.44 0.98 0.02 -1.25 -2.78 135.00 138.65 2ksn s PRO 119 Ca 0.35 1.43 0.30 0.00 0.02 0.00 0.00 61.00 63.10 2ksn s PRO 119 Cb -0.12 -1.94 1.59 0.00 0.02 0.00 0.00 34.50 34.05 2ksn s PRO 119 CO 0.21 -1.28 1.92 -0.39 -0.33 0.00 0.00 177.00 177.14 2ksn h VAL 120 N 0.06 0.00 -0.01 3.83 -1.51 -1.82 -3.23 116.25 113.57 2ksn h VAL 120 Ca -0.47 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 64.95 2ksn h VAL 120 Cb 1.25 0.76 -0.00 0.00 -2.13 0.00 0.00 31.29 31.17 2ksn h VAL 120 CO 0.54 0.00 0.04 0.10 -1.23 0.00 0.00 177.57 177.02 2ksn h TYR 121 N 0.00 0.00 0.00 5.19 -0.00 -1.92 0.53 116.97 120.78 2ksn h TYR 121 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 2ksn h TYR 121 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.79 2ksn h TYR 121 CO 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 178.16 178.08 2ksn n LEU 123 N -0.60 0.09 -3.91 0.00 4.77 -0.25 -5.04 117.00 112.06 2ksn n LEU 123 Ca 0.05 0.11 -0.29 0.00 -0.03 0.00 0.00 56.01 55.85 2ksn n LEU 123 Cb 0.48 0.04 -0.16 0.00 -2.33 0.00 0.00 43.42 41.45 2ksn n LEU 123 CO 0.00 -0.46 -0.43 0.00 -1.33 0.00 0.00 177.39 175.18 2ksn s ALA 124 N -2.00 1.60 -0.98 -1.18 0.00 0.01 -5.02 121.76 114.19 2ksn s ALA 124 Ca 0.00 -0.92 0.15 0.00 0.00 0.00 0.00 51.96 51.19 2ksn s ALA 124 Cb 0.00 -1.16 0.65 0.00 0.00 0.00 0.00 23.12 22.61 2ksn s ALA 124 CO 0.00 -0.81 1.53 -0.35 0.00 0.00 0.00 175.76 176.14 2ksn n PRO 125 N 4.83 3.64 0.18 0.00 -0.04 -1.26 -4.36 135.00 137.99 2ksn n PRO 125 Ca -0.12 -2.54 0.14 0.00 -0.04 0.00 0.00 63.50 60.93 2ksn n PRO 125 Cb 0.47 -1.91 0.59 0.00 -0.04 0.00 0.00 33.50 32.61 2ksn n PRO 125 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2ksn h PRO 126 N 3.53 0.00 -1.45 0.54 0.13 -1.95 -2.91 132.00 129.89 2ksn h PRO 126 Ca 0.00 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.48 2ksn h PRO 126 Cb 1.42 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 32.20 2ksn h PRO 126 CO 0.26 0.00 0.07 0.44 -0.23 0.00 0.00 178.00 178.54 2ksn n ILE 127 N -2.50 2.98 -0.02 -3.56 -0.00 -1.26 -4.59 119.36 110.41 2ksn n ILE 127 Ca 0.01 -4.30 -0.17 0.00 -0.00 0.00 0.00 62.75 58.29 2ksn n ILE 127 Cb 0.22 -1.22 -0.14 0.00 -0.00 0.00 0.00 39.64 38.50 2ksn n ILE 127 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 2ksn n ASN 128 N -0.61 1.67 -0.03 7.28 2.85 -1.10 -4.70 115.26 120.62 2ksn n ASN 128 Ca 0.48 0.23 -0.05 0.00 -0.11 0.00 0.00 54.58 55.14 2ksn n ASN 128 Cb 0.58 -0.52 -0.02 0.00 1.24 0.00 0.00 39.78 41.06 2ksn n ASN 128 CO 0.00 0.00 0.00 0.80 -2.11 0.00 0.00 177.26 175.95 2ksn n MET 129 N -3.31 0.13 0.00 1.20 1.56 -1.26 -5.02 117.12 110.42 2ksn n MET 129 Ca -0.29 0.04 0.00 0.00 -0.27 0.00 0.00 57.70 57.18 2ksn n MET 129 Cb 1.05 -0.97 0.00 0.00 2.15 0.00 0.00 33.22 35.45 2ksn n MET 129 CO 0.00 0.00 0.00 -0.89 -0.73 0.00 0.00 175.97 174.35 2ksn n ILE 130 N -2.86 0.00 -2.12 1.12 -0.00 -1.26 -4.83 119.36 109.41 2ksn n ILE 130 Ca -0.10 0.00 -0.33 0.00 -0.00 0.00 0.00 62.75 62.32 2ksn n ILE 130 Cb 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.24 2ksn n ILE 130 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.55 174.72 2ksn s GLU 131 N 0.00 3.42 0.56 0.38 -1.05 -1.26 -5.05 118.70 115.70 2ksn s GLU 131 Ca 0.00 1.20 -0.04 0.00 -0.15 0.00 0.00 54.97 55.98 2ksn s GLU 131 Cb 0.00 -2.05 0.01 0.00 -0.44 0.00 0.00 34.13 31.65 2ksn s GLU 131 CO 0.00 -0.73 0.85 -1.83 0.95 0.00 0.00 175.26 174.50 2ksn s GLU 132 N -3.99 2.92 0.00 -4.83 -1.05 -1.26 -4.90 118.70 105.60 2ksn s GLU 132 Ca 0.64 -0.13 0.00 0.00 -0.15 0.00 0.00 54.97 55.32 2ksn s GLU 132 Cb -0.16 -2.34 0.00 0.00 -0.44 0.00 0.00 34.13 31.20 2ksn s GLU 132 CO 0.35 -0.62 0.00 1.17 0.95 0.00 0.00 175.26 177.11 2ksn n LYS 133 N -2.48 0.00 0.00 -4.83 4.81 -1.26 -3.93 118.16 110.48 2ksn n LYS 133 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 2ksn n LYS 133 Cb 0.58 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.63 2ksn n LYS 133 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2ksn n SER 134 N 0.02 0.00 0.00 3.14 2.88 -1.26 -5.05 113.62 113.35 2ksn n SER 134 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2ksn n SER 134 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2ksn n SER 134 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2ksn n ASP 135 N 0.00 1.07 0.00 -3.46 2.03 -1.25 -4.78 116.55 110.15 2ksn n ASP 135 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2ksn n ASP 135 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2ksn n ASP 135 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2ksn n ILE 136 N -1.88 0.00 -1.82 5.18 2.08 -1.26 -2.93 119.36 118.73 2ksn n ILE 136 Ca 0.00 0.79 -0.18 0.00 0.56 0.00 0.00 62.75 63.92 2ksn n ILE 136 Cb 0.15 -1.19 0.08 0.00 -0.75 0.00 0.00 39.64 37.93 2ksn n ILE 136 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2ksn n GLU 137 N -0.87 2.97 -2.53 0.38 1.02 -1.26 -4.91 120.64 115.43 2ksn n GLU 137 Ca 0.00 -3.82 -0.43 0.00 -0.02 0.00 0.00 57.16 52.89 2ksn n GLU 137 Cb 0.00 -2.11 0.00 0.00 -0.02 0.00 0.00 31.44 29.31 2ksn n GLU 137 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2ksn n THR 138 N -0.85 3.97 -3.49 2.62 -1.04 -1.15 -4.96 114.28 109.38 2ksn n THR 138 Ca 0.40 -4.11 -0.38 0.00 -2.04 0.00 0.00 64.05 57.92 2ksn n THR 138 Cb 0.90 -2.41 -0.06 0.00 -1.82 0.00 0.00 70.33 66.94 2ksn n THR 138 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2ksn s LEU 139 N 3.11 4.47 -0.15 -4.42 2.96 -1.26 -4.94 118.68 118.45 2ksn s LEU 139 Ca 0.50 0.96 0.18 0.00 -0.22 0.00 0.00 54.13 55.55 2ksn s LEU 139 Cb 0.04 -2.60 -0.25 0.00 0.50 0.00 0.00 46.19 43.88 2ksn s LEU 139 CO 0.03 0.31 0.23 0.47 -1.32 0.00 0.00 176.35 176.08 2ksn n ASP 140 N 1.91 0.15 -0.36 3.68 8.00 -1.26 -5.25 116.55 123.42 2ksn n ASP 140 Ca -0.14 0.07 0.15 0.00 0.71 0.00 0.00 54.79 55.58 2ksn n ASP 140 Cb 0.52 0.94 0.63 0.00 -0.02 0.00 0.00 41.12 43.20 2ksn n ASP 140 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11