#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kll s SER 1 N 0.00 6.71 0.09 1.61 0.01 -1.26 -4.89 113.70 115.96 2kll s SER 1 Ca 0.00 0.67 0.03 0.00 1.31 0.00 0.00 55.95 57.97 2kll s SER 1 Cb 0.00 -2.55 -0.24 0.00 0.21 0.00 0.00 66.02 63.45 2kll s SER 1 CO 0.00 -1.15 1.16 0.28 0.41 0.00 0.00 173.24 173.94 2kll h SER 2 N 8.98 0.15 0.00 2.44 0.02 -1.87 -3.44 113.55 119.82 2kll h SER 2 Ca -0.23 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 2kll h SER 2 Cb 1.06 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.56 2kll h SER 2 CO 1.10 1.13 0.00 -0.38 -1.14 0.00 0.00 176.83 177.54 2kll n ILE 3 N -3.39 0.41 -2.77 3.27 5.41 -1.26 -4.51 119.36 116.53 2kll n ILE 3 Ca -0.05 0.14 -0.04 0.00 1.00 0.00 0.00 62.75 63.80 2kll n ILE 3 Cb 0.98 -0.92 0.01 0.00 -0.71 0.00 0.00 39.64 39.00 2kll n ILE 3 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2kll s THR 4 N -1.54 -0.95 -1.87 1.39 -1.32 -1.26 -4.94 115.64 105.16 2kll s THR 4 Ca 0.00 -0.91 0.00 0.00 -1.21 0.00 0.00 61.69 59.57 2kll s THR 4 Cb 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.99 2kll s THR 4 CO 0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 2kll n GLY 5 N 2.97 1.68 3.77 6.08 0.00 -1.26 -4.93 105.19 113.50 2kll n GLY 5 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 2kll n GLY 5 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2kll s ILE 6 N -2.48 3.30 0.03 -0.61 -4.36 -1.26 -5.04 121.20 110.78 2kll s ILE 6 Ca 0.00 0.98 0.02 0.00 -0.26 0.00 0.00 60.65 61.39 2kll s ILE 6 Cb 0.00 -3.50 -0.02 0.00 1.25 0.00 0.00 42.46 40.19 2kll s ILE 6 CO 0.00 -0.01 -0.08 -0.94 0.24 0.00 0.00 174.94 174.16 2kll s SER 7 N -1.42 0.85 0.24 4.36 1.04 -1.26 -4.69 113.70 112.81 2kll s SER 7 Ca 0.62 -0.44 -0.31 0.00 0.48 0.00 0.00 55.95 56.30 2kll s SER 7 Cb -0.27 0.00 -0.11 0.00 0.10 0.00 0.00 66.02 65.75 2kll s SER 7 CO 0.33 -0.13 1.62 -2.84 0.98 0.00 0.00 173.24 173.20 2kll s PRO 8 N -1.22 4.15 0.01 4.02 0.02 -1.26 -4.47 135.00 136.26 2kll s PRO 8 Ca -0.06 2.53 0.02 0.00 0.02 0.00 0.00 61.00 63.50 2kll s PRO 8 Cb -0.08 -3.07 -0.25 0.00 0.02 0.00 0.00 34.50 31.11 2kll s PRO 8 CO 0.00 -0.65 0.89 0.82 -0.33 0.00 0.00 177.00 177.73 2kll h ILE 9 N 3.66 1.19 -1.47 2.83 1.08 -1.65 -3.48 117.51 119.67 2kll h ILE 9 Ca -0.45 -2.88 0.10 0.00 -0.39 0.00 0.00 64.86 61.24 2kll h ILE 9 Cb 1.21 2.71 -0.26 0.00 -3.07 0.00 0.00 36.82 37.40 2kll h ILE 9 CO 0.87 0.79 0.58 0.28 -0.69 0.00 0.00 178.15 179.98 2kll s THR 10 N -2.63 0.00 -0.05 -0.27 -1.32 -1.26 -4.98 115.64 105.13 2kll s THR 10 Ca -0.07 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.44 2kll s THR 10 Cb 0.08 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 70.08 2kll s THR 10 CO 0.84 0.00 -0.12 -1.61 -2.21 0.00 0.00 174.62 171.52 2kll s GLU 11 N -0.26 1.52 0.13 7.08 2.02 -1.26 -1.33 118.70 126.60 2kll s GLU 11 Ca 0.03 -0.39 -0.11 0.00 0.02 0.00 0.00 54.97 54.51 2kll s GLU 11 Cb -0.03 -1.30 0.01 0.00 0.10 0.00 0.00 34.13 32.91 2kll s GLU 11 CO -0.06 0.06 0.30 1.52 0.02 0.00 0.00 175.26 177.10 2kll s TYR 12 N 0.54 0.11 -0.14 1.61 1.13 -0.52 -5.02 117.35 115.05 2kll s TYR 12 Ca -0.11 -0.49 -0.15 0.00 -1.41 0.00 0.00 57.07 54.90 2kll s TYR 12 Cb -0.14 0.06 -0.04 0.00 -1.10 0.00 0.00 41.96 40.73 2kll s TYR 12 CO 0.03 -0.67 0.36 -0.51 -2.51 0.00 0.00 175.55 172.25 2kll s LEU 13 N -2.88 4.26 -0.27 -3.49 1.43 -1.26 -1.03 118.68 115.43 2kll s LEU 13 Ca 0.08 0.62 -0.23 0.00 -1.03 0.00 0.00 54.13 53.58 2kll s LEU 13 Cb 0.03 -2.49 0.08 0.00 0.03 0.00 0.00 46.19 43.84 2kll s LEU 13 CO -0.07 0.06 0.75 0.00 0.23 0.00 0.00 176.35 177.33 2kll s ALA 14 N 0.52 -1.84 -0.09 4.21 0.00 -0.33 -4.56 121.76 119.67 2kll s ALA 14 Ca 0.20 2.10 -0.09 0.00 0.00 0.00 0.00 51.96 54.17 2kll s ALA 14 Cb -0.14 -1.28 -0.04 0.00 0.00 0.00 0.00 23.12 21.66 2kll s ALA 14 CO 0.06 -0.34 0.21 0.45 0.00 0.00 0.00 175.76 176.15 2kll s SER 15 N 0.66 6.50 -0.07 0.00 0.15 -1.25 -0.60 113.70 119.09 2kll s SER 15 Ca -0.02 0.60 -0.30 0.00 0.70 0.00 0.00 55.95 56.93 2kll s SER 15 Cb -0.05 -2.12 -0.02 0.00 -1.71 0.00 0.00 66.02 62.12 2kll s SER 15 CO -0.05 0.39 1.10 -0.76 1.20 0.00 0.00 173.24 175.12 2kll s LEU 16 N -1.05 4.27 -0.09 3.45 2.01 -1.26 -3.44 118.68 122.57 2kll s LEU 16 Ca 0.17 1.69 0.03 0.00 0.01 0.00 0.00 54.13 56.03 2kll s LEU 16 Cb -0.13 -3.56 0.01 0.00 0.01 0.00 0.00 46.19 42.52 2kll s LEU 16 CO 0.07 -0.50 -0.17 -0.44 1.01 0.00 0.00 176.35 176.32 2kll s SER 17 N 1.26 2.41 0.83 2.29 0.01 -0.23 -1.24 113.70 119.04 2kll s SER 17 Ca 0.52 -0.43 -0.11 0.00 1.31 0.00 0.00 55.95 57.25 2kll s SER 17 Cb -0.22 -1.10 0.09 0.00 0.21 0.00 0.00 66.02 65.00 2kll s SER 17 CO 0.21 0.07 1.10 0.42 0.41 0.00 0.00 173.24 175.45 2kll s THR 18 N 0.66 2.90 -1.19 1.44 -4.23 0.15 0.15 115.64 115.51 2kll s THR 18 Ca -0.13 0.29 0.06 0.00 -1.18 0.00 0.00 61.69 60.73 2kll s THR 18 Cb -0.16 -2.65 0.08 0.00 1.34 0.00 0.00 72.50 71.11 2kll s THR 18 CO 0.04 -0.38 1.14 0.00 -0.54 0.00 0.00 174.62 174.88 2kll n TYR 19 N -3.78 0.00 0.08 3.99 9.36 -1.09 -1.90 117.16 123.82 2kll n TYR 19 Ca 0.09 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.32 2kll n TYR 19 Cb 0.53 -0.40 0.17 0.00 -0.63 0.00 0.00 39.34 39.01 2kll n TYR 19 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2kll n ASN 20 N -1.40 3.26 -1.97 2.98 4.13 -1.26 -4.84 115.26 116.16 2kll n ASN 20 Ca 0.02 -2.50 -0.21 0.00 1.68 0.00 0.00 54.58 53.57 2kll n ASN 20 Cb 0.06 -0.60 -0.05 0.00 -1.54 0.00 0.00 39.78 37.65 2kll n ASN 20 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2kll n ASP 21 N 0.18 -5.70 -4.62 6.41 2.03 -0.80 -4.98 116.55 109.08 2kll n ASP 21 Ca 0.16 0.26 -0.28 0.00 0.52 0.00 0.00 54.79 55.45 2kll n ASP 21 Cb 0.77 -4.87 -0.09 0.00 -0.72 0.00 0.00 41.12 36.21 2kll n ASP 21 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2kll s GLN 22 N -4.37 2.28 0.12 -0.67 -0.21 -1.22 -4.16 119.66 111.43 2kll s GLN 22 Ca 0.00 -1.05 0.05 0.00 0.02 0.00 0.00 55.36 54.38 2kll s GLN 22 Cb 0.00 -2.35 -0.04 0.00 1.00 0.00 0.00 33.01 31.62 2kll s GLN 22 CO 0.00 0.49 0.06 -1.12 -2.12 0.00 0.00 175.29 172.60 2kll s SER 23 N -2.54 5.27 0.08 5.90 0.01 -0.22 0.33 113.70 122.53 2kll s SER 23 Ca 0.25 -0.15 -0.22 0.00 1.31 0.00 0.00 55.95 57.13 2kll s SER 23 Cb -0.10 -1.32 -0.07 0.00 0.21 0.00 0.00 66.02 64.74 2kll s SER 23 CO 0.16 0.13 0.67 -0.63 0.41 0.00 0.00 173.24 173.99 2kll s ILE 24 N -1.52 4.66 -0.08 1.44 -1.09 -0.37 -1.40 121.20 122.84 2kll s ILE 24 Ca 0.28 1.45 0.05 0.00 -2.23 0.00 0.00 60.65 60.20 2kll s ILE 24 Cb -0.11 -4.02 -0.01 0.00 -1.58 0.00 0.00 42.46 36.75 2kll s ILE 24 CO 0.21 0.48 -0.24 -0.89 -1.23 0.00 0.00 174.94 173.27 2kll s THR 25 N -0.74 2.14 -0.55 2.92 2.01 -0.32 -4.42 115.64 116.67 2kll s THR 25 Ca 0.33 -1.02 -0.02 0.00 0.31 0.00 0.00 61.69 61.29 2kll s THR 25 Cb -0.21 -1.79 0.14 0.00 0.01 0.00 0.00 72.50 70.65 2kll s THR 25 CO 0.22 0.56 0.35 -0.36 -0.69 0.00 0.00 174.62 174.70 2kll s PHE 26 N 0.02 3.45 -0.69 4.92 0.08 -1.26 -2.34 117.98 122.15 2kll s PHE 26 Ca -0.09 -2.66 -0.19 0.00 0.12 0.00 0.00 56.93 54.11 2kll s PHE 26 Cb -0.15 -3.18 0.11 0.00 -0.57 0.00 0.00 43.02 39.23 2kll s PHE 26 CO 0.06 -0.87 0.84 0.00 -0.10 0.00 0.00 175.22 175.14 2kll s ALA 27 N 0.28 3.42 -0.32 5.36 0.00 -0.64 -4.98 121.76 124.88 2kll s ALA 27 Ca 0.14 -2.38 -0.12 0.00 0.00 0.00 0.00 51.96 49.60 2kll s ALA 27 Cb -0.21 -3.69 -0.02 0.00 0.00 0.00 0.00 23.12 19.20 2kll s ALA 27 CO -0.03 -2.54 0.22 -0.51 0.00 0.00 0.00 175.76 172.89 2kll s LEU 28 N 2.67 4.35 0.00 0.00 1.02 -1.26 -1.37 118.68 124.09 2kll s LEU 28 Ca 0.18 -0.34 -0.02 0.00 0.02 0.00 0.00 54.13 53.97 2kll s LEU 28 Cb -0.18 -2.12 0.03 0.00 0.02 0.00 0.00 46.19 43.95 2kll s LEU 28 CO 0.02 -0.19 0.18 -0.62 0.02 0.00 0.00 176.35 175.77 2kll n GLU 29 N 5.08 -0.05 -0.15 1.70 1.02 -0.36 -4.91 120.64 122.97 2kll n GLU 29 Ca -0.13 -0.32 0.25 0.00 -0.02 0.00 0.00 57.16 56.94 2kll n GLU 29 Cb 0.50 -0.18 0.67 0.00 -0.02 0.00 0.00 31.44 32.41 2kll n GLU 29 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 2kll h ASP 30 N -0.22 0.09 0.00 1.62 3.58 -2.06 -3.29 116.42 116.13 2kll h ASP 30 Ca -0.06 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.40 2kll h ASP 30 Cb 0.17 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.22 2kll h ASP 30 CO 0.05 0.03 0.00 -1.84 -2.88 0.00 0.00 179.24 174.60 2kll n GLU 31 N -4.34 0.00 -4.07 0.28 0.28 -1.26 -5.13 120.64 106.40 2kll n GLU 31 Ca 0.17 -0.06 -0.24 0.00 -0.16 0.00 0.00 57.16 56.87 2kll n GLU 31 Cb 0.83 -0.13 -0.04 0.00 1.43 0.00 0.00 31.44 33.52 2kll n GLU 31 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2kll s SER 32 N 0.00 5.71 -0.26 -1.84 0.01 -1.24 -5.11 113.70 110.98 2kll s SER 32 Ca 0.00 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.14 2kll s SER 32 Cb 0.00 -1.53 0.07 0.00 0.21 0.00 0.00 66.02 64.77 2kll s SER 32 CO 0.00 -0.00 0.00 -0.31 0.41 0.00 0.00 173.24 173.34 2kll s TYR 33 N -1.95 2.26 -0.10 2.43 1.51 -1.26 -1.22 117.35 119.01 2kll s TYR 33 Ca 0.33 -1.81 -0.01 0.00 -1.01 0.00 0.00 57.07 54.57 2kll s TYR 33 Cb -0.09 -1.72 -0.03 0.00 -0.11 0.00 0.00 41.96 40.01 2kll s TYR 33 CO 0.25 -0.80 -0.05 -1.21 -1.11 0.00 0.00 175.55 172.63 2kll s GLU 34 N 1.43 3.14 -0.19 -0.62 2.02 -0.47 -5.02 118.70 118.99 2kll s GLU 34 Ca 0.00 -0.52 -0.02 0.00 0.02 0.00 0.00 54.97 54.45 2kll s GLU 34 Cb -0.18 -2.74 0.06 0.00 0.10 0.00 0.00 34.13 31.37 2kll s GLU 34 CO -0.11 0.50 0.02 0.42 0.02 0.00 0.00 175.26 176.11 2kll s ILE 35 N -0.35 0.63 0.38 -1.63 1.01 -1.26 -1.63 121.20 118.36 2kll s ILE 35 Ca 0.05 -0.58 0.04 0.00 0.00 0.00 0.00 60.65 60.17 2kll s ILE 35 Cb -0.12 -1.08 -0.03 0.00 0.01 0.00 0.00 42.46 41.24 2kll s ILE 35 CO 0.02 -0.15 0.12 -0.31 0.00 0.00 0.00 174.94 174.62 2kll s TYR 36 N 1.81 1.79 -0.28 3.97 2.02 -0.99 -4.29 117.35 121.38 2kll s TYR 36 Ca -0.01 -1.25 0.01 0.00 -0.37 0.00 0.00 57.07 55.45 2kll s TYR 36 Cb -0.17 -1.14 0.08 0.00 -0.40 0.00 0.00 41.96 40.34 2kll s TYR 36 CO -0.08 -0.28 0.02 0.08 -1.57 0.00 0.00 175.55 173.72 2kll s VAL 37 N -3.27 1.52 0.33 0.71 1.01 -1.16 -1.17 120.40 118.37 2kll s VAL 37 Ca 0.27 -1.57 -0.09 0.00 0.00 0.00 0.00 61.98 60.60 2kll s VAL 37 Cb 0.04 -1.98 -0.06 0.00 0.00 0.00 0.00 36.38 34.37 2kll s VAL 37 CO 0.15 -0.41 0.66 -1.61 0.00 0.00 0.00 175.10 173.89 2kll s GLU 38 N 1.34 3.75 -0.04 2.72 0.41 -0.49 -4.90 118.70 121.48 2kll s GLU 38 Ca 0.04 0.29 -0.01 0.00 -0.41 0.00 0.00 54.97 54.88 2kll s GLU 38 Cb -0.18 -2.52 -0.04 0.00 -1.78 0.00 0.00 34.13 29.61 2kll s GLU 38 CO -0.12 0.11 0.05 0.34 -0.49 0.00 0.00 175.26 175.15 2kll s ASP 39 N -2.99 5.52 -0.14 -0.19 -1.08 -1.26 -1.05 116.67 115.48 2kll s ASP 39 Ca 0.48 0.15 -0.24 0.00 -0.52 0.00 0.00 52.55 52.42 2kll s ASP 39 Cb -0.11 -1.57 -0.02 0.00 -1.46 0.00 0.00 42.92 39.76 2kll s ASP 39 CO 0.28 0.32 0.76 -0.76 0.52 0.00 0.00 175.17 176.29 2kll s LEU 40 N -1.40 4.22 -0.02 -1.34 1.43 -1.26 -4.96 118.68 115.35 2kll s LEU 40 Ca 0.19 1.14 -0.02 0.00 -1.03 0.00 0.00 54.13 54.41 2kll s LEU 40 Cb -0.12 -3.14 -0.01 0.00 0.03 0.00 0.00 46.19 42.95 2kll s LEU 40 CO 0.09 -0.29 -0.04 0.29 0.23 0.00 0.00 176.35 176.64 2kll n LYS 41 N 4.70 0.06 0.00 1.70 4.76 -1.26 -5.03 118.16 123.09 2kll n LYS 41 Ca 0.02 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 2kll n LYS 41 Cb 0.50 -0.48 0.00 0.00 -1.84 0.00 0.00 35.03 33.21 2kll n LYS 41 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2kll n LYS 42 N -2.77 0.00 -2.98 1.97 4.76 -1.26 -5.00 118.16 112.88 2kll n LYS 42 Ca -0.02 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.28 2kll n LYS 42 Cb 0.06 -0.07 0.02 0.00 -1.84 0.00 0.00 35.03 33.20 2kll n LYS 42 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2kll n ASP 43 N -1.72 -0.68 -4.74 4.39 8.00 -1.26 -5.12 116.55 115.42 2kll n ASP 43 Ca 0.00 -3.31 -0.41 0.00 0.71 0.00 0.00 54.79 51.78 2kll n ASP 43 Cb 0.00 0.56 -0.05 0.00 -0.02 0.00 0.00 41.12 41.61 2kll n ASP 43 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2kll s GLU 44 N -1.13 4.70 -0.52 -1.24 0.41 -1.26 -4.99 118.70 114.67 2kll s GLU 44 Ca 0.32 1.59 -0.29 0.00 -0.41 0.00 0.00 54.97 56.18 2kll s GLU 44 Cb 0.31 -3.30 0.03 0.00 -1.78 0.00 0.00 34.13 29.39 2kll s GLU 44 CO -0.07 0.25 1.22 0.15 -0.49 0.00 0.00 175.26 176.31 2kll s LYS 45 N -0.59 3.59 0.49 1.61 -0.14 -1.26 -5.01 119.74 118.42 2kll s LYS 45 Ca 0.46 0.47 -0.00 0.00 -1.36 0.00 0.00 55.97 55.54 2kll s LYS 45 Cb -0.27 -3.98 0.10 0.00 -1.68 0.00 0.00 37.83 31.99 2kll s LYS 45 CO 0.33 -1.57 0.67 1.63 -0.76 0.00 0.00 175.35 175.65 2kll n LYS 46 N 8.18 0.10 -4.33 1.68 4.76 -1.26 -5.09 118.16 122.21 2kll n LYS 46 Ca 0.11 -1.79 -0.34 0.00 -2.87 0.00 0.00 58.31 53.42 2kll n LYS 46 Cb 0.49 -0.46 -0.13 0.00 -1.84 0.00 0.00 35.03 33.09 2kll n LYS 46 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2kll s ASP 47 N -3.71 4.55 0.34 4.39 -1.08 -1.26 -5.11 116.67 114.79 2kll s ASP 47 Ca 0.44 -0.23 -0.15 0.00 -0.52 0.00 0.00 52.55 52.09 2kll s ASP 47 Cb -0.02 -1.75 -0.09 0.00 -1.46 0.00 0.00 42.92 39.60 2kll s ASP 47 CO 0.29 0.11 0.75 -0.54 0.52 0.00 0.00 175.17 176.31 2kll s LYS 48 N 0.68 3.98 -0.12 4.34 3.01 -1.26 -4.58 119.74 125.80 2kll s LYS 48 Ca -0.03 0.67 0.03 0.00 -1.01 0.00 0.00 55.97 55.63 2kll s LYS 48 Cb -0.15 -2.41 0.00 0.00 -1.01 0.00 0.00 37.83 34.27 2kll s LYS 48 CO 0.02 0.11 -0.23 0.08 0.51 0.00 0.00 175.35 175.85 2kll s VAL 49 N -2.06 2.05 -0.41 3.17 1.01 0.23 -4.61 120.40 119.78 2kll s VAL 49 Ca 0.54 -1.00 -0.28 0.00 0.00 0.00 0.00 61.98 61.25 2kll s VAL 49 Cb -0.10 -1.79 -0.02 0.00 0.00 0.00 0.00 36.38 34.47 2kll s VAL 49 CO 0.19 0.55 1.79 -0.22 0.00 0.00 0.00 175.10 177.42 2kll s LEU 50 N 0.56 3.46 -0.18 3.92 2.96 0.18 -1.19 118.68 128.38 2kll s LEU 50 Ca -0.14 1.02 -0.06 0.00 -0.22 0.00 0.00 54.13 54.73 2kll s LEU 50 Cb -0.17 -3.25 -0.03 0.00 0.50 0.00 0.00 46.19 43.24 2kll s LEU 50 CO 0.04 -1.88 0.02 -0.76 -1.32 0.00 0.00 176.35 172.45 2kll s LEU 51 N 7.43 3.51 0.06 -0.68 1.02 -0.19 -0.71 118.68 129.10 2kll s LEU 51 Ca 0.75 -0.06 0.06 0.00 0.02 0.00 0.00 54.13 54.90 2kll s LEU 51 Cb -0.19 -1.88 -0.03 0.00 0.02 0.00 0.00 46.19 44.11 2kll s LEU 51 CO 0.30 0.13 -0.17 -0.44 0.02 0.00 0.00 176.35 176.19 2kll s SER 52 N 0.60 2.03 0.17 2.29 0.01 -0.62 -1.44 113.70 116.75 2kll s SER 52 Ca 0.01 -0.53 0.04 0.00 1.31 0.00 0.00 55.95 56.77 2kll s SER 52 Cb -0.14 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 2kll s SER 52 CO 0.02 0.06 0.24 -0.31 0.41 0.00 0.00 173.24 173.66 2kll s TYR 53 N -0.94 3.35 0.03 2.43 2.02 -0.44 -0.70 117.35 123.11 2kll s TYR 53 Ca 0.03 0.04 -0.06 0.00 -0.37 0.00 0.00 57.07 56.72 2kll s TYR 53 Cb -0.09 -1.59 -0.01 0.00 -0.40 0.00 0.00 41.96 39.87 2kll s TYR 53 CO 0.02 0.51 0.10 0.71 -1.57 0.00 0.00 175.55 175.32 2kll s TYR 54 N -1.80 0.18 -0.18 2.71 2.02 -0.13 -1.53 117.35 118.62 2kll s TYR 54 Ca 0.33 -0.47 -0.04 0.00 -0.37 0.00 0.00 57.07 56.52 2kll s TYR 54 Cb -0.10 -0.13 -0.02 0.00 -0.40 0.00 0.00 41.96 41.30 2kll s TYR 54 CO 0.27 -0.36 -0.02 -1.83 -1.57 0.00 0.00 175.55 172.04 2kll s GLU 55 N -2.49 3.62 0.19 -0.62 -1.05 -1.26 -1.19 118.70 115.90 2kll s GLU 55 Ca -0.06 -0.53 -0.29 0.00 -0.15 0.00 0.00 54.97 53.94 2kll s GLU 55 Cb -0.02 -3.01 -0.08 0.00 -0.44 0.00 0.00 34.13 30.58 2kll s GLU 55 CO -0.04 0.09 0.92 -1.54 0.95 0.00 0.00 175.26 175.64 2kll s SER 56 N 0.78 7.57 -0.30 0.83 1.04 -1.25 -4.87 113.70 117.51 2kll s SER 56 Ca -0.00 1.86 -0.00 0.00 0.48 0.00 0.00 55.95 58.29 2kll s SER 56 Cb -0.14 -2.59 0.06 0.00 0.10 0.00 0.00 66.02 63.45 2kll s SER 56 CO 0.02 0.10 -0.01 -1.58 0.98 0.00 0.00 173.24 172.75 2kll s GLN 57 N -0.84 2.32 0.09 4.02 0.74 -1.26 -4.94 119.66 119.79 2kll s GLN 57 Ca 0.42 -1.34 -0.00 0.00 0.05 0.00 0.00 55.36 54.49 2kll s GLN 57 Cb -0.25 -3.14 -0.04 0.00 1.10 0.00 0.00 33.01 30.68 2kll s GLN 57 CO 0.31 -0.65 0.25 -1.01 -0.55 0.00 0.00 175.29 173.64 2kll s HIS 58 N 1.20 3.51 0.34 1.67 3.76 -1.26 -5.07 115.29 119.43 2kll s HIS 58 Ca -0.05 0.26 -0.29 0.00 -0.15 0.00 0.00 55.06 54.83 2kll s HIS 58 Cb -0.20 -1.77 -0.11 0.00 1.11 0.00 0.00 32.58 31.61 2kll s HIS 58 CO -0.02 0.55 1.54 -2.14 -0.85 0.00 0.00 174.74 173.82 2kll s PRO 59 N -2.69 4.11 -0.63 8.40 0.02 -1.26 -4.89 135.00 138.05 2kll s PRO 59 Ca 0.36 2.58 -0.27 0.00 0.02 0.00 0.00 61.00 63.69 2kll s PRO 59 Cb -0.12 -2.99 -0.01 0.00 0.02 0.00 0.00 34.50 31.39 2kll s PRO 59 CO 0.28 -0.59 1.78 0.45 -0.33 0.00 0.00 177.00 178.59 2kll s SER 60 N 0.17 5.40 0.01 2.53 0.15 -1.26 -4.96 113.70 115.74 2kll s SER 60 Ca 0.58 0.23 0.07 0.00 0.70 0.00 0.00 55.95 57.53 2kll s SER 60 Cb -0.47 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.28 2kll s SER 60 CO 0.56 -2.30 -0.21 0.21 1.20 0.00 0.00 173.24 172.71 2kll s ASN 61 N 7.45 2.47 0.16 5.45 3.04 -1.26 -5.10 114.94 127.15 2kll s ASN 61 Ca 0.63 -0.43 -0.31 0.00 0.04 0.00 0.00 52.86 52.78 2kll s ASN 61 Cb -0.12 -0.25 -0.10 0.00 -1.54 0.00 0.00 41.25 39.24 2kll s ASN 61 CO 0.20 0.22 1.68 -1.61 -3.04 0.00 0.00 177.10 174.55 2kll s GLU 62 N -0.74 4.17 0.37 0.43 8.01 -1.26 -4.73 118.70 124.95 2kll s GLU 62 Ca 0.08 2.48 0.00 0.00 0.01 0.00 0.00 54.97 57.53 2kll s GLU 62 Cb -0.08 -3.28 0.00 0.00 -4.31 0.00 0.00 34.13 26.46 2kll s GLU 62 CO 0.00 -0.71 0.00 0.43 0.01 0.00 0.00 175.26 174.99 2kll n SER 63 N 4.53 -8.21 0.00 -0.19 7.64 -1.26 -5.02 113.62 111.11 2kll n SER 63 Ca 0.15 0.70 0.00 0.00 1.01 0.00 0.00 58.87 60.74 2kll n SER 63 Cb 0.38 -4.27 0.00 0.00 -1.01 0.00 0.00 64.21 59.31 2kll n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kll n GLY 64 N -4.14 3.96 2.80 0.23 0.00 -1.26 -5.03 105.19 101.75 2kll n GLY 64 Ca -0.01 -0.60 -0.01 0.00 0.00 0.00 0.00 46.02 45.41 2kll n GLY 64 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kll n ASP 65 N 0.00 -6.75 0.00 1.61 2.03 -1.26 -5.03 116.55 107.15 2kll n ASP 65 Ca 0.00 1.23 0.00 0.00 0.52 0.00 0.00 54.79 56.54 2kll n ASP 65 Cb 0.00 -4.54 0.00 0.00 -0.72 0.00 0.00 41.12 35.86 2kll n ASP 65 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kll n GLY 66 N 1.01 -0.72 2.77 0.27 0.00 -1.26 -4.97 105.19 102.29 2kll n GLY 66 Ca -0.06 -0.12 -0.03 0.00 0.00 0.00 0.00 46.02 45.81 2kll n GLY 66 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2kll n VAL 67 N 0.00 1.10 -3.12 1.61 0.24 -1.26 -5.02 118.33 111.88 2kll n VAL 67 Ca 0.00 -2.86 -0.04 0.00 -2.04 0.00 0.00 64.34 59.39 2kll n VAL 67 Cb 0.00 1.07 0.00 0.00 -1.47 0.00 0.00 33.84 33.44 2kll n VAL 67 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2kll n ASP 68 N -0.45 -7.47 0.00 -1.34 8.00 -1.26 -4.90 116.55 109.14 2kll n ASP 68 Ca 0.07 -0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.47 2kll n ASP 68 Cb 0.81 -4.87 0.00 0.00 -0.02 0.00 0.00 41.12 37.04 2kll n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2kll n GLY 69 N -1.55 2.32 3.72 0.44 0.00 -1.26 -5.04 105.19 103.82 2kll n GLY 69 Ca -0.02 -1.39 -0.40 0.00 0.00 0.00 0.00 46.02 44.21 2kll n GLY 69 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2kll n LYS 70 N 2.16 1.85 -2.51 1.61 4.76 -1.26 -4.94 118.16 119.83 2kll n LYS 70 Ca 0.00 0.66 -0.42 0.00 -2.87 0.00 0.00 58.31 55.69 2kll n LYS 70 Cb 0.00 -2.46 -0.03 0.00 -1.84 0.00 0.00 35.03 30.70 2kll n LYS 70 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2kll s MET 71 N -2.46 4.51 -0.07 1.97 0.23 -1.26 -5.01 119.30 117.20 2kll s MET 71 Ca 0.65 1.68 -0.16 0.00 -1.03 0.00 0.00 55.69 56.83 2kll s MET 71 Cb -0.47 -3.35 -0.05 0.00 -1.53 0.00 0.00 34.83 29.43 2kll s MET 71 CO 0.55 -0.11 0.40 -0.51 -2.03 0.00 0.00 175.02 173.32 2kll s LEU 72 N 0.62 4.36 0.40 0.18 1.43 -1.26 -3.92 118.68 120.50 2kll s LEU 72 Ca 0.54 0.82 0.03 0.00 -1.03 0.00 0.00 54.13 54.49 2kll s LEU 72 Cb -0.28 -2.57 -0.01 0.00 0.03 0.00 0.00 46.19 43.37 2kll s LEU 72 CO 0.31 0.17 0.59 -0.04 0.23 0.00 0.00 176.35 177.61 2kll s MET 73 N -0.20 3.09 -0.03 1.70 -1.94 -0.34 -2.10 119.30 119.49 2kll s MET 73 Ca 0.23 -0.68 -0.07 0.00 -1.71 0.00 0.00 55.69 53.46 2kll s MET 73 Cb -0.15 -2.66 0.01 0.00 2.01 0.00 0.00 34.83 34.04 2kll s MET 73 CO 0.10 -0.14 0.16 0.54 -0.01 0.00 0.00 175.02 175.68 2kll s VAL 74 N -2.41 0.05 -0.07 -6.03 0.11 0.20 -0.96 120.40 111.30 2kll s VAL 74 Ca 0.47 -0.42 0.05 0.00 -2.93 0.00 0.00 61.98 59.15 2kll s VAL 74 Cb -0.10 -0.38 -0.00 0.00 -1.53 0.00 0.00 36.38 34.37 2kll s VAL 74 CO 0.35 -0.23 -0.21 0.42 -3.33 0.00 0.00 175.10 172.10 2kll s THR 75 N -0.82 1.80 -0.18 5.04 -4.23 0.12 -1.36 115.64 116.02 2kll s THR 75 Ca -0.09 -0.91 -0.03 0.00 -1.18 0.00 0.00 61.69 59.49 2kll s THR 75 Cb -0.05 -1.55 -0.01 0.00 1.34 0.00 0.00 72.50 72.23 2kll s THR 75 CO 0.01 0.51 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.76 2kll s LEU 76 N 0.11 2.89 -0.39 4.79 1.43 -1.26 -1.58 118.68 124.67 2kll s LEU 76 Ca -0.09 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.70 2kll s LEU 76 Cb -0.15 -1.70 0.14 0.00 0.03 0.00 0.00 46.19 44.51 2kll s LEU 76 CO 0.05 0.08 0.23 -0.55 0.23 0.00 0.00 176.35 176.39 2kll s SER 77 N 0.88 3.16 0.58 2.29 0.15 0.11 -2.85 113.70 118.01 2kll s SER 77 Ca -0.02 -2.43 0.34 0.00 0.70 0.00 0.00 55.95 54.54 2kll s SER 77 Cb -0.15 -0.66 1.75 0.00 -1.71 0.00 0.00 66.02 65.25 2kll s SER 77 CO 0.01 -0.28 2.16 1.55 1.20 0.00 0.00 173.24 177.88 2kll h PRO 78 N 6.80 0.00 0.00 5.44 0.13 -1.82 0.54 132.00 143.09 2kll h PRO 78 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2kll h PRO 78 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2kll h PRO 78 CO 0.36 0.05 0.00 0.25 -0.23 0.00 0.00 178.00 178.43 2kll n THR 79 N -3.40 0.00 0.00 1.56 -2.24 -1.26 -4.71 114.28 104.22 2kll n THR 79 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2kll n THR 79 Cb 0.19 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 2kll n THR 79 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2kll n LYS 80 N 0.00 0.00 -0.01 -0.78 4.76 -1.26 -4.72 118.16 116.14 2kll n LYS 80 Ca 0.00 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.24 2kll n LYS 80 Cb 0.00 -0.51 -0.14 0.00 -1.84 0.00 0.00 35.03 32.54 2kll n LYS 80 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2kll n ASP 81 N -0.24 2.04 -4.66 4.39 8.00 -1.26 -4.92 116.55 119.90 2kll n ASP 81 Ca 0.00 0.19 -0.57 0.00 0.71 0.00 0.00 54.79 55.11 2kll n ASP 81 Cb 0.00 -0.77 -0.07 0.00 -0.02 0.00 0.00 41.12 40.26 2kll n ASP 81 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2kll n PHE 82 N -3.43 1.97 -4.10 1.24 3.72 -1.26 -4.77 117.46 110.82 2kll n PHE 82 Ca -0.33 0.52 -0.23 0.00 -0.05 0.00 0.00 57.45 57.37 2kll n PHE 82 Cb 1.04 -2.46 -0.06 0.00 -0.94 0.00 0.00 39.48 37.07 2kll n PHE 82 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 2kll s TRP 83 N 4.11 2.77 -0.10 1.38 0.51 -0.45 -4.32 118.94 122.84 2kll s TRP 83 Ca 1.01 -0.32 -0.28 0.00 -2.12 0.00 0.00 56.10 54.39 2kll s TRP 83 Cb -1.07 -1.56 -0.02 0.00 -0.81 0.00 0.00 33.47 30.01 2kll s TRP 83 CO 0.64 0.38 0.92 -0.51 -0.51 0.00 0.00 176.95 177.88 2kll s LEU 84 N -3.84 4.25 -0.11 2.99 1.02 -1.13 -1.38 118.68 120.48 2kll s LEU 84 Ca 0.37 1.41 0.02 0.00 0.02 0.00 0.00 54.13 55.94 2kll s LEU 84 Cb -0.04 -3.41 0.02 0.00 0.02 0.00 0.00 46.19 42.77 2kll s LEU 84 CO 0.23 -0.37 -0.15 -1.00 0.02 0.00 0.00 176.35 175.08 2kll s HIS 85 N 1.78 1.94 -0.37 0.29 3.76 -0.26 -4.45 115.29 117.98 2kll s HIS 85 Ca 0.45 -0.92 -0.28 0.00 -0.15 0.00 0.00 55.06 54.15 2kll s HIS 85 Cb -0.18 -1.41 0.02 0.00 1.11 0.00 0.00 32.58 32.12 2kll s HIS 85 CO 0.18 -0.48 1.06 0.00 -0.85 0.00 0.00 174.74 174.64 2kll s ALA 86 N 1.04 3.39 -0.27 -1.40 0.00 -1.22 -1.33 121.76 121.98 2kll s ALA 86 Ca -0.06 -0.25 -0.14 0.00 0.00 0.00 0.00 51.96 51.52 2kll s ALA 86 Cb -0.15 -3.70 -0.04 0.00 0.00 0.00 0.00 23.12 19.24 2kll s ALA 86 CO -0.02 -1.70 0.33 -0.80 0.00 0.00 0.00 175.76 173.57 2kll s ASN 87 N 1.90 6.20 0.35 0.00 0.01 -0.27 -4.94 114.94 118.18 2kll s ASN 87 Ca 0.44 0.22 0.26 0.00 -0.71 0.00 0.00 52.86 53.07 2kll s ASN 87 Cb -0.11 -2.19 0.74 0.00 0.41 0.00 0.00 41.25 40.11 2kll s ASN 87 CO 0.20 -0.15 1.74 -1.13 -1.51 0.00 0.00 177.10 176.25 2kll h ASN 88 N 8.22 0.00 0.68 -1.22 -1.24 -1.95 -0.53 115.58 119.54 2kll h ASN 88 Ca -0.32 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.65 2kll h ASN 88 Cb 1.17 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.23 2kll h ASN 88 CO 0.62 0.00 -0.33 0.11 -1.29 0.00 0.00 177.43 176.54 2kll h LYS 89 N 0.00 -0.88 -0.29 6.67 1.57 -1.93 -3.24 116.57 118.46 2kll h LYS 89 Ca 0.00 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2kll h LYS 89 Cb 0.75 0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.26 2kll h LYS 89 CO 0.00 -0.55 0.00 0.39 -0.57 0.00 0.00 179.45 178.72 2kll n GLU 90 N -5.42 2.45 -3.79 3.15 1.02 -1.25 -4.96 120.64 111.84 2kll n GLU 90 Ca -0.13 -2.16 -0.27 0.00 -0.02 0.00 0.00 57.16 54.58 2kll n GLU 90 Cb 0.38 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.34 2kll n GLU 90 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2kll n HIS 91 N 1.43 -2.38 -3.98 -0.32 8.25 -0.27 -4.93 115.22 113.02 2kll n HIS 91 Ca 0.18 0.92 -0.08 0.00 -0.26 0.00 0.00 57.72 58.48 2kll n HIS 91 Cb 0.60 -4.34 -0.10 0.00 1.12 0.00 0.00 29.99 27.27 2kll n HIS 91 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2kll s SER 92 N -3.52 0.28 -0.18 0.41 0.01 -0.83 -0.71 113.70 109.16 2kll s SER 92 Ca 0.52 -0.69 -0.15 0.00 1.31 0.00 0.00 55.95 56.94 2kll s SER 92 Cb -0.25 0.21 -0.04 0.00 0.21 0.00 0.00 66.02 66.15 2kll s SER 92 CO 0.80 -0.53 0.34 -0.69 0.41 0.00 0.00 173.24 173.56 2kll s VAL 93 N -3.00 5.26 0.14 3.43 1.01 -1.25 -1.12 120.40 124.88 2kll s VAL 93 Ca -0.02 0.60 0.09 0.00 0.00 0.00 0.00 61.98 62.65 2kll s VAL 93 Cb 0.01 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 2kll s VAL 93 CO -0.06 0.32 -0.20 -1.61 0.00 0.00 0.00 175.10 173.54 2kll s GLU 94 N 0.91 1.25 -0.12 2.72 0.41 -0.44 -4.89 118.70 118.53 2kll s GLU 94 Ca 0.17 -1.32 -0.24 0.00 -0.41 0.00 0.00 54.97 53.18 2kll s GLU 94 Cb -0.14 -1.44 -0.03 0.00 -1.78 0.00 0.00 34.13 30.75 2kll s GLU 94 CO 0.06 0.31 0.73 -0.51 -0.49 0.00 0.00 175.26 175.36 2kll s LEU 95 N -2.34 4.24 0.00 1.80 1.02 -1.26 -1.10 118.68 121.04 2kll s LEU 95 Ca 0.12 1.11 -0.01 0.00 0.02 0.00 0.00 54.13 55.38 2kll s LEU 95 Cb -0.08 -3.09 -0.01 0.00 0.02 0.00 0.00 46.19 43.03 2kll s LEU 95 CO 0.06 -0.24 0.01 -1.00 0.02 0.00 0.00 176.35 175.21 2kll s HIS 96 N 1.45 0.10 -0.34 0.29 3.76 -0.48 -4.90 115.29 115.17 2kll s HIS 96 Ca 0.36 -0.20 -0.11 0.00 -0.15 0.00 0.00 55.06 54.96 2kll s HIS 96 Cb -0.17 -0.08 0.01 0.00 1.11 0.00 0.00 32.58 33.45 2kll s HIS 96 CO 0.15 -0.12 0.19 0.21 -0.85 0.00 0.00 174.74 174.33 2kll s LYS 97 N -0.74 3.15 0.49 1.40 2.20 -1.26 -1.34 119.74 123.64 2kll s LYS 97 Ca -0.08 -0.86 0.02 0.00 -0.36 0.00 0.00 55.97 54.69 2kll s LYS 97 Cb -0.05 -3.69 -0.03 0.00 -1.51 0.00 0.00 37.83 32.55 2kll s LYS 97 CO -0.00 -0.55 0.00 0.00 -0.36 0.00 0.00 175.35 174.45 2kll s GLU 99 N -3.84 -1.45 0.18 0.00 0.41 -1.26 -4.92 118.70 107.82 2kll s GLU 99 Ca 0.12 0.18 -0.17 0.00 -0.41 0.00 0.00 54.97 54.69 2kll s GLU 99 Cb 0.03 -1.55 0.12 0.00 -1.78 0.00 0.00 34.13 30.96 2kll s GLU 99 CO 0.06 -3.91 1.64 -0.22 -0.49 0.00 0.00 175.26 172.34 2kll h LYS 100 N -2.73 -0.06 -5.30 1.61 1.63 -2.01 -3.37 116.57 106.33 2kll h LYS 100 Ca -0.48 0.00 -0.18 0.00 -0.85 0.00 0.00 60.65 59.14 2kll h LYS 100 Cb 1.32 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.94 2kll h LYS 100 CO 0.38 -0.04 0.78 -2.30 -3.45 0.00 0.00 179.45 174.82 2kll n PRO 101 N -5.37 0.50 -2.02 1.90 -0.02 -1.26 -4.86 135.00 123.87 2kll n PRO 101 Ca 0.03 -0.50 -0.41 0.00 -2.02 0.00 0.00 63.50 60.60 2kll n PRO 101 Cb 0.28 -3.02 -0.02 0.00 -0.02 0.00 0.00 33.50 30.72 2kll n PRO 101 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2kll s LEU 102 N 11.26 4.39 0.78 2.45 1.43 -1.26 -5.01 118.68 132.71 2kll s LEU 102 Ca 1.04 2.65 -0.12 0.00 -1.03 0.00 0.00 54.13 56.68 2kll s LEU 102 Cb -0.34 -3.62 0.06 0.00 0.03 0.00 0.00 46.19 42.31 2kll s LEU 102 CO 0.23 -0.69 1.15 -2.16 0.23 0.00 0.00 176.35 175.11 2kll s PRO 103 N -0.38 2.25 0.61 1.29 0.04 -1.26 -4.68 135.00 132.86 2kll s PRO 103 Ca 0.59 0.22 0.37 0.00 0.04 0.00 0.00 61.00 62.22 2kll s PRO 103 Cb -0.42 -1.97 1.96 0.00 0.04 0.00 0.00 34.50 34.11 2kll s PRO 103 CO 0.43 -1.42 2.23 0.22 0.04 0.00 0.00 177.00 178.50 2kll h ASP 104 N -0.93 0.00 -0.18 6.66 1.82 -1.95 -0.31 116.42 121.52 2kll h ASP 104 Ca -0.46 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.18 2kll h ASP 104 Cb 1.31 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.32 2kll h ASP 104 CO 0.65 0.03 0.00 0.00 -1.61 0.00 0.00 179.24 178.31 2kll n GLN 105 N -3.35 1.45 -0.00 0.28 6.02 -1.26 -3.35 117.38 117.17 2kll n GLN 105 Ca -0.02 -0.70 0.08 0.00 -0.01 0.00 0.00 57.00 56.35 2kll n GLN 105 Cb 0.14 -1.19 -0.11 0.00 1.02 0.00 0.00 30.24 30.11 2kll n GLN 105 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2kll n ALA 106 N 0.05 3.44 -2.91 -1.58 0.00 -0.13 -3.43 120.51 115.95 2kll n ALA 106 Ca 0.08 -0.44 -0.34 0.00 0.00 0.00 0.00 53.44 52.75 2kll n ALA 106 Cb 0.18 -0.59 -0.12 0.00 0.00 0.00 0.00 19.45 18.92 2kll n ALA 106 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2kll s PHE 107 N -2.85 3.05 -0.04 0.00 0.40 -1.21 -4.57 117.98 112.76 2kll s PHE 107 Ca 0.00 -0.22 0.06 0.00 -0.60 0.00 0.00 56.93 56.17 2kll s PHE 107 Cb 0.12 -1.95 -0.01 0.00 0.51 0.00 0.00 43.02 41.68 2kll s PHE 107 CO 0.69 0.02 -0.24 -0.06 0.70 0.00 0.00 175.22 176.33 2kll s PHE 108 N 0.25 2.31 -0.24 0.36 0.08 -0.47 -3.99 117.98 116.28 2kll s PHE 108 Ca -0.02 -0.61 -0.25 0.00 0.12 0.00 0.00 56.93 56.17 2kll s PHE 108 Cb -0.14 -1.51 -0.00 0.00 -0.57 0.00 0.00 43.02 40.80 2kll s PHE 108 CO 0.03 -0.16 0.84 0.08 -0.10 0.00 0.00 175.22 175.90 2kll s VAL 109 N -0.28 4.83 0.23 -0.44 1.01 0.15 0.62 120.40 126.53 2kll s VAL 109 Ca 0.00 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.28 2kll s VAL 109 Cb -0.12 -4.12 -0.09 0.00 0.00 0.00 0.00 36.38 32.05 2kll s VAL 109 CO 0.02 -0.07 1.19 -0.22 0.00 0.00 0.00 175.10 176.02 2kll s LEU 110 N 2.81 4.48 -0.04 3.92 2.96 -0.89 -0.73 118.68 131.18 2kll s LEU 110 Ca 0.35 2.30 0.00 0.00 -0.22 0.00 0.00 54.13 56.57 2kll s LEU 110 Cb -0.15 -3.62 0.03 0.00 0.50 0.00 0.00 46.19 42.94 2kll s LEU 110 CO 0.08 -0.33 -0.01 -1.00 -1.32 0.00 0.00 176.35 173.76 2kll s HIS 111 N -0.48 0.48 -0.26 5.38 3.76 -0.40 -4.77 115.29 119.01 2kll s HIS 111 Ca 0.50 -0.08 -0.29 0.00 -0.15 0.00 0.00 55.06 55.04 2kll s HIS 111 Cb -0.33 -0.53 0.00 0.00 1.11 0.00 0.00 32.58 32.83 2kll s HIS 111 CO 0.40 -0.17 1.21 -0.80 -0.85 0.00 0.00 174.74 174.53 2kll s ASN 112 N 1.10 6.86 0.00 1.40 -0.87 -1.26 -0.60 114.94 121.56 2kll s ASN 112 Ca -0.09 1.34 0.00 0.00 -1.57 0.00 0.00 52.86 52.54 2kll s ASN 112 Cb -0.14 -2.54 0.00 0.00 -0.02 0.00 0.00 41.25 38.55 2kll s ASN 112 CO -0.01 -0.90 0.00 0.23 -2.57 0.00 0.00 177.10 173.85 2kll n MET 113 N 6.90 0.00 -2.51 -0.60 2.81 -1.24 -4.96 117.12 117.51 2kll n MET 113 Ca 0.14 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.78 2kll n MET 113 Cb 0.46 -0.25 0.13 0.00 -0.71 0.00 0.00 33.22 32.85 2kll n MET 113 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 2kll s HIS 114 N -0.68 1.39 0.13 2.03 5.65 -1.21 -5.01 115.29 117.61 2kll s HIS 114 Ca 0.00 -0.26 -0.22 0.00 0.25 0.00 0.00 55.06 54.84 2kll s HIS 114 Cb 0.00 -3.16 -0.02 0.00 -1.18 0.00 0.00 32.58 28.23 2kll s HIS 114 CO 0.00 -1.94 1.67 0.77 -0.65 0.00 0.00 174.74 174.59 2kll h SER 115 N -0.74 -0.45 0.00 9.88 0.02 -2.02 -3.32 113.55 116.93 2kll h SER 115 Ca -0.36 0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 60.61 2kll h SER 115 Cb 1.26 0.22 -0.01 0.00 0.14 0.00 0.00 62.40 64.01 2kll h SER 115 CO 0.38 -0.18 -1.48 -3.20 -1.14 0.00 0.00 176.83 171.21 2kll n ASN 116 N -5.29 2.91 -4.82 3.07 5.15 -1.26 -5.03 115.26 110.00 2kll n ASN 116 Ca -0.03 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.65 2kll n ASN 116 Cb 0.21 1.15 0.06 0.00 -0.53 0.00 0.00 39.78 40.67 2kll n ASN 116 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kll s VAL 118 N -3.08 0.00 0.10 0.00 -7.23 -0.28 -3.28 120.40 106.63 2kll s VAL 118 Ca 0.59 -1.97 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 2kll s VAL 118 Cb -0.14 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 2kll s VAL 118 CO 0.55 0.00 -0.09 -0.55 -0.31 0.00 0.00 175.10 174.69 2kll s SER 119 N -3.23 1.43 -0.29 4.85 0.15 0.23 -1.37 113.70 115.46 2kll s SER 119 Ca 0.39 -0.87 0.03 0.00 0.70 0.00 0.00 55.95 56.20 2kll s SER 119 Cb 0.05 0.02 0.08 0.00 -1.71 0.00 0.00 66.02 64.46 2kll s SER 119 CO 0.18 -0.31 -0.01 -0.36 1.20 0.00 0.00 173.24 173.94 2kll s PHE 120 N -2.76 3.17 0.33 3.44 0.08 -1.26 -1.28 117.98 119.70 2kll s PHE 120 Ca 0.08 -2.45 -0.14 0.00 0.12 0.00 0.00 56.93 54.54 2kll s PHE 120 Cb -0.01 -2.26 -0.08 0.00 -0.57 0.00 0.00 43.02 40.09 2kll s PHE 120 CO -0.01 -0.89 0.72 -2.00 -0.10 0.00 0.00 175.22 172.95 2kll s GLU 121 N 1.12 3.95 0.01 0.44 2.12 0.09 -1.29 118.70 125.14 2kll s GLU 121 Ca 0.02 0.61 -0.16 0.00 0.36 0.00 0.00 54.97 55.79 2kll s GLU 121 Cb -0.19 -2.44 -0.06 0.00 0.26 0.00 0.00 34.13 31.70 2kll s GLU 121 CO -0.08 0.14 0.46 0.00 -0.54 0.00 0.00 175.26 175.24 2kll h LYS 123 N 4.83 0.00 0.02 0.00 1.57 -1.80 -3.27 116.57 117.92 2kll h LYS 123 Ca -0.50 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.03 2kll h LYS 123 Cb 1.21 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 2kll h LYS 123 CO 0.63 0.75 -1.27 1.79 -0.57 0.00 0.00 179.45 180.78 2kll h THR 124 N 0.00 1.40 -3.11 -0.16 1.35 -1.90 -3.40 112.91 107.08 2kll h THR 124 Ca -0.01 -3.13 -0.62 0.00 -0.55 0.00 0.00 66.41 62.10 2kll h THR 124 Cb 1.47 2.72 -0.41 0.00 -1.73 0.00 0.00 68.15 70.20 2kll h THR 124 CO 0.10 0.82 -0.62 -1.81 -0.25 0.00 0.00 175.52 173.75 2kll s ASP 125 N -6.60 4.41 0.17 5.36 1.01 -1.23 -5.09 116.67 114.70 2kll s ASP 125 Ca -0.02 -3.51 -0.33 0.00 0.71 0.00 0.00 52.55 49.39 2kll s ASP 125 Cb 0.09 -1.53 -0.14 0.00 1.01 0.00 0.00 42.92 42.36 2kll s ASP 125 CO 0.83 -0.14 1.59 -2.65 0.21 0.00 0.00 175.17 175.01 2kll n PRO 126 N 2.42 2.23 -0.25 8.23 -0.02 -1.24 -1.92 135.00 144.45 2kll n PRO 126 Ca 0.16 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.44 2kll n PRO 126 Cb 0.35 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.25 2kll n PRO 126 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kll n GLY 127 N 3.41 0.77 3.40 -1.23 0.00 -1.26 -5.07 105.19 105.21 2kll n GLY 127 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2kll n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kll s VAL 128 N -2.21 3.12 0.03 1.61 1.01 -0.81 -3.47 120.40 119.68 2kll s VAL 128 Ca 0.00 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.39 2kll s VAL 128 Cb 0.00 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 2kll s VAL 128 CO 0.00 0.54 -0.17 -0.36 0.00 0.00 0.00 175.10 175.10 2kll s PHE 129 N 0.12 1.53 0.45 5.22 0.08 -0.42 -1.09 117.98 123.87 2kll s PHE 129 Ca -0.06 -0.35 -0.24 0.00 0.12 0.00 0.00 56.93 56.40 2kll s PHE 129 Cb -0.15 -0.92 -0.07 0.00 -0.57 0.00 0.00 43.02 41.31 2kll s PHE 129 CO 0.04 0.05 1.22 0.42 -0.10 0.00 0.00 175.22 176.85 2kll s ILE 130 N -0.75 2.88 -0.28 0.64 1.01 -0.41 -0.24 121.20 124.05 2kll s ILE 130 Ca 0.05 0.70 -0.28 0.00 0.00 0.00 0.00 60.65 61.12 2kll s ILE 130 Cb -0.08 -3.37 0.19 0.00 0.01 0.00 0.00 42.46 39.21 2kll s ILE 130 CO 0.01 0.02 1.35 -0.83 0.00 0.00 0.00 174.94 175.50 2kll s GLY 131 N -1.16 0.13 0.02 6.18 0.00 0.12 -4.63 107.32 107.98 2kll s GLY 131 Ca 0.62 2.96 -0.30 0.00 0.00 0.00 0.00 44.72 48.01 2kll s GLY 131 CO 0.40 1.33 1.64 0.14 0.00 0.00 0.00 173.10 176.60 2kll s VAL 132 N -0.74 3.31 0.00 1.40 1.01 -1.23 -0.82 120.40 123.33 2kll s VAL 132 Ca 0.08 0.61 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2kll s VAL 132 Cb -0.02 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.97 2kll s VAL 132 CO -0.09 -0.02 0.00 1.17 0.00 0.00 0.00 175.10 176.15 2kll n LYS 133 N 6.23 0.00 -0.06 2.72 3.00 -0.19 -4.76 118.16 125.10 2kll n LYS 133 Ca 0.16 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.26 2kll n LYS 133 Cb 0.42 -0.01 -0.12 0.00 0.00 0.00 0.00 35.03 35.32 2kll n LYS 133 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2kll h ASP 134 N 0.00 0.15 0.00 3.14 3.58 -1.99 -3.45 116.42 117.84 2kll h ASP 134 Ca 0.00 -0.68 0.00 0.00 0.42 0.00 0.00 57.03 56.77 2kll h ASP 134 Cb 0.00 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.00 2kll h ASP 134 CO 0.00 1.56 0.00 -0.46 -2.88 0.00 0.00 179.24 177.46 2kll n ASN 135 N -4.16 0.00 -4.15 2.28 6.94 -1.26 -5.10 115.26 109.81 2kll n ASN 135 Ca -0.30 -0.79 -0.11 0.00 -0.02 0.00 0.00 54.58 53.36 2kll n ASN 135 Cb 0.78 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 38.11 2kll n ASN 135 CO 0.00 0.00 0.00 -1.38 -1.03 0.00 0.00 177.26 174.85 2kll s HIS 136 N 0.00 0.94 -0.01 -2.53 -3.43 -1.26 -2.97 115.29 106.04 2kll s HIS 136 Ca 0.00 -1.21 -0.30 0.00 -0.80 0.00 0.00 55.06 52.75 2kll s HIS 136 Cb 0.00 -0.38 -0.04 0.00 -1.43 0.00 0.00 32.58 30.73 2kll s HIS 136 CO 0.00 -0.70 1.13 -0.51 -2.00 0.00 0.00 174.74 172.66 2kll s LEU 137 N -3.11 4.33 0.05 5.38 1.43 -1.26 -1.02 118.68 124.47 2kll s LEU 137 Ca 0.34 1.82 -0.06 0.00 -1.03 0.00 0.00 54.13 55.20 2kll s LEU 137 Cb 0.05 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 2kll s LEU 137 CO 0.10 -0.45 0.10 0.00 0.23 0.00 0.00 176.35 176.33 2kll s ALA 138 N 1.50 -0.03 -0.71 4.21 0.00 -0.00 -3.76 121.76 122.97 2kll s ALA 138 Ca 0.55 -0.65 -0.26 0.00 0.00 0.00 0.00 51.96 51.60 2kll s ALA 138 Cb -0.25 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.18 2kll s ALA 138 CO 0.26 -0.37 1.62 -0.51 0.00 0.00 0.00 175.76 176.76 2kll s LEU 139 N -2.40 3.24 -0.26 0.00 1.43 0.11 -0.70 118.68 120.10 2kll s LEU 139 Ca -0.01 -0.16 -0.15 0.00 -1.03 0.00 0.00 54.13 52.77 2kll s LEU 139 Cb 0.02 -2.55 -0.04 0.00 0.03 0.00 0.00 46.19 43.65 2kll s LEU 139 CO -0.07 -2.15 0.40 -0.63 0.23 0.00 0.00 176.35 174.13 2kll s ILE 140 N 7.62 5.16 -0.28 -0.59 1.01 0.67 -4.84 121.20 129.94 2kll s ILE 140 Ca 0.54 0.63 -0.19 0.00 0.00 0.00 0.00 60.65 61.62 2kll s ILE 140 Cb -0.10 -3.72 -0.02 0.00 0.01 0.00 0.00 42.46 38.64 2kll s ILE 140 CO 0.15 0.15 0.56 -0.75 0.00 0.00 0.00 174.94 175.05 2kll s LYS 141 N 2.06 3.97 -0.12 2.79 2.20 -1.26 -1.30 119.74 128.07 2kll s LYS 141 Ca 0.16 0.28 0.01 0.00 -0.36 0.00 0.00 55.97 56.06 2kll s LYS 141 Cb -0.16 -3.69 0.02 0.00 -1.51 0.00 0.00 37.83 32.49 2kll s LYS 141 CO 0.10 -0.46 -0.12 0.08 -0.36 0.00 0.00 175.35 174.58 2kll s VAL 142 N 2.44 1.31 0.23 4.02 1.01 -1.23 -5.00 120.40 123.17 2kll s VAL 142 Ca 0.23 -0.50 -0.26 0.00 0.00 0.00 0.00 61.98 61.45 2kll s VAL 142 Cb -0.15 -1.24 -0.09 0.00 0.00 0.00 0.00 36.38 34.90 2kll s VAL 142 CO 0.10 0.41 0.86 -1.81 0.00 0.00 0.00 175.10 174.66 2kll s ASP 143 N 1.33 7.43 0.29 3.32 1.11 -1.26 -4.88 116.67 124.02 2kll s ASP 143 Ca -0.00 1.76 -0.29 0.00 0.18 0.00 0.00 52.55 54.19 2kll s ASP 143 Cb -0.14 -2.54 -0.10 0.00 1.07 0.00 0.00 42.92 41.21 2kll s ASP 143 CO -0.06 0.12 1.40 -0.55 1.18 0.00 0.00 175.17 177.26 2kll s SER 144 N -1.31 6.66 0.00 0.27 0.15 -1.26 -2.07 113.70 116.14 2kll s SER 144 Ca 0.41 2.72 0.00 0.00 0.70 0.00 0.00 55.95 59.78 2kll s SER 144 Cb -0.22 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.45 2kll s SER 144 CO 0.27 -0.67 0.00 -0.24 1.20 0.00 0.00 173.24 173.81 2kll n SER 145 N 1.64 -1.29 -0.11 5.45 2.88 -1.26 -4.73 113.62 116.21 2kll n SER 145 Ca 0.04 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.36 2kll n SER 145 Cb 0.41 -2.04 -0.08 0.00 -0.75 0.00 0.00 64.21 61.75 2kll n SER 145 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2kll n GLU 146 N -1.52 0.46 -2.64 -1.46 2.13 -0.88 -4.81 120.64 111.92 2kll n GLU 146 Ca 0.00 0.19 -0.13 0.00 0.66 0.00 0.00 57.16 57.88 2kll n GLU 146 Cb 0.09 -1.27 0.02 0.00 0.27 0.00 0.00 31.44 30.55 2kll n GLU 146 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2kll n ASN 147 N -3.87 2.16 0.29 4.31 4.13 -0.91 -4.88 115.26 116.48 2kll n ASN 147 Ca -0.41 -2.95 0.15 0.00 1.68 0.00 0.00 54.58 53.05 2kll n ASN 147 Cb 0.81 -0.52 0.87 0.00 -1.54 0.00 0.00 39.78 39.39 2kll n ASN 147 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 2kll h LEU 148 N 2.91 0.00 -7.80 3.41 3.38 -1.87 -3.34 115.31 111.99 2kll h LEU 148 Ca -0.00 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.25 2kll h LEU 148 Cb 1.11 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.70 2kll h LEU 148 CO 0.58 0.05 1.38 0.00 0.09 0.00 0.00 178.44 180.54 2kll s THR 150 N 2.29 -0.24 0.05 0.00 2.01 -1.25 -4.99 115.64 113.50 2kll s THR 150 Ca 0.42 -0.43 0.32 0.00 0.31 0.00 0.00 61.69 62.31 2kll s THR 150 Cb -0.02 -0.85 0.34 0.00 0.01 0.00 0.00 72.50 71.98 2kll s THR 150 CO -0.01 -0.46 1.96 -0.33 -0.69 0.00 0.00 174.62 175.09 2kll h GLU 151 N 8.34 0.00 -0.22 4.92 5.08 -1.96 -2.79 114.58 127.94 2kll h GLU 151 Ca -0.17 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.02 2kll h GLU 151 Cb 1.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 2kll h GLU 151 CO 0.35 0.00 -0.57 -0.91 -1.00 0.00 0.00 179.01 176.88 2kll h ASN 152 N 0.00 0.79 -0.30 1.42 2.35 -1.94 -3.07 115.58 114.83 2kll h ASN 152 Ca 0.00 -0.43 -0.13 0.00 -0.55 0.00 0.00 56.30 55.19 2kll h ASN 152 Cb 0.28 -0.23 -0.08 0.00 0.05 0.00 0.00 38.32 38.35 2kll h ASN 152 CO 0.00 1.19 0.16 2.30 -1.65 0.00 0.00 177.43 179.43 2kll n ILE 153 N -3.97 1.52 -4.00 2.81 -5.35 -1.05 -3.54 119.36 105.78 2kll n ILE 153 Ca -0.04 -0.59 -0.31 0.00 -0.27 0.00 0.00 62.75 61.54 2kll n ILE 153 Cb 0.63 -0.72 -0.15 0.00 -1.74 0.00 0.00 39.64 37.65 2kll n ILE 153 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2kll s LEU 154 N -1.05 2.95 0.17 7.28 1.43 -1.16 -4.52 118.68 123.79 2kll s LEU 154 Ca 0.19 -1.26 0.06 0.00 -1.03 0.00 0.00 54.13 52.09 2kll s LEU 154 Cb 0.15 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.98 2kll s LEU 154 CO 0.04 -0.21 0.08 -0.36 0.23 0.00 0.00 176.35 176.13 2kll s PHE 155 N 1.26 3.02 -0.03 0.29 0.08 -0.47 -2.67 117.98 119.45 2kll s PHE 155 Ca -0.07 -0.07 0.04 0.00 0.12 0.00 0.00 56.93 56.95 2kll s PHE 155 Cb -0.19 -1.45 -0.00 0.00 -0.57 0.00 0.00 43.02 40.81 2kll s PHE 155 CO -0.06 0.52 -0.14 0.15 -0.10 0.00 0.00 175.22 175.60 2kll s LYS 156 N -3.06 1.34 -0.22 0.44 1.02 0.12 -1.13 119.74 118.25 2kll s LYS 156 Ca 0.30 -0.48 -0.09 0.00 0.02 0.00 0.00 55.97 55.72 2kll s LYS 156 Cb -0.10 -1.22 -0.04 0.00 -0.52 0.00 0.00 37.83 35.96 2kll s LYS 156 CO 0.21 0.21 0.10 -0.51 -0.92 0.00 0.00 175.35 174.45 2kll s LEU 157 N 0.00 3.83 -0.05 3.17 1.43 -1.26 -1.06 118.68 124.73 2kll s LEU 157 Ca -0.01 0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.09 2kll s LEU 157 Cb -0.09 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 2kll s LEU 157 CO 0.01 0.07 0.02 -0.44 0.23 0.00 0.00 176.35 176.25 2kll s SER 158 N 0.99 5.36 -0.86 2.29 0.01 -1.22 -4.99 113.70 115.28 2kll s SER 158 Ca 0.05 0.13 -0.11 0.00 1.31 0.00 0.00 55.95 57.34 2kll s SER 158 Cb -0.14 -1.51 0.22 0.00 0.21 0.00 0.00 66.02 64.81 2kll s SER 158 CO 0.03 0.34 0.78 -1.61 0.41 0.00 0.00 173.24 173.20 2kll s GLU 159 N -1.19 3.55 0.00 12.44 2.02 -1.26 -3.86 118.70 130.39 2kll s GLU 159 Ca 0.16 -2.66 0.00 0.00 0.02 0.00 0.00 54.97 52.49 2kll s GLU 159 Cb -0.12 -4.33 0.00 0.00 0.10 0.00 0.00 34.13 29.79 2kll s GLU 159 CO 0.06 -1.26 0.00 0.25 0.02 0.00 0.00 175.26 174.33