#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k4c s ILE 2 N 0.00 4.42 -0.16 0.53 1.01 -1.26 -5.02 121.20 120.72 1k4c s ILE 2 Ca 0.00 1.72 -0.16 0.00 0.00 0.00 0.00 60.65 62.20 1k4c s ILE 2 Cb 0.00 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.32 1k4c s ILE 2 CO 0.00 -0.05 0.41 -0.22 0.00 0.00 0.00 174.94 175.09 1k4c s LEU 3 N 2.54 4.22 -0.29 2.97 2.96 -1.26 -4.79 118.68 125.03 1k4c s LEU 3 Ca 0.53 0.64 -0.06 0.00 -0.22 0.00 0.00 54.13 55.02 1k4c s LEU 3 Cb -0.22 -2.57 0.01 0.00 0.50 0.00 0.00 46.19 43.92 1k4c s LEU 3 CO 0.18 -0.01 0.07 -0.76 -1.32 0.00 0.00 176.35 174.51 1k4c s LEU 4 N 0.86 3.78 -0.27 -0.68 1.02 -1.26 -1.17 118.68 120.95 1k4c s LEU 4 Ca 0.22 -0.70 -0.11 0.00 0.02 0.00 0.00 54.13 53.56 1k4c s LEU 4 Cb -0.14 -1.86 -0.05 0.00 0.02 0.00 0.00 46.19 44.15 1k4c s LEU 4 CO 0.08 -0.18 0.17 -0.89 0.02 0.00 0.00 176.35 175.55 1k4c s THR 5 N 1.49 5.23 -0.36 5.49 2.01 0.08 -3.95 115.64 125.63 1k4c s THR 5 Ca 0.03 0.14 -0.03 0.00 0.31 0.00 0.00 61.69 62.14 1k4c s THR 5 Cb -0.17 -3.48 0.08 0.00 0.01 0.00 0.00 72.50 68.94 1k4c s THR 5 CO 0.02 0.27 0.12 -1.10 -0.69 0.00 0.00 174.62 173.24 1k4c s GLN 6 N 1.62 2.23 -0.01 4.92 -0.21 -1.26 -1.17 119.66 125.78 1k4c s GLN 6 Ca 0.07 -1.54 0.01 0.00 0.02 0.00 0.00 55.36 53.92 1k4c s GLN 6 Cb -0.15 -3.42 0.00 0.00 1.00 0.00 0.00 33.01 30.44 1k4c s GLN 6 CO 0.09 -0.86 -0.01 0.45 -2.12 0.00 0.00 175.29 172.84 1k4c s SER 7 N 1.56 0.25 0.76 5.90 0.15 -1.25 -4.22 113.70 116.85 1k4c s SER 7 Ca 0.02 -0.03 -0.11 0.00 0.70 0.00 0.00 55.95 56.54 1k4c s SER 7 Cb -0.21 -0.06 0.05 0.00 -1.71 0.00 0.00 66.02 64.09 1k4c s SER 7 CO -0.02 -0.00 1.08 -2.16 1.20 0.00 0.00 173.24 173.34 1k4c s PRO 8 N 0.18 2.41 0.44 5.44 0.04 -1.26 -4.50 135.00 137.75 1k4c s PRO 8 Ca -0.01 1.11 0.25 0.00 0.04 0.00 0.00 61.00 62.38 1k4c s PRO 8 Cb -0.03 -1.92 0.77 0.00 0.04 0.00 0.00 34.50 33.35 1k4c s PRO 8 CO -0.00 -1.52 1.76 0.00 0.04 0.00 0.00 177.00 177.27 1k4c h ALA 9 N -1.03 0.96 -3.71 8.56 0.00 -1.84 -3.44 119.26 118.75 1k4c h ALA 9 Ca -0.44 -0.15 -0.36 0.00 0.00 0.00 0.00 54.91 53.97 1k4c h ALA 9 Cb 1.23 -0.03 -0.31 0.00 0.00 0.00 0.00 17.79 18.68 1k4c h ALA 9 CO 0.53 0.21 -0.76 0.42 0.00 0.00 0.00 179.25 179.65 1k4c s ILE 10 N -3.45 0.42 -0.12 0.00 1.01 -1.26 -0.59 121.20 117.20 1k4c s ILE 10 Ca 0.03 -0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.54 1k4c s ILE 10 Cb 0.08 -0.41 0.02 0.00 0.01 0.00 0.00 42.46 42.17 1k4c s ILE 10 CO 0.64 0.16 -0.12 -0.22 0.00 0.00 0.00 174.94 175.39 1k4c s LEU 11 N 0.38 1.55 -0.22 2.97 2.96 -0.17 -4.94 118.68 121.20 1k4c s LEU 11 Ca -0.04 -0.40 -0.07 0.00 -0.22 0.00 0.00 54.13 53.39 1k4c s LEU 11 Cb -0.08 -1.03 -0.03 0.00 0.50 0.00 0.00 46.19 45.55 1k4c s LEU 11 CO -0.00 -0.05 0.06 -0.44 -1.32 0.00 0.00 176.35 174.60 1k4c s SER 12 N 1.34 5.31 0.10 3.68 0.01 -1.26 -0.23 113.70 122.65 1k4c s SER 12 Ca 0.00 -0.10 0.02 0.00 1.31 0.00 0.00 55.95 57.19 1k4c s SER 12 Cb -0.14 -1.93 -0.04 0.00 0.21 0.00 0.00 66.02 64.12 1k4c s SER 12 CO -0.06 0.05 -0.07 0.54 0.41 0.00 0.00 173.24 174.11 1k4c s VAL 13 N 1.10 0.74 0.30 3.43 0.11 -0.23 -4.96 120.40 120.89 1k4c s VAL 13 Ca 0.04 -1.84 -0.04 0.00 -2.93 0.00 0.00 61.98 57.21 1k4c s VAL 13 Cb -0.14 -1.57 -0.05 0.00 -1.53 0.00 0.00 36.38 33.09 1k4c s VAL 13 CO 0.03 -0.79 0.55 -0.44 -3.33 0.00 0.00 175.10 171.12 1k4c s SER 14 N -2.86 6.42 0.32 3.54 0.01 -1.26 -0.18 113.70 119.68 1k4c s SER 14 Ca 0.10 0.67 -0.28 0.00 1.31 0.00 0.00 55.95 57.75 1k4c s SER 14 Cb 0.03 -2.13 -0.13 0.00 0.21 0.00 0.00 66.02 64.00 1k4c s SER 14 CO -0.03 -0.21 1.16 -2.65 0.41 0.00 0.00 173.24 171.91 1k4c n PRO 15 N -1.06 1.77 -0.86 12.44 -0.02 -1.26 -2.06 135.00 143.94 1k4c n PRO 15 Ca -0.02 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1k4c n PRO 15 Cb 0.54 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1k4c n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k4c n GLY 16 N 0.98 0.65 3.87 -1.23 0.00 0.26 -4.89 105.19 104.82 1k4c n GLY 16 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1k4c n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1k4c s GLU 17 N -0.35 3.87 0.24 1.61 2.12 -0.88 -3.89 118.70 121.43 1k4c s GLU 17 Ca 0.00 0.43 -0.30 0.00 0.36 0.00 0.00 54.97 55.46 1k4c s GLU 17 Cb 0.00 -2.56 -0.09 0.00 0.26 0.00 0.00 34.13 31.74 1k4c s GLU 17 CO 0.00 0.24 0.96 0.50 -0.54 0.00 0.00 175.26 176.42 1k4c s ARG 18 N -2.93 4.84 0.07 4.30 3.52 -1.26 -1.37 118.95 126.12 1k4c s ARG 18 Ca 0.50 1.52 0.05 0.00 -0.13 0.00 0.00 55.73 57.67 1k4c s ARG 18 Cb -0.11 -3.27 -0.03 0.00 -1.56 0.00 0.00 34.95 29.98 1k4c s ARG 18 CO 0.20 0.49 -0.13 0.54 -0.81 0.00 0.00 175.30 175.58 1k4c s VAL 19 N -1.16 1.04 -0.08 7.11 0.11 -0.49 -4.93 120.40 121.99 1k4c s VAL 19 Ca 0.41 -1.29 -0.00 0.00 -2.93 0.00 0.00 61.98 58.17 1k4c s VAL 19 Cb -0.27 -1.02 0.02 0.00 -1.53 0.00 0.00 36.38 33.58 1k4c s VAL 19 CO 0.33 -0.25 -0.04 -0.44 -3.33 0.00 0.00 175.10 171.37 1k4c s SER 20 N -1.74 1.66 -0.02 3.54 0.01 -1.26 -1.29 113.70 114.59 1k4c s SER 20 Ca -0.03 -0.17 -0.11 0.00 1.31 0.00 0.00 55.95 56.95 1k4c s SER 20 Cb -0.10 -0.59 -0.05 0.00 0.21 0.00 0.00 66.02 65.49 1k4c s SER 20 CO 0.02 -0.13 0.31 -0.36 0.41 0.00 0.00 173.24 173.50 1k4c s PHE 21 N 1.60 3.66 -0.06 2.43 0.40 0.69 -4.93 117.98 121.77 1k4c s PHE 21 Ca 0.01 0.79 -0.01 0.00 -0.60 0.00 0.00 56.93 57.11 1k4c s PHE 21 Cb -0.13 -2.14 -0.03 0.00 0.51 0.00 0.00 43.02 41.23 1k4c s PHE 21 CO -0.05 0.65 0.02 0.45 0.70 0.00 0.00 175.22 177.00 1k4c s SER 22 N -1.22 5.34 -0.08 1.36 0.15 -1.26 -1.69 113.70 116.30 1k4c s SER 22 Ca 0.23 0.13 -0.03 0.00 0.70 0.00 0.00 55.95 56.98 1k4c s SER 22 Cb -0.15 -1.50 0.04 0.00 -1.71 0.00 0.00 66.02 62.71 1k4c s SER 22 CO 0.12 0.35 0.09 0.00 1.20 0.00 0.00 173.24 175.00 1k4c s ARG 24 N 2.19 3.23 0.05 0.00 3.52 -0.32 -0.27 118.95 127.35 1k4c s ARG 24 Ca 0.04 -0.77 -0.11 0.00 -0.13 0.00 0.00 55.73 54.76 1k4c s ARG 24 Cb -0.13 -2.52 -0.06 0.00 -1.56 0.00 0.00 34.95 30.68 1k4c s ARG 24 CO -0.05 0.14 0.39 0.00 -0.81 0.00 0.00 175.30 174.98 1k4c s ALA 25 N 0.49 3.72 0.21 6.12 0.00 0.16 -0.74 121.76 131.72 1k4c s ALA 25 Ca -0.12 -0.34 0.35 0.00 0.00 0.00 0.00 51.96 51.85 1k4c s ALA 25 Cb -0.16 -2.29 1.75 0.00 0.00 0.00 0.00 23.12 22.41 1k4c s ALA 25 CO 0.05 0.54 2.05 0.66 0.00 0.00 0.00 175.76 179.07 1k4c h SER 26 N 4.02 0.00 -5.18 0.00 4.64 -1.47 -3.44 113.55 112.12 1k4c h SER 26 Ca -0.50 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.75 1k4c h SER 26 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.17 1k4c h SER 26 CO 0.65 0.00 -0.19 0.00 -0.87 0.00 0.00 176.83 176.42 1k4c s GLN 27 N -3.81 1.21 0.12 4.77 -2.07 -1.26 -5.00 119.66 113.62 1k4c s GLN 27 Ca -0.02 -1.03 -0.31 0.00 -1.82 0.00 0.00 55.36 52.18 1k4c s GLN 27 Cb 0.10 0.43 -0.09 0.00 -1.09 0.00 0.00 33.01 32.36 1k4c s GLN 27 CO 0.39 -0.47 1.66 0.45 -1.32 0.00 0.00 175.29 176.00 1k4c s SER 28 N -2.92 6.55 -0.14 12.60 0.15 -1.26 -4.64 113.70 124.04 1k4c s SER 28 Ca 0.13 2.60 0.15 0.00 0.70 0.00 0.00 55.95 59.53 1k4c s SER 28 Cb 0.02 -2.58 0.33 0.00 -1.71 0.00 0.00 66.02 62.09 1k4c s SER 28 CO -0.02 -0.89 1.17 2.30 1.20 0.00 0.00 173.24 177.00 1k4c n ILE 29 N 4.41 1.65 0.00 6.45 -5.35 0.10 -4.98 119.36 121.65 1k4c n ILE 29 Ca 0.15 -2.35 0.00 0.00 -0.27 0.00 0.00 62.75 60.29 1k4c n ILE 29 Cb 0.39 -0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.25 1k4c n ILE 29 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1k4c n GLY 30 N -0.96 3.98 0.23 3.28 0.00 -1.25 -1.73 105.19 108.74 1k4c n GLY 30 Ca 0.15 0.15 0.08 0.00 0.00 0.00 0.00 46.02 46.40 1k4c n GLY 30 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k4c n THR 31 N 0.00 1.81 -1.19 2.61 -2.24 -1.26 -0.39 114.28 113.62 1k4c n THR 31 Ca 0.00 -2.32 -0.24 0.00 -2.27 0.00 0.00 64.05 59.22 1k4c n THR 31 Cb 0.00 -0.17 -0.11 0.00 -2.10 0.00 0.00 70.33 67.95 1k4c n THR 31 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1k4c n ASP 32 N -1.25 6.72 -4.22 3.42 10.43 -0.71 -2.71 116.55 128.24 1k4c n ASP 32 Ca 0.16 -2.59 -0.27 0.00 2.57 0.00 0.00 54.79 54.66 1k4c n ASP 32 Cb 0.66 -1.46 -0.16 0.00 1.84 0.00 0.00 41.12 42.01 1k4c n ASP 32 CO 0.00 0.00 0.00 -0.51 -1.07 0.00 0.00 177.20 175.62 1k4c s ILE 33 N 1.13 1.63 0.03 0.53 1.10 -1.26 -1.91 121.20 122.44 1k4c s ILE 33 Ca 0.67 -0.90 0.04 0.00 -0.51 0.00 0.00 60.65 59.95 1k4c s ILE 33 Cb 0.27 -1.36 -0.02 0.00 0.15 0.00 0.00 42.46 41.50 1k4c s ILE 33 CO -0.04 0.45 -0.12 -1.00 -2.11 0.00 0.00 174.94 172.11 1k4c s HIS 34 N -0.50 1.08 -0.06 3.50 3.76 0.07 0.19 115.29 123.32 1k4c s HIS 34 Ca 0.08 -0.33 0.03 0.00 -0.15 0.00 0.00 55.06 54.69 1k4c s HIS 34 Cb -0.08 -0.65 -0.02 0.00 1.11 0.00 0.00 32.58 32.93 1k4c s HIS 34 CO -0.01 0.01 -0.13 -1.58 -0.85 0.00 0.00 174.74 172.18 1k4c s TRP 35 N -0.77 2.74 0.07 1.40 0.52 -0.31 -0.70 118.94 121.88 1k4c s TRP 35 Ca 0.01 -0.22 0.07 0.00 0.02 0.00 0.00 56.10 55.98 1k4c s TRP 35 Cb -0.07 -1.67 -0.03 0.00 -1.15 0.00 0.00 33.47 30.55 1k4c s TRP 35 CO 0.01 0.14 -0.19 0.71 0.02 0.00 0.00 176.95 177.63 1k4c s TYR 36 N -0.56 1.68 -0.10 -1.98 1.51 0.35 -0.44 117.35 117.81 1k4c s TYR 36 Ca 0.08 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.74 1k4c s TYR 36 Cb -0.11 -0.96 -0.02 0.00 -0.11 0.00 0.00 41.96 40.75 1k4c s TYR 36 CO 0.01 0.14 -0.10 -1.14 -1.11 0.00 0.00 175.55 173.35 1k4c s GLN 37 N -1.56 3.03 -0.21 -0.62 0.74 0.17 -1.23 119.66 119.98 1k4c s GLN 37 Ca 0.05 -0.61 -0.03 0.00 0.05 0.00 0.00 55.36 54.82 1k4c s GLN 37 Cb -0.09 -2.61 0.07 0.00 1.10 0.00 0.00 33.01 31.47 1k4c s GLN 37 CO 0.03 0.46 0.05 -1.14 -0.55 0.00 0.00 175.29 174.14 1k4c s GLN 38 N -0.27 0.56 0.66 1.67 0.74 0.23 -0.26 119.66 122.99 1k4c s GLN 38 Ca 0.03 -0.46 -0.11 0.00 0.05 0.00 0.00 55.36 54.87 1k4c s GLN 38 Cb -0.13 -2.01 -0.01 0.00 1.10 0.00 0.00 33.01 31.96 1k4c s GLN 38 CO 0.03 -0.71 1.06 1.03 -0.55 0.00 0.00 175.29 176.14 1k4c s ARG 39 N 1.88 3.24 0.04 1.67 0.52 -1.26 -1.48 118.95 123.56 1k4c s ARG 39 Ca 0.01 0.59 -0.37 0.00 -0.52 0.00 0.00 55.73 55.45 1k4c s ARG 39 Cb -0.17 -2.06 -0.16 0.00 0.52 0.00 0.00 34.95 33.08 1k4c s ARG 39 CO -0.12 -0.78 1.42 2.41 0.02 0.00 0.00 175.30 178.25 1k4c n THR 40 N -2.86 0.05 -1.54 0.02 -1.04 -1.26 -0.59 114.28 107.06 1k4c n THR 40 Ca 0.06 -0.01 -0.19 0.00 -2.04 0.00 0.00 64.05 61.88 1k4c n THR 40 Cb 0.56 -0.95 -0.08 0.00 -1.82 0.00 0.00 70.33 68.04 1k4c n THR 40 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1k4c n ASN 41 N 3.03 -5.56 -4.76 8.00 3.02 -1.26 -4.97 115.26 112.76 1k4c n ASN 41 Ca 0.19 0.46 -0.26 0.00 -0.03 0.00 0.00 54.58 54.95 1k4c n ASN 41 Cb 0.19 -4.71 -0.06 0.00 -0.61 0.00 0.00 39.78 34.59 1k4c n ASN 41 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1k4c s GLY 42 N -2.69 2.42 0.33 7.41 0.00 0.24 -5.13 107.32 109.90 1k4c s GLY 42 Ca 0.00 -1.80 -0.00 0.00 0.00 0.00 0.00 44.72 42.91 1k4c s GLY 42 CO 0.00 -1.95 0.53 -1.35 0.00 0.00 0.00 173.10 170.33 1k4c s SER 43 N -3.96 6.32 0.57 1.64 1.04 -1.26 -4.66 113.70 113.39 1k4c s SER 43 Ca 0.36 0.47 -0.21 0.00 0.48 0.00 0.00 55.95 57.06 1k4c s SER 43 Cb 0.03 -2.04 -0.04 0.00 0.10 0.00 0.00 66.02 64.07 1k4c s SER 43 CO 0.20 -0.26 1.34 -2.84 0.98 0.00 0.00 173.24 172.66 1k4c s PRO 44 N -4.14 3.00 -0.05 4.02 0.02 -1.26 -4.61 135.00 131.98 1k4c s PRO 44 Ca 0.40 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.61 1k4c s PRO 44 Cb -0.10 -2.15 0.02 0.00 0.02 0.00 0.00 34.50 32.30 1k4c s PRO 44 CO 0.35 -1.28 -0.03 0.50 -0.33 0.00 0.00 177.00 176.20 1k4c s ARG 45 N -3.03 0.75 0.14 5.54 3.52 0.64 -4.92 118.95 121.59 1k4c s ARG 45 Ca 0.74 -0.04 -0.31 0.00 -0.13 0.00 0.00 55.73 55.99 1k4c s ARG 45 Cb -0.39 -0.87 -0.10 0.00 -1.56 0.00 0.00 34.95 32.02 1k4c s ARG 45 CO 0.45 -0.15 1.68 -1.17 -0.81 0.00 0.00 175.30 175.30 1k4c s LEU 46 N 1.24 4.38 -0.15 -0.88 2.96 -1.26 -0.66 118.68 124.30 1k4c s LEU 46 Ca -0.06 2.66 -0.04 0.00 -0.22 0.00 0.00 54.13 56.47 1k4c s LEU 46 Cb -0.14 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 42.89 1k4c s LEU 46 CO -0.02 -0.91 -0.17 0.18 -1.32 0.00 0.00 176.35 174.11 1k4c n LEU 47 N 4.80 1.92 -3.85 -0.68 4.77 0.41 -4.91 117.00 119.46 1k4c n LEU 47 Ca 0.16 0.08 -0.12 0.00 -0.03 0.00 0.00 56.01 56.09 1k4c n LEU 47 Cb 0.38 -0.49 -0.13 0.00 -2.33 0.00 0.00 43.42 40.85 1k4c n LEU 47 CO 0.63 0.51 -0.27 -0.63 -1.33 0.00 0.00 177.39 176.30 1k4c s ILE 48 N -2.29 0.01 0.16 -0.08 -1.09 -1.19 -4.01 121.20 112.71 1k4c s ILE 48 Ca -0.21 -0.06 0.10 0.00 -2.23 0.00 0.00 60.65 58.25 1k4c s ILE 48 Cb 0.07 -0.14 -0.04 0.00 -1.58 0.00 0.00 42.46 40.77 1k4c s ILE 48 CO 0.31 -0.03 -0.22 -1.59 -1.23 0.00 0.00 174.94 172.17 1k4c s LYS 49 N -0.07 1.37 -1.39 2.79 -2.85 -0.71 -1.16 119.74 117.72 1k4c s LYS 49 Ca -0.01 -1.41 -0.06 0.00 -1.00 0.00 0.00 55.97 53.49 1k4c s LYS 49 Cb -0.01 -1.63 0.00 0.00 -2.06 0.00 0.00 37.83 34.13 1k4c s LYS 49 CO 0.00 0.36 0.39 0.66 0.10 0.00 0.00 175.35 176.86 1k4c n TYR 50 N 0.49 -1.56 0.00 1.78 4.02 -0.90 -0.46 117.16 120.53 1k4c n TYR 50 Ca -0.15 0.61 0.00 0.00 -0.01 0.00 0.00 57.90 58.35 1k4c n TYR 50 Cb 0.55 -3.39 0.00 0.00 -0.02 0.00 0.00 39.34 36.49 1k4c n TYR 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1k4c n ALA 51 N -4.48 0.00 -1.17 -0.72 0.00 0.13 -4.05 120.51 110.22 1k4c n ALA 51 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1k4c n ALA 51 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 1k4c n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1k4c n SER 52 N 0.78 0.00 -4.71 0.00 3.41 -1.17 -2.73 113.62 109.20 1k4c n SER 52 Ca 0.00 -1.00 -0.41 0.00 -0.26 0.00 0.00 58.87 57.20 1k4c n SER 52 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 1k4c n SER 52 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1k4c s GLU 53 N 0.00 4.52 0.55 4.33 2.02 0.39 -4.59 118.70 125.92 1k4c s GLU 53 Ca 0.00 1.24 -0.19 0.00 0.02 0.00 0.00 54.97 56.04 1k4c s GLU 53 Cb 0.00 -3.45 -0.05 0.00 0.10 0.00 0.00 34.13 30.72 1k4c s GLU 53 CO 0.00 -0.01 1.12 -1.12 0.02 0.00 0.00 175.26 175.27 1k4c s SER 54 N 0.93 5.71 -0.10 -0.19 0.01 -1.26 -1.74 113.70 117.06 1k4c s SER 54 Ca 0.47 2.14 0.02 0.00 1.31 0.00 0.00 55.95 59.89 1k4c s SER 54 Cb -0.20 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.44 1k4c s SER 54 CO 0.25 -1.22 -0.15 -0.63 0.41 0.00 0.00 173.24 171.89 1k4c s ILE 55 N -1.85 2.88 0.28 1.44 -1.09 -1.26 -4.85 121.20 116.75 1k4c s ILE 55 Ca 0.72 -0.75 -0.30 0.00 -2.23 0.00 0.00 60.65 58.09 1k4c s ILE 55 Cb -0.23 -2.16 -0.10 0.00 -1.58 0.00 0.00 42.46 38.39 1k4c s ILE 55 CO 0.28 0.55 1.43 -0.94 -1.23 0.00 0.00 174.94 175.03 1k4c s SER 56 N -0.04 6.63 0.00 3.58 1.04 -1.26 -2.37 113.70 121.28 1k4c s SER 56 Ca -0.04 2.73 0.00 0.00 0.48 0.00 0.00 55.95 59.12 1k4c s SER 56 Cb -0.14 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.35 1k4c s SER 56 CO 0.04 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.17 1k4c n GLY 57 N 1.77 2.92 3.75 7.32 0.00 -1.26 -5.06 105.19 114.63 1k4c n GLY 57 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1k4c n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k4c s ILE 58 N -2.75 5.11 0.33 -0.61 -1.09 -1.00 -5.04 121.20 116.16 1k4c s ILE 58 Ca 0.00 0.97 -0.28 0.00 -2.23 0.00 0.00 60.65 59.11 1k4c s ILE 58 Cb 0.00 -3.81 -0.13 0.00 -1.58 0.00 0.00 42.46 36.94 1k4c s ILE 58 CO 0.00 0.39 1.18 -2.65 -1.23 0.00 0.00 174.94 172.63 1k4c n PRO 59 N 3.16 1.82 0.31 2.79 -0.02 -1.26 -4.82 135.00 136.98 1k4c n PRO 59 Ca -0.08 0.64 0.18 0.00 -2.02 0.00 0.00 63.50 62.21 1k4c n PRO 59 Cb 0.52 -2.15 0.92 0.00 -0.02 0.00 0.00 33.50 32.76 1k4c n PRO 59 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1k4c h SER 60 N 2.30 0.00 -0.69 2.55 4.64 -1.97 -1.46 113.55 118.91 1k4c h SER 60 Ca -0.44 0.00 0.18 0.00 -0.47 0.00 0.00 61.79 61.06 1k4c h SER 60 Cb 1.31 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.36 1k4c h SER 60 CO 0.61 0.00 0.48 -0.09 -0.87 0.00 0.00 176.83 176.97 1k4c h ARG 61 N 0.00 0.15 -6.12 4.77 2.43 -1.88 -3.41 114.38 110.32 1k4c h ARG 61 Ca 0.02 -0.01 -0.56 0.00 -0.81 0.00 0.00 59.98 58.62 1k4c h ARG 61 Cb 0.51 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.98 1k4c h ARG 61 CO -0.00 0.10 0.04 -0.06 -1.51 0.00 0.00 179.97 178.54 1k4c s PHE 62 N -5.16 3.68 0.06 2.20 0.08 -0.55 -1.48 117.98 116.81 1k4c s PHE 62 Ca -0.06 1.26 -0.16 0.00 0.12 0.00 0.00 56.93 58.09 1k4c s PHE 62 Cb 0.21 -2.68 0.03 0.00 -0.57 0.00 0.00 43.02 40.00 1k4c s PHE 62 CO 0.75 0.30 0.36 -1.54 -0.10 0.00 0.00 175.22 174.99 1k4c s SER 63 N -0.01 -0.20 0.14 1.36 1.04 -0.60 -5.00 113.70 110.43 1k4c s SER 63 Ca 0.33 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.64 1k4c s SER 63 Cb -0.19 0.41 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 1k4c s SER 63 CO 0.18 -0.69 -0.10 -0.83 0.98 0.00 0.00 173.24 172.78 1k4c s GLY 64 N -2.25 1.04 0.23 7.32 0.00 -1.26 -0.10 107.32 112.29 1k4c s GLY 64 Ca -0.03 -1.45 -0.16 0.00 0.00 0.00 0.00 44.72 43.08 1k4c s GLY 64 CO -0.05 -1.55 0.54 -1.35 0.00 0.00 0.00 173.10 170.69 1k4c s SER 65 N -3.07 -0.20 0.00 1.64 1.04 -0.40 -4.36 113.70 108.36 1k4c s SER 65 Ca 0.15 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.92 1k4c s SER 65 Cb 0.02 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.74 1k4c s SER 65 CO 0.00 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 173.70 1k4c n GLY 66 N -0.37 2.42 3.50 7.32 0.00 -1.26 -1.31 105.19 115.49 1k4c n GLY 66 Ca -0.06 -2.01 -0.10 0.00 0.00 0.00 0.00 46.02 43.86 1k4c n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k4c s SER 67 N 0.00 -0.41 0.49 1.61 1.04 -1.19 -4.86 113.70 110.38 1k4c s SER 67 Ca 0.00 0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.52 1k4c s SER 67 Cb 0.00 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1k4c s SER 67 CO 0.00 -0.63 0.00 0.61 0.98 0.00 0.00 173.24 174.20 1k4c n GLY 68 N -0.07 1.34 0.00 7.32 0.00 0.47 -3.90 105.19 110.35 1k4c n GLY 68 Ca -0.11 -0.58 0.03 0.00 0.00 0.00 0.00 46.02 45.36 1k4c n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k4c n THR 69 N 0.00 0.00 -4.37 2.61 -2.24 -1.26 -0.72 114.28 108.29 1k4c n THR 69 Ca 0.00 -0.19 -0.33 0.00 -2.27 0.00 0.00 64.05 61.25 1k4c n THR 69 Cb 0.00 0.55 -0.15 0.00 -2.10 0.00 0.00 70.33 68.63 1k4c n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1k4c s ASP 70 N -2.31 3.71 0.13 3.42 1.01 -1.25 0.35 116.67 121.73 1k4c s ASP 70 Ca -0.01 -0.47 0.06 0.00 0.71 0.00 0.00 52.55 52.84 1k4c s ASP 70 Cb 0.04 -1.58 -0.04 0.00 1.01 0.00 0.00 42.92 42.34 1k4c s ASP 70 CO 0.22 0.06 -0.15 -0.36 0.21 0.00 0.00 175.17 175.15 1k4c s PHE 71 N 0.97 1.50 -0.01 4.23 0.40 0.63 -3.18 117.98 122.52 1k4c s PHE 71 Ca -0.02 -0.53 0.01 0.00 -0.60 0.00 0.00 56.93 55.79 1k4c s PHE 71 Cb -0.15 -0.78 0.00 0.00 0.51 0.00 0.00 43.02 42.61 1k4c s PHE 71 CO -0.02 0.18 -0.03 0.99 0.70 0.00 0.00 175.22 177.04 1k4c s THR 72 N -2.06 0.26 -0.18 0.64 2.01 -0.42 -1.30 115.64 114.58 1k4c s THR 72 Ca 0.10 -0.10 -0.02 0.00 0.31 0.00 0.00 61.69 61.97 1k4c s THR 72 Cb -0.05 -0.25 -0.01 0.00 0.01 0.00 0.00 72.50 72.20 1k4c s THR 72 CO 0.04 0.09 -0.08 -0.22 -0.69 0.00 0.00 174.62 173.76 1k4c s LEU 73 N 0.15 2.86 0.11 4.42 2.96 -0.68 -1.27 118.68 127.24 1k4c s LEU 73 Ca -0.01 -0.34 0.11 0.00 -0.22 0.00 0.00 54.13 53.66 1k4c s LEU 73 Cb -0.04 -1.70 -0.04 0.00 0.50 0.00 0.00 46.19 44.92 1k4c s LEU 73 CO -0.00 0.07 -0.26 -0.44 -1.32 0.00 0.00 176.35 174.39 1k4c s SER 74 N 0.94 3.34 -0.14 3.68 0.01 0.86 -0.22 113.70 122.17 1k4c s SER 74 Ca -0.01 -0.71 -0.00 0.00 1.31 0.00 0.00 55.95 56.54 1k4c s SER 74 Cb -0.15 -0.26 0.03 0.00 0.21 0.00 0.00 66.02 65.85 1k4c s SER 74 CO 0.00 0.19 -0.09 -0.63 0.41 0.00 0.00 173.24 173.13 1k4c s ILE 75 N -1.02 1.21 -0.27 1.44 1.01 -0.41 -1.55 121.20 121.60 1k4c s ILE 75 Ca 0.14 -0.47 -0.24 0.00 0.00 0.00 0.00 60.65 60.08 1k4c s ILE 75 Cb -0.10 -1.23 -0.00 0.00 0.01 0.00 0.00 42.46 41.14 1k4c s ILE 75 CO 0.06 0.34 0.79 0.20 0.00 0.00 0.00 174.94 176.32 1k4c s ASN 76 N 1.63 6.73 -0.34 3.58 -0.87 -0.55 -1.40 114.94 123.71 1k4c s ASN 76 Ca 0.04 0.84 -0.10 0.00 -1.57 0.00 0.00 52.86 52.07 1k4c s ASN 76 Cb -0.13 -2.41 0.01 0.00 -0.02 0.00 0.00 41.25 38.70 1k4c s ASN 76 CO -0.09 -0.54 0.37 -0.24 -2.57 0.00 0.00 177.10 174.04 1k4c n SER 77 N 6.05 -7.19 -4.77 -1.22 2.88 -1.20 -4.84 113.62 103.33 1k4c n SER 77 Ca 0.04 0.69 -0.37 0.00 -1.33 0.00 0.00 58.87 57.90 1k4c n SER 77 Cb 0.48 -4.81 -0.01 0.00 -0.75 0.00 0.00 64.21 59.13 1k4c n SER 77 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1k4c s VAL 78 N -2.11 3.00 0.13 2.46 1.01 -0.47 -4.65 120.40 119.77 1k4c s VAL 78 Ca 0.15 0.76 0.02 0.00 0.00 0.00 0.00 61.98 62.91 1k4c s VAL 78 Cb -0.04 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.90 1k4c s VAL 78 CO 0.67 0.00 -0.03 -1.83 0.00 0.00 0.00 175.10 173.91 1k4c s GLU 79 N -2.67 0.96 0.32 2.72 -1.05 -1.26 -0.57 118.70 117.16 1k4c s GLU 79 Ca 0.63 -1.43 0.06 0.00 -0.15 0.00 0.00 54.97 54.08 1k4c s GLU 79 Cb -0.30 -0.21 0.88 0.00 -0.44 0.00 0.00 34.13 34.06 1k4c s GLU 79 CO 0.37 -0.08 1.59 0.77 0.95 0.00 0.00 175.26 178.85 1k4c h SER 80 N 2.84 -0.22 0.14 0.83 0.02 -1.89 0.16 113.55 115.43 1k4c h SER 80 Ca -0.36 0.26 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1k4c h SER 80 Cb 1.19 0.40 0.00 0.00 0.14 0.00 0.00 62.40 64.12 1k4c h SER 80 CO 0.63 -0.34 0.00 -1.84 -1.14 0.00 0.00 176.83 174.15 1k4c n GLU 81 N -5.39 0.14 0.00 3.45 0.28 -0.83 -1.25 120.64 117.04 1k4c n GLU 81 Ca 0.26 0.59 0.14 0.00 -0.16 0.00 0.00 57.16 57.99 1k4c n GLU 81 Cb 0.86 -1.91 0.63 0.00 1.43 0.00 0.00 31.44 32.45 1k4c n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1k4c n ASP 82 N -2.19 0.48 -4.65 -1.84 8.00 0.55 -4.81 116.55 112.09 1k4c n ASP 82 Ca -0.01 -0.63 -0.42 0.00 0.71 0.00 0.00 54.79 54.44 1k4c n ASP 82 Cb 0.07 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 1k4c n ASP 82 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1k4c s ILE 83 N -2.43 3.53 -0.60 0.53 1.01 -0.38 -4.82 121.20 118.05 1k4c s ILE 83 Ca 0.30 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.58 1k4c s ILE 83 Cb 0.20 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 39.20 1k4c s ILE 83 CO 0.46 -0.12 0.00 0.00 0.00 0.00 0.00 174.94 175.28 1k4c n ALA 84 N 7.88 0.00 -2.87 9.38 0.00 -1.26 -4.76 120.51 128.88 1k4c n ALA 84 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.26 1k4c n ALA 84 Cb 0.44 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.83 1k4c n ALA 84 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1k4c s ASN 85 N -1.00 6.40 -0.11 0.00 0.02 -0.55 -1.30 114.94 118.40 1k4c s ASN 85 Ca 0.00 0.48 0.04 0.00 -1.02 0.00 0.00 52.86 52.36 1k4c s ASN 85 Cb 0.00 -2.07 0.00 0.00 0.02 0.00 0.00 41.25 39.20 1k4c s ASN 85 CO 0.00 0.41 -0.23 -0.31 0.02 0.00 0.00 177.10 176.98 1k4c s TYR 86 N -1.04 2.56 0.02 2.20 1.51 0.75 -0.60 117.35 122.75 1k4c s TYR 86 Ca 0.15 -1.10 0.08 0.00 -1.01 0.00 0.00 57.07 55.19 1k4c s TYR 86 Cb -0.12 -1.72 -0.02 0.00 -0.11 0.00 0.00 41.96 39.99 1k4c s TYR 86 CO 0.04 -0.46 -0.23 0.71 -1.11 0.00 0.00 175.55 174.51 1k4c s TYR 87 N 0.44 2.07 0.23 2.71 1.51 -0.37 -1.12 117.35 122.82 1k4c s TYR 87 Ca -0.17 -0.39 0.06 0.00 -1.01 0.00 0.00 57.07 55.56 1k4c s TYR 87 Cb -0.17 -1.27 -0.04 0.00 -0.11 0.00 0.00 41.96 40.37 1k4c s TYR 87 CO 0.07 0.06 0.21 0.00 -1.11 0.00 0.00 175.55 174.77 1k4c s GLN 89 N -3.70 0.41 0.07 0.00 -0.44 0.12 -0.91 119.66 115.21 1k4c s GLN 89 Ca 0.33 0.64 0.04 0.00 -2.50 0.00 0.00 55.36 53.87 1k4c s GLN 89 Cb -0.09 0.10 -0.04 0.00 -1.64 0.00 0.00 33.01 31.35 1k4c s GLN 89 CO 0.25 -0.10 -0.01 1.14 0.50 0.00 0.00 175.29 177.07 1k4c s GLN 90 N 0.76 2.56 -0.06 1.67 1.03 -0.67 -0.75 119.66 124.20 1k4c s GLN 90 Ca -0.04 -0.80 0.09 0.00 0.04 0.00 0.00 55.36 54.64 1k4c s GLN 90 Cb -0.06 -2.55 0.15 0.00 0.03 0.00 0.00 33.01 30.59 1k4c s GLN 90 CO -0.05 0.56 1.08 -1.13 -2.54 0.00 0.00 175.29 173.20 1k4c n SER 91 N 0.77 1.02 -0.03 12.60 3.41 -0.81 -3.24 113.62 127.35 1k4c n SER 91 Ca -0.12 -2.49 -0.17 0.00 -0.26 0.00 0.00 58.87 55.83 1k4c n SER 91 Cb 0.52 -0.31 -0.08 0.00 -0.26 0.00 0.00 64.21 64.09 1k4c n SER 91 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1k4c h ASN 92 N 0.09 0.79 -4.30 4.04 -1.24 -1.86 -3.46 115.58 109.64 1k4c h ASN 92 Ca -0.01 -0.64 -0.39 0.00 0.71 0.00 0.00 56.30 55.97 1k4c h ASN 92 Cb 1.26 -0.23 -0.19 0.00 0.73 0.00 0.00 38.32 39.88 1k4c h ASN 92 CO 0.01 1.30 -0.76 -0.13 -1.29 0.00 0.00 177.43 176.55 1k4c s ARG 93 N -3.71 0.90 0.11 6.67 0.52 -1.26 -5.14 118.95 117.03 1k4c s ARG 93 Ca -0.11 -1.10 -0.25 0.00 -0.52 0.00 0.00 55.73 53.74 1k4c s ARG 93 Cb 0.07 -0.79 -0.07 0.00 0.52 0.00 0.00 34.95 34.69 1k4c s ARG 93 CO 0.87 0.16 0.78 -0.46 0.02 0.00 0.00 175.30 176.66 1k4c s TRP 94 N -1.84 3.83 0.43 -0.53 -0.00 -1.26 -3.76 118.94 115.80 1k4c s TRP 94 Ca 0.04 1.57 -0.05 0.00 -0.00 0.00 0.00 56.10 57.66 1k4c s TRP 94 Cb -0.07 -2.80 -0.04 0.00 -0.00 0.00 0.00 33.47 30.56 1k4c s TRP 94 CO 0.02 0.40 0.72 -1.25 -0.00 0.00 0.00 176.95 176.84 1k4c s PRO 95 N -0.63 3.58 0.55 5.86 0.04 -1.26 -4.89 135.00 138.25 1k4c s PRO 95 Ca 0.37 0.15 -0.22 0.00 0.04 0.00 0.00 61.00 61.35 1k4c s PRO 95 Cb -0.22 -2.45 -0.05 0.00 0.04 0.00 0.00 34.50 31.82 1k4c s PRO 95 CO 0.25 -0.08 1.37 -0.06 0.04 0.00 0.00 177.00 178.52 1k4c s PHE 96 N -2.55 2.27 0.07 0.56 2.99 -1.25 -4.73 117.98 115.34 1k4c s PHE 96 Ca 0.47 1.36 0.01 0.00 0.00 0.00 0.00 56.93 58.77 1k4c s PHE 96 Cb -0.10 -3.82 -0.04 0.00 0.00 0.00 0.00 43.02 39.06 1k4c s PHE 96 CO 0.40 -2.95 -0.05 0.95 -0.00 0.00 0.00 175.22 173.56 1k4c s THR 97 N -1.29 0.46 0.11 0.64 -4.23 -1.20 -5.00 115.64 105.13 1k4c s THR 97 Ca 0.71 -1.65 0.08 0.00 -1.18 0.00 0.00 61.69 59.65 1k4c s THR 97 Cb -0.41 -1.31 -0.04 0.00 1.34 0.00 0.00 72.50 72.09 1k4c s THR 97 CO 0.48 -0.79 -0.13 -0.36 -0.54 0.00 0.00 174.62 173.29 1k4c s PHE 98 N -3.11 2.67 0.79 3.99 0.08 -1.26 -1.67 117.98 119.47 1k4c s PHE 98 Ca 0.04 -0.19 -0.12 0.00 0.12 0.00 0.00 56.93 56.78 1k4c s PHE 98 Cb 0.02 -1.41 0.06 0.00 -0.57 0.00 0.00 43.02 41.13 1k4c s PHE 98 CO -0.05 0.41 1.15 0.20 -0.10 0.00 0.00 175.22 176.84 1k4c s GLY 99 N -2.18 1.60 0.00 4.36 0.00 -0.09 -4.59 107.32 106.43 1k4c s GLY 99 Ca 0.20 -0.55 0.29 0.00 0.00 0.00 0.00 44.72 44.66 1k4c s GLY 99 CO 0.12 -0.09 2.01 -1.14 0.00 0.00 0.00 173.10 174.01 1k4c n SER 100 N -3.26 0.00 0.00 1.64 3.41 -1.25 -4.70 113.62 109.46 1k4c n SER 100 Ca 0.08 -0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 1k4c n SER 100 Cb 0.60 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 1k4c n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k4c n GLY 101 N 1.13 -0.53 3.04 5.00 0.00 -1.26 -5.05 105.19 107.52 1k4c n GLY 101 Ca 0.15 -1.43 -0.25 0.00 0.00 0.00 0.00 46.02 44.49 1k4c n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k4c s THR 102 N -2.23 1.19 -0.07 2.61 2.01 -0.28 -4.71 115.64 114.17 1k4c s THR 102 Ca 0.00 -0.52 -0.15 0.00 0.31 0.00 0.00 61.69 61.33 1k4c s THR 102 Cb 0.00 -1.08 -0.05 0.00 0.01 0.00 0.00 72.50 71.38 1k4c s THR 102 CO 0.00 0.37 0.38 -0.75 -0.69 0.00 0.00 174.62 173.92 1k4c s LYS 103 N 0.59 4.04 -0.21 4.92 2.47 0.24 -0.17 119.74 131.63 1k4c s LYS 103 Ca -0.14 0.31 -0.13 0.00 -1.56 0.00 0.00 55.97 54.45 1k4c s LYS 103 Cb -0.15 -3.31 -0.04 0.00 -1.46 0.00 0.00 37.83 32.86 1k4c s LYS 103 CO 0.04 0.49 0.29 -1.17 0.16 0.00 0.00 175.35 175.15 1k4c s LEU 104 N -0.39 4.16 -0.07 5.43 2.96 -0.42 -1.00 118.68 129.35 1k4c s LEU 104 Ca 0.22 0.36 0.05 0.00 -0.22 0.00 0.00 54.13 54.54 1k4c s LEU 104 Cb -0.15 -2.33 -0.01 0.00 0.50 0.00 0.00 46.19 44.20 1k4c s LEU 104 CO 0.10 0.01 -0.24 -0.70 -1.32 0.00 0.00 176.35 174.20 1k4c s GLU 105 N 1.04 2.60 -0.16 1.98 2.12 0.68 -4.01 118.70 122.95 1k4c s GLU 105 Ca 0.14 -0.87 -0.04 0.00 0.36 0.00 0.00 54.97 54.56 1k4c s GLU 105 Cb -0.14 -2.14 -0.03 0.00 0.26 0.00 0.00 34.13 32.09 1k4c s GLU 105 CO 0.06 0.32 -0.04 0.42 -0.54 0.00 0.00 175.26 175.48 1k4c s ILE 106 N -0.02 3.83 -0.73 -3.70 1.01 -1.26 -1.07 121.20 119.26 1k4c s ILE 106 Ca -0.07 -0.38 -0.18 0.00 0.00 0.00 0.00 60.65 60.02 1k4c s ILE 106 Cb -0.15 -2.68 0.14 0.00 0.01 0.00 0.00 42.46 39.78 1k4c s ILE 106 CO 0.05 0.49 0.82 -0.54 0.00 0.00 0.00 174.94 175.76 1k4c s LYS 107 N 0.47 3.31 0.45 2.79 1.02 0.74 -4.93 119.74 123.59 1k4c s LYS 107 Ca -0.04 -1.70 0.03 0.00 0.02 0.00 0.00 55.97 54.28 1k4c s LYS 107 Cb -0.14 -4.46 0.08 0.00 -0.52 0.00 0.00 37.83 32.79 1k4c s LYS 107 CO 0.03 -1.54 0.61 2.89 -0.92 0.00 0.00 175.35 176.42 1k4c n ARG 108 N 5.82 0.38 -2.40 1.68 1.85 -1.26 -4.32 116.66 118.41 1k4c n ARG 108 Ca 0.04 -1.93 -0.35 0.00 -1.00 0.00 0.00 57.85 54.62 1k4c n ARG 108 Cb 0.45 -0.33 -0.02 0.00 -1.05 0.00 0.00 32.46 31.52 1k4c n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1k4c s ALA 109 N -2.80 2.78 0.60 2.89 0.00 -1.26 -4.97 121.76 118.99 1k4c s ALA 109 Ca 0.43 0.71 -0.20 0.00 0.00 0.00 0.00 51.96 52.91 1k4c s ALA 109 Cb -0.03 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 1k4c s ALA 109 CO 0.28 -0.54 1.30 -0.51 0.00 0.00 0.00 175.76 176.29 1k4c s ASP 110 N -1.88 4.99 -0.10 0.00 1.01 -1.26 -4.80 116.67 114.62 1k4c s ASP 110 Ca 0.70 2.64 -0.05 0.00 0.71 0.00 0.00 52.55 56.55 1k4c s ASP 110 Cb -0.20 -2.62 0.05 0.00 1.01 0.00 0.00 42.92 41.15 1k4c s ASP 110 CO 0.23 -1.75 0.24 0.00 0.21 0.00 0.00 175.17 174.10 1k4c s ALA 111 N -1.39 -0.54 0.44 5.23 0.00 0.01 -4.91 121.76 120.60 1k4c s ALA 111 Ca 0.77 0.97 -0.23 0.00 0.00 0.00 0.00 51.96 53.48 1k4c s ALA 111 Cb -0.37 -0.65 -0.08 0.00 0.00 0.00 0.00 23.12 22.02 1k4c s ALA 111 CO 0.42 -0.23 1.09 0.00 0.00 0.00 0.00 175.76 177.04 1k4c s ALA 112 N 1.34 3.00 0.46 0.00 0.00 -1.26 -1.50 121.76 123.80 1k4c s ALA 112 Ca -0.09 0.78 -0.22 0.00 0.00 0.00 0.00 51.96 52.43 1k4c s ALA 112 Cb -0.11 -3.31 -0.08 0.00 0.00 0.00 0.00 23.12 19.62 1k4c s ALA 112 CO -0.08 -0.41 1.11 -1.25 0.00 0.00 0.00 175.76 175.13 1k4c s PRO 113 N -2.70 3.80 -0.33 0.00 0.04 -1.26 -4.55 135.00 130.00 1k4c s PRO 113 Ca 0.62 1.62 -0.16 0.00 0.04 0.00 0.00 61.00 63.12 1k4c s PRO 113 Cb -0.24 -2.33 -0.01 0.00 0.04 0.00 0.00 34.50 31.96 1k4c s PRO 113 CO 0.29 -0.48 0.40 0.99 0.04 0.00 0.00 177.00 178.24 1k4c s THR 114 N -1.67 5.14 -0.16 1.26 2.01 0.06 -4.86 115.64 117.42 1k4c s THR 114 Ca 0.64 0.21 -0.08 0.00 0.31 0.00 0.00 61.69 62.77 1k4c s THR 114 Cb -0.24 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 1k4c s THR 114 CO 0.29 -0.08 0.11 -0.69 -0.69 0.00 0.00 174.62 173.57 1k4c s VAL 115 N 2.11 5.21 -0.02 3.82 1.01 -1.26 -0.74 120.40 130.53 1k4c s VAL 115 Ca 0.14 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.24 1k4c s VAL 115 Cb -0.16 -3.32 0.01 0.00 0.00 0.00 0.00 36.38 32.91 1k4c s VAL 115 CO 0.12 0.52 -0.03 -0.44 0.00 0.00 0.00 175.10 175.27 1k4c s SER 116 N -0.23 0.58 -0.02 3.32 0.01 -0.40 -4.98 113.70 111.98 1k4c s SER 116 Ca 0.10 -0.07 0.07 0.00 1.31 0.00 0.00 55.95 57.36 1k4c s SER 116 Cb -0.12 -0.20 -0.02 0.00 0.21 0.00 0.00 66.02 65.89 1k4c s SER 116 CO 0.01 -0.02 -0.23 -0.51 0.41 0.00 0.00 173.24 172.90 1k4c s ILE 117 N 0.49 2.29 -0.07 1.44 2.07 -1.26 -0.38 121.20 125.78 1k4c s ILE 117 Ca -0.05 -1.06 0.02 0.00 -1.41 0.00 0.00 60.65 58.15 1k4c s ILE 117 Cb -0.09 -1.83 0.01 0.00 0.13 0.00 0.00 42.46 40.69 1k4c s ILE 117 CO -0.01 0.56 -0.12 -0.36 -1.91 0.00 0.00 174.94 173.10 1k4c s PHE 118 N -0.66 1.50 0.55 3.50 0.40 0.10 -5.00 117.98 118.36 1k4c s PHE 118 Ca 0.11 -0.58 -0.19 0.00 -0.60 0.00 0.00 56.93 55.67 1k4c s PHE 118 Cb -0.10 -1.11 -0.06 0.00 0.51 0.00 0.00 43.02 42.27 1k4c s PHE 118 CO -0.00 -0.31 1.09 -2.14 0.70 0.00 0.00 175.22 174.56 1k4c s PRO 119 N 0.76 3.42 0.61 0.24 0.02 -1.26 -2.27 135.00 136.52 1k4c s PRO 119 Ca -0.13 1.44 -0.19 0.00 0.02 0.00 0.00 61.00 62.14 1k4c s PRO 119 Cb -0.16 -2.03 -0.03 0.00 0.02 0.00 0.00 34.50 32.31 1k4c s PRO 119 CO 0.03 -0.76 1.28 -0.35 -0.33 0.00 0.00 177.00 176.86 1k4c n PRO 120 N -1.46 1.26 -1.79 5.54 -0.04 -1.20 -4.88 135.00 132.44 1k4c n PRO 120 Ca 0.10 0.48 -0.31 0.00 -0.04 0.00 0.00 63.50 63.73 1k4c n PRO 120 Cb 0.52 -2.51 0.03 0.00 -0.04 0.00 0.00 33.50 31.50 1k4c n PRO 120 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1k4c s SER 121 N -1.22 5.77 0.29 3.54 1.04 -1.26 -4.93 113.70 116.93 1k4c s SER 121 Ca 0.79 1.59 0.05 0.00 0.48 0.00 0.00 55.95 58.86 1k4c s SER 121 Cb -0.40 -2.49 0.44 0.00 0.10 0.00 0.00 66.02 63.67 1k4c s SER 121 CO 0.44 -1.18 1.70 0.77 0.98 0.00 0.00 173.24 175.95 1k4c h SER 122 N -0.31 0.32 -0.71 7.02 4.64 -1.99 -1.81 113.55 120.71 1k4c h SER 122 Ca -0.44 -0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 60.72 1k4c h SER 122 Cb 1.20 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 63.17 1k4c h SER 122 CO 0.59 0.67 0.33 -0.33 -0.87 0.00 0.00 176.83 177.22 1k4c h GLU 123 N 0.27 1.04 -0.07 4.77 3.07 -1.99 -1.63 114.58 120.04 1k4c h GLU 123 Ca 0.03 -0.15 -0.08 0.00 -0.50 0.00 0.00 59.36 58.66 1k4c h GLU 123 Cb 0.78 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.50 1k4c h GLU 123 CO 0.06 0.81 -0.27 0.37 -1.40 0.00 0.00 179.01 178.58 1k4c h GLN 124 N 1.03 0.31 -0.89 2.33 4.15 -1.78 -3.15 115.11 117.12 1k4c h GLN 124 Ca 0.25 -0.24 0.16 0.00 0.77 0.00 0.00 58.65 59.59 1k4c h GLN 124 Cb 0.13 0.04 -0.07 0.00 0.21 0.00 0.00 27.48 27.79 1k4c h GLN 124 CO -0.03 0.87 0.57 -0.07 -1.93 0.00 0.00 178.83 178.25 1k4c h LEU 125 N -0.18 0.59 -2.29 -2.39 3.38 -1.15 0.34 115.31 113.61 1k4c h LEU 125 Ca -0.01 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1k4c h LEU 125 Cb 0.91 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1k4c h LEU 125 CO 0.06 0.28 0.00 0.74 0.09 0.00 0.00 178.44 179.61 1k4c h THR 126 N 0.62 0.00 -0.50 0.22 2.02 -1.25 -0.18 112.91 113.84 1k4c h THR 126 Ca 0.45 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.63 1k4c h THR 126 Cb 0.82 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1k4c h THR 126 CO -0.20 0.00 0.00 -1.54 0.37 0.00 0.00 175.52 174.15 1k4c n SER 127 N -2.71 3.53 0.00 4.18 3.41 0.12 -4.95 113.62 117.20 1k4c n SER 127 Ca -0.02 -1.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 1k4c n SER 127 Cb 0.05 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 1k4c n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k4c n GLY 128 N 1.40 0.43 3.22 5.00 0.00 -0.08 -5.04 105.19 110.12 1k4c n GLY 128 Ca 0.20 -0.77 -0.18 0.00 0.00 0.00 0.00 46.02 45.27 1k4c n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1k4c s GLY 129 N -2.70 1.00 -0.13 -0.02 0.00 -1.21 -2.53 107.32 101.74 1k4c s GLY 129 Ca 0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 44.72 43.51 1k4c s GLY 129 CO 0.00 -1.22 0.14 0.00 0.00 0.00 0.00 173.10 172.02 1k4c s ALA 130 N -1.76 0.04 -0.16 3.20 0.00 0.65 -2.99 121.76 120.75 1k4c s ALA 130 Ca 0.05 0.19 -0.01 0.00 0.00 0.00 0.00 51.96 52.19 1k4c s ALA 130 Cb -0.07 -0.96 -0.01 0.00 0.00 0.00 0.00 23.12 22.08 1k4c s ALA 130 CO 0.03 -0.87 -0.11 -1.12 0.00 0.00 0.00 175.76 173.69 1k4c s SER 131 N 2.24 4.05 -0.25 0.00 0.01 -1.26 -0.04 113.70 118.45 1k4c s SER 131 Ca 0.04 -0.36 -0.09 0.00 1.31 0.00 0.00 55.95 56.85 1k4c s SER 131 Cb -0.14 -1.64 -0.04 0.00 0.21 0.00 0.00 66.02 64.41 1k4c s SER 131 CO -0.08 0.10 0.11 -0.69 0.41 0.00 0.00 173.24 173.09 1k4c s VAL 132 N 0.74 4.69 -0.09 3.43 1.01 0.44 -3.22 120.40 127.40 1k4c s VAL 132 Ca -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 61.89 1k4c s VAL 132 Cb -0.15 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.00 1k4c s VAL 132 CO 0.02 0.33 -0.08 -0.69 0.00 0.00 0.00 175.10 174.67 1k4c s VAL 133 N 1.51 3.60 -0.07 2.92 1.01 -0.96 -1.05 120.40 127.35 1k4c s VAL 133 Ca 0.06 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.56 1k4c s VAL 133 Cb -0.15 -2.49 0.01 0.00 0.00 0.00 0.00 36.38 33.75 1k4c s VAL 133 CO 0.06 0.57 -0.14 0.00 0.00 0.00 0.00 175.10 175.59 1k4c s PHE 135 N 0.68 3.07 -0.47 0.00 0.08 0.49 -1.13 117.98 120.69 1k4c s PHE 135 Ca -0.14 -0.15 0.02 0.00 0.12 0.00 0.00 56.93 56.78 1k4c s PHE 135 Cb -0.16 -1.93 0.12 0.00 -0.57 0.00 0.00 43.02 40.49 1k4c s PHE 135 CO 0.04 0.10 0.22 -0.51 -0.10 0.00 0.00 175.22 174.96 1k4c s LEU 136 N 0.08 4.72 -0.03 -0.37 2.01 0.25 -1.28 118.68 124.07 1k4c s LEU 136 Ca 0.01 -2.61 -0.01 0.00 0.01 0.00 0.00 54.13 51.52 1k4c s LEU 136 Cb -0.13 -1.69 -0.04 0.00 0.01 0.00 0.00 46.19 44.34 1k4c s LEU 136 CO 0.02 -0.34 0.08 0.20 1.01 0.00 0.00 176.35 177.33 1k4c s ASN 137 N 0.48 5.73 -1.16 2.29 0.02 0.08 -0.32 114.94 122.06 1k4c s ASN 137 Ca 0.14 0.19 -0.17 0.00 -1.02 0.00 0.00 52.86 52.00 1k4c s ASN 137 Cb -0.23 -1.67 -0.01 0.00 0.02 0.00 0.00 41.25 39.36 1k4c s ASN 137 CO -0.03 0.30 0.77 0.59 0.02 0.00 0.00 177.10 178.74 1k4c n ASN 138 N 1.36 -4.79 -4.67 -1.22 3.02 -0.85 -0.76 115.26 107.35 1k4c n ASN 138 Ca -0.14 -0.99 -0.25 0.00 -0.03 0.00 0.00 54.58 53.17 1k4c n ASN 138 Cb 0.53 -3.50 -0.08 0.00 -0.61 0.00 0.00 39.78 36.12 1k4c n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1k4c s PHE 139 N -3.51 2.59 -0.28 3.10 -0.12 0.12 -4.64 117.98 115.23 1k4c s PHE 139 Ca 0.41 -0.48 -0.21 0.00 -0.05 0.00 0.00 56.93 56.61 1k4c s PHE 139 Cb -0.14 -1.65 0.10 0.00 -0.63 0.00 0.00 43.02 40.70 1k4c s PHE 139 CO 0.85 0.38 0.85 -0.47 -0.05 0.00 0.00 175.22 176.78 1k4c s TYR 140 N -2.53 -0.73 1.13 3.49 6.14 -0.56 -0.60 117.35 123.68 1k4c s TYR 140 Ca 0.37 1.61 -0.13 0.00 0.64 0.00 0.00 57.07 59.56 1k4c s TYR 140 Cb 0.01 0.41 0.26 0.00 0.42 0.00 0.00 41.96 43.06 1k4c s TYR 140 CO 0.21 -0.36 1.04 -1.25 0.64 0.00 0.00 175.55 175.83 1k4c s PRO 141 N 0.88 -0.63 0.07 4.97 0.04 -1.26 -0.81 135.00 138.25 1k4c s PRO 141 Ca -0.04 0.70 0.20 0.00 0.04 0.00 0.00 61.00 61.90 1k4c s PRO 141 Cb -0.05 -1.60 0.82 0.00 0.04 0.00 0.00 34.50 33.71 1k4c s PRO 141 CO -0.10 -3.49 1.62 0.36 0.04 0.00 0.00 177.00 175.43 1k4c n LYS 142 N -4.74 0.06 -2.01 4.56 2.85 -1.26 -4.74 118.16 112.89 1k4c n LYS 142 Ca 0.03 0.25 -0.42 0.00 -1.05 0.00 0.00 58.31 57.11 1k4c n LYS 142 Cb 0.55 -1.61 -0.03 0.00 -0.65 0.00 0.00 35.03 33.30 1k4c n LYS 142 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1k4c s ASP 143 N -3.39 6.67 -0.04 -5.58 1.01 -1.26 -4.96 116.67 109.12 1k4c s ASP 143 Ca 0.08 2.25 -0.30 0.00 0.71 0.00 0.00 52.55 55.29 1k4c s ASP 143 Cb 0.11 -2.54 0.08 0.00 1.01 0.00 0.00 42.92 41.58 1k4c s ASP 143 CO 0.36 -0.91 0.70 -0.51 0.21 0.00 0.00 175.17 175.02 1k4c s ILE 144 N 3.88 0.00 -0.00 0.77 2.07 -1.26 -4.58 121.20 122.08 1k4c s ILE 144 Ca 0.73 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 60.03 1k4c s ILE 144 Cb -0.34 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.24 1k4c s ILE 144 CO 0.30 0.00 -0.19 0.20 -1.91 0.00 0.00 174.94 173.34 1k4c s ASN 145 N -1.36 2.25 -0.01 4.50 0.01 -0.85 -5.00 114.94 114.47 1k4c s ASN 145 Ca -0.09 -0.38 0.07 0.00 -0.71 0.00 0.00 52.86 51.76 1k4c s ASN 145 Cb -0.00 -0.24 -0.02 0.00 0.41 0.00 0.00 41.25 41.40 1k4c s ASN 145 CO 0.07 0.21 -0.23 0.54 -1.51 0.00 0.00 177.10 176.18 1k4c s VAL 146 N -0.52 1.79 -0.02 1.60 0.11 -1.26 -0.78 120.40 121.32 1k4c s VAL 146 Ca 0.07 -1.00 0.03 0.00 -2.93 0.00 0.00 61.98 58.15 1k4c s VAL 146 Cb -0.08 -1.49 0.00 0.00 -1.53 0.00 0.00 36.38 33.28 1k4c s VAL 146 CO -0.00 0.48 -0.09 -0.75 -3.33 0.00 0.00 175.10 171.41 1k4c s LYS 147 N -0.59 0.92 -0.04 1.54 2.20 0.08 -4.96 119.74 118.88 1k4c s LYS 147 Ca 0.09 -0.31 -0.01 0.00 -0.36 0.00 0.00 55.97 55.38 1k4c s LYS 147 Cb -0.09 -0.87 -0.04 0.00 -1.51 0.00 0.00 37.83 35.33 1k4c s LYS 147 CO -0.01 0.13 0.04 -1.58 -0.36 0.00 0.00 175.35 173.57 1k4c s TRP 148 N 0.11 3.22 -0.03 4.03 0.52 -1.26 -0.63 118.94 124.91 1k4c s TRP 148 Ca -0.02 0.20 0.00 0.00 0.02 0.00 0.00 56.10 56.31 1k4c s TRP 148 Cb -0.08 -1.76 0.03 0.00 -1.15 0.00 0.00 33.47 30.51 1k4c s TRP 148 CO 0.00 0.52 0.00 0.15 0.02 0.00 0.00 176.95 177.65 1k4c s LYS 149 N -1.32 0.26 -0.18 4.98 1.02 -0.40 0.62 119.74 124.73 1k4c s LYS 149 Ca 0.18 0.08 -0.01 0.00 0.02 0.00 0.00 55.97 56.24 1k4c s LYS 149 Cb -0.12 -0.45 -0.00 0.00 -0.52 0.00 0.00 37.83 36.74 1k4c s LYS 149 CO 0.08 -0.13 -0.13 0.42 -0.92 0.00 0.00 175.35 174.67 1k4c s ILE 150 N 1.00 2.79 -1.53 2.17 1.01 -0.22 -0.51 121.20 125.91 1k4c s ILE 150 Ca -0.10 -0.71 -0.13 0.00 0.00 0.00 0.00 60.65 59.71 1k4c s ILE 150 Cb -0.13 -2.21 0.08 0.00 0.01 0.00 0.00 42.46 40.21 1k4c s ILE 150 CO -0.02 0.49 0.93 0.47 0.00 0.00 0.00 174.94 176.82 1k4c n ASP 151 N 4.36 -4.27 0.00 3.58 8.00 -0.00 -1.13 116.55 127.08 1k4c n ASP 151 Ca -0.19 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.50 1k4c n ASP 151 Cb 0.51 -3.78 0.00 0.00 -0.02 0.00 0.00 41.12 37.83 1k4c n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k4c n GLY 152 N -1.67 1.80 3.36 0.44 0.00 -1.26 -5.01 105.19 102.85 1k4c n GLY 152 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1k4c n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k4c s SER 153 N -3.40 4.42 0.17 1.61 0.01 -0.29 -5.03 113.70 111.20 1k4c s SER 153 Ca 0.00 -0.32 -0.33 0.00 1.31 0.00 0.00 55.95 56.61 1k4c s SER 153 Cb 0.00 -1.75 -0.16 0.00 0.21 0.00 0.00 66.02 64.32 1k4c s SER 153 CO 0.00 0.04 1.09 1.21 0.41 0.00 0.00 173.24 175.99 1k4c n GLU 154 N 4.41 0.98 -5.08 12.44 2.13 -1.26 -1.05 120.64 133.21 1k4c n GLU 154 Ca -0.18 0.35 -0.29 0.00 0.66 0.00 0.00 57.16 57.70 1k4c n GLU 154 Cb 0.51 -1.80 -0.16 0.00 0.27 0.00 0.00 31.44 30.27 1k4c n GLU 154 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1k4c s ARG 155 N -0.47 1.81 0.00 5.31 6.06 0.20 -4.81 118.95 127.05 1k4c s ARG 155 Ca 0.73 -0.84 0.00 0.00 -2.50 0.00 0.00 55.73 53.12 1k4c s ARG 155 Cb -0.88 -1.78 0.00 0.00 0.06 0.00 0.00 34.95 32.35 1k4c s ARG 155 CO 0.53 0.48 0.00 1.04 -2.50 0.00 0.00 175.30 174.86 1k4c n GLN 156 N 2.42 1.28 -2.27 5.12 6.02 -1.26 -4.09 117.38 124.60 1k4c n GLN 156 Ca -0.16 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.45 1k4c n GLN 156 Cb 0.52 -0.84 -0.02 0.00 1.02 0.00 0.00 30.24 30.92 1k4c n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1k4c s ASN 157 N -3.08 6.49 0.00 1.08 -0.87 -1.26 -3.23 114.94 114.07 1k4c s ASN 157 Ca 0.00 2.37 0.00 0.00 -1.57 0.00 0.00 52.86 53.66 1k4c s ASN 157 Cb 0.00 -2.62 0.00 0.00 -0.02 0.00 0.00 41.25 38.61 1k4c s ASN 157 CO 0.00 -0.70 0.00 0.61 -2.57 0.00 0.00 177.10 174.44 1k4c n GLY 158 N 0.63 0.66 3.67 0.66 0.00 -1.26 -4.86 105.19 104.69 1k4c n GLY 158 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1k4c n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k4c s VAL 159 N -2.60 5.31 -0.06 1.61 1.01 -1.20 -1.16 120.40 123.30 1k4c s VAL 159 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 61.98 62.17 1k4c s VAL 159 Cb 0.00 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 32.93 1k4c s VAL 159 CO 0.00 0.38 -0.15 -0.76 0.00 0.00 0.00 175.10 174.57 1k4c s LEU 160 N 0.82 1.77 0.21 3.92 1.43 -0.24 -4.96 118.68 121.63 1k4c s LEU 160 Ca 0.07 -0.34 0.09 0.00 -1.03 0.00 0.00 54.13 52.92 1k4c s LEU 160 Cb -0.13 -0.92 -0.04 0.00 0.03 0.00 0.00 46.19 45.13 1k4c s LEU 160 CO 0.02 0.08 -0.02 0.20 0.23 0.00 0.00 176.35 176.86 1k4c s ASN 161 N 0.47 4.56 -0.10 2.29 0.01 -1.26 -0.48 114.94 120.44 1k4c s ASN 161 Ca -0.13 -0.53 -0.07 0.00 -0.71 0.00 0.00 52.86 51.42 1k4c s ASN 161 Cb -0.15 -0.88 0.04 0.00 0.41 0.00 0.00 41.25 40.67 1k4c s ASN 161 CO 0.04 0.06 0.24 -0.55 -1.51 0.00 0.00 177.10 175.38 1k4c s SER 162 N -3.20 -0.26 -0.06 -1.22 0.15 -0.39 -5.00 113.70 103.72 1k4c s SER 162 Ca 0.28 0.51 0.05 0.00 0.70 0.00 0.00 55.95 57.49 1k4c s SER 162 Cb -0.08 0.44 -0.01 0.00 -1.71 0.00 0.00 66.02 64.66 1k4c s SER 162 CO 0.18 -0.13 -0.23 0.26 1.20 0.00 0.00 173.24 174.52 1k4c s TRP 163 N 0.76 2.48 0.79 3.44 0.51 -1.26 -0.70 118.94 124.96 1k4c s TRP 163 Ca -0.05 -0.69 -0.11 0.00 -2.12 0.00 0.00 56.10 53.13 1k4c s TRP 163 Cb -0.07 -1.62 0.09 0.00 -0.81 0.00 0.00 33.47 31.06 1k4c s TRP 163 CO -0.05 -0.19 1.14 0.95 -0.51 0.00 0.00 176.95 178.29 1k4c s THR 164 N -0.16 2.08 0.70 2.01 -4.23 -0.75 -5.03 115.64 110.26 1k4c s THR 164 Ca -0.03 -0.09 -0.05 0.00 -1.18 0.00 0.00 61.69 60.33 1k4c s THR 164 Cb -0.14 -2.99 0.08 0.00 1.34 0.00 0.00 72.50 70.79 1k4c s THR 164 CO 0.04 0.00 1.00 -1.81 -0.54 0.00 0.00 174.62 173.31 1k4c s ASP 165 N -4.59 4.69 0.29 3.99 1.11 -1.26 -4.68 116.67 116.22 1k4c s ASP 165 Ca 0.63 0.26 -0.30 0.00 0.18 0.00 0.00 52.55 53.32 1k4c s ASP 165 Cb -0.10 -0.86 -0.12 0.00 1.07 0.00 0.00 42.92 42.90 1k4c s ASP 165 CO 0.48 -1.65 1.48 1.67 1.18 0.00 0.00 175.17 178.33 1k4c n GLN 166 N -2.89 2.39 -2.64 8.23 7.27 -1.26 -4.75 117.38 123.73 1k4c n GLN 166 Ca 0.09 0.85 -0.42 0.00 0.07 0.00 0.00 57.00 57.59 1k4c n GLN 166 Cb 0.60 -2.55 -0.03 0.00 2.41 0.00 0.00 30.24 30.67 1k4c n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1k4c s ASP 167 N 0.25 7.27 0.00 1.69 2.15 0.08 -4.92 116.67 123.18 1k4c s ASP 167 Ca 0.63 1.70 0.13 0.00 0.43 0.00 0.00 52.55 55.44 1k4c s ASP 167 Cb -0.56 -2.57 0.78 0.00 -0.30 0.00 0.00 42.92 40.28 1k4c s ASP 167 CO 0.52 -0.37 1.39 -1.54 -0.17 0.00 0.00 175.17 175.00 1k4c n SER 168 N 4.30 0.00 -0.08 -0.34 3.41 -1.26 -0.41 113.62 119.23 1k4c n SER 168 Ca 0.08 -1.28 -0.20 0.00 -0.26 0.00 0.00 58.87 57.20 1k4c n SER 168 Cb 0.49 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.32 1k4c n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1k4c n LYS 169 N -0.74 0.68 -0.16 4.33 4.76 -1.26 -1.96 118.16 123.80 1k4c n LYS 169 Ca 0.10 0.22 0.00 0.00 -2.87 0.00 0.00 58.31 55.76 1k4c n LYS 169 Cb 0.05 -1.59 0.00 0.00 -1.84 0.00 0.00 35.03 31.64 1k4c n LYS 169 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1k4c n ASP 170 N -3.48 0.00 -1.25 4.39 5.75 -1.20 -4.84 116.55 115.93 1k4c n ASP 170 Ca -0.41 -1.27 -0.16 0.00 -0.01 0.00 0.00 54.79 52.94 1k4c n ASP 170 Cb 0.99 -0.05 -0.07 0.00 -1.03 0.00 0.00 41.12 40.95 1k4c n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1k4c n SER 171 N 0.00 -5.15 -4.91 -1.12 7.64 0.45 -4.99 113.62 105.53 1k4c n SER 171 Ca 0.00 0.40 -0.20 0.00 1.01 0.00 0.00 58.87 60.08 1k4c n SER 171 Cb 0.55 -4.09 0.06 0.00 -1.01 0.00 0.00 64.21 59.73 1k4c n SER 171 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1k4c n THR 172 N -2.46 0.00 -4.42 0.44 -2.24 -1.26 -4.70 114.28 99.63 1k4c n THR 172 Ca -0.16 -1.95 -0.21 0.00 -2.27 0.00 0.00 64.05 59.46 1k4c n THR 172 Cb 0.57 -0.47 -0.10 0.00 -2.10 0.00 0.00 70.33 68.23 1k4c n THR 172 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1k4c s TYR 173 N -2.59 1.96 0.06 4.78 1.51 0.23 -0.74 117.35 122.55 1k4c s TYR 173 Ca 0.58 -0.62 -0.06 0.00 -1.01 0.00 0.00 57.07 55.96 1k4c s TYR 173 Cb -0.05 -1.05 -0.01 0.00 -0.11 0.00 0.00 41.96 40.74 1k4c s TYR 173 CO 0.37 0.36 0.10 -1.12 -1.11 0.00 0.00 175.55 174.15 1k4c s SER 174 N -3.43 0.23 -0.05 2.29 0.01 -1.26 -0.71 113.70 110.79 1k4c s SER 174 Ca 0.28 -0.69 -0.08 0.00 1.31 0.00 0.00 55.95 56.77 1k4c s SER 174 Cb 0.02 0.26 0.01 0.00 0.21 0.00 0.00 66.02 66.53 1k4c s SER 174 CO 0.11 -0.62 0.20 -0.32 0.41 0.00 0.00 173.24 173.03 1k4c s MET 175 N -3.41 0.37 0.06 12.44 0.00 0.57 -1.82 119.30 127.51 1k4c s MET 175 Ca 0.02 0.01 0.09 0.00 0.00 0.00 0.00 55.69 55.81 1k4c s MET 175 Cb 0.03 0.17 -0.03 0.00 0.00 0.00 0.00 34.83 35.00 1k4c s MET 175 CO -0.08 -0.08 -0.25 -1.54 0.00 0.00 0.00 175.02 173.07 1k4c s SER 176 N -0.55 3.31 -0.08 1.11 1.04 0.12 -0.58 113.70 118.07 1k4c s SER 176 Ca -0.06 -0.59 -0.01 0.00 0.48 0.00 0.00 55.95 55.77 1k4c s SER 176 Cb -0.04 -0.34 0.03 0.00 0.10 0.00 0.00 66.02 65.77 1k4c s SER 176 CO 0.01 0.24 -0.04 -0.55 0.98 0.00 0.00 173.24 173.89 1k4c s SER 177 N -1.42 1.75 -0.18 7.02 0.15 -0.29 -1.27 113.70 119.47 1k4c s SER 177 Ca 0.13 -0.19 0.01 0.00 0.70 0.00 0.00 55.95 56.60 1k4c s SER 177 Cb -0.10 -0.62 0.02 0.00 -1.71 0.00 0.00 66.02 63.61 1k4c s SER 177 CO 0.03 -0.14 -0.19 -0.89 1.20 0.00 0.00 173.24 173.26 1k4c s THR 178 N 1.67 2.19 -0.40 6.45 2.01 0.37 -1.22 115.64 126.71 1k4c s THR 178 Ca 0.02 -0.90 -0.13 0.00 0.31 0.00 0.00 61.69 60.99 1k4c s THR 178 Cb -0.13 -1.92 0.03 0.00 0.01 0.00 0.00 72.50 70.49 1k4c s THR 178 CO -0.05 0.53 0.26 -0.22 -0.69 0.00 0.00 174.62 174.45 1k4c s LEU 179 N 1.22 4.98 -0.19 4.42 2.96 -0.22 -1.08 118.68 130.77 1k4c s LEU 179 Ca 0.03 -1.00 -0.07 0.00 -0.22 0.00 0.00 54.13 52.87 1k4c s LEU 179 Cb -0.14 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.42 1k4c s LEU 179 CO -0.10 -0.44 0.06 -0.89 -1.32 0.00 0.00 176.35 173.65 1k4c s THR 180 N 1.61 4.63 0.15 3.68 2.01 -0.31 -0.42 115.64 126.98 1k4c s THR 180 Ca 0.03 -0.09 0.01 0.00 0.31 0.00 0.00 61.69 61.96 1k4c s THR 180 Cb -0.20 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.17 1k4c s THR 180 CO 0.08 0.43 0.00 -0.76 -0.69 0.00 0.00 174.62 173.68 1k4c s LEU 181 N 0.64 2.13 0.65 4.42 1.43 0.94 -4.69 118.68 124.20 1k4c s LEU 181 Ca 0.03 -1.14 -0.12 0.00 -1.03 0.00 0.00 54.13 51.87 1k4c s LEU 181 Cb -0.13 0.03 -0.02 0.00 0.03 0.00 0.00 46.19 46.10 1k4c s LEU 181 CO 0.02 -0.59 1.05 0.42 0.23 0.00 0.00 176.35 177.48 1k4c s THR 182 N -3.74 4.26 0.25 5.49 -4.23 -1.26 -0.25 115.64 116.15 1k4c s THR 182 Ca 0.21 0.79 -0.04 0.00 -1.18 0.00 0.00 61.69 61.47 1k4c s THR 182 Cb 0.06 -3.57 0.21 0.00 1.34 0.00 0.00 72.50 70.55 1k4c s THR 182 CO 0.01 -0.91 1.78 0.50 -0.54 0.00 0.00 174.62 175.46 1k4c h LYS 183 N -0.38 0.64 0.56 3.99 3.64 -1.74 -0.14 116.57 123.13 1k4c h LYS 183 Ca -0.44 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 1k4c h LYS 183 Cb 1.20 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1k4c h LYS 183 CO 0.59 0.42 -0.33 -0.44 -2.27 0.00 0.00 179.45 177.42 1k4c h ASP 184 N 0.66 -0.82 -0.97 4.20 5.19 -1.92 0.19 116.42 122.95 1k4c h ASP 184 Ca 0.41 0.04 0.13 0.00 -0.62 0.00 0.00 57.03 56.99 1k4c h ASP 184 Cb 0.48 0.24 -0.08 0.00 0.18 0.00 0.00 39.33 40.15 1k4c h ASP 184 CO -0.30 -0.52 0.61 -0.08 -3.12 0.00 0.00 179.24 175.83 1k4c h GLU 185 N -0.83 0.87 -0.28 3.56 4.57 -1.82 -0.67 114.58 119.98 1k4c h GLU 185 Ca -0.07 -0.05 -0.13 0.00 -1.18 0.00 0.00 59.36 57.93 1k4c h GLU 185 Cb 0.67 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 1k4c h GLU 185 CO 0.08 0.58 -0.37 -0.92 -1.18 0.00 0.00 179.01 177.20 1k4c h TYR 186 N 0.90 0.74 0.00 0.92 3.20 -0.63 -3.15 116.97 118.95 1k4c h TYR 186 Ca 0.49 -0.21 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 1k4c h TYR 186 Cb 0.57 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 1k4c h TYR 186 CO -0.00 0.91 -0.13 0.93 -1.64 0.00 0.00 178.16 178.22 1k4c h GLU 187 N 0.52 0.00 -0.90 1.82 4.39 0.93 -3.15 114.58 118.19 1k4c h GLU 187 Ca 0.05 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.41 1k4c h GLU 187 Cb 0.88 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 29.32 1k4c h GLU 187 CO 0.08 0.13 0.43 2.89 -1.16 0.00 0.00 179.01 181.38 1k4c n ARG 188 N -3.33 2.72 -3.95 2.33 1.85 -0.98 -4.89 116.66 110.42 1k4c n ARG 188 Ca -0.00 -2.70 -0.11 0.00 -1.00 0.00 0.00 57.85 54.04 1k4c n ARG 188 Cb 0.35 -2.08 -0.12 0.00 -1.05 0.00 0.00 32.46 29.55 1k4c n ARG 188 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1k4c s HIS 189 N -2.83 0.19 0.00 2.89 3.76 -1.19 -5.09 115.29 113.01 1k4c s HIS 189 Ca 0.50 -0.29 0.00 0.00 -0.15 0.00 0.00 55.06 55.12 1k4c s HIS 189 Cb 0.41 -0.13 0.00 0.00 1.11 0.00 0.00 32.58 33.97 1k4c s HIS 189 CO 0.11 -0.10 0.00 -1.71 -0.85 0.00 0.00 174.74 172.19 1k4c n ASN 190 N 2.27 0.00 -4.85 1.40 4.05 -1.26 -4.68 115.26 112.19 1k4c n ASN 190 Ca -0.18 0.15 -0.35 0.00 0.45 0.00 0.00 54.58 54.64 1k4c n ASN 190 Cb 0.57 -0.28 -0.06 0.00 1.23 0.00 0.00 39.78 41.24 1k4c n ASN 190 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1k4c s SER 191 N -2.39 6.12 -0.07 1.20 1.04 -1.26 -1.02 113.70 117.32 1k4c s SER 191 Ca 0.00 0.33 0.04 0.00 0.48 0.00 0.00 55.95 56.80 1k4c s SER 191 Cb 0.00 -1.90 -0.00 0.00 0.10 0.00 0.00 66.02 64.22 1k4c s SER 191 CO 0.00 0.33 -0.21 -0.31 0.98 0.00 0.00 173.24 174.03 1k4c s TYR 192 N -1.14 2.18 0.01 5.02 1.51 -0.82 -0.82 117.35 123.29 1k4c s TYR 192 Ca 0.20 -0.77 0.02 0.00 -1.01 0.00 0.00 57.07 55.51 1k4c s TYR 192 Cb -0.12 -1.47 -0.01 0.00 -0.11 0.00 0.00 41.96 40.25 1k4c s TYR 192 CO 0.10 -0.29 -0.06 0.95 -1.11 0.00 0.00 175.55 175.15 1k4c s THR 193 N 0.19 0.42 -0.08 -0.71 -4.23 0.33 -2.42 115.64 109.13 1k4c s THR 193 Ca -0.11 -0.57 0.05 0.00 -1.18 0.00 0.00 61.69 59.88 1k4c s THR 193 Cb -0.15 -0.42 -0.01 0.00 1.34 0.00 0.00 72.50 73.26 1k4c s THR 193 CO 0.05 -0.11 -0.23 0.00 -0.54 0.00 0.00 174.62 173.79 1k4c s GLU 195 N 0.08 2.25 -0.14 0.00 2.02 0.20 -1.75 118.70 121.36 1k4c s GLU 195 Ca -0.10 -0.68 -0.01 0.00 0.02 0.00 0.00 54.97 54.19 1k4c s GLU 195 Cb -0.16 -1.83 -0.02 0.00 0.10 0.00 0.00 34.13 32.23 1k4c s GLU 195 CO 0.06 0.19 -0.10 0.00 0.02 0.00 0.00 175.26 175.43 1k4c s ALA 196 N 0.26 2.73 -0.23 5.21 0.00 0.46 -0.74 121.76 129.45 1k4c s ALA 196 Ca -0.11 -0.88 -0.03 0.00 0.00 0.00 0.00 51.96 50.94 1k4c s ALA 196 Cb -0.15 -1.33 0.01 0.00 0.00 0.00 0.00 23.12 21.65 1k4c s ALA 196 CO 0.05 0.20 -0.07 0.99 0.00 0.00 0.00 175.76 176.94 1k4c s THR 197 N 0.41 3.03 0.02 0.00 2.01 0.04 -0.39 115.64 120.77 1k4c s THR 197 Ca -0.08 -0.76 0.01 0.00 0.31 0.00 0.00 61.69 61.17 1k4c s THR 197 Cb -0.15 -2.44 -0.02 0.00 0.01 0.00 0.00 72.50 69.90 1k4c s THR 197 CO 0.04 0.34 -0.05 -2.28 -0.69 0.00 0.00 174.62 171.99 1k4c s HIS 198 N 1.40 0.42 0.48 4.92 2.46 -1.26 -2.00 115.29 121.71 1k4c s HIS 198 Ca 0.04 -0.43 0.36 0.00 0.47 0.00 0.00 55.06 55.50 1k4c s HIS 198 Cb -0.15 -0.27 1.52 0.00 -0.13 0.00 0.00 32.58 33.55 1k4c s HIS 198 CO -0.05 -0.11 1.64 -0.22 -2.47 0.00 0.00 174.74 173.53 1k4c h LYS 199 N 4.85 0.06 0.00 2.88 3.64 -1.94 0.37 116.57 126.43 1k4c h LYS 199 Ca -0.32 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1k4c h LYS 199 Cb 1.21 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 1k4c h LYS 199 CO 0.43 0.04 0.00 0.25 -2.27 0.00 0.00 179.45 177.90 1k4c n THR 200 N -4.41 1.24 -3.70 1.00 -2.24 -1.26 -4.72 114.28 100.19 1k4c n THR 200 Ca 0.37 0.31 -0.13 0.00 -2.27 0.00 0.00 64.05 62.33 1k4c n THR 200 Cb 1.54 -1.17 -0.09 0.00 -2.10 0.00 0.00 70.33 68.51 1k4c n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1k4c s SER 201 N -2.86 -0.54 0.42 3.42 0.15 0.12 -4.98 113.70 109.43 1k4c s SER 201 Ca 0.05 1.02 0.22 0.00 0.70 0.00 0.00 55.95 57.95 1k4c s SER 201 Cb 0.05 1.02 0.85 0.00 -1.71 0.00 0.00 66.02 66.23 1k4c s SER 201 CO 0.14 -0.18 1.80 0.71 1.20 0.00 0.00 173.24 176.91 1k4c h THR 202 N 4.51 0.65 -3.42 6.45 1.35 -1.84 -3.40 112.91 117.20 1k4c h THR 202 Ca -0.29 -1.23 -0.68 0.00 -0.55 0.00 0.00 66.41 63.67 1k4c h THR 202 Cb 1.18 1.81 -0.15 0.00 -1.73 0.00 0.00 68.15 69.25 1k4c h THR 202 CO 0.20 0.26 -0.65 -0.44 -0.25 0.00 0.00 175.52 174.64 1k4c s SER 203 N -6.27 5.05 0.69 5.36 0.01 -1.26 -5.06 113.70 112.21 1k4c s SER 203 Ca 0.00 0.05 -0.15 0.00 1.31 0.00 0.00 55.95 57.16 1k4c s SER 203 Cb 0.10 -1.35 0.02 0.00 0.21 0.00 0.00 66.02 65.00 1k4c s SER 203 CO 0.65 0.34 1.15 -2.16 0.41 0.00 0.00 173.24 173.63 1k4c s PRO 204 N -1.12 2.53 -0.28 12.44 0.04 -1.26 -4.84 135.00 142.50 1k4c s PRO 204 Ca 0.15 1.55 -0.11 0.00 0.04 0.00 0.00 61.00 62.64 1k4c s PRO 204 Cb -0.11 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 1k4c s PRO 204 CO 0.05 -1.49 0.18 0.42 0.04 0.00 0.00 177.00 176.19 1k4c s ILE 205 N -2.17 5.16 0.02 0.56 1.01 0.47 -4.89 121.20 121.36 1k4c s ILE 205 Ca 0.70 0.09 0.08 0.00 0.00 0.00 0.00 60.65 61.51 1k4c s ILE 205 Cb -0.24 -3.47 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 1k4c s ILE 205 CO 0.43 0.24 -0.22 0.68 0.00 0.00 0.00 174.94 176.07 1k4c s VAL 206 N 1.73 2.45 -0.02 2.92 -7.23 -1.26 -0.41 120.40 118.58 1k4c s VAL 206 Ca 0.07 -1.18 0.02 0.00 -1.81 0.00 0.00 61.98 59.07 1k4c s VAL 206 Cb -0.16 -1.96 0.01 0.00 0.56 0.00 0.00 36.38 34.83 1k4c s VAL 206 CO 0.10 0.43 -0.06 -0.54 -0.31 0.00 0.00 175.10 174.72 1k4c s LYS 207 N -1.11 0.70 0.28 4.82 -0.14 -0.72 -5.01 119.74 118.56 1k4c s LYS 207 Ca 0.12 -0.19 0.03 0.00 -1.36 0.00 0.00 55.97 54.57 1k4c s LYS 207 Cb -0.10 -0.69 -0.03 0.00 -1.68 0.00 0.00 37.83 35.33 1k4c s LYS 207 CO 0.02 0.04 0.25 -1.12 -0.76 0.00 0.00 175.35 173.78 1k4c s SER 208 N 0.34 0.99 -0.20 2.83 0.01 -1.26 -1.24 113.70 115.17 1k4c s SER 208 Ca -0.04 -1.57 -0.28 0.00 1.31 0.00 0.00 55.95 55.36 1k4c s SER 208 Cb -0.08 0.50 0.12 0.00 0.21 0.00 0.00 66.02 66.77 1k4c s SER 208 CO 0.00 -1.00 1.00 0.72 0.41 0.00 0.00 173.24 174.36 1k4c s PHE 209 N -3.70 -0.42 -0.10 2.43 -0.12 -1.02 -5.01 117.98 110.06 1k4c s PHE 209 Ca 0.39 0.83 -0.05 0.00 -0.05 0.00 0.00 56.93 58.05 1k4c s PHE 209 Cb 0.04 0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 1k4c s PHE 209 CO 0.21 -0.32 0.09 -0.80 -0.05 0.00 0.00 175.22 174.35 1k4c s ASN 210 N -0.66 5.97 0.66 1.98 -0.87 -1.26 -1.95 114.94 118.81 1k4c s ASN 210 Ca -0.01 0.34 0.41 0.00 -1.57 0.00 0.00 52.86 52.04 1k4c s ASN 210 Cb -0.02 -1.85 2.25 0.00 -0.02 0.00 0.00 41.25 41.61 1k4c s ASN 210 CO -0.01 0.39 2.29 -0.09 -2.57 0.00 0.00 177.10 177.11 1k4c h ARG 211 N 4.97 0.00 -0.02 -0.60 2.43 -1.35 -3.49 114.38 116.32 1k4c h ARG 211 Ca -0.53 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1k4c h ARG 211 Cb 1.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 1k4c h ARG 211 CO 0.57 0.00 0.00 0.09 -1.51 0.00 0.00 179.97 179.12