#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kj6 s VAL 2 N 0.00 4.77 -0.19 2.62 1.01 -1.26 -3.94 120.40 123.41 3kj6 s VAL 2 Ca 0.00 1.74 -0.29 0.00 0.00 0.00 0.00 61.98 63.43 3kj6 s VAL 2 Cb 0.00 -4.17 0.12 0.00 0.00 0.00 0.00 36.38 32.33 3kj6 s VAL 2 CO 0.00 0.31 0.98 0.00 0.00 0.00 0.00 175.10 176.39 3kj6 s GLN 3 N 0.27 0.61 -0.28 2.72 -2.07 -1.15 -4.97 119.66 114.79 3kj6 s GLN 3 Ca 0.42 0.28 0.02 0.00 -1.82 0.00 0.00 55.36 54.25 3kj6 s GLN 3 Cb -0.21 0.29 0.06 0.00 -1.09 0.00 0.00 33.01 32.06 3kj6 s GLN 3 CO 0.24 -0.16 -0.07 -0.51 -1.32 0.00 0.00 175.29 173.47 3kj6 s LEU 4 N -0.75 3.65 0.35 2.60 1.02 -1.26 -0.93 118.68 123.36 3kj6 s LEU 4 Ca -0.01 -1.40 -0.25 0.00 0.02 0.00 0.00 54.13 52.49 3kj6 s LEU 4 Cb -0.02 -1.60 -0.10 0.00 0.02 0.00 0.00 46.19 44.49 3kj6 s LEU 4 CO 0.00 -0.22 0.95 -1.10 0.02 0.00 0.00 176.35 176.00 3kj6 s GLN 5 N 1.14 4.50 0.15 1.70 -0.21 -0.25 -2.63 119.66 124.06 3kj6 s GLN 5 Ca -0.07 1.29 -0.03 0.00 0.02 0.00 0.00 55.36 56.57 3kj6 s GLN 5 Cb -0.20 -2.66 -0.03 0.00 1.00 0.00 0.00 33.01 31.11 3kj6 s GLN 5 CO -0.04 0.21 0.12 -0.65 -2.12 0.00 0.00 175.29 172.81 3kj6 s GLN 6 N -2.30 1.03 0.20 2.91 -0.21 -1.26 -0.80 119.66 119.24 3kj6 s GLN 6 Ca 0.53 -1.41 -0.08 0.00 0.02 0.00 0.00 55.36 54.41 3kj6 s GLN 6 Cb -0.17 0.28 0.13 0.00 1.00 0.00 0.00 33.01 34.26 3kj6 s GLN 6 CO 0.22 -0.32 1.75 0.77 -2.12 0.00 0.00 175.29 175.58 3kj6 h SER 7 N 2.75 1.06 0.00 5.90 0.02 -1.82 -3.47 113.55 117.99 3kj6 h SER 7 Ca -0.34 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 3kj6 h SER 7 Cb 1.21 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.48 3kj6 h SER 7 CO 0.55 0.97 0.00 0.61 -1.14 0.00 0.00 176.83 177.82 3kj6 n GLY 8 N -0.81 2.13 2.92 -3.77 0.00 -1.18 -4.91 105.19 99.56 3kj6 n GLY 8 Ca 0.06 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.51 3kj6 n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kj6 s ALA 9 N -0.35 -0.26 -0.04 4.61 0.00 -1.26 0.03 121.76 124.47 3kj6 s ALA 9 Ca 0.00 0.68 -0.02 0.00 0.00 0.00 0.00 51.96 52.62 3kj6 s ALA 9 Cb 0.00 -0.54 0.03 0.00 0.00 0.00 0.00 23.12 22.61 3kj6 s ALA 9 CO 0.00 -0.24 0.06 -2.00 0.00 0.00 0.00 175.76 173.57 3kj6 s GLU 10 N 1.41 -0.04 -0.14 0.00 2.56 -0.92 -4.74 118.70 116.83 3kj6 s GLU 10 Ca -0.07 0.36 -0.04 0.00 0.00 0.00 0.00 54.97 55.23 3kj6 s GLU 10 Cb -0.12 -0.54 -0.03 0.00 2.00 0.00 0.00 34.13 35.44 3kj6 s GLU 10 CO -0.06 -0.33 -0.02 -1.17 -0.56 0.00 0.00 175.26 173.12 3kj6 s LEU 11 N 2.16 3.37 -0.18 2.70 1.98 -1.26 -1.07 118.68 126.37 3kj6 s LEU 11 Ca 0.05 -0.05 -0.12 0.00 -2.89 0.00 0.00 54.13 51.12 3kj6 s LEU 11 Cb -0.12 -1.81 0.06 0.00 0.66 0.00 0.00 46.19 44.98 3kj6 s LEU 11 CO -0.03 0.22 0.45 0.00 -1.89 0.00 0.00 176.35 175.10 3kj6 s ALA 12 N 0.09 -1.16 0.84 5.97 0.00 -1.05 -4.99 121.76 121.45 3kj6 s ALA 12 Ca 0.01 1.54 -0.11 0.00 0.00 0.00 0.00 51.96 53.40 3kj6 s ALA 12 Cb -0.13 -0.92 0.10 0.00 0.00 0.00 0.00 23.12 22.16 3kj6 s ALA 12 CO 0.02 -0.26 1.13 1.03 0.00 0.00 0.00 175.76 177.68 3kj6 s ARG 13 N 1.06 1.63 0.37 0.00 0.52 -1.25 -1.76 118.95 119.52 3kj6 s ARG 13 Ca -0.07 1.41 -0.27 0.00 -0.52 0.00 0.00 55.73 56.28 3kj6 s ARG 13 Cb -0.06 -1.81 -0.09 0.00 0.52 0.00 0.00 34.95 33.50 3kj6 s ARG 13 CO -0.09 -2.15 1.29 -1.25 0.02 0.00 0.00 175.30 173.12 3kj6 s PRO 14 N -4.68 4.16 0.00 3.54 0.04 -1.26 -2.71 135.00 134.09 3kj6 s PRO 14 Ca 0.65 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.84 3kj6 s PRO 14 Cb -0.21 -2.90 0.00 0.00 0.04 0.00 0.00 34.50 31.43 3kj6 s PRO 14 CO 0.56 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.68 3kj6 n GLY 15 N 0.73 1.59 0.00 0.56 0.00 -0.49 -4.98 105.19 102.60 3kj6 n GLY 15 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3kj6 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kj6 n ALA 16 N -0.33 0.00 -3.08 4.61 0.00 -1.10 -4.48 120.51 116.13 3kj6 n ALA 16 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 3kj6 n ALA 16 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 3kj6 n ALA 16 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3kj6 s SER 17 N -1.00 -0.04 0.11 0.00 0.15 -1.26 -1.20 113.70 110.47 3kj6 s SER 17 Ca 0.00 -0.03 0.07 0.00 0.70 0.00 0.00 55.95 56.69 3kj6 s SER 17 Cb 0.00 0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 64.52 3kj6 s SER 17 CO 0.00 -0.26 -0.17 0.68 1.20 0.00 0.00 173.24 174.69 3kj6 s VAL 18 N -0.89 1.50 -0.42 4.45 -7.23 -0.84 -5.03 120.40 111.95 3kj6 s VAL 18 Ca -0.10 -1.61 0.02 0.00 -1.81 0.00 0.00 61.98 58.49 3kj6 s VAL 18 Cb -0.05 -1.50 0.12 0.00 0.56 0.00 0.00 36.38 35.51 3kj6 s VAL 18 CO 0.01 -0.24 0.19 -0.75 -0.31 0.00 0.00 175.10 174.00 3kj6 s LYS 19 N -2.25 1.41 0.01 4.82 2.20 -1.26 -1.60 119.74 123.07 3kj6 s LYS 19 Ca 0.07 -1.99 -0.30 0.00 -0.36 0.00 0.00 55.97 53.39 3kj6 s LYS 19 Cb -0.08 -2.70 -0.03 0.00 -1.51 0.00 0.00 37.83 33.51 3kj6 s LYS 19 CO 0.04 -1.08 0.98 -0.51 -0.36 0.00 0.00 175.35 174.42 3kj6 s LEU 20 N 0.49 4.38 0.25 5.43 1.02 -0.90 -4.81 118.68 124.54 3kj6 s LEU 20 Ca 0.15 1.68 0.08 0.00 0.02 0.00 0.00 54.13 56.06 3kj6 s LEU 20 Cb -0.23 -3.57 -0.04 0.00 0.02 0.00 0.00 46.19 42.37 3kj6 s LEU 20 CO -0.05 -0.24 0.09 -0.94 0.02 0.00 0.00 176.35 175.22 3kj6 s SER 21 N 0.92 5.02 -0.25 2.29 1.04 -1.26 0.24 113.70 121.69 3kj6 s SER 21 Ca 0.52 -0.44 -0.03 0.00 0.48 0.00 0.00 55.95 56.48 3kj6 s SER 21 Cb -0.21 -1.12 0.11 0.00 0.10 0.00 0.00 66.02 64.90 3kj6 s SER 21 CO 0.28 -0.01 0.24 0.00 0.98 0.00 0.00 173.24 174.74 3kj6 s LYS 23 N 2.32 3.17 0.18 0.00 2.20 0.02 -1.65 119.74 125.98 3kj6 s LYS 23 Ca 0.08 -1.54 -0.25 0.00 -0.36 0.00 0.00 55.97 53.90 3kj6 s LYS 23 Cb -0.15 -4.36 -0.08 0.00 -1.51 0.00 0.00 37.83 31.73 3kj6 s LYS 23 CO -0.23 -1.52 0.78 0.00 -0.36 0.00 0.00 175.35 174.02 3kj6 s ALA 24 N 2.30 3.43 -0.30 3.13 0.00 -1.04 -1.09 121.76 128.20 3kj6 s ALA 24 Ca 0.14 0.35 -0.04 0.00 0.00 0.00 0.00 51.96 52.41 3kj6 s ALA 24 Cb -0.21 -2.96 0.19 0.00 0.00 0.00 0.00 23.12 20.14 3kj6 s ALA 24 CO 0.02 0.29 0.72 -1.54 0.00 0.00 0.00 175.76 175.26 3kj6 s SER 25 N -1.23 -1.13 0.00 0.00 1.04 -0.11 -4.78 113.70 107.50 3kj6 s SER 25 Ca 0.37 0.72 0.00 0.00 0.48 0.00 0.00 55.95 57.53 3kj6 s SER 25 Cb -0.22 1.96 0.00 0.00 0.10 0.00 0.00 66.02 67.85 3kj6 s SER 25 CO 0.26 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.88 3kj6 n GLY 26 N 5.44 -0.37 3.53 7.32 0.00 -1.25 -2.94 105.19 116.92 3kj6 n GLY 26 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.95 3kj6 n GLY 26 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3kj6 n TYR 27 N 0.00 -1.51 -2.86 1.61 4.11 -1.26 -4.46 117.16 112.80 3kj6 n TYR 27 Ca 0.00 -1.29 -0.43 0.00 -0.00 0.00 0.00 57.90 56.18 3kj6 n TYR 27 Cb 0.00 0.63 -0.04 0.00 -0.00 0.00 0.00 39.34 39.93 3kj6 n TYR 27 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.86 177.28 3kj6 s ILE 28 N -2.12 4.44 0.29 -3.48 1.01 -1.26 -4.92 121.20 115.17 3kj6 s ILE 28 Ca 0.20 0.35 0.01 0.00 0.00 0.00 0.00 60.65 61.20 3kj6 s ILE 28 Cb -0.03 -4.49 0.36 0.00 0.01 0.00 0.00 42.46 38.30 3kj6 s ILE 28 CO 0.06 -1.02 1.61 0.15 0.00 0.00 0.00 174.94 175.74 3kj6 h PHE 29 N 9.23 0.09 -0.34 3.97 3.57 -1.95 -0.41 116.94 131.10 3kj6 h PHE 29 Ca -0.26 0.06 -0.21 0.00 3.53 0.00 0.00 57.97 61.09 3kj6 h PHE 29 Cb 1.08 0.11 -0.10 0.00 2.79 0.00 0.00 35.95 39.82 3kj6 h PHE 29 CO 0.89 -0.34 0.27 -2.37 -2.23 0.00 0.00 178.31 174.53 3kj6 n THR 30 N -5.38 2.21 0.02 4.41 5.66 -1.26 -3.39 114.28 116.55 3kj6 n THR 30 Ca 0.21 -1.04 0.00 0.00 -3.05 0.00 0.00 64.05 60.18 3kj6 n THR 30 Cb 0.70 -1.13 -0.01 0.00 -1.55 0.00 0.00 70.33 68.34 3kj6 n THR 30 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 3kj6 n ASP 31 N 0.34 1.89 -4.02 1.09 9.92 -0.16 -4.61 116.55 121.00 3kj6 n ASP 31 Ca 0.21 -0.32 -0.18 0.00 -0.53 0.00 0.00 54.79 53.97 3kj6 n ASP 31 Cb 0.71 1.02 -0.15 0.00 -0.64 0.00 0.00 41.12 42.06 3kj6 n ASP 31 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 3kj6 s TYR 32 N -1.46 0.79 0.69 1.24 2.02 -1.22 -5.12 117.35 114.30 3kj6 s TYR 32 Ca 0.00 -0.15 -0.17 0.00 -0.37 0.00 0.00 57.07 56.38 3kj6 s TYR 32 Cb 0.01 -0.51 0.01 0.00 -0.40 0.00 0.00 41.96 41.06 3kj6 s TYR 32 CO 0.03 -0.02 1.26 0.66 -1.57 0.00 0.00 175.55 175.92 3kj6 n TYR 33 N 2.87 1.73 -4.95 2.71 4.02 -1.26 -4.45 117.16 117.83 3kj6 n TYR 33 Ca -0.13 0.42 -0.32 0.00 -0.01 0.00 0.00 57.90 57.85 3kj6 n TYR 33 Cb 0.57 -2.22 -0.16 0.00 -0.02 0.00 0.00 39.34 37.50 3kj6 n TYR 33 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 3kj6 s ILE 34 N -1.57 2.36 0.05 -0.72 -4.36 -0.73 -3.05 121.20 113.18 3kj6 s ILE 34 Ca 0.80 -0.90 0.02 0.00 -0.26 0.00 0.00 60.65 60.32 3kj6 s ILE 34 Cb -0.36 -1.94 -0.04 0.00 1.25 0.00 0.00 42.46 41.37 3kj6 s ILE 34 CO 0.43 0.54 0.04 0.20 0.24 0.00 0.00 174.94 176.40 3kj6 s ASN 35 N 0.48 5.35 -0.23 4.36 0.02 -0.30 -2.46 114.94 122.15 3kj6 s ASN 35 Ca -0.14 -0.02 -0.05 0.00 -1.02 0.00 0.00 52.86 51.64 3kj6 s ASN 35 Cb -0.17 -1.41 -0.01 0.00 0.02 0.00 0.00 41.25 39.68 3kj6 s ASN 35 CO 0.05 0.22 -0.01 0.26 0.02 0.00 0.00 177.10 177.64 3kj6 s TRP 36 N -1.27 3.00 -0.05 2.20 0.52 -0.84 -0.59 118.94 121.91 3kj6 s TRP 36 Ca 0.25 -0.88 0.05 0.00 0.02 0.00 0.00 56.10 55.54 3kj6 s TRP 36 Cb -0.12 -2.14 -0.02 0.00 -1.15 0.00 0.00 33.47 30.04 3kj6 s TRP 36 CO 0.17 -0.53 -0.19 0.08 0.02 0.00 0.00 176.95 176.51 3kj6 s VAL 37 N 1.50 2.64 -0.19 4.03 1.01 -0.49 -0.75 120.40 128.13 3kj6 s VAL 37 Ca 0.05 -0.87 -0.08 0.00 0.00 0.00 0.00 61.98 61.08 3kj6 s VAL 37 Cb -0.15 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 3kj6 s VAL 37 CO -0.02 0.58 0.08 -0.60 0.00 0.00 0.00 175.10 175.14 3kj6 s ARG 38 N -0.49 3.97 -0.30 2.72 3.52 -0.61 0.29 118.95 128.05 3kj6 s ARG 38 Ca 0.06 -0.34 0.01 0.00 -0.13 0.00 0.00 55.73 55.33 3kj6 s ARG 38 Cb -0.12 -3.27 0.09 0.00 -1.56 0.00 0.00 34.95 30.10 3kj6 s ARG 38 CO 0.01 0.21 0.06 -1.14 -0.81 0.00 0.00 175.30 173.63 3kj6 s GLN 39 N 0.55 1.10 0.84 5.12 0.74 -0.02 -0.15 119.66 127.83 3kj6 s GLN 39 Ca 0.04 -1.29 -0.11 0.00 0.05 0.00 0.00 55.36 54.05 3kj6 s GLN 39 Cb -0.13 -2.48 0.10 0.00 1.10 0.00 0.00 33.01 31.61 3kj6 s GLN 39 CO 0.01 -0.90 1.14 0.50 -0.55 0.00 0.00 175.29 175.49 3kj6 s ARG 40 N 1.36 1.58 -0.28 1.67 3.52 -1.25 -1.61 118.95 123.94 3kj6 s ARG 40 Ca 0.07 1.46 -0.39 0.00 -0.13 0.00 0.00 55.73 56.74 3kj6 s ARG 40 Cb -0.18 -1.80 -0.15 0.00 -1.56 0.00 0.00 34.95 31.26 3kj6 s ARG 40 CO -0.16 -2.20 1.80 -2.37 -0.81 0.00 0.00 175.30 171.56 3kj6 n THR 41 N -3.78 0.32 -1.75 4.11 5.66 -1.26 -0.98 114.28 116.60 3kj6 n THR 41 Ca 0.11 -0.07 -0.19 0.00 -3.05 0.00 0.00 64.05 60.85 3kj6 n THR 41 Cb 0.52 -1.30 -0.06 0.00 -1.55 0.00 0.00 70.33 67.94 3kj6 n THR 41 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3kj6 n GLY 42 N 4.46 1.23 3.62 1.09 0.00 -1.26 -4.96 105.19 109.38 3kj6 n GLY 42 Ca 0.28 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.02 3kj6 n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3kj6 s GLN 43 N -3.92 1.97 0.00 1.61 -0.21 -0.15 -5.15 119.66 113.80 3kj6 s GLN 43 Ca 0.00 -2.12 0.00 0.00 0.02 0.00 0.00 55.36 53.26 3kj6 s GLN 43 Cb 0.00 -1.61 0.00 0.00 1.00 0.00 0.00 33.01 32.40 3kj6 s GLN 43 CO 0.00 -0.08 0.00 0.41 -2.12 0.00 0.00 175.29 173.50 3kj6 n GLY 44 N -0.98 -2.52 3.87 3.09 0.00 -1.26 -4.41 105.19 102.98 3kj6 n GLY 44 Ca -0.06 -1.42 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 3kj6 n GLY 44 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3kj6 s PHE 45 N -0.84 3.42 -0.14 1.61 0.08 -1.26 -3.92 117.98 116.92 3kj6 s PHE 45 Ca 0.00 0.20 -0.03 0.00 0.12 0.00 0.00 56.93 57.22 3kj6 s PHE 45 Cb 0.00 -1.72 0.05 0.00 -0.57 0.00 0.00 43.02 40.78 3kj6 s PHE 45 CO 0.00 0.57 0.04 -1.83 -0.10 0.00 0.00 175.22 173.90 3kj6 s GLU 46 N -2.46 0.44 0.13 0.44 -1.05 0.78 -4.98 118.70 112.01 3kj6 s GLU 46 Ca 0.33 -0.11 -0.33 0.00 -0.15 0.00 0.00 54.97 54.71 3kj6 s GLU 46 Cb -0.13 -1.54 -0.13 0.00 -0.44 0.00 0.00 34.13 31.89 3kj6 s GLU 46 CO 0.26 -0.51 1.66 1.87 0.95 0.00 0.00 175.26 179.48 3kj6 n TRP 47 N 5.15 2.37 -0.11 4.83 -0.00 -1.26 -1.57 117.44 126.85 3kj6 n TRP 47 Ca -0.07 0.17 -0.24 0.00 -0.00 0.00 0.00 57.50 57.35 3kj6 n TRP 47 Cb 0.49 -2.59 -0.11 0.00 -0.00 0.00 0.00 31.31 29.09 3kj6 n TRP 47 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 3kj6 n ILE 48 N 3.81 1.56 -3.60 5.87 5.41 0.07 -4.67 119.36 127.80 3kj6 n ILE 48 Ca 0.18 -0.36 0.01 0.00 1.00 0.00 0.00 62.75 63.58 3kj6 n ILE 48 Cb 0.30 -1.82 -0.01 0.00 -0.71 0.00 0.00 39.64 37.40 3kj6 n ILE 48 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 3kj6 s GLY 49 N -5.52 -0.40 -0.27 7.39 0.00 -1.21 -1.17 107.32 106.14 3kj6 s GLY 49 Ca -0.33 0.96 -0.04 0.00 0.00 0.00 0.00 44.72 45.31 3kj6 s GLY 49 CO 0.58 0.23 0.12 1.85 0.00 0.00 0.00 173.10 175.87 3kj6 s GLU 50 N -2.32 0.21 -0.14 2.90 2.12 -0.32 -1.98 118.70 119.17 3kj6 s GLU 50 Ca 0.13 -0.50 -0.14 0.00 0.36 0.00 0.00 54.97 54.83 3kj6 s GLU 50 Cb 0.04 -1.34 -0.05 0.00 0.26 0.00 0.00 34.13 33.05 3kj6 s GLU 50 CO -0.04 -0.96 0.30 -1.50 -0.54 0.00 0.00 175.26 172.52 3kj6 s ILE 51 N 2.07 5.29 -0.46 -3.70 -1.16 -1.03 -2.33 121.20 119.88 3kj6 s ILE 51 Ca 0.08 0.57 -0.16 0.00 -0.51 0.00 0.00 60.65 60.63 3kj6 s ILE 51 Cb -0.16 -3.63 0.06 0.00 0.61 0.00 0.00 42.46 39.34 3kj6 s ILE 51 CO -0.31 0.42 0.39 -0.47 -2.81 0.00 0.00 174.94 172.15 3kj6 s TYR 52 N 0.24 3.23 0.23 3.50 5.04 -0.67 -1.78 117.35 127.14 3kj6 s TYR 52 Ca 0.17 -0.80 -0.06 0.00 -2.44 0.00 0.00 57.07 53.94 3kj6 s TYR 52 Cb -0.13 -3.05 0.37 0.00 0.35 0.00 0.00 41.96 39.51 3kj6 s TYR 52 CO 0.05 -0.76 1.75 -1.00 -1.34 0.00 0.00 175.55 174.25 3kj6 h PRO 53 N 8.74 0.49 0.20 4.97 0.13 -1.88 -1.53 132.00 143.13 3kj6 h PRO 53 Ca -0.28 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3kj6 h PRO 53 Cb 1.11 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.11 3kj6 h PRO 53 CO 0.85 0.33 -0.31 0.78 -0.23 0.00 0.00 178.00 179.41 3kj6 h GLY 54 N 0.51 -1.11 0.00 1.56 0.00 -1.87 -3.39 103.07 98.77 3kj6 h GLY 54 Ca 0.37 0.53 0.00 0.00 0.00 0.00 0.00 47.33 48.23 3kj6 h GLY 54 CO -0.33 -0.34 0.00 -1.26 0.00 0.00 0.00 176.54 174.61 3kj6 n SER 55 N -4.25 0.00 0.00 0.19 2.88 -1.17 -5.03 113.62 106.24 3kj6 n SER 55 Ca -0.06 0.05 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 3kj6 n SER 55 Cb 0.27 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.73 3kj6 n SER 55 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3kj6 n GLY 56 N 2.19 -0.03 3.54 0.46 0.00 -0.58 -5.07 105.19 105.69 3kj6 n GLY 56 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.54 3kj6 n GLY 56 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3kj6 n ASN 57 N 0.00 2.71 -4.31 1.61 4.13 -1.26 -4.71 115.26 113.43 3kj6 n ASN 57 Ca 0.00 0.45 -0.34 0.00 1.68 0.00 0.00 54.58 56.37 3kj6 n ASN 57 Cb 0.00 -1.37 -0.14 0.00 -1.54 0.00 0.00 39.78 36.73 3kj6 n ASN 57 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3kj6 s ILE 58 N 7.05 3.17 -0.28 2.41 1.01 -1.26 -1.67 121.20 131.62 3kj6 s ILE 58 Ca 1.04 -0.58 -0.01 0.00 0.00 0.00 0.00 60.65 61.10 3kj6 s ILE 58 Cb -0.67 -2.40 0.04 0.00 0.01 0.00 0.00 42.46 39.44 3kj6 s ILE 58 CO 0.45 0.46 -0.03 -1.81 0.00 0.00 0.00 174.94 174.02 3kj6 s ASP 59 N 1.15 4.65 0.44 3.58 1.01 -0.98 -4.96 116.67 121.55 3kj6 s ASP 59 Ca 0.01 -1.14 -0.01 0.00 0.71 0.00 0.00 52.55 52.12 3kj6 s ASP 59 Cb -0.14 -1.68 -0.02 0.00 1.01 0.00 0.00 42.92 42.09 3kj6 s ASP 59 CO -0.02 -0.21 0.68 -0.31 0.21 0.00 0.00 175.17 175.52 3kj6 s TYR 60 N 1.26 3.39 -0.07 4.23 1.51 -1.26 -1.17 117.35 125.24 3kj6 s TYR 60 Ca -0.04 0.44 -0.25 0.00 -1.01 0.00 0.00 57.07 56.22 3kj6 s TYR 60 Cb -0.19 -2.22 -0.03 0.00 -0.11 0.00 0.00 41.96 39.42 3kj6 s TYR 60 CO -0.03 -0.23 0.76 1.21 -1.11 0.00 0.00 175.55 176.15 3kj6 s ASN 61 N -4.14 7.03 0.33 2.29 3.84 -0.32 -4.93 114.94 119.05 3kj6 s ASN 61 Ca 0.46 1.25 0.14 0.00 0.21 0.00 0.00 52.86 54.92 3kj6 s ASN 61 Cb -0.10 -2.44 1.08 0.00 -0.55 0.00 0.00 41.25 39.24 3kj6 s ASN 61 CO 0.40 -0.18 1.48 -0.62 -2.79 0.00 0.00 177.10 175.38 3kj6 n GLU 62 N 4.04 -0.06 -0.02 0.43 1.02 -1.26 -0.22 120.64 124.57 3kj6 n GLU 62 Ca 0.01 1.33 -0.09 0.00 -0.02 0.00 0.00 57.16 58.39 3kj6 n GLU 62 Cb 0.51 -2.30 -0.04 0.00 -0.02 0.00 0.00 31.44 29.59 3kj6 n GLU 62 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kj6 h ARG 63 N 0.00 -0.01 -0.57 3.49 3.08 -1.95 -2.30 114.38 116.13 3kj6 h ARG 63 Ca 0.72 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.77 3kj6 h ARG 63 Cb 1.79 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.84 3kj6 h ARG 63 CO -0.78 -0.00 0.00 1.19 -1.07 0.00 0.00 179.97 179.31 3kj6 n PHE 64 N -5.17 0.83 0.00 3.04 3.01 0.70 -4.65 117.46 115.21 3kj6 n PHE 64 Ca -0.04 -0.34 0.00 0.00 1.01 0.00 0.00 57.45 58.09 3kj6 n PHE 64 Cb 0.10 -0.14 0.00 0.00 -0.01 0.00 0.00 39.48 39.43 3kj6 n PHE 64 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 3kj6 n LYS 65 N 0.57 0.00 -0.21 -1.08 4.81 -0.56 -1.10 118.16 120.59 3kj6 n LYS 65 Ca 0.15 0.83 0.04 0.00 -0.87 0.00 0.00 58.31 58.45 3kj6 n LYS 65 Cb 0.54 -1.48 0.14 0.00 0.02 0.00 0.00 35.03 34.24 3kj6 n LYS 65 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 3kj6 n ASP 66 N -2.62 1.94 -0.04 3.14 3.85 -1.26 -4.24 116.55 117.32 3kj6 n ASP 66 Ca 0.00 -2.12 -0.04 0.00 -0.71 0.00 0.00 54.79 51.93 3kj6 n ASP 66 Cb 0.00 -0.31 -0.01 0.00 -1.35 0.00 0.00 41.12 39.44 3kj6 n ASP 66 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.20 177.36 3kj6 n LYS 67 N 0.30 0.22 -3.80 0.11 3.00 -0.57 -4.92 118.16 112.52 3kj6 n LYS 67 Ca 0.10 0.09 -0.32 0.00 -0.00 0.00 0.00 58.31 58.18 3kj6 n LYS 67 Cb 0.36 -0.90 -0.05 0.00 0.00 0.00 0.00 35.03 34.45 3kj6 n LYS 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3kj6 s ALA 68 N -2.96 3.89 -0.18 3.14 0.00 -0.26 -2.47 121.76 122.93 3kj6 s ALA 68 Ca -0.12 -0.68 -0.03 0.00 0.00 0.00 0.00 51.96 51.13 3kj6 s ALA 68 Cb 0.02 -1.99 0.06 0.00 0.00 0.00 0.00 23.12 21.20 3kj6 s ALA 68 CO 0.18 0.73 0.05 0.95 0.00 0.00 0.00 175.76 177.67 3kj6 s THR 69 N -1.51 0.35 0.64 0.00 -4.23 0.94 -4.77 115.64 107.06 3kj6 s THR 69 Ca 0.35 -0.40 -0.14 0.00 -1.18 0.00 0.00 61.69 60.32 3kj6 s THR 69 Cb -0.13 -0.87 -0.01 0.00 1.34 0.00 0.00 72.50 72.83 3kj6 s THR 69 CO 0.24 -0.20 1.06 -0.76 -0.54 0.00 0.00 174.62 174.42 3kj6 s LEU 70 N 1.94 3.34 -0.28 4.79 1.43 -1.26 -1.02 118.68 127.61 3kj6 s LEU 70 Ca 0.00 1.75 -0.19 0.00 -1.03 0.00 0.00 54.13 54.67 3kj6 s LEU 70 Cb -0.16 -4.52 0.11 0.00 0.03 0.00 0.00 46.19 41.64 3kj6 s LEU 70 CO -0.08 -1.33 0.85 0.28 0.23 0.00 0.00 176.35 176.31 3kj6 s THR 71 N -2.68 0.00 0.32 5.49 -1.32 -0.89 -4.92 115.64 111.64 3kj6 s THR 71 Ca 0.62 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 61.18 3kj6 s THR 71 Cb -0.15 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.79 3kj6 s THR 71 CO 0.44 0.00 0.07 0.00 -2.21 0.00 0.00 174.62 172.93 3kj6 s ALA 72 N 1.12 3.34 -0.36 11.08 0.00 -1.26 0.15 121.76 135.83 3kj6 s ALA 72 Ca -0.06 -1.82 -0.00 0.00 0.00 0.00 0.00 51.96 50.08 3kj6 s ALA 72 Cb -0.05 -0.65 0.12 0.00 0.00 0.00 0.00 23.12 22.55 3kj6 s ALA 72 CO -0.13 0.10 0.18 0.34 0.00 0.00 0.00 175.76 176.25 3kj6 s ASP 73 N -3.77 3.56 0.43 0.00 2.15 -0.77 -4.96 116.67 113.31 3kj6 s ASP 73 Ca 0.35 -2.06 0.22 0.00 0.43 0.00 0.00 52.55 51.50 3kj6 s ASP 73 Cb -0.03 -0.73 1.20 0.00 -0.30 0.00 0.00 42.92 43.06 3kj6 s ASP 73 CO 0.21 -0.34 1.80 0.11 -0.17 0.00 0.00 175.17 176.78 3kj6 h LYS 74 N 7.41 0.30 0.00 4.34 1.57 -1.89 0.62 116.57 128.91 3kj6 h LYS 74 Ca -0.05 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3kj6 h LYS 74 Cb 0.97 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.22 3kj6 h LYS 74 CO 0.41 0.20 0.00 0.45 -0.57 0.00 0.00 179.45 179.94 3kj6 n SER 75 N -4.51 0.00 0.03 0.86 2.88 -1.26 -3.76 113.62 107.86 3kj6 n SER 75 Ca 0.24 0.66 0.02 0.00 -1.33 0.00 0.00 58.87 58.46 3kj6 n SER 75 Cb 0.92 -0.45 0.12 0.00 -0.75 0.00 0.00 64.21 64.04 3kj6 n SER 75 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3kj6 n SER 76 N -1.86 0.10 -3.29 -3.46 7.64 -1.11 -4.81 113.62 106.83 3kj6 n SER 76 Ca 0.00 0.54 -0.24 0.00 1.01 0.00 0.00 58.87 60.19 3kj6 n SER 76 Cb 0.00 -0.56 0.02 0.00 -1.01 0.00 0.00 64.21 62.66 3kj6 n SER 76 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3kj6 n SER 77 N -1.63 -4.81 -4.19 6.43 7.64 0.19 -4.86 113.62 112.39 3kj6 n SER 77 Ca 0.00 -0.39 -0.24 0.00 1.01 0.00 0.00 58.87 59.25 3kj6 n SER 77 Cb 0.02 -3.92 -0.15 0.00 -1.01 0.00 0.00 64.21 59.16 3kj6 n SER 77 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3kj6 s THR 78 N -3.07 1.44 -0.03 0.44 -4.23 -1.22 -2.48 115.64 106.49 3kj6 s THR 78 Ca 0.39 -0.92 0.06 0.00 -1.18 0.00 0.00 61.69 60.04 3kj6 s THR 78 Cb -0.19 -1.22 -0.02 0.00 1.34 0.00 0.00 72.50 72.40 3kj6 s THR 78 CO 0.48 0.29 -0.20 0.00 -0.54 0.00 0.00 174.62 174.65 3kj6 s ALA 79 N -0.59 2.41 0.29 3.99 0.00 -0.66 -1.84 121.76 125.37 3kj6 s ALA 79 Ca 0.06 -1.05 0.09 0.00 0.00 0.00 0.00 51.96 51.05 3kj6 s ALA 79 Cb -0.08 -0.76 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 3kj6 s ALA 79 CO 0.00 0.54 0.09 0.71 0.00 0.00 0.00 175.76 177.10 3kj6 s TYR 80 N -0.68 2.76 -0.16 0.00 1.51 0.12 -0.64 117.35 120.26 3kj6 s TYR 80 Ca 0.11 -0.27 -0.01 0.00 -1.01 0.00 0.00 57.07 55.89 3kj6 s TYR 80 Cb -0.10 -1.41 0.04 0.00 -0.11 0.00 0.00 41.96 40.38 3kj6 s TYR 80 CO -0.00 0.49 -0.04 1.41 -1.11 0.00 0.00 175.55 176.30 3kj6 s MET 81 N -3.77 1.30 -0.34 -0.62 1.75 0.14 -2.09 119.30 115.66 3kj6 s MET 81 Ca 0.34 -0.46 -0.26 0.00 -1.25 0.00 0.00 55.69 54.06 3kj6 s MET 81 Cb -0.05 -1.94 0.01 0.00 2.84 0.00 0.00 34.83 35.69 3kj6 s MET 81 CO 0.22 -0.44 0.93 -1.14 -0.65 0.00 0.00 175.02 173.93 3kj6 s GLN 82 N 1.68 3.93 -0.23 4.11 2.00 -0.19 -2.11 119.66 128.84 3kj6 s GLN 82 Ca 0.01 0.71 -0.00 0.00 -2.00 0.00 0.00 55.36 54.08 3kj6 s GLN 82 Cb -0.15 -3.77 0.03 0.00 0.80 0.00 0.00 33.01 29.92 3kj6 s GLN 82 CO -0.07 -0.87 -0.10 -1.17 -0.50 0.00 0.00 175.29 172.58 3kj6 s LEU 83 N 3.39 2.94 0.22 3.68 2.96 -0.63 -0.04 118.68 131.19 3kj6 s LEU 83 Ca 0.39 -0.86 0.09 0.00 -0.22 0.00 0.00 54.13 53.52 3kj6 s LEU 83 Cb -0.13 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.92 3kj6 s LEU 83 CO 0.16 -0.10 -0.01 -0.44 -1.32 0.00 0.00 176.35 174.64 3kj6 s SER 84 N 1.29 4.58 -1.41 3.68 0.01 -1.03 -1.98 113.70 118.85 3kj6 s SER 84 Ca 0.00 -0.55 -0.11 0.00 1.31 0.00 0.00 55.95 56.61 3kj6 s SER 84 Cb -0.16 -0.89 0.01 0.00 0.21 0.00 0.00 66.02 65.19 3kj6 s SER 84 CO -0.07 0.05 0.31 -1.54 0.41 0.00 0.00 173.24 172.40 3kj6 n SER 85 N -0.49 -1.08 -4.56 2.44 3.41 -0.98 -4.86 113.62 107.50 3kj6 n SER 85 Ca -0.08 -1.22 -0.37 0.00 -0.26 0.00 0.00 58.87 56.93 3kj6 n SER 85 Cb 0.57 -1.98 0.06 0.00 -0.26 0.00 0.00 64.21 62.60 3kj6 n SER 85 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kj6 n LEU 86 N -4.67 2.66 -4.26 1.04 4.77 -0.34 -4.69 117.00 111.52 3kj6 n LEU 86 Ca -0.25 0.73 -0.14 0.00 -0.03 0.00 0.00 56.01 56.32 3kj6 n LEU 86 Cb 0.65 -1.32 -0.10 0.00 -2.33 0.00 0.00 43.42 40.32 3kj6 n LEU 86 CO 0.79 -2.34 -0.29 0.28 -1.33 0.00 0.00 177.39 174.51 3kj6 s THR 87 N -1.67 0.50 0.58 -5.08 -1.32 -1.26 -1.39 115.64 106.01 3kj6 s THR 87 Ca 0.73 -1.98 0.28 0.00 -1.21 0.00 0.00 61.69 59.51 3kj6 s THR 87 Cb -0.40 -2.36 0.36 0.00 -1.51 0.00 0.00 72.50 68.60 3kj6 s THR 87 CO 0.50 -0.24 2.06 0.28 -2.21 0.00 0.00 174.62 175.01 3kj6 h SER 88 N 2.58 0.00 -0.46 8.08 0.02 -1.96 0.71 113.55 122.53 3kj6 h SER 88 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 3kj6 h SER 88 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 3kj6 h SER 88 CO 0.61 0.00 0.00 -1.84 -1.14 0.00 0.00 176.83 174.46 3kj6 n GLU 89 N -3.86 2.18 0.01 3.45 0.28 -1.26 -3.64 120.64 117.80 3kj6 n GLU 89 Ca 0.03 -1.69 0.11 0.00 -0.16 0.00 0.00 57.16 55.46 3kj6 n GLU 89 Cb 0.40 -1.41 0.09 0.00 1.43 0.00 0.00 31.44 31.95 3kj6 n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3kj6 n ASP 90 N 0.82 0.66 -4.67 -1.84 8.00 0.24 -4.91 116.55 114.85 3kj6 n ASP 90 Ca 0.16 -0.39 -0.42 0.00 0.71 0.00 0.00 54.79 54.84 3kj6 n ASP 90 Cb 0.42 0.59 -0.03 0.00 -0.02 0.00 0.00 41.12 42.09 3kj6 n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3kj6 s SER 91 N -3.35 6.66 -0.04 -2.24 0.01 -1.24 -4.88 113.70 108.62 3kj6 s SER 91 Ca 0.08 2.30 -0.18 0.00 1.31 0.00 0.00 55.95 59.46 3kj6 s SER 91 Cb 0.16 -2.54 0.06 0.00 0.21 0.00 0.00 66.02 63.90 3kj6 s SER 91 CO 0.77 -0.90 0.80 0.00 0.41 0.00 0.00 173.24 174.32 3kj6 n ALA 92 N 6.59 -2.28 -2.61 1.44 0.00 -0.81 -4.66 120.51 118.17 3kj6 n ALA 92 Ca 0.17 -0.44 -0.40 0.00 0.00 0.00 0.00 53.44 52.77 3kj6 n ALA 92 Cb 0.42 0.02 -0.08 0.00 0.00 0.00 0.00 19.45 19.82 3kj6 n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3kj6 s VAL 93 N -2.02 5.08 -0.36 0.00 1.01 -0.63 -1.88 120.40 121.59 3kj6 s VAL 93 Ca 0.19 0.83 -0.12 0.00 0.00 0.00 0.00 61.98 62.88 3kj6 s VAL 93 Cb -0.00 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.57 3kj6 s VAL 93 CO -0.01 0.09 0.23 -0.31 0.00 0.00 0.00 175.10 175.10 3kj6 s TYR 94 N 2.28 3.23 0.08 5.22 1.51 -0.22 -0.84 117.35 128.61 3kj6 s TYR 94 Ca 0.20 -0.55 -0.09 0.00 -1.01 0.00 0.00 57.07 55.62 3kj6 s TYR 94 Cb -0.16 -2.48 -0.06 0.00 -0.11 0.00 0.00 41.96 39.16 3kj6 s TYR 94 CO 0.09 -0.51 0.39 -0.06 -1.11 0.00 0.00 175.55 174.36 3kj6 s PHE 95 N 1.65 3.56 -0.45 2.71 0.40 0.15 -2.25 117.98 123.75 3kj6 s PHE 95 Ca 0.05 0.74 -0.00 0.00 -0.60 0.00 0.00 56.93 57.11 3kj6 s PHE 95 Cb -0.18 -2.12 0.12 0.00 0.51 0.00 0.00 43.02 41.34 3kj6 s PHE 95 CO 0.09 0.51 0.22 0.00 0.70 0.00 0.00 175.22 176.73 3kj6 s VAL 97 N 0.67 5.02 -0.39 0.00 -7.23 0.24 -0.82 120.40 117.88 3kj6 s VAL 97 Ca 0.12 0.23 -0.03 0.00 -1.81 0.00 0.00 61.98 60.49 3kj6 s VAL 97 Cb -0.22 -3.65 0.13 0.00 0.56 0.00 0.00 36.38 33.20 3kj6 s VAL 97 CO -0.04 -0.11 2.46 -1.14 -0.31 0.00 0.00 175.10 175.96 3kj6 n ARG 98 N -0.31 2.15 -1.67 4.82 0.63 -0.08 -1.15 116.66 121.05 3kj6 n ARG 98 Ca -0.01 -2.01 0.00 0.00 -0.92 0.00 0.00 57.85 54.91 3kj6 n ARG 98 Cb 0.53 -1.92 0.00 0.00 0.45 0.00 0.00 32.46 31.51 3kj6 n ARG 98 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3kj6 n GLY 99 N 0.65 0.64 2.79 5.14 0.00 -1.17 -4.09 105.19 109.15 3kj6 n GLY 99 Ca 0.41 -0.42 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 3kj6 n GLY 99 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3kj6 n PHE 100 N -1.18 0.00 -0.10 1.61 3.72 -1.26 -4.78 117.46 115.46 3kj6 n PHE 100 Ca 0.00 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 3kj6 n PHE 100 Cb 0.38 -1.73 -0.06 0.00 -0.94 0.00 0.00 39.48 37.13 3kj6 n PHE 100 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3kj6 n GLY 101 N 0.16 -0.45 3.09 1.37 0.00 -1.26 -4.92 105.19 103.18 3kj6 n GLY 101 Ca -0.01 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.47 3kj6 n GLY 101 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3kj6 s TYR 102 N -2.65 3.23 0.28 1.61 5.04 -1.26 -4.99 117.35 118.61 3kj6 s TYR 102 Ca -0.31 -2.20 -0.28 0.00 -2.44 0.00 0.00 57.07 51.84 3kj6 s TYR 102 Cb 0.09 -1.95 -0.09 0.00 0.35 0.00 0.00 41.96 40.35 3kj6 s TYR 102 CO 0.42 -0.86 0.95 -1.58 -1.34 0.00 0.00 175.55 173.14 3kj6 s TRP 103 N 1.14 3.81 1.20 4.97 0.52 -1.26 -0.90 118.94 128.42 3kj6 s TRP 103 Ca -0.07 1.84 -0.20 0.00 0.02 0.00 0.00 56.10 57.69 3kj6 s TRP 103 Cb -0.19 -2.98 0.29 0.00 -1.15 0.00 0.00 33.47 29.44 3kj6 s TRP 103 CO -0.05 0.26 1.14 0.20 0.02 0.00 0.00 176.95 178.51 3kj6 s GLY 104 N -1.37 1.61 0.08 0.98 0.00 -0.00 -4.80 107.32 103.82 3kj6 s GLY 104 Ca 0.46 -1.05 -0.29 0.00 0.00 0.00 0.00 44.72 43.84 3kj6 s GLY 104 CO 0.29 -0.14 1.66 1.46 0.00 0.00 0.00 173.10 176.37 3kj6 h GLN 105 N -2.55 -0.54 0.00 2.90 4.20 -1.79 -3.45 115.11 113.88 3kj6 h GLN 105 Ca -0.44 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.31 3kj6 h GLN 105 Cb 1.28 0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.18 3kj6 h GLN 105 CO 0.32 -0.36 0.00 0.41 -0.67 0.00 0.00 178.83 178.53 3kj6 n GLY 106 N -1.35 3.01 3.28 3.46 0.00 -1.26 -5.04 105.19 107.29 3kj6 n GLY 106 Ca -0.10 -1.43 -0.34 0.00 0.00 0.00 0.00 46.02 44.15 3kj6 n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kj6 s THR 107 N -0.43 2.91 -1.06 2.61 2.01 -0.96 -3.13 115.64 117.60 3kj6 s THR 107 Ca 0.00 -0.67 -0.17 0.00 0.31 0.00 0.00 61.69 61.16 3kj6 s THR 107 Cb 0.00 -2.27 0.14 0.00 0.01 0.00 0.00 72.50 70.38 3kj6 s THR 107 CO 0.00 0.48 1.30 -0.89 -0.69 0.00 0.00 174.62 174.83 3kj6 s THR 108 N 1.07 4.74 0.27 -0.82 2.01 0.10 -1.06 115.64 121.97 3kj6 s THR 108 Ca -0.00 -1.93 -0.29 0.00 0.31 0.00 0.00 61.69 59.78 3kj6 s THR 108 Cb -0.15 -4.87 -0.09 0.00 0.01 0.00 0.00 72.50 67.40 3kj6 s THR 108 CO -0.03 -1.61 1.02 -0.22 -0.69 0.00 0.00 174.62 173.09 3kj6 s LEU 109 N 2.54 4.56 -0.16 4.42 2.96 -0.79 -2.17 118.68 130.04 3kj6 s LEU 109 Ca 0.39 2.09 -0.04 0.00 -0.22 0.00 0.00 54.13 56.34 3kj6 s LEU 109 Cb -0.03 -3.68 0.07 0.00 0.50 0.00 0.00 46.19 43.05 3kj6 s LEU 109 CO -0.05 -0.03 0.14 0.28 -1.32 0.00 0.00 176.35 175.38 3kj6 s THR 110 N -1.23 -0.20 -0.31 3.68 -1.32 -0.23 -1.92 115.64 114.11 3kj6 s THR 110 Ca 0.44 -0.02 -0.26 0.00 -1.21 0.00 0.00 61.69 60.64 3kj6 s THR 110 Cb -0.28 -0.53 0.01 0.00 -1.51 0.00 0.00 72.50 70.18 3kj6 s THR 110 CO 0.35 -0.15 0.92 -0.69 -2.21 0.00 0.00 174.62 172.84 3kj6 s VAL 111 N 2.23 4.67 -0.12 5.08 1.01 -1.26 -2.54 120.40 129.47 3kj6 s VAL 111 Ca 0.04 1.45 -0.29 0.00 0.00 0.00 0.00 61.98 63.18 3kj6 s VAL 111 Cb -0.15 -4.27 0.08 0.00 0.00 0.00 0.00 36.38 32.04 3kj6 s VAL 111 CO -0.09 -0.34 0.75 -0.55 0.00 0.00 0.00 175.10 174.86 3kj6 s SER 112 N 1.61 -0.63 0.00 3.32 0.15 -0.72 -4.73 113.70 112.70 3kj6 s SER 112 Ca 0.38 0.84 0.31 0.00 0.70 0.00 0.00 55.95 58.19 3kj6 s SER 112 Cb -0.13 0.73 1.67 0.00 -1.71 0.00 0.00 66.02 66.58 3kj6 s SER 112 CO 0.13 -0.48 2.11 -1.20 1.20 0.00 0.00 173.24 175.01 3kj6 n SER 113 N 1.34 0.14 -4.79 5.45 7.64 -1.26 -3.74 113.62 118.40 3kj6 n SER 113 Ca -0.16 -0.72 -0.35 0.00 1.01 0.00 0.00 58.87 58.64 3kj6 n SER 113 Cb 0.57 -0.09 -0.02 0.00 -1.01 0.00 0.00 64.21 63.65 3kj6 n SER 113 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kj6 s ALA 114 N -2.22 2.83 0.32 -0.43 0.00 -1.26 -5.05 121.76 115.95 3kj6 s ALA 114 Ca 0.40 0.70 -0.08 0.00 0.00 0.00 0.00 51.96 52.97 3kj6 s ALA 114 Cb 0.21 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.98 3kj6 s ALA 114 CO 0.41 -0.46 0.64 -1.59 0.00 0.00 0.00 175.76 174.75 3kj6 s LYS 115 N -3.18 3.73 0.11 0.00 -2.85 -1.26 -4.99 119.74 111.29 3kj6 s LYS 115 Ca 0.68 0.25 -0.30 0.00 -1.00 0.00 0.00 55.97 55.60 3kj6 s LYS 115 Cb -0.20 -2.54 -0.06 0.00 -2.06 0.00 0.00 37.83 32.97 3kj6 s LYS 115 CO 0.23 0.14 1.01 0.99 0.10 0.00 0.00 175.35 177.82 3kj6 s THR 116 N -2.13 4.40 -0.12 3.79 2.01 -1.26 -4.82 115.64 117.51 3kj6 s THR 116 Ca 0.48 1.94 -0.04 0.00 0.31 0.00 0.00 61.69 64.38 3kj6 s THR 116 Cb -0.11 -4.24 0.06 0.00 0.01 0.00 0.00 72.50 68.22 3kj6 s THR 116 CO 0.28 0.28 0.14 0.42 -0.69 0.00 0.00 174.62 175.05 3kj6 s THR 117 N 0.16 -0.21 0.89 -0.82 -4.23 -0.61 -4.99 115.64 105.84 3kj6 s THR 117 Ca 0.49 0.15 -0.11 0.00 -1.18 0.00 0.00 61.69 61.04 3kj6 s THR 117 Cb -0.25 -0.42 0.13 0.00 1.34 0.00 0.00 72.50 73.31 3kj6 s THR 117 CO 0.30 -0.02 1.14 -0.81 -0.54 0.00 0.00 174.62 174.69 3kj6 n PRO 118 N 5.31 -0.30 -1.75 3.99 -0.04 -1.26 -0.96 135.00 139.99 3kj6 n PRO 118 Ca -0.05 -0.02 -0.31 0.00 -0.04 0.00 0.00 63.50 63.09 3kj6 n PRO 118 Cb 0.50 -2.38 0.04 0.00 -0.04 0.00 0.00 33.50 31.62 3kj6 n PRO 118 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3kj6 s PRO 119 N -4.48 3.06 -0.18 0.54 0.04 -1.25 -4.50 135.00 128.24 3kj6 s PRO 119 Ca 0.68 0.73 -0.05 0.00 0.04 0.00 0.00 61.00 62.40 3kj6 s PRO 119 Cb -0.24 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 3kj6 s PRO 119 CO 0.57 -0.96 0.01 -1.12 0.04 0.00 0.00 177.00 175.53 3kj6 s SER 120 N -4.07 5.09 -0.29 6.66 0.01 -0.33 -4.93 113.70 115.84 3kj6 s SER 120 Ca 0.57 -0.08 -0.06 0.00 1.31 0.00 0.00 55.95 57.69 3kj6 s SER 120 Cb -0.12 -1.85 0.01 0.00 0.21 0.00 0.00 66.02 64.26 3kj6 s SER 120 CO 0.54 0.14 0.07 -0.69 0.41 0.00 0.00 173.24 173.71 3kj6 s VAL 121 N 0.54 3.90 -0.06 3.43 1.01 -1.26 -0.75 120.40 127.20 3kj6 s VAL 121 Ca -0.00 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.34 3kj6 s VAL 121 Cb -0.14 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.23 3kj6 s VAL 121 CO 0.02 0.12 -0.15 -0.31 0.00 0.00 0.00 175.10 174.78 3kj6 s TYR 122 N 1.50 2.70 0.08 5.22 2.02 -0.75 -4.95 117.35 123.18 3kj6 s TYR 122 Ca 0.03 -0.27 -0.26 0.00 -0.37 0.00 0.00 57.07 56.20 3kj6 s TYR 122 Cb -0.17 -1.66 -0.06 0.00 -0.40 0.00 0.00 41.96 39.67 3kj6 s TYR 122 CO 0.02 0.10 0.81 -1.25 -1.57 0.00 0.00 175.55 173.66 3kj6 s PRO 123 N -0.52 4.55 -0.17 -1.71 0.04 -1.26 0.23 135.00 136.16 3kj6 s PRO 123 Ca 0.07 1.16 -0.07 0.00 0.04 0.00 0.00 61.00 62.20 3kj6 s PRO 123 Cb -0.12 -3.34 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 3kj6 s PRO 123 CO 0.01 0.33 0.07 -0.51 0.04 0.00 0.00 177.00 176.95 3kj6 s LEU 124 N -0.28 3.90 0.06 -3.56 2.01 0.22 -4.92 118.68 116.12 3kj6 s LEU 124 Ca 0.40 0.14 0.01 0.00 0.01 0.00 0.00 54.13 54.68 3kj6 s LEU 124 Cb -0.22 -1.98 -0.03 0.00 0.01 0.00 0.00 46.19 43.97 3kj6 s LEU 124 CO 0.25 0.21 -0.05 0.00 1.01 0.00 0.00 176.35 177.77 3kj6 s ALA 125 N 0.14 0.62 0.22 4.21 0.00 -1.26 -2.89 121.76 122.80 3kj6 s ALA 125 Ca 0.05 -1.06 -0.31 0.00 0.00 0.00 0.00 51.96 50.65 3kj6 s ALA 125 Cb -0.12 0.16 -0.15 0.00 0.00 0.00 0.00 23.12 23.01 3kj6 s ALA 125 CO 0.00 -0.21 1.10 -0.35 0.00 0.00 0.00 175.76 176.31 3kj6 n PRO 126 N 0.60 1.26 0.00 0.00 -0.04 -1.26 -4.99 135.00 130.57 3kj6 n PRO 126 Ca -0.17 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 3kj6 n PRO 126 Cb 0.59 -1.89 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 3kj6 n PRO 126 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kj6 n GLY 127 N 1.73 -0.45 2.39 0.55 0.00 -1.26 -4.53 105.19 103.62 3kj6 n GLY 127 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3kj6 n GLY 127 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kj6 n SER 128 N 0.00 8.32 -4.40 1.61 3.41 -1.26 -4.68 113.62 116.62 3kj6 n SER 128 Ca 0.00 -2.80 -0.36 0.00 -0.26 0.00 0.00 58.87 55.45 3kj6 n SER 128 Cb 0.00 -1.49 -0.09 0.00 -0.26 0.00 0.00 64.21 62.38 3kj6 n SER 128 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kj6 n ALA 129 N 2.95 -1.64 -2.77 7.33 0.00 -1.26 -4.81 120.51 120.31 3kj6 n ALA 129 Ca 0.71 -0.31 -0.43 0.00 0.00 0.00 0.00 53.44 53.42 3kj6 n ALA 129 Cb 0.24 -1.66 -0.02 0.00 0.00 0.00 0.00 19.45 18.01 3kj6 n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kj6 s ALA 130 N -3.85 3.26 -1.21 0.00 0.00 -1.26 -4.92 121.76 113.78 3kj6 s ALA 130 Ca 0.38 -2.73 -0.19 0.00 0.00 0.00 0.00 51.96 49.43 3kj6 s ALA 130 Cb -0.22 -4.30 0.08 0.00 0.00 0.00 0.00 23.12 18.68 3kj6 s ALA 130 CO 1.00 -3.19 1.61 -1.14 0.00 0.00 0.00 175.76 174.04 3kj6 s GLN 131 N 3.44 3.90 -0.36 0.00 -0.44 -1.26 -4.75 119.66 120.19 3kj6 s GLN 131 Ca 0.42 -1.88 0.10 0.00 -2.50 0.00 0.00 55.36 51.49 3kj6 s GLN 131 Cb -0.02 -5.41 0.45 0.00 -1.64 0.00 0.00 33.01 26.39 3kj6 s GLN 131 CO -0.06 -2.16 1.10 0.25 0.50 0.00 0.00 175.29 174.93 3kj6 n THR 132 N 6.22 2.05 -3.64 -0.34 -2.24 -1.26 -5.04 114.28 110.03 3kj6 n THR 132 Ca 0.43 -4.21 -0.02 0.00 -2.27 0.00 0.00 64.05 57.98 3kj6 n THR 132 Cb 0.47 -0.62 -0.04 0.00 -2.10 0.00 0.00 70.33 68.04 3kj6 n THR 132 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3kj6 s ASN 133 N -3.51 -0.02 0.45 3.42 3.04 -1.26 -4.99 114.94 112.07 3kj6 s ASN 133 Ca 0.43 0.02 0.30 0.00 0.04 0.00 0.00 52.86 53.65 3kj6 s ASN 133 Cb 0.41 0.02 1.20 0.00 -1.54 0.00 0.00 41.25 41.33 3kj6 s ASN 133 CO -0.07 -0.03 1.89 -1.28 -3.04 0.00 0.00 177.10 174.57 3kj6 h SER 134 N 2.03 0.00 -4.06 -4.21 0.87 -1.97 -3.44 113.55 102.77 3kj6 h SER 134 Ca -0.06 0.00 -0.48 0.00 -1.23 0.00 0.00 61.79 60.02 3kj6 h SER 134 Cb 1.17 0.00 -0.30 0.00 -0.44 0.00 0.00 62.40 62.83 3kj6 h SER 134 CO 0.21 0.00 -0.81 0.00 -0.53 0.00 0.00 176.83 175.70 3kj6 s ALA 135 N -3.53 1.12 -0.06 6.23 0.00 -1.26 -0.62 121.76 123.64 3kj6 s ALA 135 Ca 0.03 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.43 3kj6 s ALA 135 Cb 0.09 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 3kj6 s ALA 135 CO 0.51 0.25 0.01 0.08 0.00 0.00 0.00 175.76 176.60 3kj6 s VAL 136 N -0.15 4.33 -0.24 0.00 1.01 0.39 -4.73 120.40 121.01 3kj6 s VAL 136 Ca 0.02 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.69 3kj6 s VAL 136 Cb -0.07 -2.86 0.05 0.00 0.00 0.00 0.00 36.38 33.50 3kj6 s VAL 136 CO 0.00 0.53 -0.12 0.42 0.00 0.00 0.00 175.10 175.93 3kj6 s THR 137 N -0.96 2.08 0.00 3.92 -4.23 -1.26 -0.80 115.64 114.39 3kj6 s THR 137 Ca 0.16 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 3kj6 s THR 137 Cb -0.11 -2.15 0.00 0.00 1.34 0.00 0.00 72.50 71.58 3kj6 s THR 137 CO 0.05 0.06 0.00 0.00 -0.54 0.00 0.00 174.62 174.19 3kj6 n LEU 138 N 4.49 0.00 0.00 4.79 -0.00 0.22 -4.84 117.00 121.66 3kj6 n LEU 138 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.86 3kj6 n LEU 138 Cb 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.86 3kj6 n LEU 138 CO 0.21 -0.08 0.00 0.61 -0.00 0.00 0.00 177.39 178.13 3kj6 n GLY 139 N 5.00 1.39 3.16 1.47 0.00 -1.14 -0.64 105.19 114.44 3kj6 n GLY 139 Ca 0.00 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 44.96 3kj6 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kj6 s LEU 141 N -0.68 5.10 -0.56 0.00 1.98 0.14 -1.22 118.68 123.45 3kj6 s LEU 141 Ca 0.05 -1.76 -0.23 0.00 -2.89 0.00 0.00 54.13 49.30 3kj6 s LEU 141 Cb -0.07 -1.88 0.05 0.00 0.66 0.00 0.00 46.19 44.94 3kj6 s LEU 141 CO 0.00 -0.52 0.91 0.54 -1.89 0.00 0.00 176.35 175.39 3kj6 s VAL 142 N 1.27 4.43 -0.05 1.68 0.11 -0.49 -1.81 120.40 125.54 3kj6 s VAL 142 Ca 0.05 0.13 0.04 0.00 -2.93 0.00 0.00 61.98 59.27 3kj6 s VAL 142 Cb -0.23 -4.53 -0.02 0.00 -1.53 0.00 0.00 36.38 30.07 3kj6 s VAL 142 CO -0.02 -1.12 -0.16 -0.75 -3.33 0.00 0.00 175.10 169.72 3kj6 s LYS 143 N 3.83 2.54 -0.29 1.54 2.20 0.07 -1.22 119.74 128.41 3kj6 s LYS 143 Ca 0.28 -0.73 -0.10 0.00 -0.36 0.00 0.00 55.97 55.06 3kj6 s LYS 143 Cb -0.14 -2.35 0.01 0.00 -1.51 0.00 0.00 37.83 33.85 3kj6 s LYS 143 CO 0.17 0.56 0.39 0.41 -0.36 0.00 0.00 175.35 176.53 3kj6 n GLY 144 N 2.47 -1.09 3.13 5.54 0.00 -0.18 -1.18 105.19 113.87 3kj6 n GLY 144 Ca -0.17 0.76 -0.08 0.00 0.00 0.00 0.00 46.02 46.54 3kj6 n GLY 144 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kj6 s TYR 145 N -2.09 0.47 -0.28 1.61 -0.85 -0.14 -3.89 117.35 112.19 3kj6 s TYR 145 Ca 0.16 -0.97 -0.24 0.00 -0.52 0.00 0.00 57.07 55.50 3kj6 s TYR 145 Cb -0.04 -0.32 0.11 0.00 0.38 0.00 0.00 41.96 42.09 3kj6 s TYR 145 CO 0.50 -0.44 0.95 0.12 -1.52 0.00 0.00 175.55 175.17 3kj6 s PHE 146 N -3.92 -0.57 0.00 -3.49 2.19 -0.13 -0.60 117.98 111.46 3kj6 s PHE 146 Ca 0.09 1.34 0.00 0.00 0.33 0.00 0.00 56.93 58.69 3kj6 s PHE 146 Cb 0.07 0.36 0.00 0.00 -1.31 0.00 0.00 43.02 42.14 3kj6 s PHE 146 CO -0.09 -0.28 0.00 -0.35 1.83 0.00 0.00 175.22 176.34 3kj6 n PRO 147 N 2.57 1.00 -1.36 10.12 -0.04 -1.26 -1.57 135.00 144.47 3kj6 n PRO 147 Ca -0.14 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.99 3kj6 n PRO 147 Cb 0.56 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 34.12 3kj6 n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3kj6 s GLU 148 N -1.52 2.09 0.00 0.54 0.41 -1.26 -4.83 118.70 114.13 3kj6 s GLU 148 Ca 0.00 1.59 0.00 0.00 -0.41 0.00 0.00 54.97 56.15 3kj6 s GLU 148 Cb 0.00 -1.85 0.00 0.00 -1.78 0.00 0.00 34.13 30.50 3kj6 s GLU 148 CO 0.00 -1.83 0.00 -0.35 -0.49 0.00 0.00 175.26 172.59 3kj6 n PRO 149 N -2.99 1.90 -3.81 0.39 -0.04 -1.26 -4.75 135.00 124.43 3kj6 n PRO 149 Ca 0.12 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.45 3kj6 n PRO 149 Cb 0.51 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.84 3kj6 n PRO 149 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3kj6 s VAL 150 N -0.60 -0.01 -0.16 0.52 -7.23 -1.26 -4.29 120.40 107.37 3kj6 s VAL 150 Ca 0.00 0.03 -0.19 0.00 -1.81 0.00 0.00 61.98 60.02 3kj6 s VAL 150 Cb 0.00 -0.22 -0.04 0.00 0.56 0.00 0.00 36.38 36.69 3kj6 s VAL 150 CO 0.00 0.01 0.51 -0.89 -0.31 0.00 0.00 175.10 174.43 3kj6 s THR 151 N 0.30 5.13 -0.23 5.32 2.01 0.72 -4.89 115.64 124.00 3kj6 s THR 151 Ca -0.02 0.98 0.02 0.00 0.31 0.00 0.00 61.69 62.99 3kj6 s THR 151 Cb -0.03 -3.84 0.05 0.00 0.01 0.00 0.00 72.50 68.68 3kj6 s THR 151 CO -0.01 0.24 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.33 3kj6 s VAL 152 N 1.21 2.10 0.42 3.82 1.01 -1.26 -0.51 120.40 127.19 3kj6 s VAL 152 Ca 0.26 -1.36 0.04 0.00 0.00 0.00 0.00 61.98 60.91 3kj6 s VAL 152 Cb -0.15 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 3kj6 s VAL 152 CO 0.10 0.18 0.05 0.28 0.00 0.00 0.00 175.10 175.71 3kj6 s THR 153 N 1.18 1.20 -0.06 3.92 -1.32 -0.33 -4.98 115.64 115.26 3kj6 s THR 153 Ca -0.04 -2.00 0.01 0.00 -1.21 0.00 0.00 61.69 58.46 3kj6 s THR 153 Cb -0.17 -2.54 0.02 0.00 -1.51 0.00 0.00 72.50 68.30 3kj6 s THR 153 CO -0.08 0.00 -0.08 0.26 -2.21 0.00 0.00 174.62 172.51 3kj6 s TRP 154 N -3.03 1.06 -1.42 9.09 0.52 -1.26 -0.47 118.94 123.43 3kj6 s TRP 154 Ca 0.24 -0.36 -0.10 0.00 0.02 0.00 0.00 56.10 55.89 3kj6 s TRP 154 Cb 0.05 -0.85 0.03 0.00 -1.15 0.00 0.00 33.47 31.55 3kj6 s TRP 154 CO 0.12 -0.24 1.10 0.09 0.02 0.00 0.00 176.95 178.04 3kj6 n ASN 155 N 4.01 -5.91 -3.69 2.95 4.13 0.16 -2.22 115.26 114.69 3kj6 n ASN 155 Ca -0.23 -0.60 -0.24 0.00 1.68 0.00 0.00 54.58 55.19 3kj6 n ASN 155 Cb 0.51 -4.67 0.05 0.00 -1.54 0.00 0.00 39.78 34.13 3kj6 n ASN 155 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3kj6 n SER 156 N -2.94 -3.88 0.00 6.41 7.64 -1.26 -1.94 113.62 117.64 3kj6 n SER 156 Ca 0.02 -0.69 0.00 0.00 1.01 0.00 0.00 58.87 59.20 3kj6 n SER 156 Cb 0.55 -4.48 0.00 0.00 -1.01 0.00 0.00 64.21 59.27 3kj6 n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3kj6 n GLY 157 N -1.65 3.23 0.36 0.23 0.00 -1.07 -4.93 105.19 101.36 3kj6 n GLY 157 Ca -0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.78 3kj6 n GLY 157 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3kj6 h SER 158 N 0.00 -1.12 -3.29 1.61 0.02 -1.29 -3.41 113.55 106.07 3kj6 h SER 158 Ca 0.00 0.11 -0.53 0.00 -0.84 0.00 0.00 61.79 60.53 3kj6 h SER 158 Cb 0.00 0.40 -0.00 0.00 0.14 0.00 0.00 62.40 62.94 3kj6 h SER 158 CO 0.00 -0.44 0.51 -0.76 -1.14 0.00 0.00 176.83 175.00 3kj6 s LEU 159 N -8.71 4.39 0.06 5.07 1.02 -0.94 -4.87 118.68 114.69 3kj6 s LEU 159 Ca -0.12 1.95 0.00 0.00 0.02 0.00 0.00 54.13 55.98 3kj6 s LEU 159 Cb 0.04 -3.58 0.00 0.00 0.02 0.00 0.00 46.19 42.67 3kj6 s LEU 159 CO 0.44 -0.39 0.00 -1.54 0.02 0.00 0.00 176.35 174.88 3kj6 n SER 160 N 3.70 -0.03 -4.59 2.29 3.41 -1.26 -4.38 113.62 112.76 3kj6 n SER 160 Ca 0.07 0.09 -0.41 0.00 -0.26 0.00 0.00 58.87 58.36 3kj6 n SER 160 Cb 0.47 0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 3kj6 n SER 160 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3kj6 s SER 161 N -5.00 5.37 0.00 4.04 0.15 -1.26 -2.65 113.70 114.34 3kj6 s SER 161 Ca 0.00 1.45 0.00 0.00 0.70 0.00 0.00 55.95 58.10 3kj6 s SER 161 Cb 0.00 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 3kj6 s SER 161 CO 0.00 -2.10 0.00 0.61 1.20 0.00 0.00 173.24 172.95 3kj6 n GLY 162 N 5.71 1.90 3.36 9.45 0.00 -1.26 -4.87 105.19 119.48 3kj6 n GLY 162 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.98 3kj6 n GLY 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kj6 s VAL 163 N -2.00 2.59 -0.10 1.61 0.11 -1.08 -1.75 120.40 119.78 3kj6 s VAL 163 Ca 0.00 -0.88 0.03 0.00 -2.93 0.00 0.00 61.98 58.20 3kj6 s VAL 163 Cb 0.00 -1.99 0.01 0.00 -1.53 0.00 0.00 36.38 32.86 3kj6 s VAL 163 CO 0.00 0.57 -0.20 -1.00 -3.33 0.00 0.00 175.10 171.14 3kj6 s HIS 164 N -0.32 2.31 -0.16 1.54 3.76 -0.00 -5.01 115.29 117.40 3kj6 s HIS 164 Ca 0.02 -1.00 0.00 0.00 -0.15 0.00 0.00 55.06 53.93 3kj6 s HIS 164 Cb -0.13 -1.58 0.00 0.00 1.11 0.00 0.00 32.58 31.99 3kj6 s HIS 164 CO 0.02 -0.44 -0.15 0.99 -0.85 0.00 0.00 174.74 174.31 3kj6 s THR 165 N 0.58 2.62 0.04 1.30 2.01 -1.26 -0.74 115.64 120.19 3kj6 s THR 165 Ca -0.14 -0.78 -0.17 0.00 0.31 0.00 0.00 61.69 60.91 3kj6 s THR 165 Cb -0.17 -2.11 -0.06 0.00 0.01 0.00 0.00 72.50 70.17 3kj6 s THR 165 CO 0.04 0.51 0.49 -0.36 -0.69 0.00 0.00 174.62 174.62 3kj6 s PHE 166 N 0.88 3.77 0.25 4.92 0.40 -0.70 -5.02 117.98 122.47 3kj6 s PHE 166 Ca -0.04 1.13 -0.31 0.00 -0.60 0.00 0.00 56.93 57.11 3kj6 s PHE 166 Cb -0.15 -2.39 -0.12 0.00 0.51 0.00 0.00 43.02 40.87 3kj6 s PHE 166 CO -0.01 0.62 1.61 -0.35 0.70 0.00 0.00 175.22 177.78 3kj6 n PRO 167 N 1.75 2.59 -1.63 0.24 -0.04 -1.26 -4.19 135.00 132.46 3kj6 n PRO 167 Ca -0.12 0.93 -0.40 0.00 -0.04 0.00 0.00 63.50 63.86 3kj6 n PRO 167 Cb 0.52 -2.71 0.02 0.00 -0.04 0.00 0.00 33.50 31.29 3kj6 n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3kj6 n ALA 168 N 2.71 0.39 -3.85 0.55 0.00 -1.26 -4.87 120.51 114.18 3kj6 n ALA 168 Ca 0.12 0.17 -0.27 0.00 0.00 0.00 0.00 53.44 53.46 3kj6 n ALA 168 Cb 0.35 -2.12 -0.17 0.00 0.00 0.00 0.00 19.45 17.51 3kj6 n ALA 168 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3kj6 s VAL 169 N -1.33 1.10 0.11 0.00 1.01 0.84 -4.93 120.40 117.21 3kj6 s VAL 169 Ca 0.66 -0.35 -0.31 0.00 0.00 0.00 0.00 61.98 61.98 3kj6 s VAL 169 Cb -0.51 -1.09 -0.09 0.00 0.00 0.00 0.00 36.38 34.69 3kj6 s VAL 169 CO 0.54 0.38 1.54 -0.22 0.00 0.00 0.00 175.10 177.35 3kj6 s LEU 170 N 1.53 4.36 -0.32 3.92 2.96 -1.26 -2.44 118.68 127.42 3kj6 s LEU 170 Ca 0.02 2.47 -0.02 0.00 -0.22 0.00 0.00 54.13 56.38 3kj6 s LEU 170 Cb -0.13 -3.58 0.12 0.00 0.50 0.00 0.00 46.19 43.10 3kj6 s LEU 170 CO -0.07 -0.80 0.17 -1.58 -1.32 0.00 0.00 176.35 172.75 3kj6 s GLN 171 N 1.74 0.39 -0.46 1.98 0.74 0.01 -4.90 119.66 119.16 3kj6 s GLN 171 Ca 0.70 -0.95 -0.00 0.00 0.05 0.00 0.00 55.36 55.15 3kj6 s GLN 171 Cb -0.40 -1.26 -0.00 0.00 1.10 0.00 0.00 33.01 32.45 3kj6 s GLN 171 CO 0.31 -1.11 0.39 0.43 -0.55 0.00 0.00 175.29 174.75 3kj6 n SER 172 N 4.63 -2.12 0.00 6.67 7.64 -1.26 -3.67 113.62 125.51 3kj6 n SER 172 Ca 0.03 -0.24 0.00 0.00 1.01 0.00 0.00 58.87 59.67 3kj6 n SER 172 Cb 0.39 -2.30 0.00 0.00 -1.01 0.00 0.00 64.21 61.30 3kj6 n SER 172 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3kj6 n ASP 173 N -1.85 0.00 -4.31 6.43 4.64 -1.26 -4.97 116.55 115.23 3kj6 n ASP 173 Ca -0.11 0.00 -0.29 0.00 -1.38 0.00 0.00 54.79 53.02 3kj6 n ASP 173 Cb 0.56 -0.30 -0.15 0.00 -1.04 0.00 0.00 41.12 40.20 3kj6 n ASP 173 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 3kj6 s LEU 174 N 0.00 2.17 0.08 -2.67 2.01 -1.24 -4.94 118.68 114.08 3kj6 s LEU 174 Ca 0.00 -0.57 -0.22 0.00 0.01 0.00 0.00 54.13 53.35 3kj6 s LEU 174 Cb 0.00 -1.19 -0.07 0.00 0.01 0.00 0.00 46.19 44.95 3kj6 s LEU 174 CO 0.00 0.23 0.66 -0.31 1.01 0.00 0.00 176.35 177.94 3kj6 s TYR 175 N -0.80 3.80 0.06 0.29 2.02 0.23 -0.81 117.35 122.15 3kj6 s TYR 175 Ca 0.10 1.39 0.06 0.00 -0.37 0.00 0.00 57.07 58.26 3kj6 s TYR 175 Cb -0.10 -2.65 -0.03 0.00 -0.40 0.00 0.00 41.96 38.79 3kj6 s TYR 175 CO 0.02 0.47 -0.16 0.99 -1.57 0.00 0.00 175.55 175.30 3kj6 s THR 176 N -0.77 1.31 0.12 -0.71 2.01 -1.02 -0.96 115.64 115.62 3kj6 s THR 176 Ca 0.33 -1.24 -0.25 0.00 0.31 0.00 0.00 61.69 60.84 3kj6 s THR 176 Cb -0.20 -1.20 0.07 0.00 0.01 0.00 0.00 72.50 71.18 3kj6 s THR 176 CO 0.21 -0.06 0.75 -1.48 -0.69 0.00 0.00 174.62 173.35 3kj6 s LEU 177 N -1.50 -0.42 0.26 4.42 0.05 -0.36 -0.11 118.68 121.03 3kj6 s LEU 177 Ca 0.02 -0.13 0.03 0.00 0.05 0.00 0.00 54.13 54.11 3kj6 s LEU 177 Cb -0.09 2.39 -0.06 0.00 -2.05 0.00 0.00 46.19 46.38 3kj6 s LEU 177 CO 0.02 -0.90 0.02 -0.94 -0.55 0.00 0.00 176.35 174.00 3kj6 s SER 178 N -2.71 1.94 -0.05 1.48 1.04 -1.26 -1.39 113.70 112.75 3kj6 s SER 178 Ca 0.05 -1.28 -0.04 0.00 0.48 0.00 0.00 55.95 55.16 3kj6 s SER 178 Cb -0.02 -0.00 0.02 0.00 0.10 0.00 0.00 66.02 66.12 3kj6 s SER 178 CO -0.07 -0.56 0.13 -0.55 0.98 0.00 0.00 173.24 173.17 3kj6 s SER 179 N -3.36 -0.12 -0.03 7.02 0.15 -0.36 -1.71 113.70 115.28 3kj6 s SER 179 Ca 0.32 0.26 0.06 0.00 0.70 0.00 0.00 55.95 57.29 3kj6 s SER 179 Cb 0.07 0.23 -0.01 0.00 -1.71 0.00 0.00 66.02 64.60 3kj6 s SER 179 CO 0.11 -0.07 -0.21 -0.94 1.20 0.00 0.00 173.24 173.33 3kj6 s SER 180 N 0.38 2.54 -0.04 5.45 1.04 0.09 -0.63 113.70 122.52 3kj6 s SER 180 Ca -0.03 -0.41 0.04 0.00 0.48 0.00 0.00 55.95 56.04 3kj6 s SER 180 Cb -0.04 -0.51 -0.00 0.00 0.10 0.00 0.00 66.02 65.57 3kj6 s SER 180 CO -0.02 0.23 -0.15 0.54 0.98 0.00 0.00 173.24 174.82 3kj6 s VAL 181 N -0.26 1.24 -0.10 5.02 0.11 0.19 -0.82 120.40 125.78 3kj6 s VAL 181 Ca 0.02 -0.61 -0.01 0.00 -2.93 0.00 0.00 61.98 58.45 3kj6 s VAL 181 Cb -0.11 -1.07 -0.03 0.00 -1.53 0.00 0.00 36.38 33.65 3kj6 s VAL 181 CO 0.01 0.36 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.19 3kj6 s THR 182 N 0.07 3.70 0.10 5.04 2.01 -0.71 -0.61 115.64 125.23 3kj6 s THR 182 Ca -0.03 -0.46 -0.01 0.00 0.31 0.00 0.00 61.69 61.50 3kj6 s THR 182 Cb -0.10 -2.55 -0.04 0.00 0.01 0.00 0.00 72.50 69.82 3kj6 s THR 182 CO 0.02 0.56 0.02 0.68 -0.69 0.00 0.00 174.62 175.20 3kj6 s VAL 183 N -0.34 0.18 0.10 3.82 -7.23 0.02 -4.79 120.40 112.17 3kj6 s VAL 183 Ca 0.05 -1.88 -0.31 0.00 -1.81 0.00 0.00 61.98 58.03 3kj6 s VAL 183 Cb -0.12 -1.84 -0.09 0.00 0.56 0.00 0.00 36.38 34.88 3kj6 s VAL 183 CO 0.02 -0.67 1.75 -2.84 -0.31 0.00 0.00 175.10 173.04 3kj6 s PRO 184 N -3.99 4.17 0.57 4.82 0.02 -1.26 -0.46 135.00 138.86 3kj6 s PRO 184 Ca 0.17 2.47 0.33 0.00 0.02 0.00 0.00 61.00 63.99 3kj6 s PRO 184 Cb 0.08 -3.60 1.45 0.00 0.02 0.00 0.00 34.50 32.45 3kj6 s PRO 184 CO -0.03 -0.79 1.77 0.77 -0.33 0.00 0.00 177.00 178.39 3kj6 h SER 185 N 8.47 0.00 -0.02 2.53 0.02 -1.15 0.46 113.55 123.85 3kj6 h SER 185 Ca -0.44 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 3kj6 h SER 185 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 3kj6 h SER 185 CO 0.94 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 175.09 3kj6 n SER 186 N -3.90 1.13 0.10 3.07 3.41 -1.26 -4.20 113.62 111.97 3kj6 n SER 186 Ca 0.20 -2.03 0.00 0.00 -0.26 0.00 0.00 58.87 56.78 3kj6 n SER 186 Cb 1.10 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 3kj6 n SER 186 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3kj6 n THR 187 N 0.01 0.39 0.00 6.66 -2.24 0.16 -4.87 114.28 114.39 3kj6 n THR 187 Ca 0.01 0.13 -0.01 0.00 -2.27 0.00 0.00 64.05 61.91 3kj6 n THR 187 Cb 0.27 -0.87 -0.01 0.00 -2.10 0.00 0.00 70.33 67.63 3kj6 n THR 187 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 3kj6 h TRP 188 N 0.00 -0.12 -0.36 4.78 7.01 -1.72 1.31 115.95 126.85 3kj6 h TRP 188 Ca 0.00 0.00 0.10 0.00 2.11 0.00 0.00 58.89 61.11 3kj6 h TRP 188 Cb 0.03 0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.13 3kj6 h TRP 188 CO 0.00 -0.04 0.43 -1.00 -2.79 0.00 0.00 178.44 175.04 3kj6 h PRO 189 N -0.05 0.00 0.02 2.65 0.13 -1.91 -1.65 132.00 131.19 3kj6 h PRO 189 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3kj6 h PRO 189 Cb 0.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.18 3kj6 h PRO 189 CO -0.03 0.00 -0.01 0.77 -0.23 0.00 0.00 178.00 178.50 3kj6 h SER 190 N 0.00 -0.02 -3.43 1.44 0.02 -1.29 -3.46 113.55 106.80 3kj6 h SER 190 Ca 0.17 -0.37 -0.66 0.00 -0.84 0.00 0.00 61.79 60.09 3kj6 h SER 190 Cb 1.03 0.01 -0.20 0.00 0.14 0.00 0.00 62.40 63.38 3kj6 h SER 190 CO -0.00 0.65 -0.67 -0.70 -1.14 0.00 0.00 176.83 174.97 3kj6 s GLU 191 N -1.94 3.25 0.24 3.45 2.12 0.43 -5.07 118.70 121.18 3kj6 s GLU 191 Ca -0.08 -0.51 -0.30 0.00 0.36 0.00 0.00 54.97 54.44 3kj6 s GLU 191 Cb -0.01 -2.78 -0.15 0.00 0.26 0.00 0.00 34.13 31.45 3kj6 s GLU 191 CO 0.27 0.46 1.01 -2.37 -0.54 0.00 0.00 175.26 174.09 3kj6 n THR 192 N 2.87 1.61 -3.89 -1.70 5.66 -1.26 -4.37 114.28 113.19 3kj6 n THR 192 Ca -0.18 -0.40 -0.22 0.00 -3.05 0.00 0.00 64.05 60.20 3kj6 n THR 192 Cb 0.53 -0.84 -0.17 0.00 -1.55 0.00 0.00 70.33 68.30 3kj6 n THR 192 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 3kj6 s VAL 193 N -0.75 0.47 0.03 1.08 1.01 -1.26 -5.03 120.40 115.95 3kj6 s VAL 193 Ca 0.64 0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.68 3kj6 s VAL 193 Cb -0.78 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 3kj6 s VAL 193 CO 0.57 0.26 -0.10 0.28 0.00 0.00 0.00 175.10 176.11 3kj6 s THR 194 N 1.64 0.75 -0.13 3.92 -1.32 -1.26 -1.89 115.64 117.35 3kj6 s THR 194 Ca 0.00 -0.91 -0.03 0.00 -1.21 0.00 0.00 61.69 59.54 3kj6 s THR 194 Cb -0.13 -0.73 -0.03 0.00 -1.51 0.00 0.00 72.50 70.10 3kj6 s THR 194 CO -0.04 -0.15 -0.01 0.00 -2.21 0.00 0.00 174.62 172.21 3kj6 s ASN 196 N -0.21 4.85 -0.07 0.00 -0.87 0.38 -0.80 114.94 118.22 3kj6 s ASN 196 Ca 0.05 -0.24 -0.01 0.00 -1.57 0.00 0.00 52.86 51.09 3kj6 s ASN 196 Cb -0.13 -1.85 -0.03 0.00 -0.02 0.00 0.00 41.25 39.22 3kj6 s ASN 196 CO 0.02 0.01 -0.00 -0.69 -2.57 0.00 0.00 177.10 173.87 3kj6 s VAL 197 N 1.31 4.23 -0.11 1.60 1.01 0.10 -1.19 120.40 127.36 3kj6 s VAL 197 Ca 0.04 -0.34 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 3kj6 s VAL 197 Cb -0.15 -2.80 0.04 0.00 0.00 0.00 0.00 36.38 33.48 3kj6 s VAL 197 CO 0.01 0.56 0.04 0.00 0.00 0.00 0.00 175.10 175.71 3kj6 s ALA 198 N -0.92 0.64 -0.46 5.51 0.00 0.34 0.95 121.76 127.80 3kj6 s ALA 198 Ca 0.15 -0.24 0.01 0.00 0.00 0.00 0.00 51.96 51.88 3kj6 s ALA 198 Cb -0.11 -0.88 0.12 0.00 0.00 0.00 0.00 23.12 22.25 3kj6 s ALA 198 CO 0.04 -0.76 0.22 -1.58 0.00 0.00 0.00 175.76 173.68 3kj6 s HIS 199 N 2.01 3.50 0.24 0.00 2.46 0.21 -0.20 115.29 123.50 3kj6 s HIS 199 Ca 0.03 -2.86 -0.06 0.00 0.47 0.00 0.00 55.06 52.64 3kj6 s HIS 199 Cb -0.14 -3.02 0.24 0.00 -0.13 0.00 0.00 32.58 29.53 3kj6 s HIS 199 CO -0.06 -0.88 1.83 -1.35 -2.47 0.00 0.00 174.74 171.81 3kj6 h PRO 200 N 7.29 1.15 0.00 2.88 0.11 -1.80 0.29 132.00 141.92 3kj6 h PRO 200 Ca -0.07 -0.17 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3kj6 h PRO 200 Cb 0.98 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.88 3kj6 h PRO 200 CO 0.65 0.89 0.35 0.00 -0.21 0.00 0.00 178.00 179.68 3kj6 h ALA 201 N 1.26 1.29 0.00 -0.75 0.00 -1.85 0.10 119.26 119.32 3kj6 h ALA 201 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3kj6 h ALA 201 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3kj6 h ALA 201 CO -0.03 -0.29 0.00 -1.13 0.00 0.00 0.00 179.25 177.79 3kj6 n SER 202 N -2.41 0.52 -3.36 0.00 3.41 -1.05 -4.93 113.62 105.81 3kj6 n SER 202 Ca -0.01 -1.02 -0.16 0.00 -0.26 0.00 0.00 58.87 57.41 3kj6 n SER 202 Cb 0.38 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.41 3kj6 n SER 202 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3kj6 n SER 203 N -0.01 -4.28 -4.01 4.04 7.64 0.35 -5.00 113.62 112.34 3kj6 n SER 203 Ca 0.00 -0.68 -0.31 0.00 1.01 0.00 0.00 58.87 58.89 3kj6 n SER 203 Cb 0.13 -5.11 -0.15 0.00 -1.01 0.00 0.00 64.21 58.07 3kj6 n SER 203 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3kj6 s THR 204 N -3.39 1.84 -0.18 0.44 2.01 0.03 -5.00 115.64 111.40 3kj6 s THR 204 Ca 0.23 -1.41 -0.01 0.00 0.31 0.00 0.00 61.69 60.80 3kj6 s THR 204 Cb -0.03 -2.03 -0.00 0.00 0.01 0.00 0.00 72.50 70.45 3kj6 s THR 204 CO 0.74 -0.05 -0.11 -0.75 -0.69 0.00 0.00 174.62 173.76 3kj6 s LYS 205 N 1.25 3.29 0.04 4.92 2.20 -1.26 0.63 119.74 130.81 3kj6 s LYS 205 Ca -0.07 -0.69 0.06 0.00 -0.36 0.00 0.00 55.97 54.91 3kj6 s LYS 205 Cb -0.19 -2.77 -0.02 0.00 -1.51 0.00 0.00 37.83 33.33 3kj6 s LYS 205 CO -0.06 -0.06 -0.18 0.08 -0.36 0.00 0.00 175.35 174.77 3kj6 s VAL 206 N 1.04 1.48 0.05 4.02 1.01 0.27 -4.99 120.40 123.28 3kj6 s VAL 206 Ca -0.00 -1.12 0.08 0.00 0.00 0.00 0.00 61.98 60.94 3kj6 s VAL 206 Cb -0.15 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 3kj6 s VAL 206 CO -0.02 0.15 -0.22 -1.81 0.00 0.00 0.00 175.10 173.19 3kj6 s ASP 207 N -1.14 2.65 -0.33 3.32 1.01 -1.26 0.03 116.67 120.95 3kj6 s ASP 207 Ca 0.06 -0.57 -0.00 0.00 0.71 0.00 0.00 52.55 52.75 3kj6 s ASP 207 Cb -0.08 -0.21 0.13 0.00 1.01 0.00 0.00 42.92 43.77 3kj6 s ASP 207 CO 0.02 0.17 0.25 -0.75 0.21 0.00 0.00 175.17 175.07 3kj6 s LYS 208 N -1.32 0.44 0.49 8.23 2.47 0.02 -4.98 119.74 125.10 3kj6 s LYS 208 Ca 0.08 -0.76 -0.22 0.00 -1.56 0.00 0.00 55.97 53.51 3kj6 s LYS 208 Cb -0.09 -0.97 -0.07 0.00 -1.46 0.00 0.00 37.83 35.24 3kj6 s LYS 208 CO 0.02 -1.12 1.19 0.21 0.16 0.00 0.00 175.35 175.81 3kj6 s LYS 209 N 1.69 3.57 -0.65 4.03 2.20 -1.26 -1.58 119.74 127.73 3kj6 s LYS 209 Ca 0.14 1.83 -0.04 0.00 -0.36 0.00 0.00 55.97 57.54 3kj6 s LYS 209 Cb -0.17 -2.31 0.17 0.00 -1.51 0.00 0.00 37.83 34.01 3kj6 s LYS 209 CO -0.16 -0.73 0.48 0.42 -0.36 0.00 0.00 175.35 175.00 3kj6 s ILE 210 N -1.54 3.90 0.31 5.43 1.01 -0.79 -4.91 121.20 124.60 3kj6 s ILE 210 Ca 0.67 -2.95 -0.29 0.00 0.00 0.00 0.00 60.65 58.07 3kj6 s ILE 210 Cb -0.30 -3.52 -0.13 0.00 0.01 0.00 0.00 42.46 38.52 3kj6 s ILE 210 CO 0.36 -0.90 1.34 0.52 0.00 0.00 0.00 174.94 176.26 3kj6 n VAL 211 N 3.48 1.61 0.00 2.92 0.31 -1.26 -4.80 118.33 120.59 3kj6 n VAL 211 Ca 0.09 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 3kj6 n VAL 211 Cb 0.39 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 3kj6 n VAL 211 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 3kj6 n PRO 212 N 1.12 0.00 -3.13 5.55 -0.04 -1.26 -4.91 135.00 132.33 3kj6 n PRO 212 Ca 0.07 0.11 -0.04 0.00 -0.04 0.00 0.00 63.50 63.60 3kj6 n PRO 212 Cb 0.35 -0.63 0.02 0.00 -0.04 0.00 0.00 33.50 33.19 3kj6 n PRO 212 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 3kj6 n ARG 213 N -0.24 0.65 0.27 0.54 0.63 -1.26 -4.58 116.66 112.67 3kj6 n ARG 213 Ca 0.00 -1.35 0.14 0.00 -0.92 0.00 0.00 57.85 55.72 3kj6 n ARG 213 Cb 0.00 1.75 0.72 0.00 0.45 0.00 0.00 32.46 35.38 3kj6 n ARG 213 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3kj6 h ASP 214 N 1.45 0.00 0.00 6.15 3.32 -1.94 -3.47 116.42 121.93 3kj6 h ASP 214 Ca -0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.83 3kj6 h ASP 214 Cb 0.89 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.44 3kj6 h ASP 214 CO 0.29 0.10 0.00 0.00 -1.72 0.00 0.00 179.24 177.91 3kj6 n GLY 216 N 0.00 0.82 0.00 0.00 0.00 -1.26 -5.06 105.19 99.69 3kj6 n GLY 216 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3kj6 n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32