#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nj9 n ALA 2 N 0.00 -1.18 -3.15 1.69 0.00 -1.26 -5.04 120.51 111.57 1nj9 n ALA 2 Ca 0.00 -1.79 -0.44 0.00 0.00 0.00 0.00 53.44 51.21 1nj9 n ALA 2 Cb 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 1nj9 n ALA 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1nj9 s VAL 3 N -3.75 5.00 -0.45 0.00 1.01 -1.26 -4.94 120.40 116.00 1nj9 s VAL 3 Ca 0.74 -1.33 -0.24 0.00 0.00 0.00 0.00 61.98 61.14 1nj9 s VAL 3 Cb -0.02 -4.10 0.03 0.00 0.00 0.00 0.00 36.38 32.28 1nj9 s VAL 3 CO 0.51 -0.69 0.86 -0.69 0.00 0.00 0.00 175.10 175.09 1nj9 s VAL 4 N 1.57 4.56 -0.30 2.92 1.01 -1.26 -1.98 120.40 126.92 1nj9 s VAL 4 Ca 0.04 0.61 -0.14 0.00 0.00 0.00 0.00 61.98 62.49 1nj9 s VAL 4 Cb -0.26 -4.38 -0.03 0.00 0.00 0.00 0.00 36.38 31.71 1nj9 s VAL 4 CO 0.04 -0.77 0.34 -0.89 0.00 0.00 0.00 175.10 173.82 1nj9 s THR 5 N 3.53 5.19 0.30 3.92 2.01 0.46 -3.42 115.64 127.64 1nj9 s THR 5 Ca 0.34 0.33 0.11 0.00 0.31 0.00 0.00 61.69 62.78 1nj9 s THR 5 Cb -0.11 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.63 1nj9 s THR 5 CO 0.24 0.08 -0.17 -1.10 -0.69 0.00 0.00 174.62 172.99 1nj9 s GLN 6 N 2.01 1.72 0.21 4.92 -0.21 -1.26 0.57 119.66 127.60 1nj9 s GLN 6 Ca 0.13 -1.81 -0.31 0.00 0.02 0.00 0.00 55.36 53.39 1nj9 s GLN 6 Cb -0.16 -1.75 -0.10 0.00 1.00 0.00 0.00 33.01 32.00 1nj9 s GLN 6 CO 0.11 0.28 1.46 -1.21 -2.12 0.00 0.00 175.29 173.81 1nj9 s GLU 7 N -3.54 4.27 0.08 2.91 0.41 -1.26 -4.78 118.70 116.80 1nj9 s GLU 7 Ca 0.31 2.27 -0.36 0.00 -0.41 0.00 0.00 54.97 56.78 1nj9 s GLU 7 Cb -0.03 -3.14 -0.18 0.00 -1.78 0.00 0.00 34.13 29.00 1nj9 s GLU 7 CO 0.15 -0.46 1.57 1.03 -0.49 0.00 0.00 175.26 177.07 1nj9 h SER 8 N 5.71 -1.28 -4.26 -0.19 0.87 -1.98 -3.35 113.55 109.07 1nj9 h SER 8 Ca -0.45 0.09 -0.12 0.00 -1.23 0.00 0.00 61.79 60.09 1nj9 h SER 8 Cb 1.21 0.40 -0.23 0.00 -0.44 0.00 0.00 62.40 63.35 1nj9 h SER 8 CO 0.82 -0.68 -0.22 0.00 -0.53 0.00 0.00 176.83 176.22 1nj9 s ALA 9 N -5.92 -0.99 0.08 6.23 0.00 -1.26 -3.45 121.76 116.45 1nj9 s ALA 9 Ca -0.18 0.93 0.03 0.00 0.00 0.00 0.00 51.96 52.74 1nj9 s ALA 9 Cb 0.04 -0.42 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1nj9 s ALA 9 CO 0.61 -0.22 -0.10 -0.51 0.00 0.00 0.00 175.76 175.54 1nj9 s LEU 11 N -0.31 2.36 0.01 0.00 1.43 -1.18 -5.00 118.68 115.99 1nj9 s LEU 11 Ca -0.05 -0.74 0.04 0.00 -1.03 0.00 0.00 54.13 52.35 1nj9 s LEU 11 Cb -0.03 -0.29 -0.01 0.00 0.03 0.00 0.00 46.19 45.89 1nj9 s LEU 11 CO 0.02 -0.24 -0.12 -0.89 0.23 0.00 0.00 176.35 175.35 1nj9 s THR 12 N -2.12 0.98 0.34 5.49 2.01 -1.26 -0.04 115.64 121.04 1nj9 s THR 12 Ca 0.01 -0.70 -0.02 0.00 0.31 0.00 0.00 61.69 61.29 1nj9 s THR 12 Cb -0.05 -0.85 0.01 0.00 0.01 0.00 0.00 72.50 71.62 1nj9 s THR 12 CO 0.00 0.15 0.49 1.07 -0.69 0.00 0.00 174.62 175.64 1nj9 n THR 13 N 2.43 0.00 -4.30 -0.82 5.66 0.42 -4.91 114.28 112.76 1nj9 n THR 13 Ca -0.16 -1.68 -0.16 0.00 -3.05 0.00 0.00 64.05 59.00 1nj9 n THR 13 Cb 0.55 1.06 -0.10 0.00 -1.55 0.00 0.00 70.33 70.29 1nj9 n THR 13 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1nj9 s SER 14 N -3.10 1.79 0.42 1.09 0.01 -1.26 0.56 113.70 113.21 1nj9 s SER 14 Ca 0.27 -1.15 -0.24 0.00 1.31 0.00 0.00 55.95 56.14 1nj9 s SER 14 Cb -0.01 0.01 -0.10 0.00 0.21 0.00 0.00 66.02 66.12 1nj9 s SER 14 CO 0.20 -0.46 1.03 -2.65 0.41 0.00 0.00 173.24 171.77 1nj9 n PRO 15 N -0.34 1.39 0.00 12.44 -0.02 -1.25 -1.41 135.00 145.80 1nj9 n PRO 15 Ca -0.07 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 1nj9 n PRO 15 Cb 0.63 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 1nj9 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nj9 n GLY 16 N 1.15 2.00 3.66 -1.23 0.00 -0.21 -4.92 105.19 105.65 1nj9 n GLY 16 Ca 0.09 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1nj9 n GLY 16 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nj9 n GLU 17 N 0.00 0.44 -4.29 1.61 1.02 -0.50 -3.23 120.64 115.69 1nj9 n GLU 17 Ca 0.00 0.22 -0.34 0.00 -0.02 0.00 0.00 57.16 57.02 1nj9 n GLU 17 Cb 0.00 -2.36 -0.11 0.00 -0.02 0.00 0.00 31.44 28.95 1nj9 n GLU 17 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1nj9 s THR 18 N -1.90 4.24 0.08 2.62 2.01 -1.26 0.21 115.64 121.65 1nj9 s THR 18 Ca 0.75 -0.24 0.08 0.00 0.31 0.00 0.00 61.69 62.58 1nj9 s THR 18 Cb -0.32 -2.85 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 1nj9 s THR 18 CO 0.49 0.51 -0.22 0.54 -0.69 0.00 0.00 174.62 175.26 1nj9 s VAL 19 N 0.04 1.77 -0.16 3.82 0.11 -0.20 -4.96 120.40 120.81 1nj9 s VAL 19 Ca 0.02 -1.45 -0.01 0.00 -2.93 0.00 0.00 61.98 57.61 1nj9 s VAL 19 Cb -0.13 -1.58 0.05 0.00 -1.53 0.00 0.00 36.38 33.19 1nj9 s VAL 19 CO 0.02 0.06 -0.02 -0.89 -3.33 0.00 0.00 175.10 170.94 1nj9 s THR 20 N -1.02 0.82 -0.11 5.04 2.01 -1.26 -0.36 115.64 120.76 1nj9 s THR 20 Ca 0.08 -0.51 -0.04 0.00 0.31 0.00 0.00 61.69 61.52 1nj9 s THR 20 Cb -0.10 -1.10 -0.04 0.00 0.01 0.00 0.00 72.50 71.27 1nj9 s THR 20 CO 0.04 0.03 0.06 -0.76 -0.69 0.00 0.00 174.62 173.30 1nj9 s LEU 21 N 1.75 3.90 0.28 4.42 1.02 0.01 -4.94 118.68 125.12 1nj9 s LEU 21 Ca 0.01 0.25 0.09 0.00 0.02 0.00 0.00 54.13 54.50 1nj9 s LEU 21 Cb -0.15 -1.93 -0.04 0.00 0.02 0.00 0.00 46.19 44.09 1nj9 s LEU 21 CO -0.07 0.36 0.04 0.42 0.02 0.00 0.00 176.35 177.12 1nj9 s THR 22 N -0.77 3.40 -0.24 5.49 -4.23 -1.26 0.39 115.64 118.43 1nj9 s THR 22 Ca 0.12 -1.84 -0.04 0.00 -1.18 0.00 0.00 61.69 58.75 1nj9 s THR 22 Cb -0.12 -2.91 0.08 0.00 1.34 0.00 0.00 72.50 70.90 1nj9 s THR 22 CO 0.03 -0.33 0.11 0.00 -0.54 0.00 0.00 174.62 173.89 1nj9 s ARG 24 N 2.12 2.38 0.22 0.00 1.70 0.19 -0.96 118.95 124.61 1nj9 s ARG 24 Ca 0.06 -0.77 -0.16 0.00 -0.47 0.00 0.00 55.73 54.40 1nj9 s ARG 24 Cb -0.16 -2.28 -0.08 0.00 -0.57 0.00 0.00 34.95 31.86 1nj9 s ARG 24 CO -0.24 0.60 0.65 0.45 -1.08 0.00 0.00 175.30 175.68 1nj9 s SER 25 N -0.71 6.87 0.36 -2.89 0.15 -1.26 0.17 113.70 116.39 1nj9 s SER 25 Ca 0.11 1.22 0.23 0.00 0.70 0.00 0.00 55.95 58.21 1nj9 s SER 25 Cb -0.10 -2.34 0.29 0.00 -1.71 0.00 0.00 66.02 62.15 1nj9 s SER 25 CO 0.00 -0.01 1.48 0.77 1.20 0.00 0.00 173.24 176.68 1nj9 h SER 26 N 3.10 0.00 1.41 5.45 4.64 -1.76 -3.18 113.55 123.21 1nj9 h SER 26 Ca -0.48 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1nj9 h SER 26 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1nj9 h SER 26 CO 0.66 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.97 1nj9 n THR 27 N -2.92 0.58 0.00 2.95 -2.24 -1.26 -4.96 114.28 106.43 1nj9 n THR 27 Ca 0.03 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1nj9 n THR 27 Cb 0.53 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 1nj9 n THR 27 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nj9 n GLY 27 N 1.24 0.37 3.70 3.38 0.00 -1.20 -5.03 105.19 107.64 1nj9 n GLY 27 Ca 0.05 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.68 1nj9 n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nj9 s THR 27 N -0.82 2.92 -0.20 2.61 2.01 -1.26 -4.34 115.64 116.56 1nj9 s THR 27 Ca 0.00 0.51 -0.22 0.00 0.31 0.00 0.00 61.69 62.29 1nj9 s THR 27 Cb 0.00 -3.33 -0.02 0.00 0.01 0.00 0.00 72.50 69.16 1nj9 s THR 27 CO 0.00 0.01 0.67 -0.51 -0.69 0.00 0.00 174.62 174.11 1nj9 s ILE 27 N 2.03 4.99 0.54 1.82 2.07 -1.26 -5.03 121.20 126.36 1nj9 s ILE 27 Ca 0.72 1.28 0.04 0.00 -1.41 0.00 0.00 60.65 61.28 1nj9 s ILE 27 Cb -0.41 -3.99 0.03 0.00 0.13 0.00 0.00 42.46 38.22 1nj9 s ILE 27 CO 0.32 0.09 0.27 0.42 -1.91 0.00 0.00 174.94 174.12 1nj9 s THR 28 N 2.00 1.43 0.55 4.00 -4.23 -1.26 -4.82 115.64 113.31 1nj9 s THR 28 Ca 0.31 -1.66 0.33 0.00 -1.18 0.00 0.00 61.69 59.48 1nj9 s THR 28 Cb -0.16 -2.09 0.50 0.00 1.34 0.00 0.00 72.50 72.09 1nj9 s THR 28 CO 0.11 0.00 1.84 0.77 -0.54 0.00 0.00 174.62 176.79 1nj9 h SER 29 N 0.93 0.00 0.25 3.99 4.64 -1.96 0.97 113.55 122.36 1nj9 h SER 29 Ca -0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1nj9 h SER 29 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1nj9 h SER 29 CO 0.63 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 177.06 1nj9 n ASP 30 N -4.12 0.00 -0.21 4.97 8.00 -1.26 -2.75 116.55 121.18 1nj9 n ASP 30 Ca 0.20 -0.25 0.11 0.00 0.71 0.00 0.00 54.79 55.56 1nj9 n ASP 30 Cb 1.07 -0.18 0.04 0.00 -0.02 0.00 0.00 41.12 42.03 1nj9 n ASP 30 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1nj9 n ASN 31 N -1.18 1.29 -4.50 -2.24 5.03 0.33 -4.72 115.26 109.28 1nj9 n ASN 31 Ca 0.12 -1.06 -0.41 0.00 0.87 0.00 0.00 54.58 54.10 1nj9 n ASN 31 Cb 0.13 0.60 -0.08 0.00 -1.02 0.00 0.00 39.78 39.40 1nj9 n ASN 31 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1nj9 n TYR 32 N -0.87 -1.17 -1.54 3.10 0.53 -1.11 -0.36 117.16 115.75 1nj9 n TYR 32 Ca 0.07 0.67 -0.49 0.00 -1.02 0.00 0.00 57.90 57.14 1nj9 n TYR 32 Cb 0.38 -1.97 -0.04 0.00 -1.03 0.00 0.00 39.34 36.68 1nj9 n TYR 32 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1nj9 n ALA 33 N -4.11 -1.34 -2.95 -0.72 0.00 -1.26 -4.33 120.51 105.80 1nj9 n ALA 33 Ca 0.06 0.46 -0.10 0.00 0.00 0.00 0.00 53.44 53.86 1nj9 n ALA 33 Cb 0.48 -1.93 -0.05 0.00 0.00 0.00 0.00 19.45 17.96 1nj9 n ALA 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1nj9 s ASN 34 N -0.27 -0.18 -0.02 0.00 2.20 -1.12 0.20 114.94 115.74 1nj9 s ASN 34 Ca 0.71 -0.39 0.03 0.00 -0.94 0.00 0.00 52.86 52.27 1nj9 s ASN 34 Cb -0.88 0.46 -0.00 0.00 -2.00 0.00 0.00 41.25 38.83 1nj9 s ASN 34 CO 0.55 -0.85 -0.12 0.26 -2.94 0.00 0.00 177.10 174.00 1nj9 s TRP 35 N -3.82 1.16 0.27 1.54 0.52 0.39 -2.47 118.94 116.53 1nj9 s TRP 35 Ca 0.04 -0.28 0.10 0.00 0.02 0.00 0.00 56.10 55.98 1nj9 s TRP 35 Cb 0.02 -0.79 -0.05 0.00 -1.15 0.00 0.00 33.47 31.50 1nj9 s TRP 35 CO -0.11 -0.09 -0.15 0.14 0.02 0.00 0.00 176.95 176.76 1nj9 s VAL 36 N 0.02 2.16 -0.07 4.03 -7.23 -0.90 0.14 120.40 118.56 1nj9 s VAL 36 Ca -0.01 -2.30 0.04 0.00 -1.81 0.00 0.00 61.98 57.90 1nj9 s VAL 36 Cb -0.08 -2.31 0.00 0.00 0.56 0.00 0.00 36.38 34.55 1nj9 s VAL 36 CO 0.01 -0.41 -0.19 -1.58 -0.31 0.00 0.00 175.10 172.61 1nj9 s GLN 37 N -3.58 2.27 -0.43 4.82 0.74 0.03 -1.71 119.66 121.80 1nj9 s GLN 37 Ca 0.28 -0.69 -0.06 0.00 0.05 0.00 0.00 55.36 54.94 1nj9 s GLN 37 Cb -0.02 -1.84 0.11 0.00 1.10 0.00 0.00 33.01 32.36 1nj9 s GLN 37 CO 0.13 0.20 0.26 -2.00 -0.55 0.00 0.00 175.29 173.32 1nj9 s GLU 38 N 0.24 2.26 0.58 1.67 2.12 0.26 -2.63 118.70 123.19 1nj9 s GLU 38 Ca -0.11 -1.75 -0.15 0.00 0.36 0.00 0.00 54.97 53.32 1nj9 s GLU 38 Cb -0.15 -3.72 -0.05 0.00 0.26 0.00 0.00 34.13 30.47 1nj9 s GLU 38 CO 0.05 -1.09 1.03 0.15 -0.54 0.00 0.00 175.26 174.86 1nj9 s LYS 39 N 1.26 3.53 -0.97 4.30 -0.14 0.17 -1.84 119.74 126.04 1nj9 s LYS 39 Ca 0.06 1.06 -0.21 0.00 -1.36 0.00 0.00 55.97 55.53 1nj9 s LYS 39 Cb -0.24 -2.07 -0.27 0.00 -1.68 0.00 0.00 37.83 33.58 1nj9 s LYS 39 CO -0.02 -0.63 2.43 -2.30 -0.76 0.00 0.00 175.35 174.06 1nj9 n PRO 40 N -2.02 0.07 0.00 -1.68 -0.02 -1.26 -2.21 135.00 127.87 1nj9 n PRO 40 Ca 0.08 -0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1nj9 n PRO 40 Cb 0.53 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 1nj9 n PRO 40 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1nj9 n ASP 41 N 8.79 0.00 -4.03 2.55 9.92 -1.26 -4.80 116.55 127.72 1nj9 n ASP 41 Ca 0.65 0.00 -0.45 0.00 -0.53 0.00 0.00 54.79 54.46 1nj9 n ASP 41 Cb 0.12 0.00 0.02 0.00 -0.64 0.00 0.00 41.12 40.62 1nj9 n ASP 41 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1nj9 n HIS 42 N 0.00 -1.47 -3.62 1.24 8.25 -1.05 -4.95 115.22 113.62 1nj9 n HIS 42 Ca 0.00 0.13 -0.40 0.00 -0.26 0.00 0.00 57.72 57.19 1nj9 n HIS 42 Cb 0.00 -2.85 -0.11 0.00 1.12 0.00 0.00 29.99 28.15 1nj9 n HIS 42 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1nj9 s LEU 43 N -7.26 4.94 -0.10 2.41 0.20 -0.94 -4.93 118.68 112.99 1nj9 s LEU 43 Ca 0.48 -1.34 -0.01 0.00 0.69 0.00 0.00 54.13 53.95 1nj9 s LEU 43 Cb -0.25 -1.98 -0.03 0.00 -0.43 0.00 0.00 46.19 43.50 1nj9 s LEU 43 CO 0.96 -0.47 -0.05 -0.36 -0.29 0.00 0.00 176.35 176.14 1nj9 s PHE 44 N 1.45 3.01 0.03 5.38 0.40 -1.26 0.43 117.98 127.42 1nj9 s PHE 44 Ca 0.02 -0.06 -0.28 0.00 -0.60 0.00 0.00 56.93 56.02 1nj9 s PHE 44 Cb -0.22 -1.81 0.08 0.00 0.51 0.00 0.00 43.02 41.58 1nj9 s PHE 44 CO 0.03 0.23 0.70 -1.54 0.70 0.00 0.00 175.22 175.34 1nj9 s SER 45 N -0.43 -0.57 0.28 1.36 1.04 -1.08 -4.97 113.70 109.33 1nj9 s SER 45 Ca 0.07 0.34 -0.29 0.00 0.48 0.00 0.00 55.95 56.54 1nj9 s SER 45 Cb -0.12 0.53 -0.10 0.00 0.10 0.00 0.00 66.02 66.43 1nj9 s SER 45 CO 0.02 -0.73 1.17 -0.83 0.98 0.00 0.00 173.24 173.85 1nj9 s GLY 46 N -1.93 2.99 -0.13 7.32 0.00 -1.26 -0.79 107.32 113.52 1nj9 s GLY 46 Ca -0.04 1.00 -0.15 0.00 0.00 0.00 0.00 44.72 45.53 1nj9 s GLY 46 CO -0.02 1.66 -0.28 -0.10 0.00 0.00 0.00 173.10 174.36 1nj9 n LEU 47 N 1.31 1.78 -3.80 0.66 7.94 0.37 -4.85 117.00 120.41 1nj9 n LEU 47 Ca 0.00 0.29 -0.12 0.00 -1.11 0.00 0.00 56.01 55.07 1nj9 n LEU 47 Cb 0.44 -0.67 -0.09 0.00 0.53 0.00 0.00 43.42 43.64 1nj9 n LEU 47 CO 0.56 -0.35 -0.05 -0.63 -1.11 0.00 0.00 177.39 175.81 1nj9 s ILE 48 N -2.73 0.07 0.09 1.96 -1.09 -1.06 -4.41 121.20 114.02 1nj9 s ILE 48 Ca -0.24 -0.60 0.07 0.00 -2.23 0.00 0.00 60.65 57.65 1nj9 s ILE 48 Cb 0.03 -0.61 -0.03 0.00 -1.58 0.00 0.00 42.46 40.27 1nj9 s ILE 48 CO 0.35 -0.33 -0.18 -0.83 -1.23 0.00 0.00 174.94 172.72 1nj9 s GLY 49 N -1.48 1.05 0.00 6.18 0.00 -0.80 0.15 107.32 112.42 1nj9 s GLY 49 Ca -0.12 -1.12 0.00 0.00 0.00 0.00 0.00 44.72 43.48 1nj9 s GLY 49 CO 0.02 -1.13 0.00 -0.62 0.00 0.00 0.00 173.10 171.37 1nj9 n VAL 50 N 1.21 0.00 -3.22 1.40 0.31 0.53 -2.36 118.33 116.20 1nj9 n VAL 50 Ca -0.20 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 63.97 1nj9 n VAL 50 Cb 0.54 -0.53 0.06 0.00 -0.91 0.00 0.00 33.84 32.99 1nj9 n VAL 50 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1nj9 n ASN 51 N -0.24 -4.41 0.00 4.52 4.13 -1.02 -4.71 115.26 113.53 1nj9 n ASN 51 Ca 0.00 -0.40 0.00 0.00 1.68 0.00 0.00 54.58 55.86 1nj9 n ASN 51 Cb 0.12 -3.73 0.00 0.00 -1.54 0.00 0.00 39.78 34.63 1nj9 n ASN 51 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 1nj9 n ASN 52 N -1.88 0.00 -3.76 6.41 6.94 -0.99 -2.45 115.26 119.53 1nj9 n ASN 52 Ca -0.04 0.00 -0.42 0.00 -0.02 0.00 0.00 54.58 54.09 1nj9 n ASN 52 Cb 0.56 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.86 1nj9 n ASN 52 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1nj9 n ALA 53 N -1.84 0.22 -1.97 -2.53 0.00 -1.04 -4.67 120.51 108.68 1nj9 n ALA 53 Ca 0.00 -0.06 -0.22 0.00 0.00 0.00 0.00 53.44 53.16 1nj9 n ALA 53 Cb 0.00 -1.87 0.06 0.00 0.00 0.00 0.00 19.45 17.64 1nj9 n ALA 53 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1nj9 s ARG 54 N 6.55 2.31 -0.07 0.00 0.52 -1.26 -1.90 118.95 125.09 1nj9 s ARG 54 Ca 1.10 -0.74 0.01 0.00 -0.52 0.00 0.00 55.73 55.58 1nj9 s ARG 54 Cb -1.17 -2.40 -0.03 0.00 0.52 0.00 0.00 34.95 31.87 1nj9 s ARG 54 CO 0.49 -0.96 -0.09 -1.25 0.02 0.00 0.00 175.30 173.51 1nj9 s PRO 55 N -4.93 2.77 0.00 3.54 0.04 -1.26 -4.95 135.00 130.21 1nj9 s PRO 55 Ca 0.60 -0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.05 1nj9 s PRO 55 Cb -0.09 -2.56 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1nj9 s PRO 55 CO 0.41 0.61 0.38 -0.35 0.04 0.00 0.00 177.00 178.09 1nj9 n PRO 56 N 2.37 0.20 0.00 0.56 -0.04 -1.26 -2.34 135.00 134.49 1nj9 n PRO 56 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1nj9 n PRO 56 Cb 0.53 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 1nj9 n PRO 56 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nj9 n GLY 57 N 1.84 0.00 3.72 0.55 0.00 -1.26 -5.09 105.19 104.94 1nj9 n GLY 57 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1nj9 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nj9 s VAL 58 N -1.27 3.00 0.92 1.61 1.01 -0.99 -4.99 120.40 119.68 1nj9 s VAL 58 Ca 0.00 0.72 -0.12 0.00 0.00 0.00 0.00 61.98 62.58 1nj9 s VAL 58 Cb 0.00 -3.46 0.06 0.00 0.00 0.00 0.00 36.38 32.98 1nj9 s VAL 58 CO 0.00 0.06 0.67 -2.65 0.00 0.00 0.00 175.10 173.18 1nj9 n PRO 59 N 3.93 -0.26 0.27 2.72 -0.02 -1.26 -4.83 135.00 135.55 1nj9 n PRO 59 Ca 0.12 -0.02 0.14 0.00 -2.02 0.00 0.00 63.50 61.72 1nj9 n PRO 59 Cb 0.41 -2.03 0.75 0.00 -0.02 0.00 0.00 33.50 32.60 1nj9 n PRO 59 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nj9 h ALA 60 N -1.52 1.18 0.00 3.55 0.00 -1.98 -2.50 119.26 117.99 1nj9 h ALA 60 Ca -0.44 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1nj9 h ALA 60 Cb 1.28 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1nj9 h ALA 60 CO 0.37 0.13 0.00 0.07 0.00 0.00 0.00 179.25 179.82 1nj9 h ARG 61 N 0.00 0.00 -5.55 0.00 0.11 -1.88 -3.41 114.38 103.65 1nj9 h ARG 61 Ca -0.00 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 59.47 1nj9 h ARG 61 Cb 0.37 0.00 -0.11 0.00 1.11 0.00 0.00 29.97 31.34 1nj9 h ARG 61 CO 0.01 0.00 0.16 -0.06 0.10 0.00 0.00 179.97 180.18 1nj9 s PHE 62 N -3.84 3.30 -0.08 4.08 0.40 -0.94 -1.87 117.98 119.03 1nj9 s PHE 62 Ca -0.01 0.85 -0.04 0.00 -0.60 0.00 0.00 56.93 57.13 1nj9 s PHE 62 Cb 0.10 -2.84 0.04 0.00 0.51 0.00 0.00 43.02 40.84 1nj9 s PHE 62 CO 0.49 -0.29 0.18 0.45 0.70 0.00 0.00 175.22 176.74 1nj9 s SER 63 N 1.41 0.05 0.14 1.36 0.15 -0.23 -4.94 113.70 111.65 1nj9 s SER 63 Ca 0.27 0.37 0.03 0.00 0.70 0.00 0.00 55.95 57.32 1nj9 s SER 63 Cb -0.16 0.29 -0.04 0.00 -1.71 0.00 0.00 66.02 64.40 1nj9 s SER 63 CO 0.09 -0.18 0.24 -0.83 1.20 0.00 0.00 173.24 173.76 1nj9 s GLY 64 N 1.49 1.78 0.29 9.45 0.00 -1.26 -0.67 107.32 118.40 1nj9 s GLY 64 Ca -0.06 -1.04 -0.19 0.00 0.00 0.00 0.00 44.72 43.43 1nj9 s GLY 64 CO -0.07 -1.03 0.85 -0.45 0.00 0.00 0.00 173.10 172.40 1nj9 s SER 65 N -3.09 -0.07 -0.44 1.64 0.15 -0.82 -3.93 113.70 107.13 1nj9 s SER 65 Ca 0.34 -0.85 0.02 0.00 0.70 0.00 0.00 55.95 56.16 1nj9 s SER 65 Cb -0.11 0.71 0.13 0.00 -1.71 0.00 0.00 66.02 65.04 1nj9 s SER 65 CO 0.27 -1.38 0.22 -0.76 1.20 0.00 0.00 173.24 172.79 1nj9 s LEU 66 N -3.09 3.20 -0.26 3.45 1.43 -1.26 -1.54 118.68 120.60 1nj9 s LEU 66 Ca 0.15 -2.62 -0.07 0.00 -1.03 0.00 0.00 54.13 50.57 1nj9 s LEU 66 Cb -0.04 -1.21 -0.15 0.00 0.03 0.00 0.00 46.19 44.81 1nj9 s LEU 66 CO 0.08 -0.28 -0.26 0.41 0.23 0.00 0.00 176.35 176.53 1nj9 n THR 67 N 3.58 1.52 0.00 5.49 -1.04 -1.17 -4.94 114.28 117.72 1nj9 n THR 67 Ca 0.06 -0.47 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 1nj9 n THR 67 Cb 0.35 -1.68 0.00 0.00 -1.82 0.00 0.00 70.33 67.18 1nj9 n THR 67 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nj9 n GLY 68 N 1.73 1.23 2.46 3.41 0.00 -1.26 -4.84 105.19 107.92 1nj9 n GLY 68 Ca -0.50 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.52 1nj9 n GLY 68 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nj9 n ASP 69 N 0.00 0.40 -3.64 1.61 9.92 -1.26 -5.00 116.55 118.57 1nj9 n ASP 69 Ca 0.00 -2.07 -0.10 0.00 -0.53 0.00 0.00 54.79 52.09 1nj9 n ASP 69 Cb 0.00 -0.05 -0.03 0.00 -0.64 0.00 0.00 41.12 40.40 1nj9 n ASP 69 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 1nj9 s LYS 70 N -1.83 1.38 0.31 -1.24 -2.85 -1.26 -4.06 119.74 110.18 1nj9 s LYS 70 Ca 0.21 -0.74 -0.17 0.00 -1.00 0.00 0.00 55.97 54.26 1nj9 s LYS 70 Cb 0.34 0.55 -0.09 0.00 -2.06 0.00 0.00 37.83 36.57 1nj9 s LYS 70 CO -0.08 -0.59 0.76 0.00 0.10 0.00 0.00 175.35 175.53 1nj9 s ALA 71 N -3.83 3.32 -0.05 0.59 0.00 -0.13 -3.05 121.76 118.61 1nj9 s ALA 71 Ca 0.06 0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.17 1nj9 s ALA 71 Cb -0.01 -2.83 0.01 0.00 0.00 0.00 0.00 23.12 20.29 1nj9 s ALA 71 CO -0.06 0.31 -0.11 0.08 0.00 0.00 0.00 175.76 175.98 1nj9 s VAL 72 N -1.87 1.02 -0.32 0.00 1.01 -0.59 -0.49 120.40 119.16 1nj9 s VAL 72 Ca 0.52 -0.45 -0.05 0.00 0.00 0.00 0.00 61.98 62.00 1nj9 s VAL 72 Cb -0.12 -0.92 0.04 0.00 0.00 0.00 0.00 36.38 35.38 1nj9 s VAL 72 CO 0.18 0.32 0.07 -0.22 0.00 0.00 0.00 175.10 175.45 1nj9 s LEU 73 N 0.44 4.10 -0.15 3.92 2.96 0.16 -1.94 118.68 128.17 1nj9 s LEU 73 Ca -0.09 -1.09 -0.08 0.00 -0.22 0.00 0.00 54.13 52.66 1nj9 s LEU 73 Cb -0.13 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 1nj9 s LEU 73 CO 0.02 -0.28 0.12 -0.89 -1.32 0.00 0.00 176.35 174.00 1nj9 s THR 74 N 1.38 5.30 -0.49 3.68 2.01 0.15 -0.81 115.64 126.86 1nj9 s THR 74 Ca -0.02 0.14 0.03 0.00 0.31 0.00 0.00 61.69 62.15 1nj9 s THR 74 Cb -0.19 -3.35 0.13 0.00 0.01 0.00 0.00 72.50 69.10 1nj9 s THR 74 CO 0.02 0.54 0.26 -0.63 -0.69 0.00 0.00 174.62 174.11 1nj9 s ILE 75 N -0.36 2.00 -0.35 1.82 1.01 0.51 -1.06 121.20 124.76 1nj9 s ILE 75 Ca 0.11 -2.98 -0.27 0.00 0.00 0.00 0.00 60.65 57.50 1nj9 s ILE 75 Cb -0.12 -2.39 0.02 0.00 0.01 0.00 0.00 42.46 39.98 1nj9 s ILE 75 CO 0.01 -0.86 1.00 -0.89 0.00 0.00 0.00 174.94 174.20 1nj9 s THR 76 N -0.03 4.53 0.00 2.92 2.01 -0.78 -1.04 115.64 123.25 1nj9 s THR 76 Ca 0.18 1.43 0.00 0.00 0.31 0.00 0.00 61.69 63.61 1nj9 s THR 76 Cb -0.24 -4.38 0.00 0.00 0.01 0.00 0.00 72.50 67.89 1nj9 s THR 76 CO -0.01 -0.54 0.00 0.61 -0.69 0.00 0.00 174.62 173.99 1nj9 n GLY 77 N 4.19 0.79 3.59 4.40 0.00 -0.92 -4.63 105.19 112.62 1nj9 n GLY 77 Ca 0.09 -0.46 -0.51 0.00 0.00 0.00 0.00 46.02 45.14 1nj9 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nj9 n ALA 78 N -1.51 -0.78 -2.02 4.61 0.00 0.57 -4.25 120.51 117.13 1nj9 n ALA 78 Ca 0.00 0.51 -0.19 0.00 0.00 0.00 0.00 53.44 53.76 1nj9 n ALA 78 Cb 0.38 -2.09 0.04 0.00 0.00 0.00 0.00 19.45 17.78 1nj9 n ALA 78 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1nj9 s GLN 79 N 0.41 2.51 0.32 0.00 -1.52 -1.26 -1.05 119.66 119.07 1nj9 s GLN 79 Ca 0.83 -1.45 0.15 0.00 -1.95 0.00 0.00 55.36 52.93 1nj9 s GLN 79 Cb -0.92 -2.68 0.51 0.00 -0.22 0.00 0.00 33.01 29.70 1nj9 s GLN 79 CO 0.47 -0.64 1.67 1.79 -0.25 0.00 0.00 175.29 178.33 1nj9 h THR 80 N 0.34 1.13 -0.03 -0.19 1.35 -1.94 -2.69 112.91 110.88 1nj9 h THR 80 Ca -0.34 -1.82 0.00 0.00 -0.55 0.00 0.00 66.41 63.69 1nj9 h THR 80 Cb 1.28 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 1nj9 h THR 80 CO 0.43 0.48 0.00 -1.84 -0.25 0.00 0.00 175.52 174.34 1nj9 n GLU 81 N -3.63 1.23 0.00 4.72 0.00 -1.26 -2.61 120.64 119.08 1nj9 n GLU 81 Ca -0.01 -0.34 0.14 0.00 0.00 0.00 0.00 57.16 56.96 1nj9 n GLU 81 Cb 0.57 -1.41 0.61 0.00 0.00 0.00 0.00 31.44 31.20 1nj9 n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1nj9 n ASP 82 N -0.52 0.94 -4.59 -1.84 9.92 -1.01 -4.70 116.55 114.75 1nj9 n ASP 82 Ca 0.19 -1.15 -0.42 0.00 -0.53 0.00 0.00 54.79 52.88 1nj9 n ASP 82 Cb 0.17 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.63 1nj9 n ASP 82 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1nj9 s GLU 83 N -2.16 3.48 0.04 -1.24 2.56 -1.07 -4.77 118.70 115.54 1nj9 s GLU 83 Ca 0.36 0.57 -0.05 0.00 0.00 0.00 0.00 54.97 55.85 1nj9 s GLU 83 Cb 0.21 -4.04 0.02 0.00 2.00 0.00 0.00 34.13 32.31 1nj9 s GLU 83 CO 0.39 -1.70 0.25 0.00 -0.56 0.00 0.00 175.26 173.64 1nj9 n ALA 84 N 8.88 -0.66 -3.36 6.30 0.00 -1.18 -4.69 120.51 125.80 1nj9 n ALA 84 Ca 0.13 -0.23 -0.36 0.00 0.00 0.00 0.00 53.44 52.97 1nj9 n ALA 84 Cb 0.49 0.12 -0.13 0.00 0.00 0.00 0.00 19.45 19.93 1nj9 n ALA 84 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1nj9 s ILE 85 N -2.41 3.61 -0.27 0.00 1.09 -0.77 -0.30 121.20 122.15 1nj9 s ILE 85 Ca 0.06 -0.74 -0.16 0.00 -1.10 0.00 0.00 60.65 58.70 1nj9 s ILE 85 Cb -0.01 -2.82 -0.03 0.00 -1.06 0.00 0.00 42.46 38.54 1nj9 s ILE 85 CO 0.01 0.16 0.44 -0.31 -0.10 0.00 0.00 174.94 175.14 1nj9 s TYR 86 N 1.45 3.25 0.09 3.97 1.51 0.41 -0.57 117.35 127.46 1nj9 s TYR 86 Ca 0.02 0.47 0.03 0.00 -1.01 0.00 0.00 57.07 56.58 1nj9 s TYR 86 Cb -0.17 -2.66 -0.04 0.00 -0.11 0.00 0.00 41.96 38.99 1nj9 s TYR 86 CO -0.00 -0.28 0.10 -0.06 -1.11 0.00 0.00 175.55 174.20 1nj9 s PHE 87 N 2.18 3.22 0.33 2.71 0.08 -0.70 -0.99 117.98 124.81 1nj9 s PHE 87 Ca 0.17 0.08 0.09 0.00 0.12 0.00 0.00 56.93 57.40 1nj9 s PHE 87 Cb -0.16 -1.62 -0.05 0.00 -0.57 0.00 0.00 43.02 40.62 1nj9 s PHE 87 CO 0.10 0.53 -0.03 0.00 -0.10 0.00 0.00 175.22 175.72 1nj9 s ALA 89 N -2.51 -1.57 0.11 0.00 0.00 -1.03 -2.86 121.76 113.89 1nj9 s ALA 89 Ca 0.34 1.95 0.07 0.00 0.00 0.00 0.00 51.96 54.32 1nj9 s ALA 89 Cb -0.01 -1.46 -0.04 0.00 0.00 0.00 0.00 23.12 21.61 1nj9 s ALA 89 CO 0.18 -0.71 -0.12 -0.51 0.00 0.00 0.00 175.76 174.61 1nj9 s LEU 90 N 2.44 2.97 -0.34 0.00 1.43 0.01 -2.79 118.68 122.39 1nj9 s LEU 90 Ca -0.05 -0.42 -0.08 0.00 -1.03 0.00 0.00 54.13 52.54 1nj9 s LEU 90 Cb -0.11 -1.77 0.03 0.00 0.03 0.00 0.00 46.19 44.37 1nj9 s LEU 90 CO -0.16 0.18 0.14 0.86 0.23 0.00 0.00 176.35 177.60 1nj9 s TRP 91 N -1.20 3.23 0.54 0.29 -0.11 0.52 -0.85 118.94 121.36 1nj9 s TRP 91 Ca 0.21 -1.16 0.08 0.00 1.22 0.00 0.00 56.10 56.45 1nj9 s TRP 91 Cb -0.11 -2.33 0.05 0.00 -1.50 0.00 0.00 33.47 29.58 1nj9 s TRP 91 CO 0.13 -0.67 0.59 0.71 -4.62 0.00 0.00 176.95 173.09 1nj9 s TYR 92 N 1.48 1.67 -0.16 5.86 1.51 -0.81 -4.44 117.35 122.46 1nj9 s TYR 92 Ca 0.01 -0.74 -0.29 0.00 -1.01 0.00 0.00 57.07 55.04 1nj9 s TYR 92 Cb -0.19 -2.09 -0.03 0.00 -0.11 0.00 0.00 41.96 39.54 1nj9 s TYR 92 CO 0.04 -0.76 1.52 0.45 -1.11 0.00 0.00 175.55 175.70 1nj9 s SER 93 N -4.45 6.63 -1.26 2.29 0.15 -1.26 -1.95 113.70 113.84 1nj9 s SER 93 Ca 0.49 1.80 0.00 0.00 0.70 0.00 0.00 55.95 58.94 1nj9 s SER 93 Cb -0.04 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 1nj9 s SER 93 CO 0.30 -1.02 0.00 0.59 1.20 0.00 0.00 173.24 174.31 1nj9 n ASN 94 N 7.53 -4.35 -3.97 5.45 4.13 -1.26 -5.02 115.26 117.77 1nj9 n ASN 94 Ca 0.17 0.14 -0.09 0.00 1.68 0.00 0.00 54.58 56.48 1nj9 n ASN 94 Cb 0.44 -3.32 -0.10 0.00 -1.54 0.00 0.00 39.78 35.27 1nj9 n ASN 94 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 1nj9 s HIS 95 N -2.59 0.28 -0.20 3.10 3.76 -0.82 -5.14 115.29 113.67 1nj9 s HIS 95 Ca 0.00 -0.65 -0.03 0.00 -0.15 0.00 0.00 55.06 54.23 1nj9 s HIS 95 Cb 0.00 -0.20 -0.01 0.00 1.11 0.00 0.00 32.58 33.48 1nj9 s HIS 95 CO 0.00 -0.36 -0.05 -1.58 -0.85 0.00 0.00 174.74 171.90 1nj9 s TRP 96 N -2.86 2.95 -0.15 1.40 0.23 -1.26 -1.92 118.94 117.33 1nj9 s TRP 96 Ca -0.03 -0.81 0.01 0.00 -2.03 0.00 0.00 56.10 53.25 1nj9 s TRP 96 Cb 0.00 -2.05 0.00 0.00 0.03 0.00 0.00 33.47 31.45 1nj9 s TRP 96 CO -0.06 -0.43 -0.18 0.08 0.96 0.00 0.00 176.95 177.32 1nj9 s VAL 97 N 1.19 2.43 0.29 4.03 1.01 -0.03 -4.87 120.40 124.44 1nj9 s VAL 97 Ca 0.02 -0.85 -0.05 0.00 0.00 0.00 0.00 61.98 61.10 1nj9 s VAL 97 Cb -0.14 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 1nj9 s VAL 97 CO -0.01 0.53 0.56 -0.36 0.00 0.00 0.00 175.10 175.82 1nj9 s PHE 98 N 0.82 3.47 0.71 5.22 0.40 -1.26 -0.81 117.98 126.54 1nj9 s PHE 98 Ca -0.06 0.67 -0.05 0.00 -0.60 0.00 0.00 56.93 56.89 1nj9 s PHE 98 Cb -0.15 -2.13 0.15 0.00 0.51 0.00 0.00 43.02 41.40 1nj9 s PHE 98 CO -0.01 0.17 0.97 0.41 0.70 0.00 0.00 175.22 177.46 1nj9 n GLY 99 N -0.90 -0.06 0.30 4.36 0.00 -1.13 -4.56 105.19 103.20 1nj9 n GLY 99 Ca -0.01 -1.91 0.15 0.00 0.00 0.00 0.00 46.02 44.25 1nj9 n GLY 99 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1nj9 h GLY 100 N -0.87 0.00 0.00 -0.02 0.00 -1.86 -3.46 103.07 96.87 1nj9 h GLY 100 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1nj9 h GLY 100 CO 0.30 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.45 1nj9 n GLY 101 N -1.21 -0.69 3.12 4.60 0.00 -1.26 -5.03 105.19 104.73 1nj9 n GLY 101 Ca -0.03 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.36 1nj9 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nj9 s THR 102 N -1.26 2.07 -0.42 2.61 2.01 -0.16 -4.62 115.64 115.86 1nj9 s THR 102 Ca 0.00 -0.94 -0.21 0.00 0.31 0.00 0.00 61.69 60.85 1nj9 s THR 102 Cb 0.00 -1.87 0.02 0.00 0.01 0.00 0.00 72.50 70.66 1nj9 s THR 102 CO 0.00 0.54 0.68 -0.75 -0.69 0.00 0.00 174.62 174.39 1nj9 s LYS 103 N 1.29 3.39 -0.23 4.92 2.20 -1.22 0.15 119.74 130.24 1nj9 s LYS 103 Ca 0.05 -0.22 -0.17 0.00 -0.36 0.00 0.00 55.97 55.27 1nj9 s LYS 103 Cb -0.13 -3.92 -0.03 0.00 -1.51 0.00 0.00 37.83 32.24 1nj9 s LYS 103 CO -0.13 -0.98 0.47 -1.17 -0.36 0.00 0.00 175.35 173.18 1nj9 s LEU 104 N 2.91 4.10 -0.04 5.43 2.96 0.59 -3.10 118.68 131.53 1nj9 s LEU 104 Ca 0.25 0.53 -0.18 0.00 -0.22 0.00 0.00 54.13 54.51 1nj9 s LEU 104 Cb -0.14 -2.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.89 1nj9 s LEU 104 CO 0.19 -0.20 0.49 -0.89 -1.32 0.00 0.00 176.35 174.62 1nj9 s THR 105 N 1.87 5.03 -0.25 3.68 2.01 0.94 -3.13 115.64 125.79 1nj9 s THR 105 Ca 0.21 1.00 0.01 0.00 0.31 0.00 0.00 61.69 63.21 1nj9 s THR 105 Cb -0.15 -3.81 0.06 0.00 0.01 0.00 0.00 72.50 68.61 1nj9 s THR 105 CO 0.09 0.45 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.74 1nj9 s VAL 106 N -0.27 1.64 -0.58 3.82 1.01 -1.25 0.16 120.40 124.93 1nj9 s VAL 106 Ca 0.26 -1.37 -0.26 0.00 0.00 0.00 0.00 61.98 60.61 1nj9 s VAL 106 Cb -0.17 -1.92 -0.10 0.00 0.00 0.00 0.00 36.38 34.19 1nj9 s VAL 106 CO 0.13 -0.16 2.45 0.18 0.00 0.00 0.00 175.10 177.70 1nj9 n LEU 107 N 4.61 1.99 -1.38 3.92 4.77 0.19 -4.80 117.00 126.31 1nj9 n LEU 107 Ca -0.11 -0.55 0.11 0.00 -0.03 0.00 0.00 56.01 55.44 1nj9 n LEU 107 Cb 0.43 -1.51 0.32 0.00 -2.33 0.00 0.00 43.42 40.34 1nj9 n LEU 107 CO 0.18 -1.60 0.78 0.61 -1.33 0.00 0.00 177.39 176.03 1nj9 n GLY 108 N 6.14 2.40 3.60 -0.72 0.00 -1.26 -4.40 105.19 110.94 1nj9 n GLY 108 Ca 0.42 -0.78 -0.04 0.00 0.00 0.00 0.00 46.02 45.61 1nj9 n GLY 108 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1nj9 s GLN 109 N -1.24 0.52 0.49 1.61 -2.07 -1.26 -5.14 119.66 112.57 1nj9 s GLN 109 Ca 0.48 -0.23 -0.23 0.00 -1.82 0.00 0.00 55.36 53.56 1nj9 s GLN 109 Cb 0.27 0.22 -0.07 0.00 -1.09 0.00 0.00 33.01 32.33 1nj9 s GLN 109 CO 0.30 -0.23 1.25 -2.30 -1.32 0.00 0.00 175.29 172.99 1nj9 n PRO 110 N -0.25 1.69 -1.94 9.60 -0.02 -1.26 -4.90 135.00 137.93 1nj9 n PRO 110 Ca -0.04 0.61 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 1nj9 n PRO 110 Cb 0.60 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.64 1nj9 n PRO 110 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1nj9 s LYS 111 N -2.50 4.21 0.45 -0.52 3.01 -1.26 -4.81 119.74 118.31 1nj9 s LYS 111 Ca 0.67 2.34 0.07 0.00 -1.01 0.00 0.00 55.97 58.03 1nj9 s LYS 111 Cb -0.46 -3.33 -0.02 0.00 -1.01 0.00 0.00 37.83 33.00 1nj9 s LYS 111 CO 0.54 -0.65 0.28 0.45 0.51 0.00 0.00 175.35 176.48 1nj9 s SER 112 N 1.64 4.65 0.15 2.83 0.15 0.51 -4.91 113.70 118.72 1nj9 s SER 112 Ca 0.71 -1.03 0.08 0.00 0.70 0.00 0.00 55.95 56.41 1nj9 s SER 112 Cb -0.42 -0.28 -0.04 0.00 -1.71 0.00 0.00 66.02 63.57 1nj9 s SER 112 CO 0.32 -0.71 -0.11 -0.55 1.20 0.00 0.00 173.24 173.39 1nj9 s SER 113 N -4.05 4.24 0.23 5.45 0.15 -1.25 -3.31 113.70 115.16 1nj9 s SER 113 Ca 0.41 -0.51 -0.28 0.00 0.70 0.00 0.00 55.95 56.26 1nj9 s SER 113 Cb 0.00 -0.73 -0.09 0.00 -1.71 0.00 0.00 66.02 63.50 1nj9 s SER 113 CO 0.23 0.14 0.90 -2.16 1.20 0.00 0.00 173.24 173.55 1nj9 s PRO 114 N -2.53 4.76 -0.31 5.44 0.04 -1.26 -4.06 135.00 137.09 1nj9 s PRO 114 Ca 0.23 1.39 -0.15 0.00 0.04 0.00 0.00 61.00 62.51 1nj9 s PRO 114 Cb -0.10 -3.22 -0.02 0.00 0.04 0.00 0.00 34.50 31.20 1nj9 s PRO 114 CO 0.14 0.50 0.38 -1.12 0.04 0.00 0.00 177.00 176.95 1nj9 s SER 115 N -1.23 6.23 -0.10 6.66 0.01 0.85 -4.86 113.70 121.27 1nj9 s SER 115 Ca 0.41 0.05 -0.03 0.00 1.31 0.00 0.00 55.95 57.69 1nj9 s SER 115 Cb -0.25 -2.21 -0.03 0.00 0.21 0.00 0.00 66.02 63.74 1nj9 s SER 115 CO 0.30 -0.27 0.02 -0.69 0.41 0.00 0.00 173.24 173.01 1nj9 s VAL 116 N 2.08 4.50 -0.11 3.43 1.01 -1.26 -1.59 120.40 128.48 1nj9 s VAL 116 Ca 0.14 -0.17 -0.03 0.00 0.00 0.00 0.00 61.98 61.92 1nj9 s VAL 116 Cb -0.16 -2.91 0.04 0.00 0.00 0.00 0.00 36.38 33.35 1nj9 s VAL 116 CO 0.11 0.60 0.04 0.42 0.00 0.00 0.00 175.10 176.27 1nj9 s THR 117 N -0.82 0.19 -0.23 3.92 -4.23 -0.83 -4.96 115.64 108.68 1nj9 s THR 117 Ca 0.13 0.00 -0.16 0.00 -1.18 0.00 0.00 61.69 60.48 1nj9 s THR 117 Cb -0.12 -0.55 -0.04 0.00 1.34 0.00 0.00 72.50 73.14 1nj9 s THR 117 CO 0.02 0.03 0.39 -0.22 -0.54 0.00 0.00 174.62 174.31 1nj9 s LEU 118 N 2.03 4.11 -0.08 4.79 0.20 -1.25 -1.79 118.68 126.69 1nj9 s LEU 118 Ca 0.03 0.44 -0.00 0.00 0.69 0.00 0.00 54.13 55.29 1nj9 s LEU 118 Cb -0.14 -2.49 -0.03 0.00 -0.43 0.00 0.00 46.19 43.10 1nj9 s LEU 118 CO -0.06 -0.12 -0.04 -0.36 -0.29 0.00 0.00 176.35 175.49 1nj9 s PHE 119 N 1.58 3.04 0.66 5.38 0.08 0.55 -4.95 117.98 124.33 1nj9 s PHE 119 Ca 0.18 0.09 -0.09 0.00 0.12 0.00 0.00 56.93 57.22 1nj9 s PHE 119 Cb -0.15 -1.75 0.01 0.00 -0.57 0.00 0.00 43.02 40.56 1nj9 s PHE 119 CO 0.08 0.38 1.02 -1.25 -0.10 0.00 0.00 175.22 175.35 1nj9 s PRO 120 N -0.81 2.88 0.50 0.24 0.04 -1.26 -0.70 135.00 135.89 1nj9 s PRO 120 Ca 0.12 0.27 -0.21 0.00 0.04 0.00 0.00 61.00 61.22 1nj9 s PRO 120 Cb -0.11 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.23 1nj9 s PRO 120 CO 0.02 -0.90 1.12 -1.25 0.04 0.00 0.00 177.00 176.02 1nj9 s PRO 121 N -5.21 3.60 0.00 0.56 0.04 -1.25 -4.70 135.00 128.04 1nj9 s PRO 121 Ca 0.56 1.60 0.00 0.00 0.04 0.00 0.00 61.00 63.20 1nj9 s PRO 121 Cb -0.11 -2.16 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1nj9 s PRO 121 CO 0.49 -0.64 0.00 -1.13 0.04 0.00 0.00 177.00 175.76 1nj9 n SER 122 N -0.95 0.00 0.00 6.66 3.41 -1.26 -4.96 113.62 116.52 1nj9 n SER 122 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1nj9 n SER 122 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1nj9 n SER 122 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1nj9 n SER 123 N 0.00 0.00 -0.24 4.04 7.64 -1.26 -3.72 113.62 120.08 1nj9 n SER 123 Ca 0.00 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.06 1nj9 n SER 123 Cb 0.00 -0.12 0.33 0.00 -1.01 0.00 0.00 64.21 63.41 1nj9 n SER 123 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1nj9 n GLU 124 N -1.75 -0.05 -0.03 1.43 4.71 -1.26 0.37 120.64 124.06 1nj9 n GLU 124 Ca 0.00 1.03 -0.13 0.00 -0.01 0.00 0.00 57.16 58.05 1nj9 n GLU 124 Cb 0.00 -1.76 -0.09 0.00 -1.01 0.00 0.00 31.44 28.58 1nj9 n GLU 124 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 1nj9 h GLU 125 N 0.00 0.19 -0.69 3.49 4.81 -1.85 -3.14 114.58 117.39 1nj9 h GLU 125 Ca 0.54 -0.12 0.14 0.00 -0.13 0.00 0.00 59.36 59.79 1nj9 h GLU 125 Cb 1.31 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.66 1nj9 h GLU 125 CO -0.61 0.70 0.47 -0.07 -0.73 0.00 0.00 179.01 178.77 1nj9 h LEU 126 N -0.29 0.33 0.00 1.64 3.38 0.70 0.16 115.31 121.22 1nj9 h LEU 126 Ca 0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1nj9 h LEU 126 Cb 0.69 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1nj9 h LEU 126 CO 0.03 0.17 0.00 -0.62 0.09 0.00 0.00 178.44 178.11 1nj9 n GLU 127 N -4.46 0.31 -0.05 1.13 1.02 0.86 -1.35 120.64 118.10 1nj9 n GLU 127 Ca 0.13 0.10 0.11 0.00 -0.02 0.00 0.00 57.16 57.47 1nj9 n GLU 127 Cb 0.51 -1.50 0.12 0.00 -0.02 0.00 0.00 31.44 30.55 1nj9 n GLU 127 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1nj9 n THR 128 N -1.20 0.13 -2.89 2.62 -2.24 0.55 -4.93 114.28 106.32 1nj9 n THR 128 Ca 0.09 -0.57 -0.10 0.00 -2.27 0.00 0.00 64.05 61.21 1nj9 n THR 128 Cb 0.10 1.33 0.03 0.00 -2.10 0.00 0.00 70.33 69.69 1nj9 n THR 128 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1nj9 n ASN 129 N 1.26 -3.74 -3.83 3.42 4.05 -0.46 -4.97 115.26 111.00 1nj9 n ASN 129 Ca 0.14 -0.20 -0.13 0.00 0.45 0.00 0.00 54.58 54.83 1nj9 n ASN 129 Cb 0.55 -2.34 -0.15 0.00 1.23 0.00 0.00 39.78 39.07 1nj9 n ASN 129 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1nj9 s LYS 130 N -5.46 -0.02 -0.26 1.20 3.01 -1.22 -2.85 119.74 114.14 1nj9 s LYS 130 Ca 0.22 0.09 -0.01 0.00 -1.01 0.00 0.00 55.97 55.26 1nj9 s LYS 130 Cb -0.10 -0.11 0.08 0.00 -1.01 0.00 0.00 37.83 36.69 1nj9 s LYS 130 CO 0.28 -0.08 0.05 0.00 0.51 0.00 0.00 175.35 176.11 1nj9 s ALA 131 N 0.48 1.48 -0.38 5.17 0.00 0.08 -2.66 121.76 125.93 1nj9 s ALA 131 Ca -0.04 -1.33 -0.15 0.00 0.00 0.00 0.00 51.96 50.44 1nj9 s ALA 131 Cb -0.06 -1.46 0.00 0.00 0.00 0.00 0.00 23.12 21.61 1nj9 s ALA 131 CO -0.01 -1.43 0.33 0.99 0.00 0.00 0.00 175.76 175.64 1nj9 s THR 132 N 1.64 5.21 0.05 0.00 2.01 -1.26 -2.82 115.64 120.46 1nj9 s THR 132 Ca 0.04 -0.34 -0.25 0.00 0.31 0.00 0.00 61.69 61.44 1nj9 s THR 132 Cb -0.18 -3.88 -0.05 0.00 0.01 0.00 0.00 72.50 68.40 1nj9 s THR 132 CO -0.16 -0.22 0.77 -0.76 -0.69 0.00 0.00 174.62 173.57 1nj9 s LEU 133 N 1.86 4.45 -0.08 4.42 1.43 -0.42 -3.85 118.68 126.50 1nj9 s LEU 133 Ca 0.08 1.46 0.03 0.00 -1.03 0.00 0.00 54.13 54.66 1nj9 s LEU 133 Cb -0.18 -3.24 -0.02 0.00 0.03 0.00 0.00 46.19 42.78 1nj9 s LEU 133 CO 0.11 0.01 -0.15 -0.69 0.23 0.00 0.00 176.35 175.87 1nj9 s VAL 134 N -0.04 2.99 -0.27 -1.59 1.01 0.12 -2.13 120.40 120.50 1nj9 s VAL 134 Ca 0.39 -0.73 -0.00 0.00 0.00 0.00 0.00 61.98 61.64 1nj9 s VAL 134 Cb -0.21 -2.20 0.08 0.00 0.00 0.00 0.00 36.38 34.06 1nj9 s VAL 134 CO 0.23 0.57 0.04 0.00 0.00 0.00 0.00 175.10 175.94 1nj9 s THR 136 N 1.55 5.40 -0.19 0.00 -4.23 -0.74 -1.59 115.64 115.84 1nj9 s THR 136 Ca 0.03 0.34 -0.01 0.00 -1.18 0.00 0.00 61.69 60.87 1nj9 s THR 136 Cb -0.18 -3.48 0.00 0.00 1.34 0.00 0.00 72.50 70.18 1nj9 s THR 136 CO -0.15 0.58 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.76 1nj9 s ILE 137 N -0.77 2.80 0.13 2.99 1.01 0.22 -1.96 121.20 125.62 1nj9 s ILE 137 Ca 0.16 -0.70 0.04 0.00 0.00 0.00 0.00 60.65 60.15 1nj9 s ILE 137 Cb -0.13 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 1nj9 s ILE 137 CO 0.05 0.48 -0.09 -0.89 0.00 0.00 0.00 174.94 174.49 1nj9 s THR 138 N 1.21 1.04 -1.57 2.92 2.01 -0.62 0.41 115.64 121.04 1nj9 s THR 138 Ca 0.02 -2.03 -0.14 0.00 0.31 0.00 0.00 61.69 59.85 1nj9 s THR 138 Cb -0.14 -1.80 0.10 0.00 0.01 0.00 0.00 72.50 70.67 1nj9 s THR 138 CO -0.05 -0.78 0.91 0.47 -0.69 0.00 0.00 174.62 174.48 1nj9 n ASP 139 N -0.15 -4.18 -4.38 3.53 8.00 -0.95 -0.10 116.55 118.32 1nj9 n ASP 139 Ca -0.11 -0.85 -0.34 0.00 0.71 0.00 0.00 54.79 54.20 1nj9 n ASP 139 Cb 0.61 -3.56 -0.14 0.00 -0.02 0.00 0.00 41.12 38.01 1nj9 n ASP 139 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1nj9 s PHE 140 N -3.33 2.93 -0.04 1.24 -0.12 -0.52 -3.92 117.98 114.22 1nj9 s PHE 140 Ca 0.65 -0.67 0.04 0.00 -0.05 0.00 0.00 56.93 56.90 1nj9 s PHE 140 Cb -0.33 -1.99 -0.00 0.00 -0.63 0.00 0.00 43.02 40.07 1nj9 s PHE 140 CO 0.86 -0.30 -0.15 -0.47 -0.05 0.00 0.00 175.22 175.10 1nj9 s TYR 141 N 0.83 1.50 1.01 3.49 5.04 -1.21 -1.26 117.35 126.76 1nj9 s TYR 141 Ca -0.02 -0.41 -0.15 0.00 -2.44 0.00 0.00 57.07 54.05 1nj9 s TYR 141 Cb -0.15 -1.01 0.20 0.00 0.35 0.00 0.00 41.96 41.35 1nj9 s TYR 141 CO 0.01 -0.14 1.17 -2.14 -1.34 0.00 0.00 175.55 173.11 1nj9 s PRO 142 N 0.04 0.28 -0.12 4.97 0.02 -1.26 0.19 135.00 139.12 1nj9 s PRO 142 Ca -0.03 0.05 -0.03 0.00 0.02 0.00 0.00 61.00 61.02 1nj9 s PRO 142 Cb -0.10 -1.76 -0.04 0.00 0.02 0.00 0.00 34.50 32.62 1nj9 s PRO 142 CO 0.01 -2.73 2.62 0.41 -0.33 0.00 0.00 177.00 176.99 1nj9 n GLY 143 N -2.10 3.21 2.92 0.52 0.00 -1.26 -4.84 105.19 103.65 1nj9 n GLY 143 Ca 0.10 -0.84 -0.27 0.00 0.00 0.00 0.00 46.02 45.00 1nj9 n GLY 143 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nj9 s VAL 144 N -0.42 1.11 0.09 1.61 1.01 -1.26 -4.77 120.40 117.77 1nj9 s VAL 144 Ca 0.35 -0.40 0.07 0.00 0.00 0.00 0.00 61.98 62.00 1nj9 s VAL 144 Cb 0.20 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1nj9 s VAL 144 CO -0.03 0.33 -0.19 0.54 0.00 0.00 0.00 175.10 175.75 1nj9 s VAL 145 N 1.67 1.50 -0.03 2.92 0.11 -1.26 -4.63 120.40 120.69 1nj9 s VAL 145 Ca 0.04 -1.44 0.07 0.00 -2.93 0.00 0.00 61.98 57.72 1nj9 s VAL 145 Cb -0.13 -1.38 -0.02 0.00 -1.53 0.00 0.00 36.38 33.31 1nj9 s VAL 145 CO -0.08 -0.10 -0.23 -0.89 -3.33 0.00 0.00 175.10 170.47 1nj9 s THR 146 N -1.18 2.33 -0.11 5.04 2.01 -0.50 -4.95 115.64 118.27 1nj9 s THR 146 Ca 0.04 -1.00 -0.01 0.00 0.31 0.00 0.00 61.69 61.02 1nj9 s THR 146 Cb -0.10 -1.84 0.03 0.00 0.01 0.00 0.00 72.50 70.61 1nj9 s THR 146 CO 0.03 0.58 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.84 1nj9 s VAL 147 N -0.63 0.64 -0.10 3.82 1.01 -1.26 0.76 120.40 124.63 1nj9 s VAL 147 Ca 0.10 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 61.94 1nj9 s VAL 147 Cb -0.10 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1nj9 s VAL 147 CO -0.01 0.19 -0.23 -1.81 0.00 0.00 0.00 175.10 173.24 1nj9 s ASP 148 N 1.85 3.03 0.34 3.32 1.01 0.10 -4.98 116.67 121.35 1nj9 s ASP 148 Ca 0.03 -0.55 0.02 0.00 0.71 0.00 0.00 52.55 52.76 1nj9 s ASP 148 Cb -0.13 -1.38 -0.03 0.00 1.01 0.00 0.00 42.92 42.38 1nj9 s ASP 148 CO -0.07 0.14 0.53 0.26 0.21 0.00 0.00 175.17 176.25 1nj9 s TRP 149 N 0.42 3.42 -0.08 4.23 0.52 -1.26 -2.43 118.94 123.76 1nj9 s TRP 149 Ca -0.17 0.22 -0.08 0.00 0.02 0.00 0.00 56.10 56.09 1nj9 s TRP 149 Cb -0.18 -1.91 0.02 0.00 -1.15 0.00 0.00 33.47 30.26 1nj9 s TRP 149 CO 0.07 0.09 0.23 0.15 0.02 0.00 0.00 176.95 177.52 1nj9 s LYS 150 N -4.28 0.29 -0.19 4.98 1.02 -1.13 0.16 119.74 120.58 1nj9 s LYS 150 Ca 0.41 0.26 0.00 0.00 0.02 0.00 0.00 55.97 56.66 1nj9 s LYS 150 Cb -0.10 0.14 0.05 0.00 -0.52 0.00 0.00 37.83 37.40 1nj9 s LYS 150 CO 0.35 -0.04 -0.07 0.08 -0.92 0.00 0.00 175.35 174.74 1nj9 s VAL 151 N -0.01 1.39 -1.25 3.17 1.01 0.46 -1.25 120.40 123.92 1nj9 s VAL 151 Ca -0.01 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 1nj9 s VAL 151 Cb -0.02 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.81 1nj9 s VAL 151 CO 0.01 0.10 0.81 0.47 0.00 0.00 0.00 175.10 176.48 1nj9 n ASP 152 N 4.77 -1.84 0.00 3.32 8.00 0.14 -1.65 116.55 129.29 1nj9 n ASP 152 Ca -0.13 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 54.61 1nj9 n ASP 152 Cb 0.47 -4.43 0.00 0.00 -0.02 0.00 0.00 41.12 37.13 1nj9 n ASP 152 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nj9 n GLY 153 N -1.42 2.40 3.52 0.44 0.00 -1.26 -4.98 105.19 103.88 1nj9 n GLY 153 Ca -0.28 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 1nj9 n GLY 153 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nj9 s THR 154 N -2.59 5.05 0.17 2.61 2.01 -0.66 -4.99 115.64 117.24 1nj9 s THR 154 Ca 0.00 -0.05 -0.34 0.00 0.31 0.00 0.00 61.69 61.62 1nj9 s THR 154 Cb 0.00 -4.00 -0.15 0.00 0.01 0.00 0.00 72.50 68.36 1nj9 s THR 154 CO 0.00 -0.34 1.43 -2.65 -0.69 0.00 0.00 174.62 172.38 1nj9 n PRO 155 N 5.69 1.80 -3.58 4.92 -0.02 -1.26 -0.40 135.00 142.15 1nj9 n PRO 155 Ca -0.06 0.65 -0.37 0.00 -2.02 0.00 0.00 63.50 61.69 1nj9 n PRO 155 Cb 0.48 -2.33 -0.09 0.00 -0.02 0.00 0.00 33.50 31.54 1nj9 n PRO 155 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nj9 s VAL 156 N 0.42 5.31 -0.98 -1.45 1.01 0.12 -4.87 120.40 119.96 1nj9 s VAL 156 Ca 0.76 0.31 0.21 0.00 0.00 0.00 0.00 61.98 63.27 1nj9 s VAL 156 Cb -0.75 -3.56 -0.22 0.00 0.00 0.00 0.00 36.38 31.86 1nj9 s VAL 156 CO 0.45 0.30 0.93 0.41 0.00 0.00 0.00 175.10 177.19 1nj9 n THR 157 N 4.43 0.00 -4.09 3.92 -1.04 -1.26 -4.22 114.28 112.02 1nj9 n THR 157 Ca -0.13 -0.01 -0.14 0.00 -2.04 0.00 0.00 64.05 61.72 1nj9 n THR 157 Cb 0.52 0.92 -0.12 0.00 -1.82 0.00 0.00 70.33 69.84 1nj9 n THR 157 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nj9 s GLN 158 N -3.01 0.60 0.00 -2.82 1.03 -1.26 -4.81 119.66 109.38 1nj9 s GLN 158 Ca 0.08 -0.80 0.00 0.00 0.04 0.00 0.00 55.36 54.68 1nj9 s GLN 158 Cb 0.16 -0.42 0.00 0.00 0.03 0.00 0.00 33.01 32.78 1nj9 s GLN 158 CO 0.86 0.08 0.00 0.41 -2.54 0.00 0.00 175.29 174.10 1nj9 n GLY 159 N 1.44 3.29 3.51 2.60 0.00 -1.26 -4.99 105.19 109.78 1nj9 n GLY 159 Ca -0.22 -0.92 -0.21 0.00 0.00 0.00 0.00 46.02 44.67 1nj9 n GLY 159 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1nj9 n MET 160 N 0.00 0.13 -3.42 1.61 2.81 -1.24 -4.39 117.12 112.61 1nj9 n MET 160 Ca 0.00 -0.18 -0.42 0.00 -1.81 0.00 0.00 57.70 55.29 1nj9 n MET 160 Cb 0.00 -1.60 -0.02 0.00 -0.71 0.00 0.00 33.22 30.89 1nj9 n MET 160 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1nj9 n GLU 161 N 6.33 3.28 -3.07 0.03 4.07 -0.07 -4.87 120.64 126.34 1nj9 n GLU 161 Ca 0.63 -4.47 -0.33 0.00 -0.06 0.00 0.00 57.16 52.94 1nj9 n GLU 161 Cb 0.20 -2.50 -0.06 0.00 -0.06 0.00 0.00 31.44 29.02 1nj9 n GLU 161 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 1nj9 s THR 162 N -1.40 4.62 0.41 6.31 2.01 -1.26 -1.98 115.64 124.34 1nj9 s THR 162 Ca 0.30 1.06 0.06 0.00 0.31 0.00 0.00 61.69 63.42 1nj9 s THR 162 Cb -0.08 -3.61 0.00 0.00 0.01 0.00 0.00 72.50 68.82 1nj9 s THR 162 CO -0.09 -0.22 0.57 0.42 -0.69 0.00 0.00 174.62 174.61 1nj9 s THR 163 N -2.03 3.49 0.12 -0.82 -4.23 0.48 -4.95 115.64 107.70 1nj9 s THR 163 Ca 0.56 -0.90 -0.30 0.00 -1.18 0.00 0.00 61.69 59.86 1nj9 s THR 163 Cb -0.10 -3.21 -0.06 0.00 1.34 0.00 0.00 72.50 70.46 1nj9 s THR 163 CO 0.17 -0.10 1.09 -1.10 -0.54 0.00 0.00 174.62 174.14 1nj9 s GLN 164 N -4.35 4.56 -0.04 3.99 1.11 -1.26 -4.52 119.66 119.15 1nj9 s GLN 164 Ca 0.51 1.66 -0.32 0.00 0.01 0.00 0.00 55.36 57.22 1nj9 s GLN 164 Cb -0.10 -3.33 -0.10 0.00 -1.01 0.00 0.00 33.01 28.47 1nj9 s GLN 164 CO 0.33 -0.00 1.97 -2.30 0.01 0.00 0.00 175.29 175.30 1nj9 n PRO 165 N 3.00 2.48 -4.11 2.91 -0.02 -1.26 -4.75 135.00 133.25 1nj9 n PRO 165 Ca 0.05 0.89 -0.32 0.00 -2.02 0.00 0.00 63.50 62.10 1nj9 n PRO 165 Cb 0.47 -2.88 -0.07 0.00 -0.02 0.00 0.00 33.50 31.00 1nj9 n PRO 165 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1nj9 s SER 166 N 4.75 5.56 0.31 2.55 0.01 0.74 -4.87 113.70 122.75 1nj9 s SER 166 Ca 0.92 0.08 -0.19 0.00 1.31 0.00 0.00 55.95 58.07 1nj9 s SER 166 Cb -0.54 -1.55 -0.09 0.00 0.21 0.00 0.00 66.02 64.06 1nj9 s SER 166 CO 0.45 0.24 0.80 -0.75 0.41 0.00 0.00 173.24 174.39 1nj9 s LYS 167 N -1.92 4.20 0.33 12.44 2.20 -1.26 -0.93 119.74 134.81 1nj9 s LYS 167 Ca 0.24 0.90 0.08 0.00 -0.36 0.00 0.00 55.97 56.83 1nj9 s LYS 167 Cb -0.12 -2.59 -0.03 0.00 -1.51 0.00 0.00 37.83 33.58 1nj9 s LYS 167 CO 0.16 0.22 0.26 -0.65 -0.36 0.00 0.00 175.35 174.99 1nj9 s GLN 168 N -2.55 2.69 0.39 4.03 -0.21 -0.47 -4.93 119.66 118.62 1nj9 s GLN 168 Ca 0.51 -1.31 0.21 0.00 0.02 0.00 0.00 55.36 54.80 1nj9 s GLN 168 Cb -0.13 -2.44 1.22 0.00 1.00 0.00 0.00 33.01 32.65 1nj9 s GLN 168 CO 0.19 0.12 1.68 0.66 -2.12 0.00 0.00 175.29 175.82 1nj9 h SER 169 N 1.31 0.40 0.15 5.90 4.64 -1.98 0.43 113.55 124.40 1nj9 h SER 169 Ca -0.45 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1nj9 h SER 169 Cb 1.25 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1nj9 h SER 169 CO 0.59 -0.09 -0.01 -0.46 -0.87 0.00 0.00 176.83 175.99 1nj9 n ASN 170 N -4.80 0.16 -0.06 4.97 6.94 -1.26 -4.91 115.26 116.30 1nj9 n ASN 170 Ca 0.32 -0.82 -0.01 0.00 -0.02 0.00 0.00 54.58 54.05 1nj9 n ASN 170 Cb 1.12 -0.07 -0.00 0.00 -2.36 0.00 0.00 39.78 38.47 1nj9 n ASN 170 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1nj9 n ASN 171 N -0.96 -3.31 -4.81 0.53 3.02 0.15 -5.04 115.26 104.84 1nj9 n ASN 171 Ca 0.21 0.02 -0.22 0.00 -0.03 0.00 0.00 54.58 54.56 1nj9 n ASN 171 Cb 0.17 -0.88 0.08 0.00 -0.61 0.00 0.00 39.78 38.54 1nj9 n ASN 171 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1nj9 s LYS 172 N -0.95 2.01 0.25 3.52 1.02 -1.26 -4.81 119.74 119.52 1nj9 s LYS 172 Ca 0.00 -1.10 0.09 0.00 0.02 0.00 0.00 55.97 54.99 1nj9 s LYS 172 Cb 0.00 -2.42 -0.04 0.00 -0.52 0.00 0.00 37.83 34.85 1nj9 s LYS 172 CO 0.00 -1.16 -0.03 0.71 -0.92 0.00 0.00 175.35 173.95 1nj9 s TYR 173 N -2.97 2.67 0.04 3.18 1.51 -0.39 -1.36 117.35 120.03 1nj9 s TYR 173 Ca 0.63 -0.22 -0.05 0.00 -1.01 0.00 0.00 57.07 56.42 1nj9 s TYR 173 Cb -0.07 -1.21 -0.01 0.00 -0.11 0.00 0.00 41.96 40.56 1nj9 s TYR 173 CO 0.42 0.60 0.08 0.00 -1.11 0.00 0.00 175.55 175.54 1nj9 s MET 174 N -3.47 0.58 0.14 -0.62 0.23 -0.10 -1.44 119.30 114.62 1nj9 s MET 174 Ca 0.30 -0.80 -0.25 0.00 -1.03 0.00 0.00 55.69 53.91 1nj9 s MET 174 Cb -0.07 0.22 0.07 0.00 -1.53 0.00 0.00 34.83 33.52 1nj9 s MET 174 CO 0.19 -0.14 1.00 0.00 -2.03 0.00 0.00 175.02 174.04 1nj9 s ALA 175 N -2.71 -1.70 0.08 3.16 0.00 0.17 -0.18 121.76 120.57 1nj9 s ALA 175 Ca -0.04 0.13 -0.02 0.00 0.00 0.00 0.00 51.96 52.03 1nj9 s ALA 175 Cb -0.01 0.62 -0.03 0.00 0.00 0.00 0.00 23.12 23.70 1nj9 s ALA 175 CO -0.05 -1.05 0.03 -1.54 0.00 0.00 0.00 175.76 173.15 1nj9 s SER 176 N -2.99 0.38 0.02 0.00 1.04 -1.26 0.69 113.70 111.58 1nj9 s SER 176 Ca 0.13 -1.01 0.03 0.00 0.48 0.00 0.00 55.95 55.59 1nj9 s SER 176 Cb -0.01 0.25 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 1nj9 s SER 176 CO 0.02 -0.66 -0.10 -0.55 0.98 0.00 0.00 173.24 172.93 1nj9 s SER 177 N -2.95 1.18 -0.03 7.02 0.15 -0.62 0.18 113.70 118.63 1nj9 s SER 177 Ca 0.12 -0.36 0.05 0.00 0.70 0.00 0.00 55.95 56.46 1nj9 s SER 177 Cb 0.07 -0.07 -0.01 0.00 -1.71 0.00 0.00 66.02 64.30 1nj9 s SER 177 CO -0.07 -0.00 -0.20 -0.31 1.20 0.00 0.00 173.24 173.86 1nj9 s TYR 178 N -0.73 1.90 -0.31 3.44 2.02 -0.84 -2.40 117.35 120.43 1nj9 s TYR 178 Ca -0.01 -0.47 0.03 0.00 -0.37 0.00 0.00 57.07 56.25 1nj9 s TYR 178 Cb -0.07 -1.25 0.09 0.00 -0.40 0.00 0.00 41.96 40.34 1nj9 s TYR 178 CO 0.00 -0.12 0.02 -1.17 -1.57 0.00 0.00 175.55 172.72 1nj9 s LEU 179 N -0.22 3.89 -0.01 -1.29 2.96 -0.90 -0.89 118.68 122.21 1nj9 s LEU 179 Ca 0.01 -1.84 -0.06 0.00 -0.22 0.00 0.00 54.13 52.02 1nj9 s LEU 179 Cb -0.10 -1.44 -0.05 0.00 0.50 0.00 0.00 46.19 45.10 1nj9 s LEU 179 CO 0.01 -0.34 0.24 -0.89 -1.32 0.00 0.00 176.35 174.06 1nj9 s THR 180 N 1.11 5.34 0.34 3.68 2.01 -1.26 -1.30 115.64 125.56 1nj9 s THR 180 Ca 0.06 0.16 -0.17 0.00 0.31 0.00 0.00 61.69 62.04 1nj9 s THR 180 Cb -0.19 -3.54 0.06 0.00 0.01 0.00 0.00 72.50 68.84 1nj9 s THR 180 CO -0.10 0.41 0.86 -1.48 -0.69 0.00 0.00 174.62 173.62 1nj9 s LEU 181 N -1.64 0.02 0.49 4.42 0.05 -1.13 -4.86 118.68 116.03 1nj9 s LEU 181 Ca 0.25 -1.05 -0.02 0.00 0.05 0.00 0.00 54.13 53.36 1nj9 s LEU 181 Cb -0.13 2.65 -0.01 0.00 -2.05 0.00 0.00 46.19 46.66 1nj9 s LEU 181 CO 0.14 -1.53 0.75 0.42 -0.55 0.00 0.00 176.35 175.58 1nj9 s THR 182 N -2.17 4.11 0.14 5.48 -4.23 -1.26 -0.74 115.64 116.97 1nj9 s THR 182 Ca 0.18 -0.25 -0.14 0.00 -1.18 0.00 0.00 61.69 60.30 1nj9 s THR 182 Cb -0.04 -3.56 -0.00 0.00 1.34 0.00 0.00 72.50 70.24 1nj9 s THR 182 CO 0.10 -0.46 1.58 0.00 -0.54 0.00 0.00 174.62 175.30 1nj9 h ALA 183 N 0.23 0.59 -0.52 3.99 0.00 -1.80 1.23 119.26 122.99 1nj9 h ALA 183 Ca -0.46 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.23 1nj9 h ALA 183 Cb 1.24 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 1nj9 h ALA 183 CO 0.59 0.39 0.26 0.00 0.00 0.00 0.00 179.25 180.48 1nj9 h ARG 184 N 0.62 0.48 0.71 0.00 -0.00 -1.94 1.23 114.38 115.48 1nj9 h ARG 184 Ca 0.12 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.98 59.54 1nj9 h ARG 184 Cb 0.49 -0.11 -0.00 0.00 0.00 0.00 0.00 29.97 30.35 1nj9 h ARG 184 CO 0.02 0.32 -0.44 0.93 0.00 0.00 0.00 179.97 180.80 1nj9 h GLU 185 N 0.50 -1.04 -0.81 0.04 5.08 -1.77 -2.05 114.58 114.53 1nj9 h GLU 185 Ca 0.23 0.07 0.20 0.00 -1.00 0.00 0.00 59.36 58.86 1nj9 h GLU 185 Cb 0.15 0.24 -0.13 0.00 0.50 0.00 0.00 28.75 29.51 1nj9 h GLU 185 CO -0.17 -0.69 0.19 2.35 -1.00 0.00 0.00 179.01 179.68 1nj9 h TRP 186 N -1.08 0.28 -0.01 4.33 2.91 0.23 0.29 115.95 122.91 1nj9 h TRP 186 Ca -0.10 0.05 0.00 0.00 1.13 0.00 0.00 58.89 59.97 1nj9 h TRP 186 Cb 0.86 0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.52 1nj9 h TRP 186 CO -0.08 -0.16 0.00 0.39 -1.03 0.00 0.00 178.44 177.56 1nj9 n GLU 187 N -5.21 1.02 -0.06 2.65 1.02 0.41 -3.10 120.64 117.38 1nj9 n GLU 187 Ca 0.18 -0.03 -0.01 0.00 -0.02 0.00 0.00 57.16 57.27 1nj9 n GLU 187 Cb 0.56 -1.21 -0.16 0.00 -0.02 0.00 0.00 31.44 30.61 1nj9 n GLU 187 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1nj9 n ARG 188 N -0.68 0.70 -3.82 3.49 0.00 0.10 -5.00 116.66 111.46 1nj9 n ARG 188 Ca 0.10 -0.09 -0.23 0.00 -0.00 0.00 0.00 57.85 57.63 1nj9 n ARG 188 Cb 0.05 -1.51 -0.04 0.00 0.00 0.00 0.00 32.46 30.97 1nj9 n ARG 188 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1nj9 s HIS 189 N -2.90 2.38 0.00 -0.14 3.76 -1.13 -5.06 115.29 112.20 1nj9 s HIS 189 Ca -0.09 -0.62 0.00 0.00 -0.15 0.00 0.00 55.06 54.20 1nj9 s HIS 189 Cb 0.09 -2.04 0.00 0.00 1.11 0.00 0.00 32.58 31.74 1nj9 s HIS 189 CO 0.85 -0.13 0.00 -1.13 -0.85 0.00 0.00 174.74 173.48 1nj9 n SER 190 N -1.52 1.76 -4.72 1.40 3.41 -1.26 -4.39 113.62 108.29 1nj9 n SER 190 Ca 0.01 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.24 1nj9 n SER 190 Cb 0.63 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.52 1nj9 n SER 190 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1nj9 s SER 191 N -4.22 6.65 -0.14 4.04 0.15 -1.26 -0.15 113.70 118.77 1nj9 s SER 191 Ca 0.00 0.78 -0.04 0.00 0.70 0.00 0.00 55.95 57.39 1nj9 s SER 191 Cb 0.00 -2.27 0.07 0.00 -1.71 0.00 0.00 66.02 62.11 1nj9 s SER 191 CO 0.00 0.02 0.17 -0.31 1.20 0.00 0.00 173.24 174.32 1nj9 s TYR 192 N 0.57 -0.16 -0.04 3.44 2.02 -1.13 0.27 117.35 122.31 1nj9 s TYR 192 Ca 0.25 0.32 0.05 0.00 -0.37 0.00 0.00 57.07 57.31 1nj9 s TYR 192 Cb -0.15 -0.37 -0.01 0.00 -0.40 0.00 0.00 41.96 41.04 1nj9 s TYR 192 CO 0.09 -0.44 -0.18 0.45 -1.57 0.00 0.00 175.55 173.91 1nj9 s SER 193 N 2.28 2.22 -0.25 2.29 0.15 -0.38 -1.67 113.70 118.35 1nj9 s SER 193 Ca 0.04 -0.36 -0.07 0.00 0.70 0.00 0.00 55.95 56.26 1nj9 s SER 193 Cb -0.14 -0.55 -0.03 0.00 -1.71 0.00 0.00 66.02 63.59 1nj9 s SER 193 CO -0.09 0.17 0.07 0.00 1.20 0.00 0.00 173.24 174.60 1nj9 s GLN 195 N 1.61 3.00 -0.15 0.00 -0.21 -1.02 0.12 119.66 123.00 1nj9 s GLN 195 Ca 0.06 -0.89 -0.01 0.00 0.02 0.00 0.00 55.36 54.55 1nj9 s GLN 195 Cb -0.15 -3.10 -0.01 0.00 1.00 0.00 0.00 33.01 30.74 1nj9 s GLN 195 CO 0.04 -0.38 -0.12 0.08 -2.12 0.00 0.00 175.29 172.79 1nj9 s VAL 196 N 1.40 3.06 -0.23 1.09 1.01 0.39 -0.72 120.40 126.40 1nj9 s VAL 196 Ca 0.02 -0.64 -0.07 0.00 0.00 0.00 0.00 61.98 61.29 1nj9 s VAL 196 Cb -0.16 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 1nj9 s VAL 196 CO -0.02 0.50 0.05 -0.89 0.00 0.00 0.00 175.10 174.75 1nj9 s THR 197 N 0.65 4.28 -0.25 3.92 2.01 0.23 0.18 115.64 126.67 1nj9 s THR 197 Ca -0.06 -0.19 -0.01 0.00 0.31 0.00 0.00 61.69 61.74 1nj9 s THR 197 Cb -0.15 -2.98 0.07 0.00 0.01 0.00 0.00 72.50 69.45 1nj9 s THR 197 CO 0.02 0.37 0.03 -2.28 -0.69 0.00 0.00 174.62 172.07 1nj9 s HIS 198 N 1.36 1.75 0.00 4.92 2.46 0.43 -1.42 115.29 124.80 1nj9 s HIS 198 Ca 0.05 -1.47 0.00 0.00 0.47 0.00 0.00 55.06 54.11 1nj9 s HIS 198 Cb -0.15 -1.47 0.00 0.00 -0.13 0.00 0.00 32.58 30.83 1nj9 s HIS 198 CO 0.03 -0.75 0.00 0.39 -2.47 0.00 0.00 174.74 171.94 1nj9 n GLU 199 N 4.84 0.00 -1.22 2.88 -0.58 -1.26 -1.73 120.64 123.57 1nj9 n GLU 199 Ca -0.07 0.00 -0.22 0.00 -0.42 0.00 0.00 57.16 56.44 1nj9 n GLU 199 Cb 0.44 0.00 0.15 0.00 -0.57 0.00 0.00 31.44 31.46 1nj9 n GLU 199 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nj9 n GLY 200 N 0.00 5.10 2.81 0.62 0.00 -1.26 -4.89 105.19 107.57 1nj9 n GLY 200 Ca 0.00 -1.56 -0.14 0.00 0.00 0.00 0.00 46.02 44.32 1nj9 n GLY 200 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1nj9 s HIS 201 N -3.45 0.01 -0.17 1.61 3.76 -0.71 -5.14 115.29 111.19 1nj9 s HIS 201 Ca 0.56 0.12 0.01 0.00 -0.15 0.00 0.00 55.06 55.60 1nj9 s HIS 201 Cb 0.47 -0.16 0.01 0.00 1.11 0.00 0.00 32.58 34.00 1nj9 s HIS 201 CO 0.05 -0.07 -0.17 0.99 -0.85 0.00 0.00 174.74 174.68 1nj9 s THR 202 N 0.78 2.37 -0.42 1.30 2.01 -1.26 -0.43 115.64 120.00 1nj9 s THR 202 Ca -0.06 -0.85 -0.11 0.00 0.31 0.00 0.00 61.69 60.97 1nj9 s THR 202 Cb -0.09 -2.00 0.06 0.00 0.01 0.00 0.00 72.50 70.48 1nj9 s THR 202 CO -0.02 0.52 0.27 -0.69 -0.69 0.00 0.00 174.62 174.01 1nj9 s VAL 203 N 1.07 4.60 0.19 3.82 1.01 0.48 -4.92 120.40 126.65 1nj9 s VAL 203 Ca -0.00 -1.13 0.04 0.00 0.00 0.00 0.00 61.98 60.89 1nj9 s VAL 203 Cb -0.14 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 1nj9 s VAL 203 CO -0.06 -0.43 0.27 -0.70 0.00 0.00 0.00 175.10 174.18 1nj9 s GLU 204 N 1.52 3.27 -0.17 2.72 2.12 -1.26 0.15 118.70 127.05 1nj9 s GLU 204 Ca 0.03 -0.76 -0.06 0.00 0.36 0.00 0.00 54.97 54.53 1nj9 s GLU 204 Cb -0.22 -2.83 0.08 0.00 0.26 0.00 0.00 34.13 31.42 1nj9 s GLU 204 CO 0.05 0.47 0.35 0.21 -0.54 0.00 0.00 175.26 175.80 1nj9 s LYS 205 N -3.52 0.26 0.17 4.30 2.20 0.31 -4.94 119.74 118.53 1nj9 s LYS 205 Ca 0.33 0.89 0.05 0.00 -0.36 0.00 0.00 55.97 56.89 1nj9 s LYS 205 Cb -0.10 0.16 -0.05 0.00 -1.51 0.00 0.00 37.83 36.33 1nj9 s LYS 205 CO 0.27 -0.25 -0.09 -1.54 -0.36 0.00 0.00 175.35 173.37 1nj9 s SER 206 N 2.41 1.98 0.02 1.43 1.04 -1.26 0.92 113.70 120.24 1nj9 s SER 206 Ca -0.01 -1.05 0.03 0.00 0.48 0.00 0.00 55.95 55.39 1nj9 s SER 206 Cb -0.12 -0.04 -0.01 0.00 0.10 0.00 0.00 66.02 65.95 1nj9 s SER 206 CO -0.11 -0.33 -0.09 -1.48 0.98 0.00 0.00 173.24 172.22 1nj9 s LEU 207 N -3.23 2.12 -0.62 2.42 0.05 -0.67 -5.01 118.68 113.74 1nj9 s LEU 207 Ca 0.20 -0.32 -0.14 0.00 0.05 0.00 0.00 54.13 53.92 1nj9 s LEU 207 Cb 0.02 -0.35 0.16 0.00 -2.05 0.00 0.00 46.19 43.97 1nj9 s LEU 207 CO 0.03 -0.01 0.56 -0.55 -0.55 0.00 0.00 176.35 175.83 1nj9 s SER 208 N -0.78 6.27 0.32 1.48 0.15 -1.26 -2.85 113.70 117.04 1nj9 s SER 208 Ca -0.01 -2.11 0.03 0.00 0.70 0.00 0.00 55.95 54.56 1nj9 s SER 208 Cb -0.06 -2.17 0.63 0.00 -1.71 0.00 0.00 66.02 62.71 1nj9 s SER 208 CO 0.00 -0.74 1.91 -0.09 1.20 0.00 0.00 173.24 175.52 1nj9 h ARG 209 N 8.44 0.88 0.00 5.44 1.12 -0.84 -3.49 114.38 125.92 1nj9 h ARG 209 Ca -0.16 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 58.66 1nj9 h ARG 209 Cb 1.07 -0.20 0.00 0.00 -0.01 0.00 0.00 29.97 30.84 1nj9 h ARG 209 CO 0.92 0.58 0.00 0.00 -3.11 0.00 0.00 179.97 178.36