#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ngq s ALA 2 N 0.00 -0.83 -0.21 1.69 0.00 -1.26 -4.99 121.76 116.17 1ngq s ALA 2 Ca 0.00 0.62 0.01 0.00 0.00 0.00 0.00 51.96 52.59 1ngq s ALA 2 Cb 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 23.12 22.96 1ngq s ALA 2 CO 0.00 -0.22 -0.11 0.08 0.00 0.00 0.00 175.76 175.51 1ngq s VAL 3 N -0.66 1.73 -0.02 0.00 1.01 -1.26 -4.98 120.40 116.22 1ngq s VAL 3 Ca -0.08 -1.11 -0.24 0.00 0.00 0.00 0.00 61.98 60.56 1ngq s VAL 3 Cb -0.04 -1.81 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 1ngq s VAL 3 CO 0.03 0.15 0.73 -0.69 0.00 0.00 0.00 175.10 175.32 1ngq s VAL 4 N 1.35 4.92 -0.06 2.92 1.01 -1.26 -1.47 120.40 127.81 1ngq s VAL 4 Ca -0.02 1.53 0.06 0.00 0.00 0.00 0.00 61.98 63.55 1ngq s VAL 4 Cb -0.17 -4.08 -0.01 0.00 0.00 0.00 0.00 36.38 32.12 1ngq s VAL 4 CO -0.08 0.30 -0.24 -0.89 0.00 0.00 0.00 175.10 174.19 1ngq s THR 5 N 0.46 2.17 0.10 3.92 2.01 0.93 -4.23 115.64 120.99 1ngq s THR 5 Ca 0.38 -1.03 0.03 0.00 0.31 0.00 0.00 61.69 61.38 1ngq s THR 5 Cb -0.19 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 1ngq s THR 5 CO 0.20 0.57 -0.09 -1.10 -0.69 0.00 0.00 174.62 173.52 1ngq s GLN 6 N -0.23 0.86 0.61 4.92 -0.21 -1.26 -0.87 119.66 123.48 1ngq s GLN 6 Ca -0.02 -1.24 -0.19 0.00 0.02 0.00 0.00 55.36 53.93 1ngq s GLN 6 Cb -0.13 -0.44 -0.03 0.00 1.00 0.00 0.00 33.01 33.41 1ngq s GLN 6 CO 0.03 0.05 1.24 0.39 -2.12 0.00 0.00 175.29 174.88 1ngq n GLU 7 N 0.29 1.24 -0.03 2.91 4.71 -1.26 -4.86 120.64 123.64 1ngq n GLU 7 Ca -0.14 0.47 -0.15 0.00 -0.01 0.00 0.00 57.16 57.33 1ngq n GLU 7 Cb 0.59 -2.46 -0.12 0.00 -1.01 0.00 0.00 31.44 28.44 1ngq n GLU 7 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 1ngq h SER 8 N 0.79 0.14 -4.79 1.62 0.87 -1.94 -3.28 113.55 106.96 1ngq h SER 8 Ca -0.50 -0.80 -0.08 0.00 -1.23 0.00 0.00 61.79 59.17 1ngq h SER 8 Cb 1.34 -0.04 -0.20 0.00 -0.44 0.00 0.00 62.40 63.05 1ngq h SER 8 CO 0.54 0.93 -0.02 0.00 -0.53 0.00 0.00 176.83 177.75 1ngq s ALA 9 N -3.01 -1.35 -0.03 6.23 0.00 -1.26 -1.79 121.76 120.54 1ngq s ALA 9 Ca -0.17 1.02 -0.02 0.00 0.00 0.00 0.00 51.96 52.80 1ngq s ALA 9 Cb -0.00 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.98 1ngq s ALA 9 CO 0.72 -0.31 0.07 -0.51 0.00 0.00 0.00 175.76 175.73 1ngq s LEU 10 N -0.95 1.60 -0.09 0.00 1.43 -0.36 -4.89 118.68 115.41 1ngq s LEU 10 Ca -0.10 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.17 1ngq s LEU 10 Cb -0.03 0.20 -0.00 0.00 0.03 0.00 0.00 46.19 46.39 1ngq s LEU 10 CO 0.06 -0.04 -0.23 -0.89 0.23 0.00 0.00 176.35 175.48 1ngq s THR 11 N 0.23 2.21 0.32 5.49 2.01 -1.26 -0.62 115.64 124.03 1ngq s THR 11 Ca -0.02 -0.97 0.05 0.00 0.31 0.00 0.00 61.69 61.06 1ngq s THR 11 Cb -0.03 -1.85 -0.03 0.00 0.01 0.00 0.00 72.50 70.61 1ngq s THR 11 CO -0.01 0.56 0.30 0.28 -0.69 0.00 0.00 174.62 175.06 1ngq s THR 12 N 0.22 0.00 0.18 -0.82 -1.32 0.31 -4.95 115.64 109.26 1ngq s THR 12 Ca -0.14 -1.94 0.11 0.00 -1.21 0.00 0.00 61.69 58.51 1ngq s THR 12 Cb -0.17 -2.52 -0.04 0.00 -1.51 0.00 0.00 72.50 68.26 1ngq s THR 12 CO 0.07 0.00 -0.24 -0.44 -2.21 0.00 0.00 174.62 171.80 1ngq s SER 13 N -3.34 3.43 0.38 8.08 0.01 -1.26 -0.30 113.70 120.71 1ngq s SER 13 Ca 0.39 -0.83 -0.25 0.00 1.31 0.00 0.00 55.95 56.57 1ngq s SER 13 Cb 0.02 -0.26 -0.12 0.00 0.21 0.00 0.00 66.02 65.87 1ngq s SER 13 CO 0.26 0.14 1.03 -2.65 0.41 0.00 0.00 173.24 172.42 1ngq n PRO 14 N 0.43 1.41 0.00 12.44 -0.02 -1.26 -1.73 135.00 146.27 1ngq n PRO 14 Ca -0.14 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1ngq n PRO 14 Cb 0.55 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1ngq n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ngq n GLY 15 N 1.16 2.42 3.92 -1.23 0.00 0.50 -4.92 105.19 107.05 1ngq n GLY 15 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 1ngq n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ngq s GLU 16 N -0.43 2.36 -0.23 1.61 0.41 -0.71 -4.37 118.70 117.34 1ngq s GLU 16 Ca 0.00 -0.17 -0.07 0.00 -0.41 0.00 0.00 54.97 54.32 1ngq s GLU 16 Cb 0.00 -2.18 -0.03 0.00 -1.78 0.00 0.00 34.13 30.14 1ngq s GLU 16 CO 0.00 -1.14 0.06 0.99 -0.49 0.00 0.00 175.26 174.69 1ngq s THR 17 N -3.21 4.41 0.02 3.63 2.01 -1.26 0.12 115.64 121.35 1ngq s THR 17 Ca 0.59 -0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.49 1ngq s THR 17 Cb -0.11 -3.03 -0.02 0.00 0.01 0.00 0.00 72.50 69.35 1ngq s THR 17 CO 0.45 0.38 -0.16 0.54 -0.69 0.00 0.00 174.62 175.14 1ngq s VAL 18 N 1.22 1.25 -0.12 3.82 0.11 -0.87 -4.99 120.40 120.83 1ngq s VAL 18 Ca 0.04 -0.90 0.02 0.00 -2.93 0.00 0.00 61.98 58.22 1ngq s VAL 18 Cb -0.14 -1.09 -0.00 0.00 -1.53 0.00 0.00 36.38 33.61 1ngq s VAL 18 CO 0.03 0.18 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.89 1ngq s THR 19 N -0.64 2.35 0.05 5.04 2.01 -1.26 -1.55 115.64 121.64 1ngq s THR 19 Ca 0.04 -0.91 0.04 0.00 0.31 0.00 0.00 61.69 61.18 1ngq s THR 19 Cb -0.07 -1.94 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 1ngq s THR 19 CO 0.01 0.55 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.69 1ngq s LEU 20 N 0.44 3.35 0.26 4.42 1.43 -0.28 -4.95 118.68 123.35 1ngq s LEU 20 Ca -0.14 -0.16 0.08 0.00 -1.03 0.00 0.00 54.13 52.88 1ngq s LEU 20 Cb -0.17 -2.02 -0.05 0.00 0.03 0.00 0.00 46.19 43.98 1ngq s LEU 20 CO 0.06 0.23 -0.11 0.42 0.23 0.00 0.00 176.35 177.18 1ngq s THR 21 N -1.17 1.85 -0.22 5.49 -4.23 -1.26 -0.93 115.64 115.17 1ngq s THR 21 Ca 0.22 -2.20 -0.03 0.00 -1.18 0.00 0.00 61.69 58.49 1ngq s THR 21 Cb -0.11 -2.31 0.07 0.00 1.34 0.00 0.00 72.50 71.48 1ngq s THR 21 CO 0.13 -0.40 0.07 0.00 -0.54 0.00 0.00 174.62 173.88 1ngq s ARG 23 N 1.91 3.24 -0.15 0.00 3.52 -0.05 -1.85 118.95 125.57 1ngq s ARG 23 Ca 0.02 -0.34 -0.07 0.00 -0.13 0.00 0.00 55.73 55.21 1ngq s ARG 23 Cb -0.17 -2.94 -0.04 0.00 -1.56 0.00 0.00 34.95 30.24 1ngq s ARG 23 CO -0.14 0.65 0.11 0.45 -0.81 0.00 0.00 175.30 175.55 1ngq s SER 24 N -0.71 6.08 0.53 -2.12 0.15 -1.26 -0.05 113.70 116.31 1ngq s SER 24 Ca 0.12 0.30 0.32 0.00 0.70 0.00 0.00 55.95 57.39 1ngq s SER 24 Cb -0.12 -1.99 1.26 0.00 -1.71 0.00 0.00 66.02 63.47 1ngq s SER 24 CO 0.02 0.31 1.95 0.77 1.20 0.00 0.00 173.24 177.49 1ngq h SER 25 N 5.74 0.00 0.87 5.45 4.64 -1.64 -3.24 113.55 125.36 1ngq h SER 25 Ca -0.48 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.66 1ngq h SER 25 Cb 1.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.25 1ngq h SER 25 CO 0.64 0.02 -1.22 0.71 -0.87 0.00 0.00 176.83 176.12 1ngq h THR 26 N 0.00 0.83 0.00 2.95 1.35 -1.94 -3.48 112.91 112.62 1ngq h THR 26 Ca -0.00 -2.40 0.00 0.00 -0.55 0.00 0.00 66.41 63.46 1ngq h THR 26 Cb 0.56 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 1ngq h THR 26 CO 0.00 0.47 0.00 0.61 -0.25 0.00 0.00 175.52 176.36 1ngq n GLY 27 N 1.39 -1.09 3.73 5.82 0.00 -1.23 -5.13 105.19 108.68 1ngq n GLY 27 Ca -0.07 -0.93 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 1ngq n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngq s ALA 28 N -1.00 2.24 0.15 4.61 0.00 -1.26 -4.28 121.76 122.21 1ngq s ALA 28 Ca 0.00 0.94 -0.25 0.00 0.00 0.00 0.00 51.96 52.65 1ngq s ALA 28 Cb 0.00 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.57 1ngq s ALA 28 CO 0.00 -1.70 0.75 0.08 0.00 0.00 0.00 175.76 174.89 1ngq s VAL 29 N -1.85 4.43 0.38 0.00 1.01 0.11 -4.96 120.40 119.52 1ngq s VAL 29 Ca 0.76 1.64 0.04 0.00 0.00 0.00 0.00 61.98 64.41 1ngq s VAL 29 Cb -0.30 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 31.94 1ngq s VAL 29 CO 0.42 0.52 0.12 0.42 0.00 0.00 0.00 175.10 176.58 1ngq s THR 30 N -1.08 0.65 -0.95 3.92 -4.23 -1.26 -4.55 115.64 108.14 1ngq s THR 30 Ca 0.35 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.94 1ngq s THR 30 Cb -0.23 -2.45 0.07 0.00 1.34 0.00 0.00 72.50 71.24 1ngq s THR 30 CO 0.25 0.00 1.25 0.35 -0.54 0.00 0.00 174.62 175.93 1ngq n THR 31 N -0.82 1.49 0.98 3.99 -2.24 -1.26 -1.46 114.28 114.96 1ngq n THR 31 Ca -0.04 0.39 0.10 0.00 -2.27 0.00 0.00 64.05 62.23 1ngq n THR 31 Cb 0.65 -1.28 0.32 0.00 -2.10 0.00 0.00 70.33 67.92 1ngq n THR 31 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ngq n SER 32 N -1.55 2.09 0.00 3.42 3.41 -1.26 -3.08 113.62 116.64 1ngq n SER 32 Ca 0.02 -1.81 0.10 0.00 -0.26 0.00 0.00 58.87 56.92 1ngq n SER 32 Cb 0.08 -0.15 -0.08 0.00 -0.26 0.00 0.00 64.21 63.80 1ngq n SER 32 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1ngq n ASN 33 N 0.60 0.89 -4.14 4.04 4.13 -0.54 -4.79 115.26 115.46 1ngq n ASN 33 Ca 0.16 -0.85 -0.35 0.00 1.68 0.00 0.00 54.58 55.22 1ngq n ASN 33 Cb 0.39 0.97 -0.04 0.00 -1.54 0.00 0.00 39.78 39.56 1ngq n ASN 33 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1ngq n TYR 34 N -1.55 -1.40 -1.55 3.10 4.01 -1.18 0.15 117.16 118.74 1ngq n TYR 34 Ca 0.04 0.45 -0.52 0.00 -0.16 0.00 0.00 57.90 57.70 1ngq n TYR 34 Cb 0.35 -2.99 -0.05 0.00 -0.31 0.00 0.00 39.34 36.34 1ngq n TYR 34 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ngq n ALA 35 N -4.69 -1.70 -2.39 -0.72 0.00 -1.26 -3.56 120.51 106.18 1ngq n ALA 35 Ca -0.24 0.51 -0.29 0.00 0.00 0.00 0.00 53.44 53.42 1ngq n ALA 35 Cb 0.65 -1.94 -0.13 0.00 0.00 0.00 0.00 19.45 18.03 1ngq n ALA 35 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1ngq s ASN 36 N 0.03 3.25 -0.06 0.00 0.01 -0.46 -0.47 114.94 117.23 1ngq s ASN 36 Ca 0.79 -0.72 0.02 0.00 -0.71 0.00 0.00 52.86 52.24 1ngq s ASN 36 Cb -0.98 -0.22 0.01 0.00 0.41 0.00 0.00 41.25 40.47 1ngq s ASN 36 CO 0.52 0.18 -0.11 0.26 -1.51 0.00 0.00 177.10 176.44 1ngq s TRP 37 N -1.03 1.37 0.04 2.20 0.52 -0.67 -1.12 118.94 120.26 1ngq s TRP 37 Ca 0.13 -0.48 0.06 0.00 0.02 0.00 0.00 56.10 55.82 1ngq s TRP 37 Cb -0.10 -1.01 -0.02 0.00 -1.15 0.00 0.00 33.47 31.19 1ngq s TRP 37 CO 0.05 -0.25 -0.16 0.08 0.02 0.00 0.00 176.95 176.69 1ngq s VAL 38 N 0.64 1.27 -0.06 4.03 1.01 0.45 -2.21 120.40 125.54 1ngq s VAL 38 Ca -0.13 -1.07 0.05 0.00 0.00 0.00 0.00 61.98 60.82 1ngq s VAL 38 Cb -0.15 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 1ngq s VAL 38 CO 0.03 0.05 -0.19 -1.58 0.00 0.00 0.00 175.10 173.41 1ngq s GLN 39 N -1.18 2.55 -0.25 2.72 0.74 -0.61 -0.46 119.66 123.17 1ngq s GLN 39 Ca 0.03 -0.79 -0.00 0.00 0.05 0.00 0.00 55.36 54.65 1ngq s GLN 39 Cb -0.08 -2.30 0.04 0.00 1.10 0.00 0.00 33.01 31.77 1ngq s GLN 39 CO 0.01 0.50 -0.08 -2.00 -0.55 0.00 0.00 175.29 173.18 1ngq s GLU 40 N -0.44 2.68 0.37 1.67 2.12 0.11 -2.79 118.70 122.41 1ngq s GLU 40 Ca 0.05 -1.07 0.05 0.00 0.36 0.00 0.00 54.97 54.36 1ngq s GLU 40 Cb -0.12 -2.93 -0.01 0.00 0.26 0.00 0.00 34.13 31.33 1ngq s GLU 40 CO 0.02 -0.44 0.53 0.15 -0.54 0.00 0.00 175.26 174.98 1ngq s LYS 41 N 1.26 3.11 0.38 4.30 -0.14 -0.53 -1.93 119.74 126.20 1ngq s LYS 41 Ca -0.02 -0.84 -0.27 0.00 -1.36 0.00 0.00 55.97 53.48 1ngq s LYS 41 Cb -0.17 -2.74 -0.09 0.00 -1.68 0.00 0.00 37.83 33.14 1ngq s LYS 41 CO -0.05 -0.03 1.30 -1.25 -0.76 0.00 0.00 175.35 174.56 1ngq s PRO 42 N -4.28 4.08 0.00 -1.68 0.04 -1.26 -2.86 135.00 129.03 1ngq s PRO 42 Ca 0.46 2.16 0.00 0.00 0.04 0.00 0.00 61.00 63.66 1ngq s PRO 42 Cb -0.10 -2.84 0.00 0.00 0.04 0.00 0.00 34.50 31.60 1ngq s PRO 42 CO 0.33 -0.40 0.00 -0.25 0.04 0.00 0.00 177.00 176.72 1ngq n ASP 43 N 0.32 0.00 -3.82 6.66 8.00 -1.26 -4.50 116.55 121.95 1ngq n ASP 43 Ca 0.03 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.26 1ngq n ASP 43 Cb 0.43 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.56 1ngq n ASP 43 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1ngq n HIS 44 N -0.82 -2.20 -3.34 1.24 8.25 -1.24 -4.93 115.22 112.18 1ngq n HIS 44 Ca 0.00 0.89 -0.45 0.00 -0.26 0.00 0.00 57.72 57.90 1ngq n HIS 44 Cb 0.00 -4.19 -0.07 0.00 1.12 0.00 0.00 29.99 26.85 1ngq n HIS 44 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1ngq s LEU 45 N -7.07 5.76 -0.05 2.41 1.98 -1.14 -5.01 118.68 115.58 1ngq s LEU 45 Ca 0.42 -1.46 0.01 0.00 -2.89 0.00 0.00 54.13 50.21 1ngq s LEU 45 Cb -0.21 -2.21 -0.03 0.00 0.66 0.00 0.00 46.19 44.40 1ngq s LEU 45 CO 0.82 -0.75 -0.05 -0.36 -1.89 0.00 0.00 176.35 174.12 1ngq s PHE 46 N 1.73 2.97 0.01 5.38 0.08 -1.26 -1.45 117.98 125.44 1ngq s PHE 46 Ca 0.05 0.04 0.00 0.00 0.12 0.00 0.00 56.93 57.14 1ngq s PHE 46 Cb -0.26 -1.69 -0.01 0.00 -0.57 0.00 0.00 43.02 40.49 1ngq s PHE 46 CO 0.06 0.38 -0.02 0.99 -0.10 0.00 0.00 175.22 176.52 1ngq s THR 47 N -0.90 0.11 -0.11 0.64 2.01 -1.12 -5.02 115.64 111.25 1ngq s THR 47 Ca 0.14 -0.58 -0.09 0.00 0.31 0.00 0.00 61.69 61.47 1ngq s THR 47 Cb -0.11 -0.20 -0.04 0.00 0.01 0.00 0.00 72.50 72.15 1ngq s THR 47 CO 0.04 -0.30 0.19 -0.83 -0.69 0.00 0.00 174.62 173.03 1ngq s GLY 48 N -0.92 2.20 -0.07 4.40 0.00 -1.26 -1.57 107.32 110.10 1ngq s GLY 48 Ca -0.09 -0.57 -0.07 0.00 0.00 0.00 0.00 44.72 43.99 1ngq s GLY 48 CO -0.01 -0.18 -0.13 1.04 0.00 0.00 0.00 173.10 173.83 1ngq n LEU 49 N 2.27 0.73 -4.25 0.66 4.32 -0.94 -4.53 117.00 115.26 1ngq n LEU 49 Ca -0.18 0.13 -0.24 0.00 -0.02 0.00 0.00 56.01 55.70 1ngq n LEU 49 Cb 0.54 -0.59 -0.13 0.00 -1.62 0.00 0.00 43.42 41.62 1ngq n LEU 49 CO 0.33 -0.41 -0.51 -0.63 -1.22 0.00 0.00 177.39 174.95 1ngq s ILE 50 N -1.71 1.59 0.03 -0.08 1.09 -1.22 0.12 121.20 121.01 1ngq s ILE 50 Ca -0.11 -1.35 -0.06 0.00 -1.10 0.00 0.00 60.65 58.03 1ngq s ILE 50 Cb 0.01 -1.43 -0.01 0.00 -1.06 0.00 0.00 42.46 39.98 1ngq s ILE 50 CO 0.16 0.03 0.12 -0.83 -0.10 0.00 0.00 174.94 174.31 1ngq s GLY 51 N -1.56 0.13 -1.37 6.18 0.00 0.13 -1.67 107.32 109.16 1ngq s GLY 51 Ca 0.06 -0.42 -0.05 0.00 0.00 0.00 0.00 44.72 44.31 1ngq s GLY 51 CO 0.03 -0.56 0.87 0.61 0.00 0.00 0.00 173.10 174.05 1ngq n GLY 52 N 0.93 -0.39 5.00 0.20 0.00 -0.92 -0.84 105.19 109.18 1ngq n GLY 52 Ca -0.20 0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1ngq n GLY 52 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ngq n THR 53 N -4.46 0.00 -2.06 2.61 -1.04 0.38 -4.10 114.28 105.62 1ngq n THR 53 Ca -0.16 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 61.87 1ngq n THR 53 Cb 0.62 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.16 1ngq n THR 53 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1ngq n ASN 54 N 1.95 0.69 -4.55 8.00 2.04 -1.20 -3.20 115.26 118.99 1ngq n ASN 54 Ca 0.00 -2.24 -0.40 0.00 -0.44 0.00 0.00 54.58 51.51 1ngq n ASN 54 Cb 0.00 -0.28 -0.10 0.00 -2.53 0.00 0.00 39.78 36.87 1ngq n ASN 54 CO 0.00 0.00 0.00 0.20 -0.44 0.00 0.00 177.26 177.02 1ngq s ASN 55 N -1.68 6.10 -0.10 0.53 0.01 -0.02 -4.76 114.94 115.02 1ngq s ASN 55 Ca 0.17 -0.21 -0.28 0.00 -0.71 0.00 0.00 52.86 51.83 1ngq s ASN 55 Cb 0.19 -2.16 -0.02 0.00 0.41 0.00 0.00 41.25 39.67 1ngq s ASN 55 CO -0.06 -0.22 0.94 -0.60 -1.51 0.00 0.00 177.10 175.65 1ngq s ARG 56 N 1.84 4.41 0.96 -0.60 3.52 -1.26 0.22 118.95 128.05 1ngq s ARG 56 Ca 0.09 1.27 -0.12 0.00 -0.13 0.00 0.00 55.73 56.83 1ngq s ARG 56 Cb -0.17 -3.53 0.08 0.00 -1.56 0.00 0.00 34.95 29.78 1ngq s ARG 56 CO 0.11 -0.26 0.63 0.00 -0.81 0.00 0.00 175.30 174.97 1ngq n ALA 57 N 4.83 -2.17 -2.24 6.12 0.00 0.32 -4.89 120.51 122.48 1ngq n ALA 57 Ca 0.07 -0.66 -0.40 0.00 0.00 0.00 0.00 53.44 52.45 1ngq n ALA 57 Cb 0.49 -1.91 -0.05 0.00 0.00 0.00 0.00 19.45 17.98 1ngq n ALA 57 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ngq s PRO 58 N -3.96 4.57 0.00 0.00 0.05 -1.26 -3.71 135.00 130.69 1ngq s PRO 58 Ca 0.60 1.18 0.00 0.00 0.05 0.00 0.00 61.00 62.83 1ngq s PRO 58 Cb -0.21 -3.34 0.00 0.00 0.05 0.00 0.00 34.50 31.00 1ngq s PRO 58 CO 0.64 0.35 0.00 0.41 0.05 0.00 0.00 177.00 178.46 1ngq n GLY 59 N 2.13 0.54 3.55 0.56 0.00 -1.26 -5.06 105.19 105.64 1ngq n GLY 59 Ca -0.02 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 44.86 1ngq n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ngq s VAL 60 N -2.00 4.50 0.65 1.61 1.01 -1.24 -5.07 120.40 119.85 1ngq s VAL 60 Ca 0.00 -0.12 -0.17 0.00 0.00 0.00 0.00 61.98 61.68 1ngq s VAL 60 Cb 0.00 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.29 1ngq s VAL 60 CO 0.00 0.42 0.80 -2.65 0.00 0.00 0.00 175.10 173.66 1ngq n PRO 61 N 4.07 0.62 0.06 2.72 -0.02 -1.26 -4.88 135.00 136.30 1ngq n PRO 61 Ca -0.16 0.25 0.09 0.00 -2.02 0.00 0.00 63.50 61.66 1ngq n PRO 61 Cb 0.52 -2.03 0.38 0.00 -0.02 0.00 0.00 33.50 32.36 1ngq n PRO 61 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ngq n ALA 62 N -2.03 1.62 0.29 3.55 0.00 -1.26 -2.78 120.51 119.89 1ngq n ALA 62 Ca 0.13 0.02 0.10 0.00 0.00 0.00 0.00 53.44 53.68 1ngq n ALA 62 Cb 0.48 -1.29 0.48 0.00 0.00 0.00 0.00 19.45 19.12 1ngq n ALA 62 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1ngq n ARG 63 N -1.83 0.14 -3.78 0.00 1.85 -1.26 -4.51 116.66 107.27 1ngq n ARG 63 Ca 0.03 0.50 -0.36 0.00 -1.00 0.00 0.00 57.85 57.01 1ngq n ARG 63 Cb 0.18 -1.85 -0.10 0.00 -1.05 0.00 0.00 32.46 29.65 1ngq n ARG 63 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1ngq s PHE 64 N -3.35 3.26 0.00 2.89 0.08 -1.12 0.59 117.98 120.34 1ngq s PHE 64 Ca 0.02 0.09 -0.07 0.00 0.12 0.00 0.00 56.93 57.08 1ngq s PHE 64 Cb 0.07 -2.21 0.00 0.00 -0.57 0.00 0.00 43.02 40.32 1ngq s PHE 64 CO 0.28 0.03 0.14 -1.54 -0.10 0.00 0.00 175.22 174.03 1ngq s SER 65 N 0.93 0.03 0.32 1.36 1.04 -0.72 -4.96 113.70 111.70 1ngq s SER 65 Ca 0.06 -0.22 0.10 0.00 0.48 0.00 0.00 55.95 56.37 1ngq s SER 65 Cb -0.13 0.21 -0.06 0.00 0.10 0.00 0.00 66.02 66.14 1ngq s SER 65 CO 0.03 -0.38 -0.10 -0.83 0.98 0.00 0.00 173.24 172.94 1ngq s GLY 66 N -1.42 2.03 0.04 7.32 0.00 -1.26 -0.20 107.32 113.83 1ngq s GLY 66 Ca -0.15 -1.97 -0.26 0.00 0.00 0.00 0.00 44.72 42.34 1ngq s GLY 66 CO 0.01 -1.97 1.21 -1.14 0.00 0.00 0.00 173.10 171.22 1ngq n SER 67 N -0.77 -1.37 -4.32 1.64 3.41 -0.24 -4.56 113.62 107.41 1ngq n SER 67 Ca -0.05 -1.45 -0.33 0.00 -0.26 0.00 0.00 58.87 56.78 1ngq n SER 67 Cb 0.62 2.16 -0.15 0.00 -0.26 0.00 0.00 64.21 66.58 1ngq n SER 67 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ngq s LEU 68 N 0.00 2.56 -0.21 1.04 1.43 -1.26 0.35 118.68 122.59 1ngq s LEU 68 Ca 0.28 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 1ngq s LEU 68 Cb -0.01 -1.57 0.05 0.00 0.03 0.00 0.00 46.19 44.68 1ngq s LEU 68 CO 0.01 0.14 -0.10 -0.63 0.23 0.00 0.00 176.35 176.01 1ngq s ILE 69 N 0.49 1.68 0.00 -0.59 1.01 -0.08 -4.92 121.20 118.79 1ngq s ILE 69 Ca -0.10 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 59.44 1ngq s ILE 69 Cb -0.16 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.52 1ngq s ILE 69 CO 0.05 0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.71 1ngq n GLY 70 N 4.66 1.62 1.65 6.18 0.00 -1.26 -2.00 105.19 116.04 1ngq n GLY 70 Ca -0.14 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.29 1ngq n GLY 70 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ngq n ASP 71 N 5.61 3.57 -4.16 1.61 5.68 -1.26 -4.89 116.55 122.70 1ngq n ASP 71 Ca 0.00 -3.51 -0.10 0.00 -0.50 0.00 0.00 54.79 50.68 1ngq n ASP 71 Cb 0.00 -0.71 -0.10 0.00 -1.14 0.00 0.00 41.12 39.17 1ngq n ASP 71 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1ngq s LYS 72 N -3.16 0.89 0.18 0.11 -2.85 -0.85 0.07 119.74 114.12 1ngq s LYS 72 Ca 0.51 -1.40 -0.19 0.00 -1.00 0.00 0.00 55.97 53.88 1ngq s LYS 72 Cb 0.43 0.09 -0.08 0.00 -2.06 0.00 0.00 37.83 36.21 1ngq s LYS 72 CO 0.07 -0.18 0.68 0.00 0.10 0.00 0.00 175.35 176.02 1ngq s ALA 73 N -3.90 3.47 0.08 0.59 0.00 -0.77 -0.90 121.76 120.33 1ngq s ALA 73 Ca 0.19 0.12 0.04 0.00 0.00 0.00 0.00 51.96 52.32 1ngq s ALA 73 Cb 0.07 -2.76 -0.03 0.00 0.00 0.00 0.00 23.12 20.40 1ngq s ALA 73 CO -0.01 0.36 -0.12 0.00 0.00 0.00 0.00 175.76 175.99 1ngq s ALA 74 N -1.40 1.09 -0.16 0.00 0.00 0.16 -1.31 121.76 120.13 1ngq s ALA 74 Ca 0.39 -1.04 0.02 0.00 0.00 0.00 0.00 51.96 51.32 1ngq s ALA 74 Cb -0.18 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 22.92 1ngq s ALA 74 CO 0.21 0.07 -0.21 -1.17 0.00 0.00 0.00 175.76 174.67 1ngq s LEU 75 N -1.98 2.15 -0.10 0.00 0.20 -0.10 -1.08 118.68 117.76 1ngq s LEU 75 Ca -0.00 -0.61 0.01 0.00 0.69 0.00 0.00 54.13 54.21 1ngq s LEU 75 Cb -0.08 -1.47 -0.02 0.00 -0.43 0.00 0.00 46.19 44.19 1ngq s LEU 75 CO 0.01 0.05 -0.12 -0.89 -0.29 0.00 0.00 176.35 175.11 1ngq s THR 76 N 1.01 3.22 -0.38 3.68 2.01 0.72 -1.13 115.64 124.77 1ngq s THR 76 Ca -0.02 -0.63 -0.10 0.00 0.31 0.00 0.00 61.69 61.25 1ngq s THR 76 Cb -0.15 -2.33 0.03 0.00 0.01 0.00 0.00 72.50 70.07 1ngq s THR 76 CO -0.06 0.55 0.20 -0.63 -0.69 0.00 0.00 174.62 173.99 1ngq s ILE 77 N -0.11 4.46 -0.66 1.82 1.01 -0.59 -1.76 121.20 125.36 1ngq s ILE 77 Ca -0.01 -0.95 -0.16 0.00 0.00 0.00 0.00 60.65 59.54 1ngq s ILE 77 Cb -0.14 -3.52 0.16 0.00 0.01 0.00 0.00 42.46 38.98 1ngq s ILE 77 CO 0.03 -0.26 0.63 -0.89 0.00 0.00 0.00 174.94 174.46 1ngq s THR 78 N 1.52 5.33 0.00 2.92 2.01 0.20 -2.05 115.64 125.58 1ngq s THR 78 Ca 0.02 -1.84 0.00 0.00 0.31 0.00 0.00 61.69 60.17 1ngq s THR 78 Cb -0.20 -4.41 0.00 0.00 0.01 0.00 0.00 72.50 67.90 1ngq s THR 78 CO 0.06 -0.97 0.00 0.61 -0.69 0.00 0.00 174.62 173.63 1ngq n GLY 79 N 4.76 0.66 3.54 4.40 0.00 -0.92 -4.68 105.19 112.96 1ngq n GLY 79 Ca -0.02 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 1ngq n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ngq n ALA 80 N 0.00 -0.47 -2.46 4.61 0.00 0.32 -4.47 120.51 118.04 1ngq n ALA 80 Ca 0.00 0.05 -0.24 0.00 0.00 0.00 0.00 53.44 53.25 1ngq n ALA 80 Cb 0.00 -1.97 -0.10 0.00 0.00 0.00 0.00 19.45 17.38 1ngq n ALA 80 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1ngq s GLN 81 N -2.26 1.64 0.49 0.00 2.00 -1.26 -0.37 119.66 119.88 1ngq s GLN 81 Ca 0.70 -1.73 0.17 0.00 -2.00 0.00 0.00 55.36 52.50 1ngq s GLN 81 Cb -0.47 -1.73 1.19 0.00 0.80 0.00 0.00 33.01 32.81 1ngq s GLN 81 CO 0.52 0.33 2.04 1.15 -0.50 0.00 0.00 175.29 178.83 1ngq h THR 82 N 2.40 0.90 0.00 -0.34 2.02 -1.94 0.22 112.91 116.17 1ngq h THR 82 Ca -0.41 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 66.71 1ngq h THR 82 Cb 1.25 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 1ngq h THR 82 CO 0.59 0.03 0.00 -0.08 0.37 0.00 0.00 175.52 176.43 1ngq h GLU 83 N 0.18 0.00 -0.02 6.66 4.81 -1.95 -2.98 114.58 121.27 1ngq h GLU 83 Ca 0.18 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1ngq h GLU 83 Cb 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1ngq h GLU 83 CO -0.03 0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 178.00 1ngq n ASP 84 N -2.99 0.26 -4.61 1.04 8.00 0.07 -4.78 116.55 113.54 1ngq n ASP 84 Ca 0.02 -1.43 -0.43 0.00 0.71 0.00 0.00 54.79 53.66 1ngq n ASP 84 Cb 0.35 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.41 1ngq n ASP 84 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1ngq s GLU 85 N -1.97 3.68 0.02 -1.24 2.12 -1.13 -4.87 118.70 115.31 1ngq s GLU 85 Ca 0.30 0.98 -0.04 0.00 0.36 0.00 0.00 54.97 56.58 1ngq s GLU 85 Cb 0.14 -3.97 0.01 0.00 0.26 0.00 0.00 34.13 30.57 1ngq s GLU 85 CO 0.24 -1.43 0.17 0.00 -0.54 0.00 0.00 175.26 173.71 1ngq n ALA 86 N 8.39 -0.47 -2.86 6.30 0.00 -0.86 -4.94 120.51 126.07 1ngq n ALA 86 Ca 0.16 -0.14 -0.35 0.00 0.00 0.00 0.00 53.44 53.10 1ngq n ALA 86 Cb 0.48 0.06 -0.11 0.00 0.00 0.00 0.00 19.45 19.88 1ngq n ALA 86 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ngq s ILE 87 N -2.35 4.66 -0.19 0.00 1.01 -0.81 -0.91 121.20 122.60 1ngq s ILE 87 Ca 0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 60.65 60.57 1ngq s ILE 87 Cb -0.00 -3.12 -0.02 0.00 0.01 0.00 0.00 42.46 39.32 1ngq s ILE 87 CO 0.00 0.42 -0.02 -0.31 0.00 0.00 0.00 174.94 175.04 1ngq s TYR 88 N 0.76 3.02 -0.02 3.97 1.51 -0.75 0.05 117.35 125.89 1ngq s TYR 88 Ca 0.03 -0.47 0.05 0.00 -1.01 0.00 0.00 57.07 55.67 1ngq s TYR 88 Cb -0.13 -2.05 -0.03 0.00 -0.11 0.00 0.00 41.96 39.64 1ngq s TYR 88 CO 0.02 -0.22 -0.14 -0.06 -1.11 0.00 0.00 175.55 174.04 1ngq s PHE 89 N 0.87 2.68 0.18 2.71 0.08 0.39 -0.48 117.98 124.41 1ngq s PHE 89 Ca 0.00 -0.17 0.08 0.00 0.12 0.00 0.00 56.93 56.96 1ngq s PHE 89 Cb -0.14 -1.58 -0.04 0.00 -0.57 0.00 0.00 43.02 40.68 1ngq s PHE 89 CO 0.02 0.22 -0.00 0.00 -0.10 0.00 0.00 175.22 175.36 1ngq s ALA 91 N -1.77 0.59 -0.02 0.00 0.00 -0.27 -0.03 121.76 120.26 1ngq s ALA 91 Ca 0.28 -0.39 0.05 0.00 0.00 0.00 0.00 51.96 51.90 1ngq s ALA 91 Cb -0.09 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1ngq s ALA 91 CO 0.18 0.12 -0.17 -0.51 0.00 0.00 0.00 175.76 175.39 1ngq s LEU 92 N -0.42 2.00 -0.03 0.00 1.43 -0.47 -1.36 118.68 119.84 1ngq s LEU 92 Ca 0.01 -0.31 -0.14 0.00 -1.03 0.00 0.00 54.13 52.65 1ngq s LEU 92 Cb -0.04 -0.88 -0.05 0.00 0.03 0.00 0.00 46.19 45.25 1ngq s LEU 92 CO -0.00 0.19 0.38 0.86 0.23 0.00 0.00 176.35 178.02 1ngq s TRP 93 N -0.30 3.69 -0.50 0.29 -0.11 0.12 -2.03 118.94 120.10 1ngq s TRP 93 Ca 0.04 0.92 0.08 0.00 1.22 0.00 0.00 56.10 58.36 1ngq s TRP 93 Cb -0.07 -2.28 0.30 0.00 -1.50 0.00 0.00 33.47 29.91 1ngq s TRP 93 CO -0.00 0.59 0.75 0.66 -4.62 0.00 0.00 176.95 174.33 1ngq n TYR 94 N 2.07 2.04 0.00 5.86 4.01 -0.35 -4.34 117.16 126.45 1ngq n TYR 94 Ca -0.14 -3.90 0.00 0.00 -0.16 0.00 0.00 57.90 53.70 1ngq n TYR 94 Cb 0.52 -0.46 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 1ngq n TYR 94 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1ngq n SER 95 N 0.55 0.00 0.00 7.72 7.64 -1.26 -3.85 113.62 124.42 1ngq n SER 95 Ca 0.27 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.15 1ngq n SER 95 Cb 0.49 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 1ngq n SER 95 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1ngq n ASN 96 N 0.18 0.00 -4.02 6.43 0.23 -1.26 -5.14 115.26 111.68 1ngq n ASN 96 Ca 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.95 1ngq n ASN 96 Cb 0.00 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 37.64 1ngq n ASN 96 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 1ngq s HIS 97 N 0.00 0.50 -0.04 -2.53 -3.43 -1.25 -5.16 115.29 103.38 1ngq s HIS 97 Ca 0.00 -0.84 -0.00 0.00 -0.80 0.00 0.00 55.06 53.42 1ngq s HIS 97 Cb 0.00 0.03 -0.03 0.00 -1.43 0.00 0.00 32.58 31.14 1ngq s HIS 97 CO 0.00 -0.89 0.01 -1.58 -2.00 0.00 0.00 174.74 170.28 1ngq s TRP 98 N -4.03 3.13 -0.08 0.38 0.52 -1.26 -1.22 118.94 116.38 1ngq s TRP 98 Ca 0.25 0.14 0.02 0.00 0.02 0.00 0.00 56.10 56.53 1ngq s TRP 98 Cb 0.01 -1.73 0.01 0.00 -1.15 0.00 0.00 33.47 30.61 1ngq s TRP 98 CO 0.08 0.47 -0.14 0.08 0.02 0.00 0.00 176.95 177.46 1ngq s VAL 99 N -1.00 1.34 0.06 4.03 1.01 -0.86 -5.00 120.40 119.98 1ngq s VAL 99 Ca 0.17 -0.59 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 1ngq s VAL 99 Cb -0.11 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.01 1ngq s VAL 99 CO 0.07 0.40 0.26 -0.36 0.00 0.00 0.00 175.10 175.48 1ngq s PHE 100 N 0.69 3.52 0.79 5.22 0.08 -1.26 -1.37 117.98 125.65 1ngq s PHE 100 Ca -0.14 0.42 -0.09 0.00 0.12 0.00 0.00 56.93 57.25 1ngq s PHE 100 Cb -0.16 -1.89 0.11 0.00 -0.57 0.00 0.00 43.02 40.51 1ngq s PHE 100 CO 0.03 0.56 1.11 0.20 -0.10 0.00 0.00 175.22 177.02 1ngq s GLY 101 N -2.23 1.71 0.20 4.36 0.00 0.96 -4.58 107.32 107.75 1ngq s GLY 101 Ca 0.34 -1.10 0.25 0.00 0.00 0.00 0.00 44.72 44.21 1ngq s GLY 101 CO 0.23 -0.56 1.74 0.61 0.00 0.00 0.00 173.10 175.13 1ngq n GLY 102 N -3.17 -1.48 0.00 0.20 0.00 -1.26 -4.72 105.19 94.76 1ngq n GLY 102 Ca 0.11 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1ngq n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ngq n GLY 103 N 0.72 -0.85 3.30 -0.02 0.00 -1.26 -5.02 105.19 102.06 1ngq n GLY 103 Ca 0.04 -1.47 -0.35 0.00 0.00 0.00 0.00 46.02 44.24 1ngq n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ngq s THR 104 N -3.22 3.35 -0.33 2.61 2.01 0.36 -4.56 115.64 115.87 1ngq s THR 104 Ca 0.00 -0.52 -0.29 0.00 0.31 0.00 0.00 61.69 61.19 1ngq s THR 104 Cb 0.00 -2.54 0.02 0.00 0.01 0.00 0.00 72.50 69.99 1ngq s THR 104 CO 0.00 0.41 1.11 -0.75 -0.69 0.00 0.00 174.62 174.70 1ngq s LYS 105 N 1.47 4.02 -0.17 4.92 2.47 -0.74 -1.81 119.74 129.91 1ngq s LYS 105 Ca 0.06 1.06 -0.06 0.00 -1.56 0.00 0.00 55.97 55.46 1ngq s LYS 105 Cb -0.14 -3.77 -0.04 0.00 -1.46 0.00 0.00 37.83 32.42 1ngq s LYS 105 CO -0.03 -0.97 0.04 -1.17 0.16 0.00 0.00 175.35 173.39 1ngq s LEU 106 N 3.80 3.73 -0.18 5.43 2.96 -0.09 -1.23 118.68 133.10 1ngq s LEU 106 Ca 0.47 0.07 -0.02 0.00 -0.22 0.00 0.00 54.13 54.42 1ngq s LEU 106 Cb -0.12 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 1ngq s LEU 106 CO 0.18 0.20 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.43 1ngq s THR 107 N 0.22 3.21 -0.52 3.68 2.01 0.21 -2.02 115.64 122.42 1ngq s THR 107 Ca 0.03 -0.57 -0.07 0.00 0.31 0.00 0.00 61.69 61.39 1ngq s THR 107 Cb -0.13 -2.41 0.14 0.00 0.01 0.00 0.00 72.50 70.11 1ngq s THR 107 CO 0.01 0.47 0.37 -0.69 -0.69 0.00 0.00 174.62 174.09 1ngq s VAL 108 N 1.03 3.99 -0.47 3.82 1.01 -1.26 -0.53 120.40 127.99 1ngq s VAL 108 Ca -0.00 -2.18 -0.37 0.00 0.00 0.00 0.00 61.98 59.43 1ngq s VAL 108 Cb -0.15 -3.63 -0.17 0.00 0.00 0.00 0.00 36.38 32.44 1ngq s VAL 108 CO -0.01 -0.80 1.91 0.18 0.00 0.00 0.00 175.10 176.38 1ngq n LEU 109 N 4.43 0.62 -0.59 3.92 4.32 0.59 -4.72 117.00 125.57 1ngq n LEU 109 Ca -0.01 0.55 0.06 0.00 -0.02 0.00 0.00 56.01 56.60 1ngq n LEU 109 Cb 0.41 -0.79 0.10 0.00 -1.62 0.00 0.00 43.42 41.52 1ngq n LEU 109 CO 0.38 -0.67 0.53 0.61 -1.22 0.00 0.00 177.39 177.02 1ngq n GLY 110 N 6.45 1.04 3.61 -0.72 0.00 -1.26 -4.33 105.19 109.98 1ngq n GLY 110 Ca 0.49 -0.39 -0.03 0.00 0.00 0.00 0.00 46.02 46.09 1ngq n GLY 110 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ngq s GLN 111 N -1.03 0.52 0.72 1.61 -2.07 -1.26 -5.17 119.66 112.99 1ngq s GLN 111 Ca 0.19 -0.24 -0.15 0.00 -1.82 0.00 0.00 55.36 53.35 1ngq s GLN 111 Cb 0.12 0.21 0.04 0.00 -1.09 0.00 0.00 33.01 32.28 1ngq s GLN 111 CO 0.17 -0.23 1.20 -2.14 -1.32 0.00 0.00 175.29 172.96 1ngq s PRO 112 N -2.63 2.20 0.79 9.60 0.02 -1.26 -4.95 135.00 138.77 1ngq s PRO 112 Ca 0.11 1.72 -0.13 0.00 0.02 0.00 0.00 61.00 62.71 1ngq s PRO 112 Cb 0.01 -1.85 0.07 0.00 0.02 0.00 0.00 34.50 32.76 1ngq s PRO 112 CO -0.04 -1.78 1.18 0.15 -0.33 0.00 0.00 177.00 176.18 1ngq s LYS 113 N -3.93 1.80 -0.08 5.54 1.02 -1.26 -4.94 119.74 117.89 1ngq s LYS 113 Ca 0.73 1.66 -0.04 0.00 0.02 0.00 0.00 55.97 58.35 1ngq s LYS 113 Cb -0.28 -1.80 0.04 0.00 -0.52 0.00 0.00 37.83 35.27 1ngq s LYS 113 CO 0.45 -2.07 0.19 0.45 -0.92 0.00 0.00 175.35 173.45 1ngq s SER 114 N -2.31 -0.18 0.58 2.83 0.15 0.02 -4.97 113.70 109.82 1ngq s SER 114 Ca 0.71 0.40 -0.15 0.00 0.70 0.00 0.00 55.95 57.61 1ngq s SER 114 Cb -0.27 0.28 -0.04 0.00 -1.71 0.00 0.00 66.02 64.28 1ngq s SER 114 CO 0.50 -0.16 1.04 -0.44 1.20 0.00 0.00 173.24 175.38 1ngq s SER 115 N 1.20 6.01 0.62 5.45 0.01 -1.26 -1.71 113.70 124.01 1ngq s SER 115 Ca -0.09 1.71 -0.15 0.00 1.31 0.00 0.00 55.95 58.73 1ngq s SER 115 Cb -0.11 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.57 1ngq s SER 115 CO -0.07 -1.01 1.06 -2.16 0.41 0.00 0.00 173.24 171.46 1ngq s PRO 116 N -4.21 3.24 -0.34 12.44 0.04 -1.26 -4.41 135.00 140.49 1ngq s PRO 116 Ca 0.61 1.14 -0.04 0.00 0.04 0.00 0.00 61.00 62.75 1ngq s PRO 116 Cb -0.14 -2.03 0.06 0.00 0.04 0.00 0.00 34.50 32.44 1ngq s PRO 116 CO 0.38 -0.87 0.09 -1.12 0.04 0.00 0.00 177.00 175.52 1ngq s SER 117 N -3.03 5.15 -0.11 6.66 0.01 -0.42 -4.94 113.70 117.02 1ngq s SER 117 Ca 0.62 -1.41 -0.03 0.00 1.31 0.00 0.00 55.95 56.43 1ngq s SER 117 Cb -0.15 -1.80 -0.03 0.00 0.21 0.00 0.00 66.02 64.24 1ngq s SER 117 CO 0.41 -0.36 0.01 -0.69 0.41 0.00 0.00 173.24 173.02 1ngq s VAL 118 N 1.28 4.41 -0.05 3.43 1.01 -1.26 -0.90 120.40 128.32 1ngq s VAL 118 Ca -0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 1ngq s VAL 118 Cb -0.21 -2.89 0.03 0.00 0.00 0.00 0.00 36.38 33.32 1ngq s VAL 118 CO -0.00 0.57 0.11 -0.89 0.00 0.00 0.00 175.10 174.89 1ngq s THR 119 N -0.56 -0.04 -0.12 3.92 2.01 -0.64 -5.00 115.64 115.21 1ngq s THR 119 Ca 0.10 0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.26 1ngq s THR 119 Cb -0.12 -0.19 -0.01 0.00 0.01 0.00 0.00 72.50 72.20 1ngq s THR 119 CO 0.02 0.06 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.61 1ngq s LEU 120 N 0.91 2.42 0.09 4.42 0.20 -1.26 -0.16 118.68 125.30 1ngq s LEU 120 Ca -0.07 -0.44 0.06 0.00 0.69 0.00 0.00 54.13 54.37 1ngq s LEU 120 Cb -0.09 -1.52 -0.04 0.00 -0.43 0.00 0.00 46.19 44.11 1ngq s LEU 120 CO -0.04 0.15 -0.09 -0.36 -0.29 0.00 0.00 176.35 175.73 1ngq s PHE 121 N 0.40 2.78 0.57 5.38 0.40 -0.18 -4.97 117.98 122.37 1ngq s PHE 121 Ca -0.14 -0.13 -0.07 0.00 -0.60 0.00 0.00 56.93 56.00 1ngq s PHE 121 Cb -0.17 -1.47 -0.01 0.00 0.51 0.00 0.00 43.02 41.88 1ngq s PHE 121 CO 0.06 0.42 0.90 -2.14 0.70 0.00 0.00 175.22 175.16 1ngq s PRO 122 N -2.11 3.21 0.30 0.24 0.02 -1.26 -2.73 135.00 132.67 1ngq s PRO 122 Ca 0.21 0.21 -0.29 0.00 0.02 0.00 0.00 61.00 61.15 1ngq s PRO 122 Cb -0.11 -2.26 -0.11 0.00 0.02 0.00 0.00 34.50 32.04 1ngq s PRO 122 CO 0.13 -0.55 1.49 -2.14 -0.33 0.00 0.00 177.00 175.60 1ngq s PRO 123 N -4.97 4.19 0.91 5.54 0.02 -1.24 -4.83 135.00 134.62 1ngq s PRO 123 Ca 0.52 2.45 -0.12 0.00 0.02 0.00 0.00 61.00 63.87 1ngq s PRO 123 Cb -0.11 -3.05 0.14 0.00 0.02 0.00 0.00 34.50 31.51 1ngq s PRO 123 CO 0.47 -0.49 1.12 -1.54 -0.33 0.00 0.00 177.00 176.22 1ngq s SER 124 N 0.20 3.47 0.15 2.53 1.04 -1.26 -4.92 113.70 114.90 1ngq s SER 124 Ca 0.58 1.12 0.07 0.00 0.48 0.00 0.00 55.95 58.20 1ngq s SER 124 Cb -0.45 -1.75 -0.11 0.00 0.10 0.00 0.00 66.02 63.81 1ngq s SER 124 CO 0.50 -2.60 1.34 0.77 0.98 0.00 0.00 173.24 174.23 1ngq h SER 125 N -1.52 0.01 0.32 7.02 4.64 -1.97 -2.64 113.55 119.42 1ngq h SER 125 Ca -0.51 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 60.76 1ngq h SER 125 Cb 1.32 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.40 1ngq h SER 125 CO 0.60 0.94 -0.18 -0.33 -0.87 0.00 0.00 176.83 176.99 1ngq h GLU 126 N 0.00 0.00 0.00 4.77 5.08 -1.98 -0.68 114.58 121.78 1ngq h GLU 126 Ca -0.01 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.18 1ngq h GLU 126 Cb 1.65 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.88 1ngq h GLU 126 CO 0.12 0.18 -1.01 1.49 -1.00 0.00 0.00 179.01 178.79 1ngq h GLU 127 N 0.00 0.00 0.00 2.33 4.81 -1.84 -3.19 114.58 116.69 1ngq h GLU 127 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ngq h GLU 127 Cb 0.39 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1ngq h GLU 127 CO 0.02 0.55 0.00 1.28 -0.73 0.00 0.00 179.01 180.13 1ngq n LEU 128 N -3.13 0.00 -0.38 1.64 4.77 -0.31 -2.20 117.00 117.39 1ngq n LEU 128 Ca -0.04 0.35 0.14 0.00 -0.03 0.00 0.00 56.01 56.43 1ngq n LEU 128 Cb 0.85 -0.35 0.46 0.00 -2.33 0.00 0.00 43.42 42.04 1ngq n LEU 128 CO 0.43 -0.00 0.78 -0.62 -1.33 0.00 0.00 177.39 176.65 1ngq n GLU 129 N -1.35 1.32 0.00 3.23 -0.58 -0.91 -3.30 120.64 119.04 1ngq n GLU 129 Ca 0.12 -0.77 0.07 0.00 -0.42 0.00 0.00 57.16 56.16 1ngq n GLU 129 Cb 0.27 -1.48 -0.00 0.00 -0.57 0.00 0.00 31.44 29.65 1ngq n GLU 129 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1ngq n THR 130 N -0.17 0.00 -1.86 2.62 -1.04 -0.93 -4.96 114.28 107.94 1ngq n THR 130 Ca 0.16 -0.35 -0.03 0.00 -2.04 0.00 0.00 64.05 61.79 1ngq n THR 130 Cb 0.35 1.15 -0.00 0.00 -1.82 0.00 0.00 70.33 70.01 1ngq n THR 130 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1ngq n ASN 131 N -0.23 -2.08 -4.07 8.00 6.94 -1.21 -4.96 115.26 117.66 1ngq n ASN 131 Ca 0.05 0.01 -0.11 0.00 -0.02 0.00 0.00 54.58 54.51 1ngq n ASN 131 Cb 0.28 -1.16 -0.11 0.00 -2.36 0.00 0.00 39.78 36.43 1ngq n ASN 131 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1ngq s LYS 132 N -3.77 0.55 -0.11 -3.83 2.47 -1.15 -0.16 119.74 113.74 1ngq s LYS 132 Ca 0.00 -0.87 -0.04 0.00 -1.56 0.00 0.00 55.97 53.50 1ngq s LYS 132 Cb 0.00 -0.16 0.05 0.00 -1.46 0.00 0.00 37.83 36.26 1ngq s LYS 132 CO 0.00 0.01 0.23 0.00 0.16 0.00 0.00 175.35 175.74 1ngq s ALA 133 N -1.98 -0.45 -0.12 3.13 0.00 -1.21 -3.12 121.76 118.01 1ngq s ALA 133 Ca -0.06 0.86 -0.01 0.00 0.00 0.00 0.00 51.96 52.75 1ngq s ALA 133 Cb -0.06 -0.80 0.03 0.00 0.00 0.00 0.00 23.12 22.29 1ngq s ALA 133 CO -0.02 -0.44 -0.06 0.99 0.00 0.00 0.00 175.76 176.24 1ngq s THR 134 N 1.91 0.96 -0.21 0.00 2.01 -1.26 -0.32 115.64 118.73 1ngq s THR 134 Ca -0.03 -0.32 -0.21 0.00 0.31 0.00 0.00 61.69 61.44 1ngq s THR 134 Cb -0.11 -1.04 -0.02 0.00 0.01 0.00 0.00 72.50 71.33 1ngq s THR 134 CO -0.08 0.29 0.63 -0.76 -0.69 0.00 0.00 174.62 174.01 1ngq s LEU 135 N 1.73 4.13 -0.21 4.42 2.01 -0.43 -3.73 118.68 126.60 1ngq s LEU 135 Ca 0.04 0.81 -0.07 0.00 0.01 0.00 0.00 54.13 54.92 1ngq s LEU 135 Cb -0.13 -2.88 -0.03 0.00 0.01 0.00 0.00 46.19 43.15 1ngq s LEU 135 CO -0.08 -0.28 0.05 -0.69 1.01 0.00 0.00 176.35 176.36 1ngq s VAL 136 N 1.99 4.47 -0.26 -1.59 1.01 -1.10 -2.10 120.40 122.82 1ngq s VAL 136 Ca 0.28 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.10 1ngq s VAL 136 Cb -0.16 -3.04 0.02 0.00 0.00 0.00 0.00 36.38 33.20 1ngq s VAL 136 CO 0.10 0.41 -0.03 0.00 0.00 0.00 0.00 175.10 175.59 1ngq s THR 138 N 1.38 4.69 -0.13 0.00 -4.23 0.77 -0.56 115.64 117.56 1ngq s THR 138 Ca 0.01 -0.10 -0.02 0.00 -1.18 0.00 0.00 61.69 60.41 1ngq s THR 138 Cb -0.16 -3.02 0.04 0.00 1.34 0.00 0.00 72.50 70.70 1ngq s THR 138 CO -0.03 0.58 -0.01 -0.63 -0.54 0.00 0.00 174.62 174.00 1ngq s ILE 139 N -0.68 0.62 0.27 2.99 1.01 0.22 -1.62 121.20 124.01 1ngq s ILE 139 Ca 0.11 -0.26 0.03 0.00 0.00 0.00 0.00 60.65 60.54 1ngq s ILE 139 Cb -0.12 -0.87 -0.06 0.00 0.01 0.00 0.00 42.46 41.42 1ngq s ILE 139 CO 0.02 0.11 0.04 0.42 0.00 0.00 0.00 174.94 175.53 1ngq s THR 140 N 1.85 1.01 -1.52 2.92 -4.23 -0.08 -0.49 115.64 115.10 1ngq s THR 140 Ca 0.02 -2.02 -0.13 0.00 -1.18 0.00 0.00 61.69 58.38 1ngq s THR 140 Cb -0.14 -2.57 0.08 0.00 1.34 0.00 0.00 72.50 71.21 1ngq s THR 140 CO -0.07 -0.14 1.01 0.47 -0.54 0.00 0.00 174.62 175.35 1ngq n ASP 141 N -0.53 -5.03 -4.72 3.99 8.00 -0.54 -1.30 116.55 116.43 1ngq n ASP 141 Ca -0.03 -0.75 -0.30 0.00 0.71 0.00 0.00 54.79 54.42 1ngq n ASP 141 Cb 0.65 -4.02 -0.07 0.00 -0.02 0.00 0.00 41.12 37.66 1ngq n ASP 141 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1ngq s PHE 142 N -3.30 3.07 -0.26 1.24 -0.12 -0.69 -4.41 117.98 113.51 1ngq s PHE 142 Ca 0.66 0.02 -0.17 0.00 -0.05 0.00 0.00 56.93 57.39 1ngq s PHE 142 Cb -0.33 -1.57 0.07 0.00 -0.63 0.00 0.00 43.02 40.56 1ngq s PHE 142 CO 0.82 0.49 0.65 -0.47 -0.05 0.00 0.00 175.22 176.66 1ngq s TYR 143 N -1.33 -0.92 0.83 3.49 5.04 -0.69 -0.04 117.35 123.73 1ngq s TYR 143 Ca 0.27 1.94 -0.14 0.00 -2.44 0.00 0.00 57.07 56.70 1ngq s TYR 143 Cb -0.12 0.49 0.04 0.00 0.35 0.00 0.00 41.96 42.72 1ngq s TYR 143 CO 0.19 -0.46 0.77 -2.30 -1.34 0.00 0.00 175.55 172.41 1ngq n PRO 144 N 3.88 0.05 -1.32 4.97 -0.02 -1.26 -0.80 135.00 140.49 1ngq n PRO 144 Ca -0.19 0.08 -0.30 0.00 -2.02 0.00 0.00 63.50 61.06 1ngq n PRO 144 Cb 0.58 -2.09 -0.07 0.00 -0.02 0.00 0.00 33.50 31.90 1ngq n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ngq n GLY 145 N 1.14 4.02 2.77 -1.23 0.00 -1.26 -4.82 105.19 105.80 1ngq n GLY 145 Ca 0.10 -1.52 -0.16 0.00 0.00 0.00 0.00 46.02 44.45 1ngq n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ngq s VAL 146 N 1.06 -0.08 0.13 1.61 1.01 -1.26 -4.85 120.40 118.03 1ngq s VAL 146 Ca 0.66 0.26 -0.03 0.00 0.00 0.00 0.00 61.98 62.88 1ngq s VAL 146 Cb 0.24 -0.12 -0.03 0.00 0.00 0.00 0.00 36.38 36.46 1ngq s VAL 146 CO -0.06 0.11 0.10 0.68 0.00 0.00 0.00 175.10 175.93 1ngq s VAL 147 N 1.36 0.10 -0.12 2.92 -7.23 -1.26 -4.60 120.40 111.57 1ngq s VAL 147 Ca -0.06 -1.80 0.01 0.00 -1.81 0.00 0.00 61.98 58.33 1ngq s VAL 147 Cb -0.13 -1.98 0.02 0.00 0.56 0.00 0.00 36.38 34.86 1ngq s VAL 147 CO -0.03 -0.46 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.26 1ngq s THR 148 N -4.03 1.53 -0.15 5.32 2.01 -0.99 -4.98 115.64 114.36 1ngq s THR 148 Ca 0.22 -0.65 0.01 0.00 0.31 0.00 0.00 61.69 61.58 1ngq s THR 148 Cb 0.07 -1.41 -0.00 0.00 0.01 0.00 0.00 72.50 71.16 1ngq s THR 148 CO 0.01 0.45 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.53 1ngq s VAL 149 N 1.11 2.57 -0.05 3.82 1.01 -1.26 -0.14 120.40 127.46 1ngq s VAL 149 Ca -0.04 -0.81 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1ngq s VAL 149 Cb -0.14 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.18 1ngq s VAL 149 CO -0.04 0.52 -0.09 -1.81 0.00 0.00 0.00 175.10 173.68 1ngq s ASP 150 N 0.79 1.36 -0.02 3.32 1.01 0.16 -4.97 116.67 118.32 1ngq s ASP 150 Ca -0.06 -0.22 -0.05 0.00 0.71 0.00 0.00 52.55 52.93 1ngq s ASP 150 Cb -0.15 -0.60 -0.04 0.00 1.01 0.00 0.00 42.92 43.13 1ngq s ASP 150 CO -0.00 0.01 0.21 0.26 0.21 0.00 0.00 175.17 175.86 1ngq s TRP 151 N 0.67 3.57 -0.26 4.23 0.52 -1.26 0.53 118.94 126.94 1ngq s TRP 151 Ca -0.12 0.48 -0.02 0.00 0.02 0.00 0.00 56.10 56.46 1ngq s TRP 151 Cb -0.14 -1.92 0.11 0.00 -1.15 0.00 0.00 33.47 30.37 1ngq s TRP 151 CO 0.02 0.65 0.23 0.15 0.02 0.00 0.00 176.95 178.02 1ngq s LYS 152 N -1.69 0.24 -0.11 4.98 1.02 -0.34 -1.21 119.74 122.64 1ngq s LYS 152 Ca 0.25 -0.15 -0.23 0.00 0.02 0.00 0.00 55.97 55.85 1ngq s LYS 152 Cb -0.13 -0.97 -0.03 0.00 -0.52 0.00 0.00 37.83 36.18 1ngq s LYS 152 CO 0.15 -0.92 0.72 0.08 -0.92 0.00 0.00 175.35 174.46 1ngq s VAL 153 N 2.28 5.00 -0.59 3.17 1.01 -0.44 -2.26 120.40 128.56 1ngq s VAL 153 Ca 0.08 1.45 -0.01 0.00 0.00 0.00 0.00 61.98 63.51 1ngq s VAL 153 Cb -0.15 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.18 1ngq s VAL 153 CO -0.28 0.17 0.02 0.47 0.00 0.00 0.00 175.10 175.48 1ngq n ASP 154 N 4.36 -2.56 0.00 3.32 8.00 0.39 0.25 116.55 130.32 1ngq n ASP 154 Ca 0.00 0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.81 1ngq n ASP 154 Cb 0.50 -2.24 0.00 0.00 -0.02 0.00 0.00 41.12 39.36 1ngq n ASP 154 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ngq n GLY 155 N -0.68 2.63 3.47 0.44 0.00 -1.26 -4.94 105.19 104.84 1ngq n GLY 155 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 1ngq n GLY 155 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ngq s THR 156 N -2.68 4.40 -0.35 2.61 2.01 0.14 -5.03 115.64 116.73 1ngq s THR 156 Ca 0.00 -0.14 -0.38 0.00 0.31 0.00 0.00 61.69 61.48 1ngq s THR 156 Cb 0.00 -3.06 -0.14 0.00 0.01 0.00 0.00 72.50 69.31 1ngq s THR 156 CO 0.00 0.34 2.05 -0.81 -0.69 0.00 0.00 174.62 175.51 1ngq n PRO 157 N 4.84 0.93 -1.38 4.92 -0.04 -1.26 -1.33 135.00 141.67 1ngq n PRO 157 Ca -0.16 0.29 -0.31 0.00 -0.04 0.00 0.00 63.50 63.28 1ngq n PRO 157 Cb 0.51 -2.19 0.08 0.00 -0.04 0.00 0.00 33.50 31.87 1ngq n PRO 157 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ngq s VAL 158 N 5.93 3.43 0.00 0.52 1.01 -0.35 -4.89 120.40 126.05 1ngq s VAL 158 Ca 1.08 0.47 0.00 0.00 0.00 0.00 0.00 61.98 63.52 1ngq s VAL 158 Cb -1.03 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 32.29 1ngq s VAL 158 CO 0.57 -0.61 0.00 1.07 0.00 0.00 0.00 175.10 176.13 1ngq n THR 159 N -3.44 0.00 -4.18 3.92 5.66 -1.26 -4.73 114.28 110.25 1ngq n THR 159 Ca 0.08 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.92 1ngq n THR 159 Cb 0.54 0.62 -0.15 0.00 -1.55 0.00 0.00 70.33 69.80 1ngq n THR 159 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ngq s GLN 160 N 0.00 0.49 0.00 1.09 1.03 -1.26 -4.83 119.66 116.17 1ngq s GLN 160 Ca 0.00 -0.19 0.00 0.00 0.04 0.00 0.00 55.36 55.21 1ngq s GLN 160 Cb 0.00 -0.48 0.00 0.00 0.03 0.00 0.00 33.01 32.56 1ngq s GLN 160 CO 0.00 0.11 0.00 0.41 -2.54 0.00 0.00 175.29 173.27 1ngq n GLY 161 N 3.04 1.80 3.88 2.60 0.00 -1.26 -4.99 105.19 110.25 1ngq n GLY 161 Ca -0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1ngq n GLY 161 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1ngq s MET 162 N -0.13 3.78 -0.11 1.61 0.23 -1.25 -2.52 119.30 120.92 1ngq s MET 162 Ca 0.00 0.26 -0.05 0.00 -1.03 0.00 0.00 55.69 54.87 1ngq s MET 162 Cb 0.00 -2.62 0.05 0.00 -1.53 0.00 0.00 34.83 30.73 1ngq s MET 162 CO 0.00 0.28 0.24 -1.21 -2.03 0.00 0.00 175.02 172.29 1ngq s GLU 163 N -2.99 0.17 -0.14 3.16 2.02 -0.24 -4.98 118.70 115.71 1ngq s GLU 163 Ca 0.47 0.57 0.02 0.00 0.02 0.00 0.00 54.97 56.06 1ngq s GLU 163 Cb -0.11 -0.12 0.01 0.00 0.10 0.00 0.00 34.13 34.02 1ngq s GLU 163 CO 0.23 -0.20 -0.20 0.99 0.02 0.00 0.00 175.26 176.10 1ngq s THR 164 N 1.60 1.91 1.18 3.63 2.01 -1.26 0.11 115.64 124.81 1ngq s THR 164 Ca -0.06 -0.88 -0.17 0.00 0.31 0.00 0.00 61.69 60.88 1ngq s THR 164 Cb -0.11 -1.70 0.27 0.00 0.01 0.00 0.00 72.50 70.97 1ngq s THR 164 CO -0.08 0.52 1.08 0.42 -0.69 0.00 0.00 174.62 175.87 1ngq s THR 165 N 0.92 1.69 0.06 -0.82 -4.23 -0.48 -4.99 115.64 107.79 1ngq s THR 165 Ca -0.06 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.32 1ngq s THR 165 Cb -0.15 -2.41 -0.06 0.00 1.34 0.00 0.00 72.50 71.22 1ngq s THR 165 CO -0.03 0.00 0.44 -1.10 -0.54 0.00 0.00 174.62 173.39 1ngq s GLN 166 N -5.18 3.88 0.15 3.99 1.11 -1.26 -4.76 119.66 117.59 1ngq s GLN 166 Ca 0.69 0.35 -0.34 0.00 0.01 0.00 0.00 55.36 56.07 1ngq s GLN 166 Cb -0.14 -3.08 -0.15 0.00 -1.01 0.00 0.00 33.01 28.63 1ngq s GLN 166 CO 0.57 0.60 1.43 -2.30 0.01 0.00 0.00 175.29 175.61 1ngq n PRO 167 N 1.29 1.71 -5.00 2.91 -0.02 -1.26 -4.80 135.00 129.83 1ngq n PRO 167 Ca -0.10 0.61 -0.32 0.00 -2.02 0.00 0.00 63.50 61.67 1ngq n PRO 167 Cb 0.52 -2.30 -0.14 0.00 -0.02 0.00 0.00 33.50 31.56 1ngq n PRO 167 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ngq s SER 168 N 0.58 3.75 -0.09 2.55 0.15 -0.19 -4.93 113.70 115.51 1ngq s SER 168 Ca 0.78 -0.28 -0.30 0.00 0.70 0.00 0.00 55.95 56.85 1ngq s SER 168 Cb -0.78 -0.78 -0.02 0.00 -1.71 0.00 0.00 66.02 62.73 1ngq s SER 168 CO 0.44 0.32 1.19 -0.54 1.20 0.00 0.00 173.24 175.86 1ngq s LYS 169 N -0.61 4.33 0.85 5.44 1.02 -1.26 -1.26 119.74 128.24 1ngq s LYS 169 Ca 0.09 1.64 -0.09 0.00 0.02 0.00 0.00 55.97 57.62 1ngq s LYS 169 Cb -0.11 -3.61 0.16 0.00 -0.52 0.00 0.00 37.83 33.75 1ngq s LYS 169 CO 0.01 -0.51 1.17 -0.65 -0.92 0.00 0.00 175.35 174.45 1ngq s GLN 170 N 2.54 1.19 0.14 1.68 -0.21 0.06 -4.94 119.66 120.12 1ngq s GLN 170 Ca 0.54 -0.64 -0.17 0.00 0.02 0.00 0.00 55.36 55.12 1ngq s GLN 170 Cb -0.23 -2.05 -0.01 0.00 1.00 0.00 0.00 33.01 31.71 1ngq s GLN 170 CO 0.19 -1.94 1.77 0.66 -2.12 0.00 0.00 175.29 173.85 1ngq h SER 171 N -1.13 0.42 0.20 5.90 4.64 -1.97 -1.63 113.55 119.98 1ngq h SER 171 Ca -0.41 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1ngq h SER 171 Cb 1.26 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1ngq h SER 171 CO 0.42 0.35 0.00 -0.46 -0.87 0.00 0.00 176.83 176.26 1ngq n ASN 172 N -4.81 0.00 0.00 4.97 0.23 -1.26 -4.83 115.26 109.56 1ngq n ASN 172 Ca -0.01 0.08 0.00 0.00 -0.53 0.00 0.00 54.58 54.13 1ngq n ASN 172 Cb 0.05 -0.26 0.00 0.00 -2.08 0.00 0.00 39.78 37.49 1ngq n ASN 172 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1ngq n ASN 173 N -1.26 -2.34 -4.97 0.53 5.03 -0.61 -5.07 115.26 106.57 1ngq n ASN 173 Ca 0.06 0.00 -0.21 0.00 0.87 0.00 0.00 54.58 55.30 1ngq n ASN 173 Cb 0.09 -0.39 0.08 0.00 -1.02 0.00 0.00 39.78 38.53 1ngq n ASN 173 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1ngq s LYS 174 N -1.24 2.10 0.39 3.52 1.02 -1.26 -4.85 119.74 119.42 1ngq s LYS 174 Ca 0.00 -1.64 0.04 0.00 0.02 0.00 0.00 55.97 54.39 1ngq s LYS 174 Cb 0.00 -2.58 -0.04 0.00 -0.52 0.00 0.00 37.83 34.68 1ngq s LYS 174 CO 0.00 -1.06 0.07 0.71 -0.92 0.00 0.00 175.35 174.15 1ngq s TYR 175 N -2.80 1.94 0.13 3.18 1.51 0.94 -0.76 117.35 121.50 1ngq s TYR 175 Ca 0.64 -1.04 -0.07 0.00 -1.01 0.00 0.00 57.07 55.58 1ngq s TYR 175 Cb -0.05 -1.33 -0.01 0.00 -0.11 0.00 0.00 41.96 40.46 1ngq s TYR 175 CO 0.41 -0.03 0.21 0.00 -1.11 0.00 0.00 175.55 175.03 1ngq s MET 176 N -3.81 1.01 -0.19 -0.62 0.23 -0.39 -1.46 119.30 114.06 1ngq s MET 176 Ca 0.28 -1.15 -0.33 0.00 -1.03 0.00 0.00 55.69 53.47 1ngq s MET 176 Cb 0.06 0.34 0.15 0.00 -1.53 0.00 0.00 34.83 33.84 1ngq s MET 176 CO 0.14 -0.34 1.18 0.00 -2.03 0.00 0.00 175.02 173.97 1ngq s ALA 177 N -3.94 -2.04 0.04 3.16 0.00 0.35 -1.02 121.76 118.31 1ngq s ALA 177 Ca 0.14 1.62 0.01 0.00 0.00 0.00 0.00 51.96 53.72 1ngq s ALA 177 Cb 0.05 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 1ngq s ALA 177 CO -0.04 -0.48 -0.05 -1.54 0.00 0.00 0.00 175.76 173.66 1ngq s SER 178 N -1.78 0.53 -0.01 0.00 1.04 -1.26 -0.61 113.70 111.62 1ngq s SER 178 Ca 0.07 -0.63 0.05 0.00 0.48 0.00 0.00 55.95 55.91 1ngq s SER 178 Cb -0.01 0.10 -0.01 0.00 0.10 0.00 0.00 66.02 66.20 1ngq s SER 178 CO -0.05 -0.33 -0.15 -0.55 0.98 0.00 0.00 173.24 173.15 1ngq s SER 179 N -1.85 1.72 -0.03 7.02 0.15 0.27 -1.38 113.70 119.61 1ngq s SER 179 Ca -0.09 -0.28 0.07 0.00 0.70 0.00 0.00 55.95 56.35 1ngq s SER 179 Cb -0.06 -0.18 -0.02 0.00 -1.71 0.00 0.00 66.02 64.05 1ngq s SER 179 CO -0.02 0.17 -0.25 -0.31 1.20 0.00 0.00 173.24 174.02 1ngq s TYR 180 N -0.39 2.29 -0.26 3.44 1.51 0.12 -0.47 117.35 123.58 1ngq s TYR 180 Ca 0.05 -0.50 0.01 0.00 -1.01 0.00 0.00 57.07 55.62 1ngq s TYR 180 Cb -0.06 -1.48 0.07 0.00 -0.11 0.00 0.00 41.96 40.38 1ngq s TYR 180 CO -0.00 -0.08 -0.00 -1.17 -1.11 0.00 0.00 175.55 173.18 1ngq s LEU 181 N -0.48 2.68 -0.25 -1.29 0.20 -0.89 -1.08 118.68 117.57 1ngq s LEU 181 Ca 0.06 -1.37 -0.11 0.00 0.69 0.00 0.00 54.13 53.41 1ngq s LEU 181 Cb -0.11 -1.13 -0.05 0.00 -0.43 0.00 0.00 46.19 44.47 1ngq s LEU 181 CO 0.00 -0.30 0.17 -0.89 -0.29 0.00 0.00 176.35 175.04 1ngq s THR 182 N 1.41 5.33 0.07 3.68 2.01 -1.05 -1.32 115.64 125.78 1ngq s THR 182 Ca -0.00 0.17 0.00 0.00 0.31 0.00 0.00 61.69 62.17 1ngq s THR 182 Cb -0.18 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 68.83 1ngq s THR 182 CO -0.10 0.32 0.03 0.18 -0.69 0.00 0.00 174.62 174.35 1ngq n LEU 183 N 4.53 0.00 -4.72 4.42 4.77 0.57 -4.81 117.00 121.76 1ngq n LEU 183 Ca -0.15 -0.43 -0.23 0.00 -0.03 0.00 0.00 56.01 55.18 1ngq n LEU 183 Cb 0.52 0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 1ngq n LEU 183 CO 0.34 -0.18 -0.25 0.42 -1.33 0.00 0.00 177.39 176.40 1ngq s THR 184 N -0.83 3.74 0.28 -5.08 -4.23 -1.26 -3.34 115.64 104.90 1ngq s THR 184 Ca 0.02 -1.70 -0.04 0.00 -1.18 0.00 0.00 61.69 58.79 1ngq s THR 184 Cb -0.00 -3.06 0.36 0.00 1.34 0.00 0.00 72.50 71.15 1ngq s THR 184 CO 0.01 -0.34 1.60 0.00 -0.54 0.00 0.00 174.62 175.35 1ngq h ALA 185 N 1.69 0.90 -0.11 3.99 0.00 -0.77 0.37 119.26 125.33 1ngq h ALA 185 Ca -0.46 0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1ngq h ALA 185 Cb 1.25 0.56 -0.00 0.00 0.00 0.00 0.00 17.79 19.59 1ngq h ALA 185 CO 0.61 -0.47 -0.01 0.07 0.00 0.00 0.00 179.25 179.44 1ngq h ARG 186 N 0.04 0.20 -0.93 0.00 0.11 -1.94 -2.67 114.38 109.19 1ngq h ARG 186 Ca 0.49 -0.07 0.08 0.00 0.10 0.00 0.00 59.98 60.59 1ngq h ARG 186 Cb 0.91 -0.01 -0.07 0.00 1.11 0.00 0.00 29.97 31.91 1ngq h ARG 186 CO -0.84 0.48 0.60 0.00 0.10 0.00 0.00 179.97 180.31 1ngq h ALA 187 N 0.71 1.54 0.05 0.08 0.00 -1.69 -2.00 119.26 117.95 1ngq h ALA 187 Ca 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1ngq h ALA 187 Cb 0.40 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 1ngq h ALA 187 CO 0.01 0.30 -0.45 2.35 0.00 0.00 0.00 179.25 181.45 1ngq h TRP 188 N 1.00 -1.32 0.00 0.00 2.91 -0.75 -2.06 115.95 115.74 1ngq h TRP 188 Ca 0.42 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.48 1ngq h TRP 188 Cb 0.30 0.57 0.00 0.00 -0.51 0.00 0.00 29.16 29.52 1ngq h TRP 188 CO -0.00 -0.50 0.00 1.49 -1.03 0.00 0.00 178.44 178.40 1ngq h GLU 189 N -0.60 0.00 0.00 2.65 4.57 -1.13 -3.32 114.58 116.74 1ngq h GLU 189 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1ngq h GLU 189 Cb 0.63 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 1ngq h GLU 189 CO -0.27 0.00 0.00 -2.13 -1.18 0.00 0.00 179.01 175.43 1ngq n ARG 190 N -2.95 0.00 -0.61 1.92 0.63 -0.79 -4.88 116.66 109.99 1ngq n ARG 190 Ca -0.02 0.04 -0.30 0.00 -0.92 0.00 0.00 57.85 56.66 1ngq n ARG 190 Cb 0.14 -0.69 0.21 0.00 0.45 0.00 0.00 32.46 32.57 1ngq n ARG 190 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1ngq s HIS 191 N -0.41 1.47 0.00 -0.14 0.09 -1.14 -5.02 115.29 110.15 1ngq s HIS 191 Ca 0.00 1.47 0.00 0.00 -0.00 0.00 0.00 55.06 56.53 1ngq s HIS 191 Cb 0.00 -3.21 0.00 0.00 -0.00 0.00 0.00 32.58 29.37 1ngq s HIS 191 CO 0.00 -3.39 0.00 0.45 -0.00 0.00 0.00 174.74 171.80 1ngq n SER 192 N -4.61 3.80 -4.02 1.40 2.88 -1.26 -4.91 113.62 106.89 1ngq n SER 192 Ca 0.07 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.31 1ngq n SER 192 Cb 0.53 0.66 -0.16 0.00 -0.75 0.00 0.00 64.21 64.49 1ngq n SER 192 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1ngq s SER 193 N -1.77 2.76 0.06 -3.46 0.15 -1.26 -3.56 113.70 106.61 1ngq s SER 193 Ca 0.00 -0.53 0.05 0.00 0.70 0.00 0.00 55.95 56.18 1ngq s SER 193 Cb 0.00 -1.19 -0.04 0.00 -1.71 0.00 0.00 66.02 63.08 1ngq s SER 193 CO 0.00 -0.06 -0.08 -0.31 1.20 0.00 0.00 173.24 173.99 1ngq s TYR 194 N 1.47 2.83 -0.21 3.44 1.51 -1.19 0.15 117.35 125.35 1ngq s TYR 194 Ca 0.04 -0.10 -0.16 0.00 -1.01 0.00 0.00 57.07 55.85 1ngq s TYR 194 Cb -0.13 -1.52 0.06 0.00 -0.11 0.00 0.00 41.96 40.26 1ngq s TYR 194 CO -0.11 0.40 0.53 -1.54 -1.11 0.00 0.00 175.55 173.73 1ngq s SER 195 N -1.88 -0.62 -0.26 2.29 1.04 -0.96 -1.73 113.70 111.58 1ngq s SER 195 Ca 0.20 1.12 -0.04 0.00 0.48 0.00 0.00 55.95 57.71 1ngq s SER 195 Cb -0.11 1.07 0.01 0.00 0.10 0.00 0.00 66.02 67.09 1ngq s SER 195 CO 0.12 -0.20 -0.01 0.00 0.98 0.00 0.00 173.24 174.13 1ngq s GLN 197 N 1.42 3.61 -0.15 0.00 1.11 0.19 -1.44 119.66 124.39 1ngq s GLN 197 Ca 0.02 -0.54 0.01 0.00 0.01 0.00 0.00 55.36 54.87 1ngq s GLN 197 Cb -0.16 -2.99 0.01 0.00 -1.01 0.00 0.00 33.01 28.86 1ngq s GLN 197 CO -0.02 0.09 -0.19 0.08 0.01 0.00 0.00 175.29 175.27 1ngq s VAL 198 N 0.76 2.29 -0.26 1.09 1.01 0.20 0.35 120.40 125.84 1ngq s VAL 198 Ca -0.01 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 1ngq s VAL 198 Cb -0.14 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1ngq s VAL 198 CO 0.02 0.53 0.12 -0.89 0.00 0.00 0.00 175.10 174.88 1ngq s THR 199 N 0.93 4.70 0.00 3.92 2.01 0.80 -1.19 115.64 126.81 1ngq s THR 199 Ca -0.04 -0.04 0.01 0.00 0.31 0.00 0.00 61.69 61.93 1ngq s THR 199 Cb -0.15 -3.21 -0.00 0.00 0.01 0.00 0.00 72.50 69.14 1ngq s THR 199 CO -0.03 0.31 -0.02 -2.28 -0.69 0.00 0.00 174.62 171.90 1ngq s HIS 200 N 1.66 0.17 0.00 4.92 5.04 -0.06 -2.33 115.29 124.68 1ngq s HIS 200 Ca 0.07 -0.06 0.00 0.00 -1.54 0.00 0.00 55.06 53.52 1ngq s HIS 200 Cb -0.15 -0.11 0.00 0.00 0.04 0.00 0.00 32.58 32.36 1ngq s HIS 200 CO 0.06 -0.01 0.00 -1.91 -2.34 0.00 0.00 174.74 170.54 1ngq n GLU 201 N 2.94 -0.30 0.00 2.88 4.07 -1.26 -0.22 120.64 128.74 1ngq n GLU 201 Ca -0.13 -0.15 0.00 0.00 -0.06 0.00 0.00 57.16 56.82 1ngq n GLU 201 Cb 0.59 0.27 0.00 0.00 -0.06 0.00 0.00 31.44 32.24 1ngq n GLU 201 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ngq n GLY 202 N -0.55 1.44 3.90 8.31 0.00 -1.26 -4.99 105.19 112.03 1ngq n GLY 202 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1ngq n GLY 202 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ngq s HIS 203 N -0.58 3.48 0.09 1.61 3.76 0.69 -5.08 115.29 119.27 1ngq s HIS 203 Ca 0.00 0.70 0.10 0.00 -0.15 0.00 0.00 55.06 55.70 1ngq s HIS 203 Cb 0.00 -2.16 -0.04 0.00 1.11 0.00 0.00 32.58 31.50 1ngq s HIS 203 CO 0.00 0.10 -0.24 0.99 -0.85 0.00 0.00 174.74 174.75 1ngq s THR 204 N -2.17 2.42 -0.07 1.30 2.01 -1.26 -0.88 115.64 116.98 1ngq s THR 204 Ca 0.45 -1.52 -0.01 0.00 0.31 0.00 0.00 61.69 60.92 1ngq s THR 204 Cb -0.11 -2.03 0.03 0.00 0.01 0.00 0.00 72.50 70.40 1ngq s THR 204 CO 0.31 0.21 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.76 1ngq s VAL 205 N -0.98 0.43 -0.14 3.82 1.01 -0.33 -5.01 120.40 119.20 1ngq s VAL 205 Ca 0.14 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.21 1ngq s VAL 205 Cb -0.10 -0.57 0.00 0.00 0.00 0.00 0.00 36.38 35.71 1ngq s VAL 205 CO 0.05 0.27 -0.18 -0.70 0.00 0.00 0.00 175.10 174.54 1ngq s GLU 206 N 1.88 3.16 -0.22 2.72 2.12 -1.26 0.60 118.70 127.71 1ngq s GLU 206 Ca 0.04 -0.78 0.01 0.00 0.36 0.00 0.00 54.97 54.60 1ngq s GLU 206 Cb -0.12 -2.55 0.05 0.00 0.26 0.00 0.00 34.13 31.77 1ngq s GLU 206 CO -0.05 0.04 -0.11 0.15 -0.54 0.00 0.00 175.26 174.75 1ngq s LYS 207 N 0.73 2.13 0.04 4.30 -0.14 -0.52 -4.98 119.74 121.30 1ngq s LYS 207 Ca -0.08 -1.01 0.07 0.00 -1.36 0.00 0.00 55.97 53.59 1ngq s LYS 207 Cb -0.16 -2.60 -0.03 0.00 -1.68 0.00 0.00 37.83 33.36 1ngq s LYS 207 CO 0.01 -0.47 -0.19 -1.12 -0.76 0.00 0.00 175.35 172.82 1ngq s SER 208 N 1.30 3.76 0.26 2.83 0.01 -1.26 -0.77 113.70 119.82 1ngq s SER 208 Ca -0.04 -0.43 0.09 0.00 1.31 0.00 0.00 55.95 56.89 1ngq s SER 208 Cb -0.17 -0.59 -0.04 0.00 0.21 0.00 0.00 66.02 65.42 1ngq s SER 208 CO -0.07 0.26 0.01 -0.22 0.41 0.00 0.00 173.24 173.62 1ngq s LEU 209 N -1.40 3.23 -0.20 2.44 0.20 -0.71 -5.02 118.68 117.22 1ngq s LEU 209 Ca 0.14 -0.61 -0.04 0.00 0.69 0.00 0.00 54.13 54.31 1ngq s LEU 209 Cb -0.10 -1.76 0.09 0.00 -0.43 0.00 0.00 46.19 43.98 1ngq s LEU 209 CO 0.05 0.01 0.19 -0.44 -0.29 0.00 0.00 176.35 175.87 1ngq s SER 210 N -3.63 1.64 0.00 3.68 0.01 -1.26 -3.18 113.70 110.96 1ngq s SER 210 Ca 0.31 -0.34 0.13 0.00 1.31 0.00 0.00 55.95 57.36 1ngq s SER 210 Cb -0.07 0.23 0.77 0.00 0.21 0.00 0.00 66.02 67.16 1ngq s SER 210 CO 0.20 -0.34 1.20 -1.14 0.41 0.00 0.00 173.24 173.57