#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gpq s ALA 2 N 0.00 -0.70 -0.23 -5.12 0.00 -1.26 -5.01 121.76 109.45 2gpq s ALA 2 Ca 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 51.96 51.83 2gpq s ALA 2 Cb 0.00 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 19.87 2gpq s ALA 2 CO 0.00 -4.01 -0.06 0.99 0.00 0.00 0.00 175.76 172.68 2gpq s THR 3 N -2.40 3.04 -0.04 0.00 2.01 -1.26 -5.10 115.64 111.89 2gpq s THR 3 Ca 0.69 -0.77 0.03 0.00 0.31 0.00 0.00 61.69 61.95 2gpq s THR 3 Cb -0.26 -2.45 0.00 0.00 0.01 0.00 0.00 72.50 69.81 2gpq s THR 3 CO 0.65 0.33 -0.14 0.68 -0.69 0.00 0.00 174.62 175.45 2gpq s VAL 4 N 1.40 1.22 0.14 3.82 -7.23 -1.26 -5.07 120.40 113.41 2gpq s VAL 4 Ca 0.03 -0.59 0.06 0.00 -1.81 0.00 0.00 61.98 59.68 2gpq s VAL 4 Cb -0.15 -1.07 -0.04 0.00 0.56 0.00 0.00 36.38 35.68 2gpq s VAL 4 CO -0.05 0.36 -0.14 -1.61 -0.31 0.00 0.00 175.10 173.35 2gpq s GLU 5 N 0.21 1.10 1.01 4.82 8.01 -1.26 -5.15 118.70 127.44 2gpq s GLU 5 Ca -0.06 -1.33 -0.12 0.00 0.01 0.00 0.00 54.97 53.46 2gpq s GLU 5 Cb -0.12 -0.95 0.20 0.00 -4.31 0.00 0.00 34.13 28.95 2gpq s GLU 5 CO 0.02 0.18 1.09 -1.25 0.01 0.00 0.00 175.26 175.31 2gpq s PRO 6 N -2.94 0.30 0.51 0.39 0.04 -1.26 -4.34 135.00 127.70 2gpq s PRO 6 Ca 0.12 0.53 -0.09 0.00 0.04 0.00 0.00 61.00 61.61 2gpq s PRO 6 Cb -0.04 -1.72 0.12 0.00 0.04 0.00 0.00 34.50 32.90 2gpq s PRO 6 CO 0.04 -2.82 0.60 -0.85 0.04 0.00 0.00 177.00 174.00 2gpq n GLU 7 N -4.24 -1.11 -4.07 4.56 0.28 -1.26 -4.77 120.64 110.04 2gpq n GLU 7 Ca 0.05 -0.94 -0.29 0.00 -0.16 0.00 0.00 57.16 55.83 2gpq n GLU 7 Cb 0.57 -0.70 -0.06 0.00 1.43 0.00 0.00 31.44 32.68 2gpq n GLU 7 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2gpq s THR 8 N -2.25 4.49 0.18 3.84 2.01 -1.26 -5.11 115.64 117.55 2gpq s THR 8 Ca 0.35 -0.91 -0.05 0.00 0.31 0.00 0.00 61.69 61.39 2gpq s THR 8 Cb -0.02 -3.21 -0.06 0.00 0.01 0.00 0.00 72.50 69.22 2gpq s THR 8 CO 0.26 0.03 0.43 0.42 -0.69 0.00 0.00 174.62 175.07 2gpq s THR 9 N -1.53 5.11 0.08 -0.82 -4.23 -1.26 -5.03 115.64 107.95 2gpq s THR 9 Ca 0.30 0.08 -0.35 0.00 -1.18 0.00 0.00 61.69 60.54 2gpq s THR 9 Cb -0.11 -3.65 -0.15 0.00 1.34 0.00 0.00 72.50 69.93 2gpq s THR 9 CO 0.22 -0.05 1.53 -2.65 -0.54 0.00 0.00 174.62 173.13 2gpq n PRO 10 N -0.16 1.70 -2.55 3.99 -0.02 -1.26 -4.94 135.00 131.75 2gpq n PRO 10 Ca -0.02 0.61 -0.36 0.00 -2.02 0.00 0.00 63.50 61.72 2gpq n PRO 10 Cb 0.52 -2.34 -0.04 0.00 -0.02 0.00 0.00 33.50 31.63 2gpq n PRO 10 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2gpq s THR 11 N 1.22 3.76 1.02 3.45 -4.23 -1.26 -5.01 115.64 114.59 2gpq s THR 11 Ca 0.84 1.28 -0.15 0.00 -1.18 0.00 0.00 61.69 62.47 2gpq s THR 11 Cb -0.81 -3.62 0.07 0.00 1.34 0.00 0.00 72.50 69.48 2gpq s THR 11 CO 0.44 -0.06 0.28 -2.65 -0.54 0.00 0.00 174.62 172.09 2gpq n PRO 12 N -0.31 -0.86 -3.40 3.99 -0.02 -1.26 -4.96 135.00 128.18 2gpq n PRO 12 Ca 0.06 -0.22 -0.30 0.00 -2.02 0.00 0.00 63.50 61.02 2gpq n PRO 12 Cb 0.50 -1.81 -0.07 0.00 -0.02 0.00 0.00 33.50 32.10 2gpq n PRO 12 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2gpq n ASN 13 N -1.60 4.20 -4.74 2.55 2.85 -1.26 -5.09 115.26 112.17 2gpq n ASN 13 Ca 0.04 -3.41 -0.30 0.00 -0.11 0.00 0.00 54.58 50.81 2gpq n ASN 13 Cb 0.57 -0.80 0.12 0.00 1.24 0.00 0.00 39.78 40.91 2gpq n ASN 13 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2gpq s PRO 14 N -2.40 1.53 0.15 1.20 0.04 -1.26 -4.98 135.00 129.28 2gpq s PRO 14 Ca 0.36 0.85 -0.31 0.00 0.04 0.00 0.00 61.00 61.95 2gpq s PRO 14 Cb 0.10 -1.84 -0.08 0.00 0.04 0.00 0.00 34.50 32.73 2gpq s PRO 14 CO -0.01 -2.06 1.32 -1.25 0.04 0.00 0.00 177.00 175.04 2gpq s PRO 15 N -4.96 4.37 0.19 0.56 0.04 -1.26 -5.02 135.00 128.92 2gpq s PRO 15 Ca 0.63 2.02 -0.22 0.00 0.04 0.00 0.00 61.00 63.47 2gpq s PRO 15 Cb -0.17 -3.23 0.05 0.00 0.04 0.00 0.00 34.50 31.19 2gpq s PRO 15 CO 0.56 -0.31 0.61 0.99 0.04 0.00 0.00 177.00 178.89 2gpq s THR 16 N 0.58 0.01 0.26 1.26 2.01 -1.26 -5.15 115.64 113.34 2gpq s THR 16 Ca 0.60 -0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.29 2gpq s THR 16 Cb -0.36 -1.27 0.00 0.00 0.01 0.00 0.00 72.50 70.89 2gpq s THR 16 CO 0.34 -0.03 0.00 1.07 -0.69 0.00 0.00 174.62 175.31 2gpq n THR 17 N -0.38 0.00 -3.24 -0.82 5.66 -1.26 -5.04 114.28 109.19 2gpq n THR 17 Ca -0.14 0.22 0.00 0.00 -3.05 0.00 0.00 64.05 61.09 2gpq n THR 17 Cb 0.63 -0.50 0.00 0.00 -1.55 0.00 0.00 70.33 68.92 2gpq n THR 17 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2gpq n GLU 18 N -3.16 0.00 -2.57 1.09 1.02 -1.26 -5.06 120.64 110.70 2gpq n GLU 18 Ca -0.02 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.72 2gpq n GLU 18 Cb 0.60 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 32.04 2gpq n GLU 18 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2gpq n GLU 19 N 0.00 5.10 0.00 3.49 -0.00 -1.26 -4.83 120.64 123.14 2gpq n GLU 19 Ca 0.00 -4.55 0.00 0.00 -0.00 0.00 0.00 57.16 52.61 2gpq n GLU 19 Cb 0.00 -2.44 0.00 0.00 -0.00 0.00 0.00 31.44 29.00 2gpq n GLU 19 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2gpq n GLU 20 N -0.12 0.00 -2.99 3.44 2.13 -1.26 -4.97 120.64 116.87 2gpq n GLU 20 Ca 0.47 0.47 -0.07 0.00 0.66 0.00 0.00 57.16 58.69 2gpq n GLU 20 Cb 0.26 -1.40 0.01 0.00 0.27 0.00 0.00 31.44 30.58 2gpq n GLU 20 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2gpq n LYS 21 N -1.83 -1.92 -1.76 5.31 5.02 -1.26 -4.82 118.16 116.90 2gpq n LYS 21 Ca 0.00 1.81 -0.41 0.00 -2.02 0.00 0.00 58.31 57.69 2gpq n LYS 21 Cb 0.00 -5.44 -0.03 0.00 -0.02 0.00 0.00 35.03 29.54 2gpq n LYS 21 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2gpq s THR 22 N -2.72 3.18 -0.39 -0.18 2.01 -1.26 -3.72 115.64 112.56 2gpq s THR 22 Ca 0.15 0.16 -0.12 0.00 0.31 0.00 0.00 61.69 62.20 2gpq s THR 22 Cb -0.04 -3.30 0.01 0.00 0.01 0.00 0.00 72.50 69.18 2gpq s THR 22 CO 0.77 -0.23 0.41 1.21 -0.69 0.00 0.00 174.62 176.09 2gpq n GLU 23 N 8.78 -2.69 0.00 4.92 4.07 -1.26 -4.94 120.64 129.51 2gpq n GLU 23 Ca 0.28 2.30 0.00 0.00 -0.06 0.00 0.00 57.16 59.68 2gpq n GLU 23 Cb 0.49 -5.44 0.00 0.00 -0.06 0.00 0.00 31.44 26.43 2gpq n GLU 23 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2gpq n SER 24 N 0.03 0.00 -1.45 4.31 7.64 -1.24 -5.17 113.62 117.73 2gpq n SER 24 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.96 2gpq n SER 24 Cb 0.33 0.02 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 2gpq n SER 24 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2gpq n ASN 25 N -0.85 -7.84 0.00 6.43 5.15 -1.26 -4.58 115.26 112.31 2gpq n ASN 25 Ca 0.00 1.74 0.00 0.00 -0.60 0.00 0.00 54.58 55.72 2gpq n ASN 25 Cb 0.00 -4.63 0.00 0.00 -0.53 0.00 0.00 39.78 34.62 2gpq n ASN 25 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 2gpq n GLN 26 N -2.53 0.00 -2.95 1.20 7.27 -1.26 -4.62 117.38 114.49 2gpq n GLN 26 Ca 0.00 0.00 -0.21 0.00 0.07 0.00 0.00 57.00 56.86 2gpq n GLN 26 Cb 0.45 0.00 0.03 0.00 2.41 0.00 0.00 30.24 33.13 2gpq n GLN 26 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2gpq n GLU 27 N 0.00 -4.51 -3.47 3.69 -0.58 -1.26 -4.97 120.64 109.54 2gpq n GLU 27 Ca 0.00 0.85 -0.24 0.00 -0.42 0.00 0.00 57.16 57.34 2gpq n GLU 27 Cb 0.00 -5.56 -0.12 0.00 -0.57 0.00 0.00 31.44 25.19 2gpq n GLU 27 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2gpq s VAL 28 N -3.13 -0.15 0.18 2.62 1.01 -1.26 -4.50 120.40 115.17 2gpq s VAL 28 Ca 0.28 -0.90 -0.13 0.00 0.00 0.00 0.00 61.98 61.22 2gpq s VAL 28 Cb -0.12 -0.97 0.08 0.00 0.00 0.00 0.00 36.38 35.37 2gpq s VAL 28 CO 0.34 -0.69 1.84 0.00 0.00 0.00 0.00 175.10 176.58 2gpq h ALA 29 N 7.93 0.74 0.00 5.51 0.00 -1.97 -3.47 119.26 128.00 2gpq h ALA 29 Ca -0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2gpq h ALA 29 Cb 1.02 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2gpq h ALA 29 CO 0.35 0.19 0.00 -1.71 0.00 0.00 0.00 179.25 178.08 2gpq n ASN 30 N -4.66 0.00 0.21 0.00 2.85 -1.26 -4.95 115.26 107.44 2gpq n ASN 30 Ca 0.04 0.00 0.15 0.00 -0.11 0.00 0.00 54.58 54.66 2gpq n ASN 30 Cb 0.03 0.00 0.61 0.00 1.24 0.00 0.00 39.78 41.66 2gpq n ASN 30 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2gpq h PRO 31 N 0.00 0.00 -2.89 1.20 0.13 -2.01 -3.48 132.00 124.95 2gpq h PRO 31 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2gpq h PRO 31 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2gpq h PRO 31 CO 0.00 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 175.86 2gpq n GLU 32 N -2.69 0.00 -1.77 0.86 0.00 -1.26 -4.99 120.64 110.79 2gpq n GLU 32 Ca 0.01 0.48 0.00 0.00 0.00 0.00 0.00 57.16 57.65 2gpq n GLU 32 Cb 0.26 -0.96 0.00 0.00 0.00 0.00 0.00 31.44 30.74 2gpq n GLU 32 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2gpq n HIS 33 N 0.02 -4.00 -0.65 4.31 8.25 -1.26 -4.98 115.22 116.91 2gpq n HIS 33 Ca 0.00 2.41 0.02 0.00 -0.26 0.00 0.00 57.72 59.89 2gpq n HIS 33 Cb 0.00 -3.38 0.03 0.00 1.12 0.00 0.00 29.99 27.76 2gpq n HIS 33 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2gpq n TYR 34 N 1.53 0.00 -3.92 4.41 4.02 -1.26 -4.97 117.16 116.96 2gpq n TYR 34 Ca 0.00 -0.45 -0.31 0.00 -0.01 0.00 0.00 57.90 57.14 2gpq n TYR 34 Cb 0.00 -0.06 -0.15 0.00 -0.02 0.00 0.00 39.34 39.11 2gpq n TYR 34 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2gpq s ILE 35 N -1.09 1.66 -0.17 -0.72 -1.09 -1.26 -5.08 121.20 113.46 2gpq s ILE 35 Ca 0.07 -1.69 -0.02 0.00 -2.23 0.00 0.00 60.65 56.78 2gpq s ILE 35 Cb 0.06 -2.11 0.05 0.00 -1.58 0.00 0.00 42.46 38.88 2gpq s ILE 35 CO 0.01 -0.42 0.01 -0.54 -1.23 0.00 0.00 174.94 172.76 2gpq s LYS 36 N 1.26 0.84 -0.22 2.79 -0.14 -1.26 -4.88 119.74 118.13 2gpq s LYS 36 Ca 0.04 -0.38 -0.13 0.00 -1.36 0.00 0.00 55.97 54.13 2gpq s LYS 36 Cb -0.19 -1.93 -0.04 0.00 -1.68 0.00 0.00 37.83 33.99 2gpq s LYS 36 CO -0.12 -0.55 0.27 -1.58 -0.76 0.00 0.00 175.35 172.62 2gpq s HIS 37 N 1.81 3.34 -0.53 3.18 2.46 -1.26 -5.03 115.29 119.27 2gpq s HIS 37 Ca 0.00 0.41 -0.22 0.00 0.47 0.00 0.00 55.06 55.72 2gpq s HIS 37 Cb -0.16 -2.39 0.05 0.00 -0.13 0.00 0.00 32.58 29.94 2gpq s HIS 37 CO -0.07 0.03 0.81 -1.25 -2.47 0.00 0.00 174.74 171.79 2gpq s PRO 38 N 1.17 3.26 0.02 2.88 0.04 -1.26 -3.18 135.00 137.92 2gpq s PRO 38 Ca 0.13 -0.49 -0.24 0.00 0.04 0.00 0.00 61.00 60.44 2gpq s PRO 38 Cb -0.14 -4.06 -0.05 0.00 0.04 0.00 0.00 34.50 30.29 2gpq s PRO 38 CO 0.06 -1.36 0.74 -0.51 0.04 0.00 0.00 177.00 175.97 2gpq s LEU 39 N 3.41 4.42 0.55 -3.56 1.43 -1.23 -4.93 118.68 118.78 2gpq s LEU 39 Ca 0.25 1.37 0.37 0.00 -1.03 0.00 0.00 54.13 55.09 2gpq s LEU 39 Cb -0.15 -3.18 1.54 0.00 0.03 0.00 0.00 46.19 44.43 2gpq s LEU 39 CO 0.17 -0.00 1.77 1.56 0.23 0.00 0.00 176.35 180.07 2gpq h GLN 40 N 5.88 0.00 0.00 1.70 7.50 -1.95 -3.43 115.11 124.81 2gpq h GLN 40 Ca -0.43 0.00 -0.19 0.00 0.50 0.00 0.00 58.65 58.52 2gpq h GLN 40 Cb 1.20 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 28.69 2gpq h GLN 40 CO 0.72 0.00 -0.06 0.09 -1.50 0.00 0.00 178.83 178.08 2gpq n ASN 41 N -4.07 -1.24 -4.50 1.46 3.02 -1.26 -5.15 115.26 103.51 2gpq n ASN 41 Ca 0.26 -2.49 -0.34 0.00 -0.03 0.00 0.00 54.58 51.97 2gpq n ASN 41 Cb 1.29 2.25 -0.12 0.00 -0.61 0.00 0.00 39.78 42.59 2gpq n ASN 41 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2gpq s ARG 42 N -2.55 3.71 -0.12 3.52 3.03 -1.26 -4.62 118.95 120.66 2gpq s ARG 42 Ca 0.22 -0.49 0.01 0.00 2.03 0.00 0.00 55.73 57.50 2gpq s ARG 42 Cb -0.01 -3.05 -0.01 0.00 -1.03 0.00 0.00 34.95 30.85 2gpq s ARG 42 CO 0.16 0.15 -0.16 -1.58 -1.13 0.00 0.00 175.30 172.73 2gpq s TRP 43 N 0.65 2.74 0.14 5.89 0.52 0.43 -3.20 118.94 126.11 2gpq s TRP 43 Ca -0.00 -0.79 0.04 0.00 0.02 0.00 0.00 56.10 55.37 2gpq s TRP 43 Cb -0.14 -1.81 -0.04 0.00 -1.15 0.00 0.00 33.47 30.33 2gpq s TRP 43 CO 0.02 -0.29 0.14 0.00 0.02 0.00 0.00 176.95 176.84 2gpq s ALA 44 N 0.38 3.62 -0.09 0.98 0.00 0.07 0.68 121.76 127.39 2gpq s ALA 44 Ca -0.13 -1.13 0.04 0.00 0.00 0.00 0.00 51.96 50.74 2gpq s ALA 44 Cb -0.16 -1.43 -0.00 0.00 0.00 0.00 0.00 23.12 21.52 2gpq s ALA 44 CO 0.06 0.58 -0.24 -1.17 0.00 0.00 0.00 175.76 175.00 2gpq s LEU 45 N -2.90 2.08 0.07 0.00 2.96 0.32 -2.37 118.68 118.83 2gpq s LEU 45 Ca 0.31 -0.54 0.07 0.00 -0.22 0.00 0.00 54.13 53.75 2gpq s LEU 45 Cb -0.11 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 45.16 2gpq s LEU 45 CO 0.24 0.17 -0.20 0.26 -1.32 0.00 0.00 176.35 175.50 2gpq s TRP 46 N 0.25 1.74 -0.07 5.38 0.52 -0.77 -2.09 118.94 123.90 2gpq s TRP 46 Ca -0.16 -0.40 0.04 0.00 0.02 0.00 0.00 56.10 55.60 2gpq s TRP 46 Cb -0.17 -0.99 -0.02 0.00 -1.15 0.00 0.00 33.47 31.14 2gpq s TRP 46 CO 0.08 0.14 -0.18 0.12 0.02 0.00 0.00 176.95 177.13 2gpq s PHE 47 N -1.01 2.62 -0.14 -1.98 5.36 0.64 -1.00 117.98 122.47 2gpq s PHE 47 Ca 0.06 -0.44 -0.00 0.00 -0.96 0.00 0.00 56.93 55.58 2gpq s PHE 47 Cb -0.09 -1.65 -0.01 0.00 -0.34 0.00 0.00 43.02 40.92 2gpq s PHE 47 CO 0.03 -0.03 -0.13 0.12 -1.46 0.00 0.00 175.22 173.75 2gpq s PHE 48 N -0.33 2.81 -0.03 10.12 2.19 0.25 -2.03 117.98 130.96 2gpq s PHE 48 Ca 0.02 -0.68 0.02 0.00 0.33 0.00 0.00 56.93 56.61 2gpq s PHE 48 Cb -0.13 -1.86 0.01 0.00 -1.31 0.00 0.00 43.02 39.74 2gpq s PHE 48 CO 0.02 -0.24 -0.06 -1.59 1.83 0.00 0.00 175.22 175.18 2gpq s LYS 49 N 0.43 0.77 -0.27 10.12 0.00 -1.25 -1.79 119.74 127.74 2gpq s LYS 49 Ca -0.10 -0.16 -0.10 0.00 0.00 0.00 0.00 55.97 55.61 2gpq s LYS 49 Cb -0.16 -0.76 -0.04 0.00 0.00 0.00 0.00 37.83 36.87 2gpq s LYS 49 CO 0.05 0.00 0.15 -0.80 0.00 0.00 0.00 175.35 174.75 2gpq s ASN 50 N 0.54 5.71 -0.43 0.03 -0.87 -1.26 -4.81 114.94 113.85 2gpq s ASN 50 Ca -0.07 -0.08 -0.12 0.00 -1.57 0.00 0.00 52.86 51.02 2gpq s ASN 50 Cb -0.11 -2.05 0.07 0.00 -0.02 0.00 0.00 41.25 39.14 2gpq s ASN 50 CO 0.00 -0.04 0.31 1.51 -2.57 0.00 0.00 177.10 176.31 2gpq s ASP 51 N 1.68 5.86 0.00 -1.22 -4.77 -1.26 -4.81 116.67 112.15 2gpq s ASP 51 Ca 0.07 -1.36 0.00 0.00 -3.30 0.00 0.00 52.55 47.96 2gpq s ASP 51 Cb -0.16 -2.07 0.00 0.00 -1.09 0.00 0.00 42.92 39.60 2gpq s ASP 51 CO 0.08 -0.56 0.00 0.29 0.70 0.00 0.00 175.17 175.68 2gpq n LYS 52 N 5.05 0.00 -2.84 2.11 4.76 -1.26 -3.89 118.16 122.09 2gpq n LYS 52 Ca -0.11 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 2gpq n LYS 52 Cb 0.44 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.64 2gpq n LYS 52 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2gpq s SER 53 N 0.00 -0.64 0.14 4.39 1.04 -1.26 -5.17 113.70 112.20 2gpq s SER 53 Ca 0.00 -0.44 0.01 0.00 0.48 0.00 0.00 55.95 56.00 2gpq s SER 53 Cb 0.00 0.83 -0.04 0.00 0.10 0.00 0.00 66.02 66.90 2gpq s SER 53 CO 0.00 -0.06 -0.01 -0.75 0.98 0.00 0.00 173.24 173.40 2gpq s LYS 54 N 1.67 0.99 0.54 4.02 2.47 -1.25 -5.16 119.74 123.02 2gpq s LYS 54 Ca 0.18 -1.45 -0.07 0.00 -1.56 0.00 0.00 55.97 53.06 2gpq s LYS 54 Cb 0.03 -0.16 -0.03 0.00 -1.46 0.00 0.00 37.83 36.21 2gpq s LYS 54 CO -0.12 -0.11 0.89 0.95 0.16 0.00 0.00 175.35 177.12 2gpq s THR 55 N -3.71 4.71 0.10 3.43 -4.23 -1.26 -4.85 115.64 109.83 2gpq s THR 55 Ca 0.20 0.44 -0.15 0.00 -1.18 0.00 0.00 61.69 61.00 2gpq s THR 55 Cb 0.06 -3.83 -0.10 0.00 1.34 0.00 0.00 72.50 69.98 2gpq s THR 55 CO 0.01 -0.92 1.40 4.11 -0.54 0.00 0.00 174.62 178.67 2gpq h TRP 56 N -0.02 0.87 0.00 3.99 0.09 -1.94 -1.27 115.95 117.66 2gpq h TRP 56 Ca -0.46 -0.28 -0.00 0.00 0.09 0.00 0.00 58.89 58.24 2gpq h TRP 56 Cb 1.20 -0.17 -0.00 0.00 0.08 0.00 0.00 29.16 30.27 2gpq h TRP 56 CO 0.60 1.04 -0.00 0.37 0.09 0.00 0.00 178.44 180.54 2gpq h GLN 57 N 0.44 0.00 0.05 0.12 4.15 -1.98 -0.77 115.11 117.13 2gpq h GLN 57 Ca 0.03 0.00 -0.36 0.00 0.77 0.00 0.00 58.65 59.09 2gpq h GLN 57 Cb 0.93 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.57 2gpq h GLN 57 CO 0.08 0.00 -2.15 0.00 -1.93 0.00 0.00 178.83 174.84 2gpq n ALA 58 N -2.10 1.23 -1.29 3.38 0.00 -1.10 -4.30 120.51 116.33 2gpq n ALA 58 Ca -0.02 -0.87 -0.26 0.00 0.00 0.00 0.00 53.44 52.29 2gpq n ALA 58 Cb 0.11 -0.47 0.15 0.00 0.00 0.00 0.00 19.45 19.24 2gpq n ALA 58 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2gpq n ASN 59 N -3.25 4.80 -4.61 0.00 0.23 -0.50 -4.95 115.26 106.98 2gpq n ASN 59 Ca -0.34 -3.68 -0.43 0.00 -0.53 0.00 0.00 54.58 49.61 2gpq n ASN 59 Cb 1.05 -0.86 -0.02 0.00 -2.08 0.00 0.00 39.78 37.87 2gpq n ASN 59 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 2gpq s LEU 60 N -3.45 3.71 -0.01 -4.53 2.96 -0.34 -3.97 118.68 113.05 2gpq s LEU 60 Ca 0.58 0.78 0.03 0.00 -0.22 0.00 0.00 54.13 55.30 2gpq s LEU 60 Cb 0.48 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.60 2gpq s LEU 60 CO 0.07 -1.21 -0.09 -0.60 -1.32 0.00 0.00 176.35 173.20 2gpq s ARG 61 N 4.41 2.54 -0.20 1.98 6.06 -0.86 -5.03 118.95 127.85 2gpq s ARG 61 Ca 0.52 -0.71 -0.05 0.00 -2.50 0.00 0.00 55.73 53.00 2gpq s ARG 61 Cb -0.11 -2.48 -0.02 0.00 0.06 0.00 0.00 34.95 32.40 2gpq s ARG 61 CO 0.28 0.61 -0.01 -1.17 -2.50 0.00 0.00 175.30 172.51 2gpq s LEU 62 N -1.21 3.20 -0.14 -0.88 1.98 -1.26 -0.26 118.68 120.12 2gpq s LEU 62 Ca 0.15 -0.22 -0.10 0.00 -2.89 0.00 0.00 54.13 51.07 2gpq s LEU 62 Cb -0.11 -1.81 -0.07 0.00 0.66 0.00 0.00 46.19 44.86 2gpq s LEU 62 CO 0.05 0.06 0.04 0.40 -1.89 0.00 0.00 176.35 175.02 2gpq h ILE 63 N 5.40 0.32 0.00 6.68 2.04 -1.76 -3.47 117.51 126.73 2gpq h ILE 63 Ca -0.36 -1.31 0.00 0.00 1.00 0.00 0.00 64.86 64.19 2gpq h ILE 63 Cb 1.18 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2gpq h ILE 63 CO 0.61 0.11 0.00 -1.54 0.00 0.00 0.00 178.15 177.33 2gpq n SER 64 N -4.65 0.00 -3.99 1.72 3.41 -1.04 -5.04 113.62 104.03 2gpq n SER 64 Ca -0.08 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.45 2gpq n SER 64 Cb 0.25 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.12 2gpq n SER 64 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2gpq s LYS 65 N -2.00 0.72 -0.03 4.33 -2.85 -1.26 0.12 119.74 118.77 2gpq s LYS 65 Ca 0.00 -1.11 -0.08 0.00 -1.00 0.00 0.00 55.97 53.77 2gpq s LYS 65 Cb 0.00 0.27 0.01 0.00 -2.06 0.00 0.00 37.83 36.05 2gpq s LYS 65 CO 0.00 -0.18 0.19 -0.59 0.10 0.00 0.00 175.35 174.86 2gpq s PHE 66 N -3.90 -0.10 -0.08 1.78 -0.71 0.21 -4.81 117.98 110.38 2gpq s PHE 66 Ca 0.07 0.20 0.11 0.00 -1.04 0.00 0.00 56.93 56.27 2gpq s PHE 66 Cb 0.07 0.02 0.17 0.00 -1.21 0.00 0.00 43.02 42.07 2gpq s PHE 66 CO -0.10 -0.22 1.06 -0.40 -1.34 0.00 0.00 175.22 174.21 2gpq n ASP 67 N 2.07 1.71 -3.66 1.98 5.75 -1.26 0.16 116.55 123.31 2gpq n ASP 67 Ca -0.18 -2.57 -0.15 0.00 -0.01 0.00 0.00 54.79 51.88 2gpq n ASP 67 Cb 0.57 -0.29 -0.08 0.00 -1.03 0.00 0.00 41.12 40.29 2gpq n ASP 67 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2gpq s THR 68 N -1.84 0.01 0.41 2.12 -4.23 -1.26 -3.47 115.64 107.37 2gpq s THR 68 Ca 0.19 -0.08 0.08 0.00 -1.18 0.00 0.00 61.69 60.70 2gpq s THR 68 Cb 0.16 -0.81 0.28 0.00 1.34 0.00 0.00 72.50 73.47 2gpq s THR 68 CO 0.02 -0.04 2.04 1.62 -0.54 0.00 0.00 174.62 177.71 2gpq h VAL 69 N 3.88 1.06 0.00 2.29 3.04 -1.92 0.20 116.25 124.81 2gpq h VAL 69 Ca -0.28 -0.19 -0.03 0.00 -1.01 0.00 0.00 66.70 65.19 2gpq h VAL 69 Cb 1.16 0.46 -0.00 0.00 -2.01 0.00 0.00 31.29 30.90 2gpq h VAL 69 CO 0.25 0.10 -0.16 1.05 -1.01 0.00 0.00 177.57 177.80 2gpq h GLU 70 N 0.55 0.00 0.18 4.17 4.11 -1.90 -1.04 114.58 120.64 2gpq h GLU 70 Ca 0.19 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.61 2gpq h GLU 70 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 2gpq h GLU 70 CO -0.05 0.16 -0.08 -0.44 0.07 0.00 0.00 179.01 178.67 2gpq h ASP 71 N 0.00 -0.20 -0.57 3.06 5.19 -1.33 -2.54 116.42 120.03 2gpq h ASP 71 Ca -0.00 0.01 0.11 0.00 -0.62 0.00 0.00 57.03 56.53 2gpq h ASP 71 Cb 0.28 0.05 -0.10 0.00 0.18 0.00 0.00 39.33 39.74 2gpq h ASP 71 CO 0.02 -0.01 -0.10 2.19 -3.12 0.00 0.00 179.24 178.23 2gpq h PHE 72 N -0.50 -0.22 -0.47 4.55 -5.15 -1.47 -0.89 116.94 112.79 2gpq h PHE 72 Ca -0.02 0.05 0.08 0.00 -0.20 0.00 0.00 57.97 57.87 2gpq h PHE 72 Cb 0.18 0.18 -0.07 0.00 0.22 0.00 0.00 35.95 36.47 2gpq h PHE 72 CO 0.05 -0.21 0.08 -1.49 -2.00 0.00 0.00 178.31 174.74 2gpq h TRP 73 N 0.03 0.13 -0.98 6.09 4.06 -1.31 0.39 115.95 124.36 2gpq h TRP 73 Ca 0.28 0.03 0.16 0.00 2.06 0.00 0.00 58.89 61.41 2gpq h TRP 73 Cb 0.43 0.01 -0.09 0.00 -1.00 0.00 0.00 29.16 28.52 2gpq h TRP 73 CO -0.43 -0.01 0.62 0.00 -3.56 0.00 0.00 178.44 175.05 2gpq h ALA 74 N 1.37 1.67 0.04 1.49 0.00 -0.72 -0.21 119.26 122.90 2gpq h ALA 74 Ca 0.24 0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.96 2gpq h ALA 74 Cb 0.31 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2gpq h ALA 74 CO -0.32 0.03 -1.08 1.25 0.00 0.00 0.00 179.25 179.13 2gpq h LEU 75 N 0.83 0.12 -1.53 0.00 5.85 -0.72 -3.27 115.31 116.58 2gpq h LEU 75 Ca 0.52 -0.13 0.08 0.00 0.84 0.00 0.00 57.88 59.19 2gpq h LEU 75 Cb 0.72 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 2gpq h LEU 75 CO -0.30 1.10 0.42 0.22 -0.34 0.00 0.00 178.44 179.55 2gpq h TYR 76 N 0.02 0.57 0.00 1.25 3.20 0.15 0.79 116.97 122.95 2gpq h TYR 76 Ca -0.05 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.76 2gpq h TYR 76 Cb 1.83 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.90 2gpq h TYR 76 CO 0.02 0.29 -0.38 -0.91 -1.64 0.00 0.00 178.16 175.54 2gpq h ASN 77 N 0.55 0.00 1.40 -2.11 -0.26 -1.49 -1.90 115.58 111.77 2gpq h ASN 77 Ca 0.29 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.93 2gpq h ASN 77 Cb 0.41 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.65 2gpq h ASN 77 CO -0.09 0.38 -0.62 0.45 -1.06 0.00 0.00 177.43 176.49 2gpq h HIS 78 N 0.00 0.00 -1.56 1.19 3.86 -0.99 -3.36 115.15 114.28 2gpq h HIS 78 Ca -0.00 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.71 2gpq h HIS 78 Cb 0.92 0.00 -0.41 0.00 1.06 0.00 0.00 27.41 28.98 2gpq h HIS 78 CO 0.00 0.41 -0.96 0.44 0.86 0.00 0.00 177.93 178.68 2gpq n ILE 79 N -3.11 1.57 -1.56 2.45 -5.35 -0.52 -5.06 119.36 107.78 2gpq n ILE 79 Ca 0.00 -4.36 -0.42 0.00 -0.27 0.00 0.00 62.75 57.71 2gpq n ILE 79 Cb 0.71 -0.46 -0.04 0.00 -1.74 0.00 0.00 39.64 38.11 2gpq n ILE 79 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2gpq n GLN 80 N -0.16 1.44 -1.50 6.28 6.02 -0.73 -4.75 117.38 123.98 2gpq n GLN 80 Ca 0.25 0.29 -0.29 0.00 -0.01 0.00 0.00 57.00 57.24 2gpq n GLN 80 Cb 0.67 -3.13 -0.19 0.00 1.02 0.00 0.00 30.24 28.61 2gpq n GLN 80 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 2gpq n LEU 81 N 12.82 -0.62 0.00 1.08 -0.00 -1.26 -2.70 117.00 126.32 2gpq n LEU 81 Ca 0.35 -0.30 0.00 0.00 -0.00 0.00 0.00 56.01 56.06 2gpq n LEU 81 Cb 0.43 -0.74 0.00 0.00 -0.00 0.00 0.00 43.42 43.12 2gpq n LEU 81 CO 0.70 -1.21 0.00 -0.24 -0.00 0.00 0.00 177.39 176.65 2gpq n SER 82 N 8.04 0.00 0.11 1.45 2.88 -1.26 -4.94 113.62 119.90 2gpq n SER 82 Ca 0.66 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 58.27 2gpq n SER 82 Cb 0.12 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.59 2gpq n SER 82 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2gpq h SER 83 N 0.00 0.00 -0.44 -3.46 0.02 -1.88 -3.29 113.55 104.50 2gpq h SER 83 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2gpq h SER 83 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2gpq h SER 83 CO 0.00 0.25 0.00 -0.46 -1.14 0.00 0.00 176.83 175.48 2gpq n ASN 84 N -2.91 3.36 -2.64 3.07 6.94 -1.26 -4.61 115.26 117.20 2gpq n ASN 84 Ca -0.02 -1.95 -0.28 0.00 -0.02 0.00 0.00 54.58 52.32 2gpq n ASN 84 Cb 0.66 -0.29 -0.06 0.00 -2.36 0.00 0.00 39.78 37.73 2gpq n ASN 84 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2gpq n LEU 85 N 1.27 6.67 -4.80 -4.53 7.99 -1.24 -4.94 117.00 117.42 2gpq n LEU 85 Ca 0.18 -4.10 -0.35 0.00 -0.01 0.00 0.00 56.01 51.73 2gpq n LEU 85 Cb 0.55 -1.30 -0.07 0.00 -0.11 0.00 0.00 43.42 42.49 2gpq n LEU 85 CO 0.14 1.80 0.63 -0.04 -1.51 0.00 0.00 177.39 178.41 2gpq s MET 86 N -1.06 4.39 0.21 3.23 -1.94 -1.26 -4.97 119.30 117.89 2gpq s MET 86 Ca 0.60 1.19 -0.30 0.00 -1.71 0.00 0.00 55.69 55.46 2gpq s MET 86 Cb 0.33 -2.50 -0.16 0.00 2.01 0.00 0.00 34.83 34.51 2gpq s MET 86 CO -0.16 0.14 0.93 -2.30 -0.01 0.00 0.00 175.02 173.62 2gpq n PRO 87 N -0.03 0.85 -1.04 2.03 -0.02 -1.26 -1.49 135.00 134.04 2gpq n PRO 87 Ca 0.04 0.30 -0.01 0.00 -2.02 0.00 0.00 63.50 61.81 2gpq n PRO 87 Cb 0.52 -1.62 -0.01 0.00 -0.02 0.00 0.00 33.50 32.37 2gpq n PRO 87 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gpq n GLY 88 N 1.69 0.51 3.88 -1.23 0.00 -1.26 -5.00 105.19 103.79 2gpq n GLY 88 Ca 0.14 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 2gpq n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gpq s ASP 90 N -1.77 -0.04 0.25 0.00 -1.08 -0.74 -2.61 116.67 110.68 2gpq s ASP 90 Ca 0.31 -0.36 -0.09 0.00 -0.52 0.00 0.00 52.55 51.89 2gpq s ASP 90 Cb -0.14 0.35 -0.01 0.00 -1.46 0.00 0.00 42.92 41.66 2gpq s ASP 90 CO 0.18 -0.65 0.41 -0.72 0.52 0.00 0.00 175.17 174.91 2gpq s TYR 91 N -3.00 0.61 -0.17 -5.34 1.13 -0.08 0.88 117.35 111.38 2gpq s TYR 91 Ca -0.02 -0.93 -0.15 0.00 -1.41 0.00 0.00 57.07 54.56 2gpq s TYR 91 Cb 0.01 0.01 0.05 0.00 -1.10 0.00 0.00 41.96 40.93 2gpq s TYR 91 CO -0.06 -0.95 0.45 -1.12 -2.51 0.00 0.00 175.55 171.35 2gpq s SER 92 N -3.08 -0.48 -0.28 -0.18 0.01 -0.17 0.17 113.70 109.69 2gpq s SER 92 Ca 0.27 0.91 0.03 0.00 1.31 0.00 0.00 55.95 58.47 2gpq s SER 92 Cb 0.01 0.90 0.07 0.00 0.21 0.00 0.00 66.02 67.21 2gpq s SER 92 CO 0.11 -0.16 -0.08 -0.22 0.41 0.00 0.00 173.24 173.30 2gpq s LEU 93 N 0.42 3.70 0.37 2.44 0.20 0.63 -1.85 118.68 124.60 2gpq s LEU 93 Ca -0.02 -1.53 -0.03 0.00 0.69 0.00 0.00 54.13 53.24 2gpq s LEU 93 Cb -0.04 -1.57 0.01 0.00 -0.43 0.00 0.00 46.19 44.17 2gpq s LEU 93 CO -0.02 -0.23 0.54 0.72 -0.29 0.00 0.00 176.35 177.08 2gpq s PHE 94 N 1.07 1.00 -0.01 5.38 -0.12 -1.00 -2.01 117.98 122.29 2gpq s PHE 94 Ca -0.05 -1.28 -0.30 0.00 -0.05 0.00 0.00 56.93 55.24 2gpq s PHE 94 Cb -0.20 0.05 -0.06 0.00 -0.63 0.00 0.00 43.02 42.18 2gpq s PHE 94 CO -0.05 -1.24 1.64 0.15 -0.05 0.00 0.00 175.22 175.66 2gpq s LYS 95 N -2.77 4.19 0.55 1.99 1.02 -1.08 -0.75 119.74 122.90 2gpq s LYS 95 Ca 0.29 2.22 0.36 0.00 0.02 0.00 0.00 55.97 58.86 2gpq s LYS 95 Cb -0.01 -3.85 1.52 0.00 -0.52 0.00 0.00 37.83 34.97 2gpq s LYS 95 CO 0.21 -0.79 1.77 0.38 -0.92 0.00 0.00 175.35 176.00 2gpq h ASP 96 N 9.09 0.00 -0.02 2.83 2.03 -1.89 0.55 116.42 129.01 2gpq h ASP 96 Ca -0.40 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.90 2gpq h ASP 96 Cb 1.19 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.69 2gpq h ASP 96 CO 0.94 0.00 0.03 1.23 -1.03 0.00 0.00 179.24 180.41 2gpq h GLY 97 N 0.00 0.00 -1.51 7.15 0.00 -1.89 -3.43 103.07 103.39 2gpq h GLY 97 Ca 0.54 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 47.36 2gpq h GLY 97 CO -0.01 0.00 0.34 -0.42 0.00 0.00 0.00 176.54 176.45 2gpq s ILE 98 N -4.41 3.05 -0.01 2.60 -1.09 0.19 -4.91 121.20 116.62 2gpq s ILE 98 Ca -0.05 0.42 0.01 0.00 -2.23 0.00 0.00 60.65 58.80 2gpq s ILE 98 Cb 0.14 -2.88 0.00 0.00 -1.58 0.00 0.00 42.46 38.14 2gpq s ILE 98 CO 0.48 -0.37 -0.03 -0.70 -1.23 0.00 0.00 174.94 173.09 2gpq s GLU 99 N -4.44 0.30 -0.99 2.79 2.56 -1.26 -5.01 118.70 112.64 2gpq s GLU 99 Ca 0.65 -0.09 -0.25 0.00 0.00 0.00 0.00 54.97 55.29 2gpq s GLU 99 Cb -0.20 -0.32 -0.22 0.00 2.00 0.00 0.00 34.13 35.39 2gpq s GLU 99 CO 0.49 0.04 2.04 -2.30 -0.56 0.00 0.00 175.26 174.97 2gpq n PRO 100 N 3.21 0.10 -3.51 4.30 -0.02 -1.26 -3.94 135.00 133.88 2gpq n PRO 100 Ca -0.15 -1.54 -0.19 0.00 -2.02 0.00 0.00 63.50 59.60 2gpq n PRO 100 Cb 0.57 -3.71 0.01 0.00 -0.02 0.00 0.00 33.50 30.35 2gpq n PRO 100 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gpq n MET 101 N 7.87 -1.59 0.03 -0.52 0.00 -1.26 -4.93 117.12 116.72 2gpq n MET 101 Ca 0.38 1.12 0.00 0.00 0.00 0.00 0.00 57.70 59.20 2gpq n MET 101 Cb 0.47 -3.36 0.00 0.00 0.00 0.00 0.00 33.22 30.33 2gpq n MET 101 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 2gpq n TRP 102 N -1.95 -0.64 -0.03 3.17 7.02 -1.25 -4.84 117.44 118.92 2gpq n TRP 102 Ca -0.18 0.10 -0.03 0.00 -1.02 0.00 0.00 57.50 56.37 2gpq n TRP 102 Cb 0.63 0.56 -0.05 0.00 -2.42 0.00 0.00 31.31 30.03 2gpq n TRP 102 CO 0.00 0.00 0.00 -0.85 -2.02 0.00 0.00 177.69 174.82 2gpq n GLU 103 N -2.69 2.89 -0.81 -0.99 0.28 -1.26 -4.11 120.64 113.96 2gpq n GLU 103 Ca 0.00 -0.01 -0.13 0.00 -0.16 0.00 0.00 57.16 56.87 2gpq n GLU 103 Cb 0.00 -1.15 0.16 0.00 1.43 0.00 0.00 31.44 31.87 2gpq n GLU 103 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2gpq n ASP 104 N -2.20 3.67 0.22 -1.84 8.00 -1.26 -4.49 116.55 118.66 2gpq n ASP 104 Ca -0.09 -3.03 0.18 0.00 0.71 0.00 0.00 54.79 52.56 2gpq n ASP 104 Cb 0.67 -0.72 0.84 0.00 -0.02 0.00 0.00 41.12 41.89 2gpq n ASP 104 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2gpq h GLU 105 N 1.09 0.00 -0.28 -1.24 9.09 -1.84 0.14 114.58 121.54 2gpq h GLU 105 Ca 0.36 0.00 0.08 0.00 0.05 0.00 0.00 59.36 59.85 2gpq h GLU 105 Cb 2.16 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 29.25 2gpq h GLU 105 CO 0.69 0.00 0.24 0.87 0.05 0.00 0.00 179.01 180.86 2gpq h LYS 106 N 0.00 0.00 -0.11 1.06 1.57 -1.98 -0.56 116.57 116.55 2gpq h LYS 106 Ca 0.08 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.70 2gpq h LYS 106 Cb 0.66 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.97 2gpq h LYS 106 CO -0.00 0.00 -0.57 -0.91 -0.57 0.00 0.00 179.45 177.40 2gpq h ASN 107 N 0.00 0.69 0.25 0.86 4.21 -1.25 -3.07 115.58 117.27 2gpq h ASN 107 Ca 0.13 -0.64 -0.02 0.00 1.21 0.00 0.00 56.30 56.98 2gpq h ASN 107 Cb 0.62 -0.20 -0.00 0.00 -1.12 0.00 0.00 38.32 37.61 2gpq h ASN 107 CO -0.00 1.22 -0.08 0.50 -1.29 0.00 0.00 177.43 177.78 2gpq h LYS 108 N 0.21 0.00 0.00 0.81 1.63 -1.24 -0.51 116.57 117.47 2gpq h LYS 108 Ca -0.04 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2gpq h LYS 108 Cb 1.21 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.84 2gpq h LYS 108 CO 0.12 0.08 0.00 -0.09 -3.45 0.00 0.00 179.45 176.11 2gpq h ARG 109 N 0.00 0.00 0.00 1.90 9.65 -1.29 -3.40 114.38 121.25 2gpq h ARG 109 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2gpq h ARG 109 Cb 0.23 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.81 2gpq h ARG 109 CO 0.01 0.00 0.00 0.41 2.80 0.00 0.00 179.97 183.19 2gpq n GLY 110 N 0.17 -0.95 2.14 2.80 0.00 -0.20 -4.41 105.19 104.74 2gpq n GLY 110 Ca 0.02 -1.16 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 2gpq n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gpq n GLY 111 N 2.93 3.08 3.59 -0.02 0.00 -0.95 -2.56 105.19 111.27 2gpq n GLY 111 Ca 0.00 -1.74 -0.10 0.00 0.00 0.00 0.00 46.02 44.17 2gpq n GLY 111 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2gpq s ARG 112 N -2.80 0.58 0.06 1.61 1.70 -0.55 0.16 118.95 119.71 2gpq s ARG 112 Ca 0.24 0.27 -0.08 0.00 -0.47 0.00 0.00 55.73 55.69 2gpq s ARG 112 Cb 0.01 0.27 -0.05 0.00 -0.57 0.00 0.00 34.95 34.61 2gpq s ARG 112 CO 0.17 -0.15 0.35 -1.58 -1.08 0.00 0.00 175.30 173.01 2gpq s TRP 113 N -0.75 3.56 -0.24 5.89 0.51 -0.53 -1.59 118.94 125.79 2gpq s TRP 113 Ca -0.01 0.67 -0.04 0.00 -2.12 0.00 0.00 56.10 54.60 2gpq s TRP 113 Cb -0.02 -2.07 0.00 0.00 -0.81 0.00 0.00 33.47 30.58 2gpq s TRP 113 CO -0.00 0.54 -0.02 -1.17 -0.51 0.00 0.00 176.95 175.79 2gpq s LEU 114 N -1.98 3.14 -0.17 2.99 1.98 0.50 -2.35 118.68 122.79 2gpq s LEU 114 Ca 0.32 -0.53 -0.17 0.00 -2.89 0.00 0.00 54.13 50.86 2gpq s LEU 114 Cb -0.13 -1.76 -0.04 0.00 0.66 0.00 0.00 46.19 44.92 2gpq s LEU 114 CO 0.19 -0.07 0.43 -0.63 -1.89 0.00 0.00 176.35 174.37 2gpq s ILE 115 N 1.46 5.19 -0.46 6.68 -1.09 0.28 -0.67 121.20 132.59 2gpq s ILE 115 Ca 0.04 0.80 -0.12 0.00 -2.23 0.00 0.00 60.65 59.13 2gpq s ILE 115 Cb -0.15 -3.76 0.09 0.00 -1.58 0.00 0.00 42.46 37.06 2gpq s ILE 115 CO -0.02 0.28 0.36 -0.89 -1.23 0.00 0.00 174.94 173.43 2gpq s THR 116 N 1.08 4.72 -0.13 2.92 2.01 -1.26 -2.19 115.64 122.79 2gpq s THR 116 Ca 0.21 -1.37 -0.03 0.00 0.31 0.00 0.00 61.69 60.81 2gpq s THR 116 Cb -0.15 -3.92 -0.03 0.00 0.01 0.00 0.00 72.50 68.41 2gpq s THR 116 CO 0.08 -0.63 -0.01 -0.22 -0.69 0.00 0.00 174.62 173.15 2gpq s LEU 117 N 1.51 3.44 0.41 4.42 2.96 0.22 -4.95 118.68 126.70 2gpq s LEU 117 Ca 0.04 -0.00 -0.17 0.00 -0.22 0.00 0.00 54.13 53.78 2gpq s LEU 117 Cb -0.25 -1.82 -0.09 0.00 0.50 0.00 0.00 46.19 44.53 2gpq s LEU 117 CO 0.03 0.25 0.86 0.20 -1.32 0.00 0.00 176.35 176.37 2gpq s ASN 118 N -0.10 6.76 0.31 3.68 0.02 -1.26 0.07 114.94 124.41 2gpq s ASN 118 Ca 0.03 1.45 -0.01 0.00 -1.02 0.00 0.00 52.86 53.31 2gpq s ASN 118 Cb -0.13 -2.45 0.48 0.00 0.02 0.00 0.00 41.25 39.18 2gpq s ASN 118 CO 0.02 -0.36 1.95 0.07 0.02 0.00 0.00 177.10 178.80 2gpq h LYS 119 N 1.74 0.97 0.00 -0.60 2.10 -1.87 -1.59 116.57 117.32 2gpq h LYS 119 Ca -0.48 -0.09 -0.06 0.00 -2.00 0.00 0.00 60.65 58.02 2gpq h LYS 119 Cb 1.18 -0.20 -0.01 0.00 -0.90 0.00 0.00 32.23 32.30 2gpq h LYS 119 CO 0.63 0.68 -0.29 0.37 -2.00 0.00 0.00 179.45 178.84 2gpq h GLN 120 N 0.99 0.00 -0.67 0.07 5.75 -1.93 -2.18 115.11 117.14 2gpq h GLN 120 Ca 0.26 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.76 2gpq h GLN 120 Cb -0.03 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.52 2gpq h GLN 120 CO -0.05 0.29 0.00 1.04 -2.65 0.00 0.00 178.83 177.46 2gpq n GLN 121 N -4.08 3.02 0.26 1.69 6.02 -0.61 -4.41 117.38 119.27 2gpq n GLN 121 Ca -0.02 -1.84 -0.13 0.00 -0.01 0.00 0.00 57.00 55.01 2gpq n GLN 121 Cb 0.35 -1.80 -0.07 0.00 1.02 0.00 0.00 30.24 29.74 2gpq n GLN 121 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2gpq h ARG 122 N 2.48 -0.67 -0.61 -1.09 3.08 -1.21 1.59 114.38 117.97 2gpq h ARG 122 Ca 0.00 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2gpq h ARG 122 Cb 1.19 0.15 -0.03 0.00 0.08 0.00 0.00 29.97 31.36 2gpq h ARG 122 CO 0.22 -0.38 0.39 0.07 -1.07 0.00 0.00 179.97 179.19 2gpq h ARG 123 N -1.09 0.81 0.03 0.04 -0.00 -1.80 -1.10 114.38 111.26 2gpq h ARG 123 Ca -0.07 -0.06 -0.36 0.00 -0.00 0.00 0.00 59.98 59.50 2gpq h ARG 123 Cb 0.60 -0.18 -0.05 0.00 -0.00 0.00 0.00 29.97 30.34 2gpq h ARG 123 CO 0.12 0.55 -2.00 0.43 -0.00 0.00 0.00 179.97 179.06 2gpq n SER 124 N -4.43 1.97 -0.08 0.08 7.64 -1.23 -4.41 113.62 113.15 2gpq n SER 124 Ca 0.06 0.26 -0.13 0.00 1.01 0.00 0.00 58.87 60.07 2gpq n SER 124 Cb 0.05 -0.81 -0.07 0.00 -1.01 0.00 0.00 64.21 62.38 2gpq n SER 124 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2gpq h ASP 125 N -0.60 0.00 -0.09 6.43 1.82 0.21 -3.29 116.42 120.90 2gpq h ASP 125 Ca -0.51 -0.32 0.04 0.00 -0.39 0.00 0.00 57.03 55.84 2gpq h ASP 125 Cb 1.65 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 41.60 2gpq h ASP 125 CO -0.19 1.08 -0.46 0.25 -1.61 0.00 0.00 179.24 178.31 2gpq h LEU 126 N -1.00 -1.44 -0.48 2.28 5.85 0.62 1.54 115.31 122.68 2gpq h LEU 126 Ca -0.15 0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.82 2gpq h LEU 126 Cb 0.86 0.57 -0.06 0.00 0.37 0.00 0.00 40.66 42.40 2gpq h LEU 126 CO -0.09 -0.46 0.14 -2.24 -0.34 0.00 0.00 178.44 175.44 2gpq h ASP 127 N -0.55 0.10 0.31 1.25 2.03 -1.58 0.71 116.42 118.68 2gpq h ASP 127 Ca 0.05 0.07 -0.13 0.00 -0.73 0.00 0.00 57.03 56.30 2gpq h ASP 127 Cb 0.66 0.08 -0.01 0.00 -0.83 0.00 0.00 39.33 39.23 2gpq h ASP 127 CO -0.39 0.08 -0.52 -0.09 -1.03 0.00 0.00 179.24 177.29 2gpq h ARG 128 N 0.29 0.23 0.18 4.15 9.65 -1.48 -2.50 114.38 124.90 2gpq h ARG 128 Ca 0.24 -0.14 -0.01 0.00 -1.10 0.00 0.00 59.98 58.97 2gpq h ARG 128 Cb 0.28 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.88 2gpq h ARG 128 CO -0.27 0.70 -0.09 0.35 2.80 0.00 0.00 179.97 183.46 2gpq h PHE 129 N 0.18 -0.23 -0.56 2.20 3.04 0.31 -2.16 116.94 119.73 2gpq h PHE 129 Ca 0.00 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 2gpq h PHE 129 Cb 0.98 0.08 -0.03 0.00 2.56 0.00 0.00 35.95 39.54 2gpq h PHE 129 CO 0.02 0.13 0.30 2.35 -2.02 0.00 0.00 178.31 179.09 2gpq h TRP 130 N -0.63 0.74 -0.44 0.41 2.91 -0.94 -1.12 115.95 116.88 2gpq h TRP 130 Ca -0.03 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 59.94 2gpq h TRP 130 Cb 0.46 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 28.85 2gpq h TRP 130 CO 0.04 0.53 0.07 1.25 -1.03 0.00 0.00 178.44 179.30 2gpq h LEU 131 N 0.77 0.62 0.18 0.65 7.12 -1.41 -0.78 115.31 122.46 2gpq h LEU 131 Ca 0.20 -0.11 -0.01 0.00 0.13 0.00 0.00 57.88 58.09 2gpq h LEU 131 Cb 0.03 -0.16 0.00 0.00 -0.53 0.00 0.00 40.66 40.00 2gpq h LEU 131 CO -0.03 0.65 -0.09 -0.33 -0.13 0.00 0.00 178.44 178.51 2gpq h GLU 132 N 0.65 -0.24 0.21 1.25 4.39 -0.56 -2.16 114.58 118.12 2gpq h GLU 132 Ca 0.14 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.86 2gpq h GLU 132 Cb 0.30 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 2gpq h GLU 132 CO 0.00 0.15 -0.19 0.00 -1.16 0.00 0.00 179.01 177.81 2gpq h THR 133 N -0.69 0.58 -0.78 1.13 1.03 -1.14 0.90 112.91 113.94 2gpq h THR 133 Ca -0.02 0.00 0.14 0.00 -0.01 0.00 0.00 66.41 66.52 2gpq h THR 133 Cb 0.49 0.58 -0.05 0.00 -1.07 0.00 0.00 68.15 68.09 2gpq h THR 133 CO 0.04 0.00 0.52 -0.07 -0.01 0.00 0.00 175.52 176.00 2gpq h LEU 134 N -0.43 0.45 -0.17 0.00 3.38 -1.24 0.38 115.31 117.68 2gpq h LEU 134 Ca -0.00 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2gpq h LEU 134 Cb 0.40 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2gpq h LEU 134 CO -0.04 0.23 -0.58 -0.07 0.09 0.00 0.00 178.44 178.08 2gpq h LEU 135 N 0.48 0.00 -0.46 1.67 4.07 -0.59 -2.43 115.31 118.05 2gpq h LEU 135 Ca 0.38 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.35 2gpq h LEU 135 Cb 0.80 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.52 2gpq h LEU 135 CO -0.13 0.58 0.30 0.00 -1.08 0.00 0.00 178.44 178.10 2gpq h LEU 137 N 0.61 0.00 0.03 0.00 3.38 -1.52 -3.31 115.31 114.50 2gpq h LEU 137 Ca 0.17 -0.81 -0.05 0.00 0.09 0.00 0.00 57.88 57.28 2gpq h LEU 137 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2gpq h LEU 137 CO -0.04 1.00 -0.24 0.40 0.09 0.00 0.00 178.44 179.65 2gpq h ILE 138 N -1.00 1.70 0.00 1.22 2.04 -1.48 -3.45 117.51 116.53 2gpq h ILE 138 Ca -0.04 -2.39 0.00 0.00 1.00 0.00 0.00 64.86 63.43 2gpq h ILE 138 Cb 0.92 3.31 0.00 0.00 -0.74 0.00 0.00 36.82 40.30 2gpq h ILE 138 CO -0.03 0.62 0.00 0.61 0.00 0.00 0.00 178.15 179.36 2gpq n GLY 139 N 1.62 1.95 3.64 5.37 0.00 0.44 -5.02 105.19 113.19 2gpq n GLY 139 Ca -0.12 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.85 2gpq n GLY 139 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2gpq s GLU 140 N 0.00 0.54 0.06 1.61 -1.05 0.35 -4.89 118.70 115.32 2gpq s GLU 140 Ca 0.00 0.91 0.00 0.00 -0.15 0.00 0.00 54.97 55.73 2gpq s GLU 140 Cb 0.00 0.12 0.00 0.00 -0.44 0.00 0.00 34.13 33.81 2gpq s GLU 140 CO 0.00 -0.11 0.00 0.45 0.95 0.00 0.00 175.26 176.55 2gpq n SER 141 N 3.89 -0.54 0.00 0.83 2.88 -1.25 -4.53 113.62 114.90 2gpq n SER 141 Ca -0.19 0.54 0.12 0.00 -1.33 0.00 0.00 58.87 58.01 2gpq n SER 141 Cb 0.58 0.92 0.55 0.00 -0.75 0.00 0.00 64.21 65.51 2gpq n SER 141 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2gpq n PHE 142 N -3.03 0.03 -4.84 0.66 3.72 -1.25 -4.97 117.46 107.78 2gpq n PHE 142 Ca 0.00 0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 2gpq n PHE 142 Cb 0.00 -0.51 0.00 0.00 -0.94 0.00 0.00 39.48 38.03 2gpq n PHE 142 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2gpq n ASP 143 N -1.52 -3.21 0.23 4.37 9.92 -1.26 -3.08 116.55 121.99 2gpq n ASP 143 Ca 0.06 0.00 0.15 0.00 -0.53 0.00 0.00 54.79 54.47 2gpq n ASP 143 Cb 0.30 0.00 0.81 0.00 -0.64 0.00 0.00 41.12 41.59 2gpq n ASP 143 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 2gpq h ASP 144 N 0.00 0.00 -0.23 -2.24 3.58 -1.98 -2.70 116.42 112.85 2gpq h ASP 144 Ca 0.00 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.31 2gpq h ASP 144 Cb 0.00 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 40.98 2gpq h ASP 144 CO 0.00 0.00 0.18 -1.22 -2.88 0.00 0.00 179.24 175.32 2gpq n TYR 145 N -2.55 0.71 0.03 0.28 4.01 -1.18 -3.66 117.16 114.80 2gpq n TYR 145 Ca -0.02 -1.15 0.08 0.00 -0.16 0.00 0.00 57.90 56.65 2gpq n TYR 145 Cb 0.05 -0.57 -0.12 0.00 -0.31 0.00 0.00 39.34 38.39 2gpq n TYR 145 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2gpq n SER 146 N 0.57 1.34 -0.10 7.72 3.41 -1.02 -4.44 113.62 121.09 2gpq n SER 146 Ca 0.14 -0.04 0.25 0.00 -0.26 0.00 0.00 58.87 58.96 2gpq n SER 146 Cb 0.64 1.69 0.71 0.00 -0.26 0.00 0.00 64.21 67.00 2gpq n SER 146 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2gpq h ASP 147 N 0.00 0.00 0.16 4.04 3.04 -1.85 0.41 116.42 122.23 2gpq h ASP 147 Ca 0.00 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.74 2gpq h ASP 147 Cb 0.71 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.99 2gpq h ASP 147 CO 0.00 0.00 -0.21 -0.78 -2.04 0.00 0.00 179.24 176.21 2gpq h ASP 148 N 0.00 0.09 -3.22 4.15 3.58 -1.88 -3.40 116.42 115.73 2gpq h ASP 148 Ca 0.35 -0.02 -0.57 0.00 0.42 0.00 0.00 57.03 57.22 2gpq h ASP 148 Cb 1.45 -0.02 -0.05 0.00 1.72 0.00 0.00 39.33 42.43 2gpq h ASP 148 CO -0.00 0.30 1.09 -0.69 -2.88 0.00 0.00 179.24 177.06 2gpq s VAL 149 N -4.57 3.86 -0.11 2.25 1.01 0.14 0.12 120.40 123.10 2gpq s VAL 149 Ca -0.04 0.88 -0.09 0.00 0.00 0.00 0.00 61.98 62.72 2gpq s VAL 149 Cb 0.15 -4.15 -0.27 0.00 0.00 0.00 0.00 36.38 32.12 2gpq s VAL 149 CO 0.72 -0.72 0.42 0.00 0.00 0.00 0.00 175.10 175.52 2gpq s GLY 151 N -5.39 -0.27 0.01 0.00 0.00 -1.07 -2.62 107.32 97.98 2gpq s GLY 151 Ca -0.22 0.00 0.01 0.00 0.00 0.00 0.00 44.72 44.52 2gpq s GLY 151 CO 0.77 -0.09 -0.05 0.00 0.00 0.00 0.00 173.10 173.73 2gpq s ALA 152 N -3.84 0.39 0.03 3.20 0.00 -0.85 0.70 121.76 121.39 2gpq s ALA 152 Ca 0.07 -0.37 0.09 0.00 0.00 0.00 0.00 51.96 51.74 2gpq s ALA 152 Cb -0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.04 2gpq s ALA 152 CO -0.05 0.04 -0.25 0.08 0.00 0.00 0.00 175.76 175.58 2gpq s VAL 153 N -0.54 2.01 -0.23 0.00 1.01 0.35 -0.26 120.40 122.74 2gpq s VAL 153 Ca -0.03 -1.28 0.01 0.00 0.00 0.00 0.00 61.98 60.69 2gpq s VAL 153 Cb -0.04 -1.71 0.06 0.00 0.00 0.00 0.00 36.38 34.68 2gpq s VAL 153 CO -0.00 0.39 -0.07 -0.69 0.00 0.00 0.00 175.10 174.73 2gpq s VAL 154 N -0.75 1.63 -0.19 2.92 1.01 0.44 0.11 120.40 125.59 2gpq s VAL 154 Ca 0.10 -1.23 -0.03 0.00 0.00 0.00 0.00 61.98 60.83 2gpq s VAL 154 Cb -0.10 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 2gpq s VAL 154 CO 0.01 -0.03 -0.07 0.54 0.00 0.00 0.00 175.10 175.55 2gpq s ASN 155 N 1.36 4.28 -0.35 3.32 2.20 0.43 -0.90 114.94 125.27 2gpq s ASN 155 Ca -0.05 -0.34 -0.04 0.00 -0.94 0.00 0.00 52.86 51.48 2gpq s ASN 155 Cb -0.18 -1.71 0.06 0.00 -2.00 0.00 0.00 41.25 37.42 2gpq s ASN 155 CO -0.06 0.05 0.11 -0.69 -2.94 0.00 0.00 177.10 173.57 2gpq s VAL 156 N 1.03 3.47 0.26 3.54 1.01 -1.07 -0.21 120.40 128.43 2gpq s VAL 156 Ca 0.00 -1.44 -0.29 0.00 0.00 0.00 0.00 61.98 60.24 2gpq s VAL 156 Cb -0.15 -3.08 -0.09 0.00 0.00 0.00 0.00 36.38 33.06 2gpq s VAL 156 CO -0.00 -0.30 1.19 -0.13 0.00 0.00 0.00 175.10 175.85 2gpq s ARG 157 N 1.30 4.52 0.66 2.72 1.81 0.41 -3.99 118.95 126.36 2gpq s ARG 157 Ca -0.00 1.94 0.27 0.00 -1.72 0.00 0.00 55.73 56.21 2gpq s ARG 157 Cb -0.21 -3.18 1.44 0.00 -0.45 0.00 0.00 34.95 32.56 2gpq s ARG 157 CO -0.00 0.00 1.82 0.00 -0.68 0.00 0.00 175.30 176.44 2gpq h ALA 158 N 4.24 1.51 -0.38 2.13 0.00 -1.94 0.94 119.26 125.75 2gpq h ALA 158 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2gpq h ALA 158 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2gpq h ALA 158 CO 0.69 -0.46 0.00 1.63 0.00 0.00 0.00 179.25 181.12 2gpq n LYS 159 N -2.94 2.36 0.00 0.00 4.01 -1.26 -5.00 118.16 115.33 2gpq n LYS 159 Ca -0.00 -2.13 0.00 0.00 -0.51 0.00 0.00 58.31 55.66 2gpq n LYS 159 Cb 0.49 -1.42 0.00 0.00 -0.51 0.00 0.00 35.03 33.59 2gpq n LYS 159 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2gpq n GLY 160 N 1.14 2.24 3.88 0.72 0.00 0.32 -3.50 105.19 109.99 2gpq n GLY 160 Ca 0.16 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 2gpq n GLY 160 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2gpq s ASP 161 N 0.00 6.59 -0.06 1.61 -1.08 0.11 0.15 116.67 123.99 2gpq s ASP 161 Ca 0.00 0.85 -0.06 0.00 -0.52 0.00 0.00 52.55 52.82 2gpq s ASP 161 Cb 0.00 -2.20 0.02 0.00 -1.46 0.00 0.00 42.92 39.28 2gpq s ASP 161 CO 0.00 -0.06 0.18 -0.54 0.52 0.00 0.00 175.17 175.27 2gpq s LYS 162 N -2.82 0.23 -0.00 4.34 1.02 0.71 0.71 119.74 123.93 2gpq s LYS 162 Ca 0.46 0.21 0.03 0.00 0.02 0.00 0.00 55.97 56.69 2gpq s LYS 162 Cb -0.11 0.11 -0.01 0.00 -0.52 0.00 0.00 37.83 37.30 2gpq s LYS 162 CO 0.22 -0.03 -0.10 0.42 -0.92 0.00 0.00 175.35 174.94 2gpq s ILE 163 N -0.01 0.78 0.01 2.17 1.09 -0.93 -0.43 121.20 123.89 2gpq s ILE 163 Ca -0.01 -0.49 0.02 0.00 -1.10 0.00 0.00 60.65 59.07 2gpq s ILE 163 Cb -0.02 -0.67 -0.01 0.00 -1.06 0.00 0.00 42.46 40.70 2gpq s ILE 163 CO 0.00 0.17 -0.07 0.00 -0.10 0.00 0.00 174.94 174.95 2gpq s ALA 164 N -0.33 0.53 -0.06 9.38 0.00 0.31 0.10 121.76 131.69 2gpq s ALA 164 Ca 0.03 -0.45 0.03 0.00 0.00 0.00 0.00 51.96 51.56 2gpq s ALA 164 Cb -0.04 -0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.02 2gpq s ALA 164 CO -0.00 0.07 -0.14 0.42 0.00 0.00 0.00 175.76 176.11 2gpq s ILE 165 N -0.61 1.22 -0.14 0.00 1.01 -0.99 0.13 121.20 121.83 2gpq s ILE 165 Ca -0.02 -0.55 -0.03 0.00 0.00 0.00 0.00 60.65 60.05 2gpq s ILE 165 Cb -0.05 -1.10 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 2gpq s ILE 165 CO 0.00 0.37 -0.05 -1.66 0.00 0.00 0.00 174.94 173.60 2gpq s TRP 166 N 0.50 3.00 0.39 3.97 1.48 0.22 -1.46 118.94 127.04 2gpq s TRP 166 Ca -0.12 -0.25 0.01 0.00 -1.06 0.00 0.00 56.10 54.68 2gpq s TRP 166 Cb -0.15 -1.90 -0.02 0.00 -1.16 0.00 0.00 33.47 30.25 2gpq s TRP 166 CO 0.04 0.03 0.59 0.95 -4.06 0.00 0.00 176.95 174.50 2gpq s THR 167 N 0.11 4.48 -0.03 0.66 -4.23 0.42 -1.95 115.64 115.10 2gpq s THR 167 Ca -0.01 -0.57 -0.24 0.00 -1.18 0.00 0.00 61.69 59.68 2gpq s THR 167 Cb -0.14 -3.63 -0.21 0.00 1.34 0.00 0.00 72.50 69.86 2gpq s THR 167 CO 0.03 -0.40 1.14 0.71 -0.54 0.00 0.00 174.62 175.57 2gpq h THR 168 N 0.63 1.48 -3.55 3.99 1.35 0.68 -2.53 112.91 114.96 2gpq h THR 168 Ca -0.48 -1.62 -0.65 0.00 -0.55 0.00 0.00 66.41 63.11 2gpq h THR 168 Cb 1.24 2.45 -0.40 0.00 -1.73 0.00 0.00 68.15 69.71 2gpq h THR 168 CO 0.58 0.44 -0.69 -1.61 -0.25 0.00 0.00 175.52 174.00 2gpq s GLU 169 N -3.62 1.66 0.61 4.72 2.02 -1.26 -3.01 118.70 119.82 2gpq s GLU 169 Ca -0.16 -2.16 0.25 0.00 0.02 0.00 0.00 54.97 52.92 2gpq s GLU 169 Cb 0.02 -3.22 1.38 0.00 0.10 0.00 0.00 34.13 32.41 2gpq s GLU 169 CO 0.72 -1.01 1.76 0.00 0.02 0.00 0.00 175.26 176.75 2gpq h GLU 171 N 0.00 0.00 -4.49 0.00 4.22 -1.94 -3.39 114.58 108.98 2gpq h GLU 171 Ca 0.00 0.00 -0.64 0.00 0.08 0.00 0.00 59.36 58.80 2gpq h GLU 171 Cb 0.74 0.00 0.06 0.00 0.50 0.00 0.00 28.75 30.05 2gpq h GLU 171 CO 0.00 0.00 2.22 0.09 -2.18 0.00 0.00 179.01 179.14 2gpq n ASN 172 N -2.94 2.42 -0.07 1.04 4.13 0.39 -4.66 115.26 115.57 2gpq n ASN 172 Ca 0.04 -2.65 0.25 0.00 1.68 0.00 0.00 54.58 53.90 2gpq n ASN 172 Cb 0.48 -1.05 0.61 0.00 -1.54 0.00 0.00 39.78 38.28 2gpq n ASN 172 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 2gpq h ARG 173 N 8.05 0.00 0.02 3.52 3.08 -1.82 0.23 114.38 127.46 2gpq h ARG 173 Ca 0.41 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.47 2gpq h ARG 173 Cb 0.65 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 2gpq h ARG 173 CO 1.96 0.00 -0.10 0.93 -1.07 0.00 0.00 179.97 181.69 2gpq h GLU 174 N 0.00 -0.17 0.19 0.04 5.08 -1.95 0.81 114.58 118.58 2gpq h GLU 174 Ca 0.35 0.01 -0.35 0.00 -1.00 0.00 0.00 59.36 58.37 2gpq h GLU 174 Cb 1.98 0.04 0.01 0.00 0.50 0.00 0.00 28.75 31.28 2gpq h GLU 174 CO -0.00 -0.11 -1.72 0.00 -1.00 0.00 0.00 179.01 176.18 2gpq h ALA 175 N 0.78 0.14 0.12 3.43 0.00 -0.92 -1.75 119.26 121.06 2gpq h ALA 175 Ca 0.03 -1.12 -0.00 0.00 0.00 0.00 0.00 54.91 53.82 2gpq h ALA 175 Cb 0.21 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 2gpq h ALA 175 CO -0.08 0.99 -0.09 0.28 0.00 0.00 0.00 179.25 180.35 2gpq h VAL 176 N 0.08 0.81 0.00 0.00 2.07 -0.76 -2.03 116.25 116.41 2gpq h VAL 176 Ca -0.34 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 2gpq h VAL 176 Cb 2.08 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.66 2gpq h VAL 176 CO 0.18 0.00 -0.00 0.74 0.02 0.00 0.00 177.57 178.50 2gpq h THR 177 N -0.21 0.65 -0.09 2.57 2.02 0.50 -1.36 112.91 116.98 2gpq h THR 177 Ca -0.01 -1.48 0.04 0.00 0.77 0.00 0.00 66.41 65.73 2gpq h THR 177 Cb 0.19 1.23 -0.06 0.00 -1.74 0.00 0.00 68.15 67.77 2gpq h THR 177 CO -0.00 0.22 -0.34 -0.74 0.37 0.00 0.00 175.52 175.03 2gpq h HIS 178 N -1.00 -0.96 0.00 3.16 6.17 -1.22 1.49 115.15 122.79 2gpq h HIS 178 Ca -0.00 0.04 -0.24 0.00 0.71 0.00 0.00 60.37 60.88 2gpq h HIS 178 Cb 0.37 0.43 0.01 0.00 2.52 0.00 0.00 27.41 30.74 2gpq h HIS 178 CO 0.10 -0.42 -0.97 -0.84 0.71 0.00 0.00 177.93 176.51 2gpq h ILE 179 N -0.44 1.38 -0.31 6.26 -0.00 -1.50 -1.86 117.51 121.03 2gpq h ILE 179 Ca 0.08 -2.42 -0.17 0.00 -0.00 0.00 0.00 64.86 62.35 2gpq h ILE 179 Cb 0.57 2.42 -0.00 0.00 -0.00 0.00 0.00 36.82 39.81 2gpq h ILE 179 CO -0.34 0.73 -0.49 1.23 -0.00 0.00 0.00 178.15 179.27 2gpq h GLY 180 N 1.06 0.93 1.90 0.16 0.00 -0.93 0.20 103.07 106.39 2gpq h GLY 180 Ca -0.09 -1.04 -0.22 0.00 0.00 0.00 0.00 47.33 45.98 2gpq h GLY 180 CO 0.17 0.94 -1.06 0.07 0.00 0.00 0.00 176.54 176.66 2gpq h ARG 181 N 0.67 0.00 0.21 4.80 -0.00 0.20 -2.65 114.38 117.61 2gpq h ARG 181 Ca 0.03 0.00 -0.28 0.00 -0.00 0.00 0.00 59.98 59.72 2gpq h ARG 181 Cb 1.09 0.00 0.03 0.00 -0.00 0.00 0.00 29.97 31.09 2gpq h ARG 181 CO 0.11 0.94 -1.26 0.28 -0.00 0.00 0.00 179.97 180.04 2gpq h VAL 182 N 0.00 1.35 -0.33 0.08 2.07 -1.37 0.44 116.25 118.49 2gpq h VAL 182 Ca -0.04 -2.64 -0.00 0.00 0.82 0.00 0.00 66.70 64.85 2gpq h VAL 182 Cb 1.78 3.09 -0.02 0.00 -1.52 0.00 0.00 31.29 34.63 2gpq h VAL 182 CO 0.12 0.78 0.20 0.22 0.02 0.00 0.00 177.57 178.91 2gpq h TYR 183 N -0.04 0.43 -0.05 1.57 3.20 -1.05 -1.69 116.97 119.34 2gpq h TYR 183 Ca -0.22 0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.50 2gpq h TYR 183 Cb 1.98 -0.14 0.01 0.00 1.54 0.00 0.00 36.73 40.12 2gpq h TYR 183 CO 0.15 0.31 -0.56 0.87 -1.64 0.00 0.00 178.16 177.29 2gpq h LYS 184 N 0.43 0.47 -0.33 1.82 1.79 -1.55 -0.80 116.57 118.39 2gpq h LYS 184 Ca 0.12 -0.44 0.06 0.00 -2.18 0.00 0.00 60.65 58.21 2gpq h LYS 184 Cb 0.00 0.11 -0.08 0.00 -1.58 0.00 0.00 32.23 30.68 2gpq h LYS 184 CO -0.02 1.08 -0.43 1.49 -1.08 0.00 0.00 179.45 180.49 2gpq h GLU 185 N 0.01 -0.36 0.00 3.15 4.22 0.02 1.17 114.58 122.80 2gpq h GLU 185 Ca -0.06 0.02 -0.03 0.00 0.08 0.00 0.00 59.36 59.38 2gpq h GLU 185 Cb 1.24 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.56 2gpq h GLU 185 CO 0.11 -0.24 -0.16 0.07 -2.18 0.00 0.00 179.01 176.62 2gpq h ARG 186 N -0.37 0.00 -0.63 1.92 0.11 -1.41 -2.91 114.38 111.09 2gpq h ARG 186 Ca 0.12 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.20 2gpq h ARG 186 Cb 0.59 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.67 2gpq h ARG 186 CO -0.53 0.16 0.00 -0.11 0.10 0.00 0.00 179.97 179.59 2gpq n LEU 187 N -3.28 3.91 -0.23 0.08 7.94 0.15 -4.92 117.00 120.66 2gpq n LEU 187 Ca 0.01 -1.97 0.00 0.00 -1.11 0.00 0.00 56.01 52.94 2gpq n LEU 187 Cb 0.42 -0.52 0.00 0.00 0.53 0.00 0.00 43.42 43.85 2gpq n LEU 187 CO 0.32 0.65 0.00 0.61 -1.11 0.00 0.00 177.39 177.86 2gpq n GLY 188 N 0.94 0.52 1.03 -3.96 0.00 0.35 -4.83 105.19 99.24 2gpq n GLY 188 Ca 0.20 -0.12 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 2gpq n GLY 188 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2gpq n LEU 189 N -0.23 0.00 -0.17 0.99 4.77 0.11 0.16 117.00 122.64 2gpq n LEU 189 Ca 0.00 -0.03 0.02 0.00 -0.03 0.00 0.00 56.01 55.96 2gpq n LEU 189 Cb 0.12 -0.20 0.05 0.00 -2.33 0.00 0.00 43.42 41.05 2gpq n LEU 189 CO 0.00 -1.43 0.29 -2.65 -1.33 0.00 0.00 177.39 172.26 2gpq n PRO 190 N 0.65 -0.06 0.00 3.23 -0.02 -0.53 0.10 135.00 138.37 2gpq n PRO 190 Ca 0.01 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2gpq n PRO 190 Cb 0.02 -1.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.46 2gpq n PRO 190 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2gpq n PRO 191 N -4.71 0.00 0.00 0.52 -0.04 -1.26 -3.29 135.00 126.22 2gpq n PRO 191 Ca 0.06 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 2gpq n PRO 191 Cb 0.21 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 2gpq n PRO 191 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2gpq n LYS 192 N -1.13 0.00 -3.87 0.54 5.02 0.29 -5.12 118.16 113.88 2gpq n LYS 192 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 2gpq n LYS 192 Cb 0.15 -0.17 -0.12 0.00 -0.02 0.00 0.00 35.03 34.87 2gpq n LYS 192 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2gpq s ILE 193 N -1.59 0.03 -0.32 -0.18 -1.09 0.41 -4.99 121.20 113.47 2gpq s ILE 193 Ca 0.00 -0.24 -0.10 0.00 -2.23 0.00 0.00 60.65 58.09 2gpq s ILE 193 Cb 0.00 -0.18 0.00 0.00 -1.58 0.00 0.00 42.46 40.70 2gpq s ILE 193 CO 0.00 -0.13 0.16 0.68 -1.23 0.00 0.00 174.94 174.43 2gpq s VAL 194 N -0.39 4.60 -0.18 2.92 -7.23 -1.26 -1.46 120.40 117.41 2gpq s VAL 194 Ca -0.04 -0.51 -0.29 0.00 -1.81 0.00 0.00 61.98 59.32 2gpq s VAL 194 Cb -0.03 -3.40 -0.00 0.00 0.56 0.00 0.00 36.38 33.51 2gpq s VAL 194 CO 0.00 -0.00 1.12 -0.63 -0.31 0.00 0.00 175.10 175.28 2gpq s ILE 195 N 1.60 4.54 0.10 -0.62 1.01 -0.10 -4.05 121.20 123.67 2gpq s ILE 195 Ca 0.04 1.85 -0.30 0.00 0.00 0.00 0.00 60.65 62.24 2gpq s ILE 195 Cb -0.18 -4.19 -0.06 0.00 0.01 0.00 0.00 42.46 38.04 2gpq s ILE 195 CO 0.06 -0.13 1.16 -0.83 0.00 0.00 0.00 174.94 175.21 2gpq s GLY 196 N 1.44 2.56 -0.25 6.18 0.00 0.15 -1.55 107.32 115.86 2gpq s GLY 196 Ca 0.49 0.83 -0.10 0.00 0.00 0.00 0.00 44.72 45.95 2gpq s GLY 196 CO 0.12 1.92 0.14 -0.19 0.00 0.00 0.00 173.10 175.08 2gpq s TYR 197 N 0.66 3.23 -0.20 1.90 2.02 0.29 0.19 117.35 125.44 2gpq s TYR 197 Ca 0.56 0.05 0.01 0.00 -0.37 0.00 0.00 57.07 57.32 2gpq s TYR 197 Cb -0.29 -2.27 0.04 0.00 -0.40 0.00 0.00 41.96 39.04 2gpq s TYR 197 CO 0.31 -0.07 -0.13 -1.14 -1.57 0.00 0.00 175.55 172.95 2gpq s GLN 198 N 1.28 2.33 0.02 -0.62 0.74 -0.62 0.01 119.66 122.79 2gpq s GLN 198 Ca 0.07 -0.93 0.06 0.00 0.05 0.00 0.00 55.36 54.60 2gpq s GLN 198 Cb -0.14 -2.53 -0.03 0.00 1.10 0.00 0.00 33.01 31.40 2gpq s GLN 198 CO 0.06 -0.39 -0.14 0.45 -0.55 0.00 0.00 175.29 174.71 2gpq s SER 199 N 1.31 4.05 0.55 6.67 0.15 -1.25 -1.49 113.70 123.70 2gpq s SER 199 Ca -0.01 -0.32 0.24 0.00 0.70 0.00 0.00 55.95 56.57 2gpq s SER 199 Cb -0.16 -0.77 1.46 0.00 -1.71 0.00 0.00 66.02 64.84 2gpq s SER 199 CO -0.09 0.28 2.07 -0.74 1.20 0.00 0.00 173.24 175.96 2gpq h HIS 200 N 4.65 0.00 -0.57 3.44 2.76 -1.70 -0.82 115.15 122.91 2gpq h HIS 200 Ca -0.48 0.00 0.08 0.00 -2.20 0.00 0.00 60.37 57.78 2gpq h HIS 200 Cb 1.16 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.08 2gpq h HIS 200 CO 0.54 0.00 0.38 0.00 -1.30 0.00 0.00 177.93 177.55 2gpq h ALA 201 N 1.81 1.96 0.00 5.26 0.00 -1.83 -0.27 119.26 126.19 2gpq h ALA 201 Ca 0.13 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 2gpq h ALA 201 Cb 0.59 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2gpq h ALA 201 CO -0.00 -0.08 -0.67 0.22 0.00 0.00 0.00 179.25 178.72 2gpq h ASP 202 N 0.44 0.00 1.28 0.00 1.82 -1.38 1.07 116.42 119.65 2gpq h ASP 202 Ca 0.26 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.88 2gpq h ASP 202 Cb 0.45 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.46 2gpq h ASP 202 CO -0.07 0.67 -0.09 0.74 -1.61 0.00 0.00 179.24 178.88 2gpq h THR 203 N 0.00 0.19 0.00 2.25 2.02 -1.07 -3.00 112.91 113.30 2gpq h THR 203 Ca -0.01 -0.90 -0.04 0.00 0.77 0.00 0.00 66.41 66.24 2gpq h THR 203 Cb 1.33 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 69.50 2gpq h THR 203 CO 0.09 0.09 -1.13 0.00 0.37 0.00 0.00 175.52 174.93 2gpq n ALA 204 N -2.13 1.98 -1.05 6.16 0.00 -0.97 -4.71 120.51 119.79 2gpq n ALA 204 Ca 0.01 -0.10 -0.25 0.00 0.00 0.00 0.00 53.44 53.10 2gpq n ALA 204 Cb 0.42 0.45 0.10 0.00 0.00 0.00 0.00 19.45 20.42 2gpq n ALA 204 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2gpq n THR 205 N -2.59 3.14 0.00 0.00 -1.04 0.37 -4.95 114.28 109.21 2gpq n THR 205 Ca -0.04 -2.12 0.00 0.00 -2.04 0.00 0.00 64.05 59.84 2gpq n THR 205 Cb 0.54 -0.94 0.00 0.00 -1.82 0.00 0.00 70.33 68.12 2gpq n THR 205 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2gpq n LYS 206 N -0.66 0.00 -2.67 -2.82 4.81 -1.13 -3.56 118.16 112.13 2gpq n LYS 206 Ca 0.51 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.92 2gpq n LYS 206 Cb 0.99 0.00 0.04 0.00 0.02 0.00 0.00 35.03 36.08 2gpq n LYS 206 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2gpq n SER 207 N 1.31 -1.51 -4.57 3.14 2.88 -1.25 -4.42 113.62 109.19 2gpq n SER 207 Ca 0.00 -1.09 -0.23 0.00 -1.33 0.00 0.00 58.87 56.21 2gpq n SER 207 Cb 0.00 0.77 -0.07 0.00 -0.75 0.00 0.00 64.21 64.15 2gpq n SER 207 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2gpq s GLY 208 N 0.85 -0.23 -0.73 0.46 0.00 -1.23 -4.86 107.32 101.58 2gpq s GLY 208 Ca 0.24 -1.78 -0.26 0.00 0.00 0.00 0.00 44.72 42.93 2gpq s GLY 208 CO -0.10 3.78 2.42 1.44 0.00 0.00 0.00 173.10 180.63 2gpq n SER 209 N 15.98 1.86 0.00 1.64 7.64 -1.26 -3.74 113.62 135.74 2gpq n SER 209 Ca 0.43 -1.24 0.00 0.00 1.01 0.00 0.00 58.87 59.07 2gpq n SER 209 Cb 0.46 -1.62 0.00 0.00 -1.01 0.00 0.00 64.21 62.04 2gpq n SER 209 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2gpq n THR 210 N 8.55 0.00 -2.02 0.44 -1.04 -1.26 -4.96 114.28 113.99 2gpq n THR 210 Ca 0.45 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 62.19 2gpq n THR 210 Cb 0.45 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.98 2gpq n THR 210 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2gpq n THR 211 N -1.76 2.74 -2.79 12.58 -1.04 -1.25 -5.02 114.28 117.75 2gpq n THR 211 Ca 0.00 -4.21 0.00 0.00 -2.04 0.00 0.00 64.05 57.80 2gpq n THR 211 Cb 0.00 -1.18 0.00 0.00 -1.82 0.00 0.00 70.33 67.33 2gpq n THR 211 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2gpq n LYS 212 N -0.67 -0.77 -1.36 -2.82 0.00 -1.26 -4.94 118.16 106.34 2gpq n LYS 212 Ca 0.46 0.92 0.03 0.00 -0.00 0.00 0.00 58.31 59.73 2gpq n LYS 212 Cb 0.79 -0.78 0.02 0.00 -0.00 0.00 0.00 35.03 35.05 2gpq n LYS 212 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2gpq n ASN 213 N 1.93 0.85 0.00 -5.58 6.94 -1.25 -4.49 115.26 113.66 2gpq n ASN 213 Ca 0.00 -2.00 0.00 0.00 -0.02 0.00 0.00 54.58 52.56 2gpq n ASN 213 Cb 0.18 -0.28 0.00 0.00 -2.36 0.00 0.00 39.78 37.32 2gpq n ASN 213 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09 2gpq n ARG 214 N 0.43 0.00 -3.91 -3.83 3.00 0.10 -3.78 116.66 108.67 2gpq n ARG 214 Ca 0.05 0.00 -0.10 0.00 -0.00 0.00 0.00 57.85 57.80 2gpq n ARG 214 Cb 1.08 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 33.45 2gpq n ARG 214 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 2gpq s PHE 215 N 0.00 0.17 -0.10 -0.14 5.36 -1.22 -4.95 117.98 117.10 2gpq s PHE 215 Ca 0.00 -0.47 0.04 0.00 -0.96 0.00 0.00 56.93 55.53 2gpq s PHE 215 Cb 0.00 -0.12 -0.00 0.00 -0.34 0.00 0.00 43.02 42.56 2gpq s PHE 215 CO 0.00 -0.39 -0.23 0.14 -1.46 0.00 0.00 175.22 173.28 2gpq s VAL 216 N -2.70 2.13 0.00 3.12 -7.23 -1.26 0.11 120.40 114.57 2gpq s VAL 216 Ca -0.04 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.14 2gpq s VAL 216 Cb -0.01 -1.82 0.00 0.00 0.56 0.00 0.00 36.38 35.12 2gpq s VAL 216 CO -0.05 0.56 0.00 0.52 -0.31 0.00 0.00 175.10 175.82