#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gpq n ALA 2 N 0.00 -0.61 -3.74 3.17 0.00 -1.26 -4.98 120.51 113.09 2gpq n ALA 2 Ca 0.00 0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.37 2gpq n ALA 2 Cb 0.00 -2.27 -0.17 0.00 0.00 0.00 0.00 19.45 17.01 2gpq n ALA 2 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2gpq s THR 3 N -3.00 0.33 -0.27 0.00 -4.23 -1.26 -5.12 115.64 102.10 2gpq s THR 3 Ca 0.03 -0.04 -0.02 0.00 -1.18 0.00 0.00 61.69 60.49 2gpq s THR 3 Cb -0.01 -0.62 0.03 0.00 1.34 0.00 0.00 72.50 73.24 2gpq s THR 3 CO 0.04 0.09 -0.03 0.54 -0.54 0.00 0.00 174.62 174.72 2gpq s VAL 4 N 1.98 2.96 0.07 2.29 0.11 -1.26 -5.11 120.40 121.44 2gpq s VAL 4 Ca 0.03 -1.14 0.05 0.00 -2.93 0.00 0.00 61.98 57.99 2gpq s VAL 4 Cb -0.14 -2.57 -0.04 0.00 -1.53 0.00 0.00 36.38 32.10 2gpq s VAL 4 CO -0.06 0.09 -0.03 -1.61 -3.33 0.00 0.00 175.10 170.15 2gpq s GLU 5 N 1.31 2.48 -1.11 1.54 2.02 -1.26 -5.02 118.70 118.65 2gpq s GLU 5 Ca -0.02 -0.84 -0.07 0.00 0.02 0.00 0.00 54.97 54.07 2gpq s GLU 5 Cb -0.18 -2.49 -0.07 0.00 0.10 0.00 0.00 34.13 31.49 2gpq s GLU 5 CO -0.03 0.55 2.45 -0.35 0.02 0.00 0.00 175.26 177.90 2gpq n PRO 6 N 0.86 2.62 -0.73 0.39 -0.04 -1.26 -4.91 135.00 131.93 2gpq n PRO 6 Ca -0.13 -1.68 0.10 0.00 -0.04 0.00 0.00 63.50 61.76 2gpq n PRO 6 Cb 0.52 -2.54 -0.02 0.00 -0.04 0.00 0.00 33.50 31.42 2gpq n PRO 6 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2gpq n GLU 7 N 3.89 -1.48 -4.75 0.54 -0.58 -1.26 -4.81 120.64 112.20 2gpq n GLU 7 Ca 0.56 0.97 -0.33 0.00 -0.42 0.00 0.00 57.16 57.94 2gpq n GLU 7 Cb 0.20 -1.80 -0.13 0.00 -0.57 0.00 0.00 31.44 29.14 2gpq n GLU 7 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2gpq s THR 8 N -1.27 3.34 -0.29 2.62 2.01 -1.26 -5.09 115.64 115.69 2gpq s THR 8 Ca 0.00 -0.60 -0.29 0.00 0.31 0.00 0.00 61.69 61.11 2gpq s THR 8 Cb 0.00 -2.35 0.01 0.00 0.01 0.00 0.00 72.50 70.17 2gpq s THR 8 CO 0.00 0.58 1.12 0.42 -0.69 0.00 0.00 174.62 176.04 2gpq s THR 9 N -0.53 4.46 0.41 -0.82 -4.23 -1.26 -5.00 115.64 108.67 2gpq s THR 9 Ca 0.07 1.70 -0.25 0.00 -1.18 0.00 0.00 61.69 62.04 2gpq s THR 9 Cb -0.12 -4.34 -0.11 0.00 1.34 0.00 0.00 72.50 69.28 2gpq s THR 9 CO 0.02 -0.41 1.08 -2.65 -0.54 0.00 0.00 174.62 172.12 2gpq n PRO 10 N 6.84 1.52 -3.76 3.99 -0.02 -1.26 -4.99 135.00 137.32 2gpq n PRO 10 Ca 0.13 0.54 -0.33 0.00 -2.02 0.00 0.00 63.50 61.82 2gpq n PRO 10 Cb 0.47 -2.12 -0.05 0.00 -0.02 0.00 0.00 33.50 31.78 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 -1.23 5.27 -0.32 3.45 -4.23 -1.26 -5.01 115.64 112.31 2gpq s THR 11 Ca 0.62 0.04 -0.33 0.00 -1.18 0.00 0.00 61.69 60.83 2gpq s THR 11 Cb -0.56 -3.60 -0.10 0.00 1.34 0.00 0.00 72.50 69.59 2gpq s THR 11 CO 0.58 0.23 2.20 -2.65 -0.54 0.00 0.00 174.62 174.44 2gpq n PRO 12 N 0.66 1.30 0.00 3.99 -0.02 -1.26 -4.87 135.00 134.81 2gpq n PRO 12 Ca -0.07 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2gpq n PRO 12 Cb 0.52 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 2gpq n PRO 12 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2gpq n ASN 13 N 10.39 0.00 -4.27 2.55 6.94 -1.26 -5.12 115.26 124.49 2gpq n ASN 13 Ca 0.38 0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.66 2gpq n ASN 13 Cb 0.29 0.00 0.25 0.00 -2.36 0.00 0.00 39.78 37.95 2gpq n ASN 13 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 2gpq s PRO 14 N -2.00 -1.14 0.22 -0.53 0.04 -1.26 -4.95 135.00 125.39 2gpq s PRO 14 Ca 0.00 0.53 -0.30 0.00 0.04 0.00 0.00 61.00 61.27 2gpq s PRO 14 Cb 0.00 -1.55 -0.09 0.00 0.04 0.00 0.00 34.50 32.89 2gpq s PRO 14 CO 0.00 -3.79 1.38 -1.25 0.04 0.00 0.00 177.00 173.38 2gpq s PRO 15 N -4.76 4.33 0.23 0.56 0.04 -1.26 -5.00 135.00 129.14 2gpq s PRO 15 Ca 0.68 2.18 -0.10 0.00 0.04 0.00 0.00 61.00 63.80 2gpq s PRO 15 Cb -0.20 -3.15 0.04 0.00 0.04 0.00 0.00 34.50 31.23 2gpq s PRO 15 CO 0.61 -0.34 0.53 2.41 0.04 0.00 0.00 177.00 180.25 2gpq n THR 16 N 2.48 0.00 -3.76 1.26 -1.04 -1.26 -5.17 114.28 106.78 2gpq n THR 16 Ca 0.06 -0.58 -0.13 0.00 -2.04 0.00 0.00 64.05 61.36 2gpq n THR 16 Cb 0.41 0.61 -0.14 0.00 -1.82 0.00 0.00 70.33 69.39 2gpq n THR 16 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2gpq s THR 17 N -2.40 -0.04 0.39 12.58 -1.32 -1.26 -5.14 115.64 118.45 2gpq s THR 17 Ca 0.11 0.15 -0.27 0.00 -1.21 0.00 0.00 61.69 60.47 2gpq s THR 17 Cb -0.03 -0.22 -0.09 0.00 -1.51 0.00 0.00 72.50 70.64 2gpq s THR 17 CO 0.07 0.06 1.35 -0.70 -2.21 0.00 0.00 174.62 173.19 2gpq s GLU 18 N 1.00 4.04 0.09 7.08 2.56 -1.26 -5.00 118.70 127.21 2gpq s GLU 18 Ca -0.08 2.27 -0.16 0.00 0.00 0.00 0.00 54.97 57.00 2gpq s GLU 18 Cb -0.10 -2.85 -0.07 0.00 2.00 0.00 0.00 34.13 33.12 2gpq s GLU 18 CO -0.05 -0.47 0.53 -2.00 -0.56 0.00 0.00 175.26 172.71 2gpq s GLU 19 N -2.14 4.05 0.40 4.30 2.56 -1.26 -5.08 118.70 121.53 2gpq s GLU 19 Ca 0.55 0.57 -0.07 0.00 0.00 0.00 0.00 54.97 56.02 2gpq s GLU 19 Cb -0.40 -3.11 0.10 0.00 2.00 0.00 0.00 34.13 32.72 2gpq s GLU 19 CO 0.53 0.58 0.24 0.39 -0.56 0.00 0.00 175.26 176.44 2gpq n GLU 20 N 1.35 -2.78 -0.24 4.30 -0.58 -1.26 -4.84 120.64 116.59 2gpq n GLU 20 Ca -0.09 -0.40 0.11 0.00 -0.42 0.00 0.00 57.16 56.36 2gpq n GLU 20 Cb 0.51 -0.51 0.38 0.00 -0.57 0.00 0.00 31.44 31.25 2gpq n GLU 20 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 2gpq h LYS 21 N 0.00 0.67 -5.93 3.49 -0.00 -2.07 -3.46 116.57 109.27 2gpq h LYS 21 Ca -0.11 -0.04 -0.37 0.00 -0.00 0.00 0.00 60.65 60.13 2gpq h LYS 21 Cb 0.36 -0.15 0.11 0.00 -0.00 0.00 0.00 32.23 32.55 2gpq h LYS 21 CO 0.06 0.45 -0.88 2.41 -0.00 0.00 0.00 179.45 181.49 2gpq n THR 22 N -4.53 -6.45 -3.58 0.07 -1.04 -1.26 -4.99 114.28 92.49 2gpq n THR 22 Ca 0.16 -0.93 -0.07 0.00 -2.04 0.00 0.00 64.05 61.17 2gpq n THR 22 Cb 0.41 -4.85 -0.02 0.00 -1.82 0.00 0.00 70.33 64.05 2gpq n THR 22 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2gpq s GLU 23 N -5.49 0.99 -0.38 -2.82 2.56 -1.26 -5.13 118.70 107.17 2gpq s GLU 23 Ca 0.31 -0.44 -0.05 0.00 0.00 0.00 0.00 54.97 54.79 2gpq s GLU 23 Cb -0.08 0.41 0.07 0.00 2.00 0.00 0.00 34.13 36.53 2gpq s GLU 23 CO 0.81 -0.44 0.16 -1.12 -0.56 0.00 0.00 175.26 174.11 2gpq s SER 24 N -2.66 5.32 0.27 -1.70 0.01 -1.26 -5.08 113.70 108.61 2gpq s SER 24 Ca 0.07 -1.53 0.04 0.00 1.31 0.00 0.00 55.95 55.85 2gpq s SER 24 Cb -0.01 -1.87 -0.06 0.00 0.21 0.00 0.00 66.02 64.29 2gpq s SER 24 CO -0.05 -0.44 0.01 0.21 0.41 0.00 0.00 173.24 173.37 2gpq s ASN 25 N 1.73 2.20 -1.22 2.44 3.04 -1.26 -5.06 114.94 116.80 2gpq s ASN 25 Ca 0.02 -1.27 -0.05 0.00 0.04 0.00 0.00 52.86 51.60 2gpq s ASN 25 Cb -0.22 -0.06 0.19 0.00 -1.54 0.00 0.00 41.25 39.63 2gpq s ASN 25 CO -0.00 -0.51 2.10 0.00 -3.04 0.00 0.00 177.10 175.65 2gpq n GLN 26 N -0.54 4.68 -2.70 0.43 1.13 -1.26 -4.81 117.38 114.31 2gpq n GLN 26 Ca -0.04 -3.87 -0.01 0.00 -1.94 0.00 0.00 57.00 51.14 2gpq n GLN 26 Cb 0.65 -2.62 -0.01 0.00 0.11 0.00 0.00 30.24 28.37 2gpq n GLN 26 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2gpq n GLU 27 N 1.52 -3.72 -2.54 -1.09 1.02 -1.26 -4.86 120.64 109.71 2gpq n GLU 27 Ca 0.53 2.93 -0.43 0.00 -0.02 0.00 0.00 57.16 60.17 2gpq n GLU 27 Cb 0.27 -5.37 -0.02 0.00 -0.02 0.00 0.00 31.44 26.30 2gpq n GLU 27 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2gpq s VAL 28 N -1.49 4.46 -0.42 2.62 0.11 -1.26 -4.24 120.40 120.18 2gpq s VAL 28 Ca -0.05 1.76 -0.15 0.00 -2.93 0.00 0.00 61.98 60.61 2gpq s VAL 28 Cb 0.00 -4.13 0.02 0.00 -1.53 0.00 0.00 36.38 30.74 2gpq s VAL 28 CO 0.79 -0.05 0.55 0.00 -3.33 0.00 0.00 175.10 173.07 2gpq n ALA 29 N 5.55 -3.04 0.02 1.54 0.00 -1.26 -4.93 120.51 118.39 2gpq n ALA 29 Ca 0.11 1.12 0.00 0.00 0.00 0.00 0.00 53.44 54.67 2gpq n ALA 29 Cb 0.47 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.34 2gpq n ALA 29 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2gpq n ASN 30 N -0.22 -0.43 -0.05 0.00 4.13 -1.26 -5.00 115.26 112.43 2gpq n ASN 30 Ca 0.11 0.46 -0.14 0.00 1.68 0.00 0.00 54.58 56.69 2gpq n ASN 30 Cb 0.43 0.77 -0.07 0.00 -1.54 0.00 0.00 39.78 39.37 2gpq n ASN 30 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2gpq h PRO 31 N 0.00 0.39 0.00 3.52 0.13 -1.89 -3.48 132.00 130.67 2gpq h PRO 31 Ca 0.00 -0.24 -0.10 0.00 -0.87 0.00 0.00 66.00 64.78 2gpq h PRO 31 Cb 0.00 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 31.13 2gpq h PRO 31 CO 0.00 0.83 -0.08 0.39 -0.23 0.00 0.00 178.00 178.91 2gpq n GLU 32 N -4.47 0.17 -1.20 0.86 -0.58 -1.26 -5.08 120.64 109.08 2gpq n GLU 32 Ca -0.07 -0.88 -0.05 0.00 -0.42 0.00 0.00 57.16 55.75 2gpq n GLU 32 Cb 0.42 0.79 -0.02 0.00 -0.57 0.00 0.00 31.44 32.07 2gpq n GLU 32 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2gpq n HIS 33 N -0.18 -0.33 -3.01 -0.32 8.25 -1.26 -4.54 115.22 113.84 2gpq n HIS 33 Ca 0.01 -0.58 -0.04 0.00 -0.26 0.00 0.00 57.72 56.85 2gpq n HIS 33 Cb 0.17 0.63 -0.01 0.00 1.12 0.00 0.00 29.99 31.90 2gpq n HIS 33 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2gpq s TYR 34 N 0.02 -1.42 -0.09 4.41 1.51 -1.26 -5.14 117.35 115.39 2gpq s TYR 34 Ca 0.01 -0.38 0.03 0.00 -1.01 0.00 0.00 57.07 55.72 2gpq s TYR 34 Cb 0.07 0.20 0.01 0.00 -0.11 0.00 0.00 41.96 42.13 2gpq s TYR 34 CO -0.02 -1.20 -0.17 -1.50 -1.11 0.00 0.00 175.55 171.55 2gpq s ILE 35 N 1.23 1.54 -0.11 2.71 1.10 -1.26 -5.13 121.20 121.28 2gpq s ILE 35 Ca 0.24 -0.70 -0.10 0.00 -0.51 0.00 0.00 60.65 59.58 2gpq s ILE 35 Cb -0.02 -1.37 -0.05 0.00 0.15 0.00 0.00 42.46 41.17 2gpq s ILE 35 CO -0.06 0.45 0.22 -1.59 -2.11 0.00 0.00 174.94 171.84 2gpq s LYS 36 N 0.64 3.77 -0.03 3.50 0.00 -1.26 -4.71 119.74 121.65 2gpq s LYS 36 Ca -0.14 0.01 0.03 0.00 0.00 0.00 0.00 55.97 55.87 2gpq s LYS 36 Cb -0.16 -3.26 0.00 0.00 0.00 0.00 0.00 37.83 34.41 2gpq s LYS 36 CO 0.04 0.61 -0.10 -1.58 0.00 0.00 0.00 175.35 174.33 2gpq s HIS 37 N -0.63 1.03 0.14 1.78 2.46 -1.26 -4.98 115.29 113.83 2gpq s HIS 37 Ca 0.16 -0.26 -0.30 0.00 0.47 0.00 0.00 55.06 55.13 2gpq s HIS 37 Cb -0.13 -0.72 -0.07 0.00 -0.13 0.00 0.00 32.58 31.53 2gpq s HIS 37 CO 0.05 -0.10 1.01 -1.25 -2.47 0.00 0.00 174.74 171.98 2gpq s PRO 38 N 0.16 4.66 -0.03 2.88 0.04 -1.26 -2.62 135.00 138.83 2gpq s PRO 38 Ca -0.03 1.55 -0.07 0.00 0.04 0.00 0.00 61.00 62.49 2gpq s PRO 38 Cb -0.09 -3.34 -0.05 0.00 0.04 0.00 0.00 34.50 31.07 2gpq s PRO 38 CO 0.01 0.17 0.24 -0.51 0.04 0.00 0.00 177.00 176.94 2gpq s LEU 39 N -0.14 4.39 0.43 -3.56 1.43 -1.25 -4.89 118.68 115.09 2gpq s LEU 39 Ca 0.48 0.55 0.22 0.00 -1.03 0.00 0.00 54.13 54.35 2gpq s LEU 39 Cb -0.26 -2.48 0.96 0.00 0.03 0.00 0.00 46.19 44.45 2gpq s LEU 39 CO 0.32 0.31 1.86 -0.61 0.23 0.00 0.00 176.35 178.46 2gpq h GLN 40 N 4.34 0.00 0.00 1.70 5.75 -1.97 -3.46 115.11 121.47 2gpq h GLN 40 Ca -0.52 0.00 -0.41 0.00 -0.15 0.00 0.00 58.65 57.58 2gpq h GLN 40 Cb 1.21 0.00 -0.10 0.00 1.07 0.00 0.00 27.48 29.66 2gpq h GLN 40 CO 0.63 0.26 -0.37 0.09 -2.65 0.00 0.00 178.83 176.80 2gpq n ASN 41 N -3.60 0.23 -4.53 -0.69 4.13 -1.26 -5.15 115.26 104.40 2gpq n ASN 41 Ca -0.01 -2.73 -0.34 0.00 1.68 0.00 0.00 54.58 53.17 2gpq n ASN 41 Cb 0.40 1.09 -0.11 0.00 -1.54 0.00 0.00 39.78 39.62 2gpq n ASN 41 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2gpq s ARG 42 N -3.15 3.77 -0.17 3.52 0.52 -1.26 -4.62 118.95 117.56 2gpq s ARG 42 Ca 0.25 -0.45 -0.05 0.00 -0.52 0.00 0.00 55.73 54.95 2gpq s ARG 42 Cb 0.01 -3.10 -0.03 0.00 0.52 0.00 0.00 34.95 32.35 2gpq s ARG 42 CO 0.17 0.17 -0.00 -1.58 0.02 0.00 0.00 175.30 174.08 2gpq s TRP 43 N 0.61 3.10 0.16 -0.53 0.52 0.48 0.97 118.94 124.24 2gpq s TRP 43 Ca 0.00 -0.21 0.07 0.00 0.02 0.00 0.00 56.10 55.99 2gpq s TRP 43 Cb -0.14 -2.01 -0.04 0.00 -1.15 0.00 0.00 33.47 30.13 2gpq s TRP 43 CO 0.02 -0.01 -0.02 0.00 0.02 0.00 0.00 176.95 176.96 2gpq s ALA 44 N 0.46 3.16 -0.16 0.98 0.00 0.13 0.11 121.76 126.43 2gpq s ALA 44 Ca -0.01 -1.35 0.01 0.00 0.00 0.00 0.00 51.96 50.61 2gpq s ALA 44 Cb -0.14 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.02 2gpq s ALA 44 CO 0.02 0.51 -0.17 -1.17 0.00 0.00 0.00 175.76 174.95 2gpq s LEU 45 N -2.81 2.33 0.09 0.00 0.20 0.38 -2.07 118.68 116.81 2gpq s LEU 45 Ca 0.26 -0.53 0.10 0.00 0.69 0.00 0.00 54.13 54.65 2gpq s LEU 45 Cb -0.10 -1.52 -0.03 0.00 -0.43 0.00 0.00 46.19 44.11 2gpq s LEU 45 CO 0.18 0.07 -0.26 0.26 -0.29 0.00 0.00 176.35 176.30 2gpq s TRP 46 N 0.92 2.26 -0.12 5.38 0.52 -0.54 -2.05 118.94 125.30 2gpq s TRP 46 Ca -0.04 -0.39 -0.01 0.00 0.02 0.00 0.00 56.10 55.67 2gpq s TRP 46 Cb -0.15 -1.28 0.04 0.00 -1.15 0.00 0.00 33.47 30.93 2gpq s TRP 46 CO -0.03 0.24 -0.01 0.12 0.02 0.00 0.00 176.95 177.29 2gpq s PHE 47 N -0.96 1.08 -0.04 -1.98 2.19 0.12 -0.57 117.98 117.83 2gpq s PHE 47 Ca 0.12 -0.59 0.07 0.00 0.33 0.00 0.00 56.93 56.86 2gpq s PHE 47 Cb -0.10 -1.02 -0.01 0.00 -1.31 0.00 0.00 43.02 40.57 2gpq s PHE 47 CO 0.04 -0.48 -0.24 -0.06 1.83 0.00 0.00 175.22 176.31 2gpq s PHE 48 N 1.84 2.27 -0.02 10.12 0.08 0.31 -1.66 117.98 130.92 2gpq s PHE 48 Ca 0.03 -0.58 0.00 0.00 0.12 0.00 0.00 56.93 56.51 2gpq s PHE 48 Cb -0.14 -1.48 0.02 0.00 -0.57 0.00 0.00 43.02 40.85 2gpq s PHE 48 CO -0.07 -0.14 -0.00 -1.59 -0.10 0.00 0.00 175.22 173.32 2gpq s LYS 49 N -0.31 0.19 -0.27 0.44 -2.85 -1.26 -1.31 119.74 114.37 2gpq s LYS 49 Ca 0.02 0.04 -0.10 0.00 -1.00 0.00 0.00 55.97 54.92 2gpq s LYS 49 Cb -0.12 -0.31 -0.05 0.00 -2.06 0.00 0.00 37.83 35.29 2gpq s LYS 49 CO 0.02 -0.07 0.16 0.54 0.10 0.00 0.00 175.35 176.10 2gpq s ASN 50 N 0.61 5.84 -0.44 0.03 2.20 -1.26 -4.80 114.94 117.13 2gpq s ASN 50 Ca -0.06 -0.04 -0.13 0.00 -0.94 0.00 0.00 52.86 51.70 2gpq s ASN 50 Cb -0.09 -2.08 0.07 0.00 -2.00 0.00 0.00 41.25 37.16 2gpq s ASN 50 CO -0.01 -0.03 0.32 -0.62 -2.94 0.00 0.00 177.10 173.81 2gpq s ASP 51 N 1.64 5.91 -1.00 3.54 -1.08 -1.26 -4.61 116.67 119.81 2gpq s ASP 51 Ca 0.07 -1.33 -0.07 0.00 -0.52 0.00 0.00 52.55 50.69 2gpq s ASP 51 Cb -0.16 -2.09 -0.04 0.00 -1.46 0.00 0.00 42.92 39.17 2gpq s ASP 51 CO 0.09 -0.57 0.85 1.17 0.52 0.00 0.00 175.17 177.23 2gpq n LYS 52 N 5.07 -1.88 -3.08 4.34 4.81 -1.26 -3.88 118.16 122.28 2gpq n LYS 52 Ca -0.11 0.92 -0.02 0.00 -0.87 0.00 0.00 58.31 58.23 2gpq n LYS 52 Cb 0.44 -5.46 0.01 0.00 0.02 0.00 0.00 35.03 30.04 2gpq n LYS 52 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2gpq n SER 53 N -2.84 -7.67 -4.53 3.14 7.64 -1.26 -5.04 113.62 103.06 2gpq n SER 53 Ca -0.07 -0.15 -0.24 0.00 1.01 0.00 0.00 58.87 59.43 2gpq n SER 53 Cb 0.59 -5.30 -0.09 0.00 -1.01 0.00 0.00 64.21 58.40 2gpq n SER 53 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2gpq s LYS 54 N -3.17 1.89 -0.04 1.43 2.47 -1.25 -5.13 119.74 115.94 2gpq s LYS 54 Ca 0.06 -1.68 -0.18 0.00 -1.56 0.00 0.00 55.97 52.61 2gpq s LYS 54 Cb -0.01 -1.89 -0.05 0.00 -1.46 0.00 0.00 37.83 34.42 2gpq s LYS 54 CO 0.75 0.32 0.50 0.99 0.16 0.00 0.00 175.35 178.07 2gpq s THR 55 N -2.46 5.02 0.48 3.43 2.01 -1.26 -4.71 115.64 118.15 2gpq s THR 55 Ca 0.31 1.04 0.13 0.00 0.31 0.00 0.00 61.69 63.48 2gpq s THR 55 Cb -0.05 -3.83 0.26 0.00 0.01 0.00 0.00 72.50 68.89 2gpq s THR 55 CO 0.17 0.44 2.12 4.11 -0.69 0.00 0.00 174.62 180.76 2gpq h TRP 56 N 5.68 0.15 -0.07 4.92 0.09 -1.91 -0.97 115.95 123.84 2gpq h TRP 56 Ca -0.46 0.00 -0.10 0.00 0.09 0.00 0.00 58.89 58.43 2gpq h TRP 56 Cb 1.20 -0.05 -0.01 0.00 0.08 0.00 0.00 29.16 30.38 2gpq h TRP 56 CO 0.66 0.10 -0.40 0.37 0.09 0.00 0.00 178.44 179.26 2gpq h GLN 57 N 0.16 0.15 0.06 0.12 -0.00 -1.97 0.82 115.11 114.45 2gpq h GLN 57 Ca 0.04 -0.07 -0.25 0.00 -0.00 0.00 0.00 58.65 58.38 2gpq h GLN 57 Cb -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.46 2gpq h GLN 57 CO -0.01 0.53 -1.15 0.00 0.00 0.00 0.00 178.83 178.20 2gpq h ALA 58 N 1.46 0.25 -0.22 3.38 0.00 -1.62 -3.31 119.26 119.20 2gpq h ALA 58 Ca 0.01 -0.93 -0.12 0.00 0.00 0.00 0.00 54.91 53.87 2gpq h ALA 58 Cb 0.77 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 2gpq h ALA 58 CO 0.06 1.14 -0.28 0.27 0.00 0.00 0.00 179.25 180.44 2gpq n ASN 59 N -3.43 2.25 -4.61 0.00 0.23 -0.64 -5.02 115.26 104.05 2gpq n ASN 59 Ca -0.05 -3.85 -0.43 0.00 -0.53 0.00 0.00 54.58 49.72 2gpq n ASN 59 Cb 0.99 -0.59 -0.03 0.00 -2.08 0.00 0.00 39.78 38.07 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 -3.27 3.66 -0.14 -4.53 2.96 0.28 -4.24 118.68 113.40 2gpq s LEU 60 Ca 0.42 1.62 -0.01 0.00 -0.22 0.00 0.00 54.13 55.94 2gpq s LEU 60 Cb 0.39 -3.52 -0.02 0.00 0.50 0.00 0.00 46.19 43.54 2gpq s LEU 60 CO -0.03 -1.60 -0.11 -0.60 -1.32 0.00 0.00 176.35 172.69 2gpq s ARG 61 N 5.47 3.42 -0.17 1.98 6.06 -0.66 -5.05 118.95 130.00 2gpq s ARG 61 Ca 0.83 -0.66 -0.11 0.00 -2.50 0.00 0.00 55.73 53.29 2gpq s ARG 61 Cb -0.27 -2.71 -0.05 0.00 0.06 0.00 0.00 34.95 31.99 2gpq s ARG 61 CO 0.34 0.17 0.19 -0.51 -2.50 0.00 0.00 175.30 172.99 2gpq s LEU 62 N 0.47 4.25 -0.04 -0.88 1.43 -1.26 0.15 118.68 122.79 2gpq s LEU 62 Ca -0.08 0.36 -0.02 0.00 -1.03 0.00 0.00 54.13 53.35 2gpq s LEU 62 Cb -0.15 -2.18 -0.01 0.00 0.03 0.00 0.00 46.19 43.87 2gpq s LEU 62 CO 0.04 0.18 -0.04 0.40 0.23 0.00 0.00 176.35 177.16 2gpq h ILE 63 N 4.58 0.00 0.00 -0.59 1.08 -1.73 -3.46 117.51 117.38 2gpq h ILE 63 Ca -0.43 -0.34 0.00 0.00 -0.39 0.00 0.00 64.86 63.70 2gpq h ILE 63 Cb 1.16 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.91 2gpq h ILE 63 CO 0.74 0.00 0.00 -0.24 -0.69 0.00 0.00 178.15 177.96 2gpq n SER 64 N -3.04 0.00 -4.20 1.72 2.88 -0.99 -5.03 113.62 104.96 2gpq n SER 64 Ca -0.02 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.40 2gpq n SER 64 Cb 0.07 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.42 2gpq n SER 64 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2gpq s LYS 65 N -2.00 0.92 0.13 -1.46 -2.85 -1.26 0.14 119.74 113.36 2gpq s LYS 65 Ca 0.00 -1.36 -0.20 0.00 -1.00 0.00 0.00 55.97 53.42 2gpq s LYS 65 Cb 0.00 -0.40 0.05 0.00 -2.06 0.00 0.00 37.83 35.42 2gpq s LYS 65 CO 0.00 0.03 0.50 -0.06 0.10 0.00 0.00 175.35 175.92 2gpq s PHE 66 N -3.36 -0.37 -0.23 1.78 0.08 0.29 -4.93 117.98 111.24 2gpq s PHE 66 Ca 0.13 0.15 0.11 0.00 0.12 0.00 0.00 56.93 57.44 2gpq s PHE 66 Cb 0.03 0.39 0.45 0.00 -0.57 0.00 0.00 43.02 43.31 2gpq s PHE 66 CO -0.02 -0.75 1.19 -3.47 -0.10 0.00 0.00 175.22 172.07 2gpq n ASP 67 N -0.19 3.07 -3.68 1.36 -0.08 -1.26 0.18 116.55 115.95 2gpq n ASP 67 Ca -0.17 -3.54 -0.13 0.00 -1.51 0.00 0.00 54.79 49.44 2gpq n ASP 67 Cb 0.64 -0.42 -0.09 0.00 2.34 0.00 0.00 41.12 43.59 2gpq n ASP 67 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2gpq s THR 68 N -3.65 -0.00 0.14 5.18 2.01 -1.26 -3.83 115.64 114.24 2gpq s THR 68 Ca 0.43 0.01 -0.15 0.00 0.31 0.00 0.00 61.69 62.28 2gpq s THR 68 Cb 0.39 -0.77 0.01 0.00 0.01 0.00 0.00 72.50 72.13 2gpq s THR 68 CO -0.03 0.00 1.68 1.62 -0.69 0.00 0.00 174.62 177.21 2gpq h VAL 69 N 4.38 1.21 0.00 3.82 3.04 -1.85 -0.31 116.25 126.55 2gpq h VAL 69 Ca -0.29 -0.67 -0.02 0.00 -1.01 0.00 0.00 66.70 64.71 2gpq h VAL 69 Cb 1.18 0.82 -0.00 0.00 -2.01 0.00 0.00 31.29 31.27 2gpq h VAL 69 CO 0.17 0.24 -0.11 -0.08 -1.01 0.00 0.00 177.57 176.78 2gpq h GLU 70 N 0.57 0.00 0.03 4.17 4.22 -1.84 -0.33 114.58 121.39 2gpq h GLU 70 Ca 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.58 2gpq h GLU 70 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2gpq h GLU 70 CO -0.01 0.11 -0.01 -0.44 -2.18 0.00 0.00 179.01 176.48 2gpq h ASP 71 N 0.00 -0.03 -1.01 1.04 3.32 -1.74 -2.51 116.42 115.49 2gpq h ASP 71 Ca -0.00 0.00 0.29 0.00 0.02 0.00 0.00 57.03 57.34 2gpq h ASP 71 Cb 0.22 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 2gpq h ASP 71 CO 0.01 0.10 0.73 0.15 -1.72 0.00 0.00 179.24 178.51 2gpq h PHE 72 N -0.27 0.00 -0.10 4.55 3.04 -1.11 0.35 116.94 123.39 2gpq h PHE 72 Ca -0.00 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.92 2gpq h PHE 72 Cb 0.03 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.53 2gpq h PHE 72 CO 0.02 0.00 -0.04 -1.49 -2.02 0.00 0.00 178.31 174.78 2gpq h TRP 73 N 0.00 0.24 -0.13 0.41 4.06 -1.15 -2.53 115.95 116.84 2gpq h TRP 73 Ca 0.48 -0.05 0.04 0.00 2.06 0.00 0.00 58.89 61.41 2gpq h TRP 73 Cb 1.94 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 30.04 2gpq h TRP 73 CO 0.00 0.53 0.20 0.00 -3.56 0.00 0.00 178.44 175.62 2gpq h ALA 74 N 0.67 1.60 0.09 1.49 0.00 0.15 0.42 119.26 123.68 2gpq h ALA 74 Ca 0.03 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2gpq h ALA 74 Cb 0.46 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2gpq h ALA 74 CO 0.01 -0.27 -0.04 1.25 0.00 0.00 0.00 179.25 180.20 2gpq h LEU 75 N 0.00 -0.10 -0.97 0.00 7.12 -1.01 -3.18 115.31 117.17 2gpq h LEU 75 Ca 0.06 -0.47 -0.09 0.00 0.13 0.00 0.00 57.88 57.50 2gpq h LEU 75 Cb 0.47 0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.61 2gpq h LEU 75 CO -0.00 0.55 -0.28 1.88 -0.13 0.00 0.00 178.44 180.47 2gpq h TYR 76 N -0.89 0.46 0.00 1.25 0.05 -1.04 -2.55 116.97 114.25 2gpq h TYR 76 Ca -0.01 -0.10 0.00 0.00 0.05 0.00 0.00 58.73 58.67 2gpq h TYR 76 Cb 0.57 -0.11 0.00 0.00 1.01 0.00 0.00 36.73 38.20 2gpq h TYR 76 CO 0.12 0.66 0.00 0.27 -1.05 0.00 0.00 178.16 178.16 2gpq n ASN 77 N -4.11 0.00 -0.98 3.88 0.23 0.08 -2.15 115.26 112.21 2gpq n ASN 77 Ca -0.01 0.39 0.09 0.00 -0.53 0.00 0.00 54.58 54.52 2gpq n ASN 77 Cb 0.41 -0.45 0.22 0.00 -2.08 0.00 0.00 39.78 37.88 2gpq n ASN 77 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2gpq n HIS 78 N -1.45 0.61 -1.38 -2.53 1.44 -0.96 -4.29 115.22 106.66 2gpq n HIS 78 Ca 0.05 -0.41 0.08 0.00 -2.01 0.00 0.00 57.72 55.43 2gpq n HIS 78 Cb 0.20 -0.01 0.16 0.00 0.12 0.00 0.00 29.99 30.46 2gpq n HIS 78 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 2gpq n ILE 79 N 1.13 1.88 -1.54 0.61 5.41 -0.91 -4.93 119.36 120.99 2gpq n ILE 79 Ca 0.17 -2.54 -0.35 0.00 1.00 0.00 0.00 62.75 61.04 2gpq n ILE 79 Cb 0.52 -0.17 -0.05 0.00 -0.71 0.00 0.00 39.64 39.23 2gpq n ILE 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2gpq n GLN 80 N -1.18 0.85 -0.01 0.38 1.13 -1.25 0.61 117.38 117.90 2gpq n GLN 80 Ca 0.16 -0.07 0.00 0.00 -1.94 0.00 0.00 57.00 55.15 2gpq n GLN 80 Cb 0.68 -3.18 0.00 0.00 0.11 0.00 0.00 30.24 27.85 2gpq n GLN 80 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2gpq n LEU 81 N 15.35 0.00 0.03 1.08 7.94 -1.26 -4.87 117.00 135.27 2gpq n LEU 81 Ca 0.42 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 55.43 2gpq n LEU 81 Cb 0.47 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.36 2gpq n LEU 81 CO 0.73 0.00 -0.24 -0.24 -1.11 0.00 0.00 177.39 176.53 2gpq n SER 82 N 0.00 0.50 0.08 1.96 2.88 0.20 -3.82 113.62 115.43 2gpq n SER 82 Ca 0.00 -0.03 0.12 0.00 -1.33 0.00 0.00 58.87 57.63 2gpq n SER 82 Cb 0.00 1.09 0.18 0.00 -0.75 0.00 0.00 64.21 64.73 2gpq n SER 82 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2gpq h SER 83 N 0.00 0.00 -1.46 -3.46 0.87 -1.58 -3.41 113.55 104.51 2gpq h SER 83 Ca 0.00 -0.14 -0.31 0.00 -1.23 0.00 0.00 61.79 60.11 2gpq h SER 83 Cb 0.88 0.00 -0.24 0.00 -0.44 0.00 0.00 62.40 62.60 2gpq h SER 83 CO 0.00 0.07 -0.67 -3.20 -0.53 0.00 0.00 176.83 172.50 2gpq n ASN 84 N -2.29 -2.36 -0.00 6.23 5.15 -1.26 -4.90 115.26 115.83 2gpq n ASN 84 Ca 0.03 -2.74 0.00 0.00 -0.60 0.00 0.00 54.58 51.27 2gpq n ASN 84 Cb 0.46 0.92 -0.00 0.00 -0.53 0.00 0.00 39.78 40.63 2gpq n ASN 84 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gpq n LEU 85 N 2.84 0.00 -3.92 1.20 -0.00 -1.25 -4.85 117.00 111.02 2gpq n LEU 85 Ca 0.22 -0.14 -0.24 0.00 -0.00 0.00 0.00 56.01 55.85 2gpq n LEU 85 Cb 0.53 0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 43.79 2gpq n LEU 85 CO 0.02 0.00 -0.43 0.00 -0.00 0.00 0.00 177.39 176.98 2gpq s MET 86 N -1.72 1.26 0.52 1.47 0.23 -1.26 -5.13 119.30 114.67 2gpq s MET 86 Ca -0.00 -0.21 -0.21 0.00 -1.03 0.00 0.00 55.69 54.24 2gpq s MET 86 Cb 0.00 -1.24 -0.07 0.00 -1.53 0.00 0.00 34.83 31.99 2gpq s MET 86 CO 0.00 -0.13 1.05 -2.30 -2.03 0.00 0.00 175.02 171.61 2gpq n PRO 87 N 4.39 1.23 -0.04 3.16 -0.02 -1.26 -2.96 135.00 139.50 2gpq n PRO 87 Ca -0.18 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2gpq n PRO 87 Cb 0.51 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 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 1.15 0.48 3.80 -1.23 0.00 -0.93 -4.91 105.19 103.54 2gpq n GLY 88 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.71 -0.36 0.01 0.00 1.47 -0.43 -2.32 116.67 113.33 2gpq s ASP 90 Ca 0.48 0.68 -0.00 0.00 1.18 0.00 0.00 52.55 54.89 2gpq s ASP 90 Cb -0.17 0.66 -0.01 0.00 -0.34 0.00 0.00 42.92 43.06 2gpq s ASP 90 CO 0.21 -0.13 -0.02 -0.72 0.68 0.00 0.00 175.17 175.19 2gpq s TYR 91 N 0.51 0.18 -0.02 2.11 1.13 -0.55 0.11 117.35 120.81 2gpq s TYR 91 Ca -0.03 -0.36 0.05 0.00 -1.41 0.00 0.00 57.07 55.33 2gpq s TYR 91 Cb -0.04 -0.13 -0.01 0.00 -1.10 0.00 0.00 41.96 40.68 2gpq s TYR 91 CO -0.03 -0.14 -0.18 -1.12 -2.51 0.00 0.00 175.55 171.58 2gpq s SER 92 N -1.02 2.09 -0.44 -0.18 0.01 0.26 0.95 113.70 115.37 2gpq s SER 92 Ca -0.11 -0.33 -0.02 0.00 1.31 0.00 0.00 55.95 56.80 2gpq s SER 92 Cb -0.07 -0.32 0.12 0.00 0.21 0.00 0.00 66.02 65.96 2gpq s SER 92 CO -0.01 0.20 0.24 -0.22 0.41 0.00 0.00 173.24 173.86 2gpq s LEU 93 N -0.30 5.22 0.38 2.44 1.98 0.40 -1.47 118.68 127.32 2gpq s LEU 93 Ca 0.04 -2.19 0.06 0.00 -2.89 0.00 0.00 54.13 49.15 2gpq s LEU 93 Cb -0.08 -1.82 -0.02 0.00 0.66 0.00 0.00 46.19 44.92 2gpq s LEU 93 CO 0.00 -0.50 0.23 0.72 -1.89 0.00 0.00 176.35 174.91 2gpq s PHE 94 N 0.90 1.79 0.34 5.38 -0.12 -0.88 -0.15 117.98 125.24 2gpq s PHE 94 Ca 0.10 -1.54 -0.29 0.00 -0.05 0.00 0.00 56.93 55.15 2gpq s PHE 94 Cb -0.22 -0.90 -0.12 0.00 -0.63 0.00 0.00 43.02 41.15 2gpq s PHE 94 CO -0.04 -0.67 1.48 1.17 -0.05 0.00 0.00 175.22 177.11 2gpq n LYS 95 N -0.78 2.54 0.22 1.99 4.81 -1.04 0.19 118.16 126.09 2gpq n LYS 95 Ca 0.02 0.89 0.15 0.00 -0.87 0.00 0.00 58.31 58.51 2gpq n LYS 95 Cb 0.63 -2.61 0.78 0.00 0.02 0.00 0.00 35.03 33.85 2gpq n LYS 95 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2gpq h ASP 96 N 3.49 0.00 0.56 3.14 5.19 0.29 -1.45 116.42 127.64 2gpq h ASP 96 Ca -0.48 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.93 2gpq h ASP 96 Cb 1.25 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.76 2gpq h ASP 96 CO 0.69 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 177.42 2gpq n GLY 97 N -1.00 -1.07 3.63 2.75 0.00 -1.26 -4.84 105.19 103.40 2gpq n GLY 97 Ca -0.01 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 2gpq n GLY 97 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2gpq n ILE 98 N -1.45 3.47 -4.12 -0.61 0.13 -0.55 -4.77 119.36 111.47 2gpq n ILE 98 Ca 0.05 -0.50 -0.10 0.00 -1.10 0.00 0.00 62.75 61.10 2gpq n ILE 98 Cb 0.20 -1.22 -0.10 0.00 -0.84 0.00 0.00 39.64 37.67 2gpq n ILE 98 CO 0.00 0.00 0.00 -1.61 2.80 0.00 0.00 176.55 177.74 2gpq s GLU 99 N -2.63 0.68 -1.07 9.51 2.02 -1.26 -4.97 118.70 120.98 2gpq s GLU 99 Ca 0.73 -1.14 -0.07 0.00 0.02 0.00 0.00 54.97 54.51 2gpq s GLU 99 Cb -0.44 -0.10 -0.06 0.00 0.10 0.00 0.00 34.13 33.62 2gpq s GLU 99 CO 0.49 -0.03 2.34 -0.35 0.02 0.00 0.00 175.26 177.74 2gpq n PRO 100 N 0.42 2.47 -3.57 0.39 -0.04 -1.26 -4.47 135.00 128.95 2gpq n PRO 100 Ca -0.16 -1.62 -0.21 0.00 -0.04 0.00 0.00 63.50 61.47 2gpq n PRO 100 Cb 0.59 -2.52 0.05 0.00 -0.04 0.00 0.00 33.50 31.58 2gpq n PRO 100 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2gpq n MET 101 N 4.00 -3.93 0.01 0.54 2.81 -1.26 -4.93 117.12 114.36 2gpq n MET 101 Ca 0.53 0.67 0.00 0.00 -1.81 0.00 0.00 57.70 57.09 2gpq n MET 101 Cb 0.17 -5.22 0.00 0.00 -0.71 0.00 0.00 33.22 27.46 2gpq n MET 101 CO 0.00 0.00 0.00 1.87 1.51 0.00 0.00 175.97 179.35 2gpq n TRP 102 N -4.02 -0.16 -0.03 2.03 -0.00 -1.26 -4.89 117.44 109.10 2gpq n TRP 102 Ca -0.21 0.03 -0.01 0.00 -0.00 0.00 0.00 57.50 57.31 2gpq n TRP 102 Cb 0.65 0.18 -0.07 0.00 -0.00 0.00 0.00 31.31 32.08 2gpq n TRP 102 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 2gpq n GLU 103 N -2.67 1.69 -0.85 5.87 -0.58 -1.26 -4.55 120.64 118.29 2gpq n GLU 103 Ca 0.00 -0.04 -0.13 0.00 -0.42 0.00 0.00 57.16 56.58 2gpq n GLU 103 Cb 0.00 -1.21 0.17 0.00 -0.57 0.00 0.00 31.44 29.83 2gpq n GLU 103 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2gpq n ASP 104 N -2.10 3.75 0.24 1.62 -0.08 -1.26 -4.50 116.55 114.22 2gpq n ASP 104 Ca -0.08 -3.07 0.18 0.00 -1.51 0.00 0.00 54.79 50.30 2gpq n ASP 104 Cb 0.54 -0.73 0.85 0.00 2.34 0.00 0.00 41.12 44.13 2gpq n ASP 104 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2gpq h GLU 105 N 1.20 0.00 -0.15 -0.67 5.08 -1.88 -0.55 114.58 117.62 2gpq h GLU 105 Ca 0.37 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.77 2gpq h GLU 105 Cb 2.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.45 2gpq h GLU 105 CO 0.72 0.00 0.24 1.57 -1.00 0.00 0.00 179.01 180.54 2gpq h LYS 106 N 0.00 0.00 -0.01 2.33 5.09 -1.97 0.26 116.57 122.27 2gpq h LYS 106 Ca 0.07 0.00 -0.26 0.00 0.09 0.00 0.00 60.65 60.55 2gpq h LYS 106 Cb 0.65 0.00 0.02 0.00 0.10 0.00 0.00 32.23 33.00 2gpq h LYS 106 CO -0.00 0.00 -1.02 -2.95 -2.09 0.00 0.00 179.45 173.39 2gpq h ASN 107 N 0.00 0.91 0.75 7.07 -1.07 -1.40 -3.15 115.58 118.68 2gpq h ASN 107 Ca 0.07 -0.71 -0.04 0.00 0.07 0.00 0.00 56.30 55.69 2gpq h ASN 107 Cb 0.56 -0.28 -0.01 0.00 -2.07 0.00 0.00 38.32 36.53 2gpq h ASN 107 CO -0.00 1.52 -0.18 0.11 0.07 0.00 0.00 177.43 178.94 2gpq h LYS 108 N 0.40 0.00 0.00 4.14 1.57 -1.13 -2.29 116.57 119.26 2gpq h LYS 108 Ca -0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2gpq h LYS 108 Cb 1.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.98 2gpq h LYS 108 CO 0.20 0.18 0.00 -0.09 -0.57 0.00 0.00 179.45 179.17 2gpq h ARG 109 N 0.00 0.00 0.00 3.15 2.43 -1.36 -3.37 114.38 115.23 2gpq h ARG 109 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2gpq h ARG 109 Cb 0.61 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 2gpq h ARG 109 CO 0.02 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.89 2gpq n GLY 110 N 0.76 -0.71 1.48 2.80 0.00 -0.86 -3.86 105.19 104.79 2gpq n GLY 110 Ca 0.04 -1.21 -0.07 0.00 0.00 0.00 0.00 46.02 44.78 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 3.16 3.01 3.56 -0.02 0.00 -0.98 -3.74 105.19 110.18 2gpq n GLY 111 Ca 0.00 -1.60 -0.10 0.00 0.00 0.00 0.00 46.02 44.33 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 -2.45 0.63 0.05 1.61 1.70 -0.32 0.14 118.95 120.30 2gpq s ARG 112 Ca 0.15 0.04 0.06 0.00 -0.47 0.00 0.00 55.73 55.51 2gpq s ARG 112 Cb 0.00 0.29 -0.03 0.00 -0.57 0.00 0.00 34.95 34.64 2gpq s ARG 112 CO 0.11 -0.22 -0.12 -1.58 -1.08 0.00 0.00 175.30 172.40 2gpq s TRP 113 N -1.58 2.71 -0.14 5.89 0.51 -0.87 -0.56 118.94 124.90 2gpq s TRP 113 Ca 0.00 -0.16 -0.04 0.00 -2.12 0.00 0.00 56.10 53.78 2gpq s TRP 113 Cb -0.01 -1.50 -0.03 0.00 -0.81 0.00 0.00 33.47 31.13 2gpq s TRP 113 CO -0.01 0.34 -0.01 -1.17 -0.51 0.00 0.00 176.95 175.59 2gpq s LEU 114 N -1.65 3.43 0.01 2.99 0.20 0.07 -2.34 118.68 121.39 2gpq s LEU 114 Ca 0.17 -0.03 0.05 0.00 0.69 0.00 0.00 54.13 55.01 2gpq s LEU 114 Cb -0.11 -1.82 -0.02 0.00 -0.43 0.00 0.00 46.19 43.81 2gpq s LEU 114 CO 0.08 0.22 -0.16 -0.51 -0.29 0.00 0.00 176.35 175.69 2gpq s ILE 115 N 0.08 1.23 -0.06 6.68 2.07 0.19 -3.02 121.20 128.38 2gpq s ILE 115 Ca 0.01 -0.80 0.04 0.00 -1.41 0.00 0.00 60.65 58.49 2gpq s ILE 115 Cb -0.13 -1.05 0.00 0.00 0.13 0.00 0.00 42.46 41.40 2gpq s ILE 115 CO 0.02 0.24 -0.18 -0.89 -1.91 0.00 0.00 174.94 172.23 2gpq s THR 116 N -0.53 1.50 -0.12 4.00 2.01 -1.26 0.84 115.64 122.08 2gpq s THR 116 Ca 0.05 -0.73 -0.00 0.00 0.31 0.00 0.00 61.69 61.32 2gpq s THR 116 Cb -0.07 -1.30 -0.02 0.00 0.01 0.00 0.00 72.50 71.12 2gpq s THR 116 CO 0.00 0.43 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.49 2gpq s LEU 117 N 0.21 2.85 0.43 4.42 1.43 0.24 -4.94 118.68 123.32 2gpq s LEU 117 Ca -0.09 -0.25 -0.24 0.00 -1.03 0.00 0.00 54.13 52.52 2gpq s LEU 117 Cb -0.14 -1.64 -0.08 0.00 0.03 0.00 0.00 46.19 44.36 2gpq s LEU 117 CO 0.04 0.20 1.12 0.20 0.23 0.00 0.00 176.35 178.13 2gpq s ASN 118 N 0.16 6.45 0.11 2.29 -0.87 -1.26 0.65 114.94 122.47 2gpq s ASN 118 Ca -0.06 2.20 -0.21 0.00 -1.57 0.00 0.00 52.86 53.23 2gpq s ASN 118 Cb -0.15 -2.60 -0.08 0.00 -0.02 0.00 0.00 41.25 38.41 2gpq s ASN 118 CO 0.04 -0.71 1.73 0.11 -2.57 0.00 0.00 177.10 175.70 2gpq h LYS 119 N 2.30 0.06 -0.43 -0.60 1.57 -1.95 -1.43 116.57 116.10 2gpq h LYS 119 Ca -0.49 -0.00 0.13 0.00 -1.87 0.00 0.00 60.65 58.41 2gpq h LYS 119 Cb 1.23 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.51 2gpq h LYS 119 CO 0.61 0.04 0.33 0.37 -0.57 0.00 0.00 179.45 180.23 2gpq h GLN 120 N 0.06 0.00 -0.67 3.15 5.75 -1.99 0.37 115.11 121.79 2gpq h GLN 120 Ca 0.06 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 2gpq h GLN 120 Cb 0.06 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.61 2gpq h GLN 120 CO -0.09 0.00 0.00 1.04 -2.65 0.00 0.00 178.83 177.13 2gpq n GLN 121 N -4.29 3.48 0.01 1.69 1.13 -0.57 -4.44 117.38 114.39 2gpq n GLN 121 Ca 0.07 -2.18 -0.11 0.00 -1.94 0.00 0.00 57.00 52.84 2gpq n GLN 121 Cb 0.53 -1.92 -0.06 0.00 0.11 0.00 0.00 30.24 28.89 2gpq n GLN 121 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 2gpq h ARG 122 N 2.89 0.10 -0.02 -1.09 -0.00 0.08 1.74 114.38 118.10 2gpq h ARG 122 Ca 0.00 -0.01 -0.13 0.00 -0.00 0.00 0.00 59.98 59.84 2gpq h ARG 122 Cb 1.39 -0.02 -0.02 0.00 -0.00 0.00 0.00 29.97 31.32 2gpq h ARG 122 CO 0.28 0.08 -0.61 -0.09 -0.00 0.00 0.00 179.97 179.64 2gpq h ARG 123 N 0.09 0.06 0.02 0.08 9.65 -1.80 -2.41 114.38 120.08 2gpq h ARG 123 Ca 0.03 -0.04 -0.35 0.00 -1.10 0.00 0.00 59.98 58.52 2gpq h ARG 123 Cb 0.00 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.54 2gpq h ARG 123 CO -0.01 0.65 -1.97 0.45 2.80 0.00 0.00 179.97 181.90 2gpq n SER 124 N -3.83 1.95 -0.08 -3.80 2.88 -1.12 -4.46 113.62 105.17 2gpq n SER 124 Ca -0.01 0.29 -0.12 0.00 -1.33 0.00 0.00 58.87 57.70 2gpq n SER 124 Cb 0.61 -0.83 -0.06 0.00 -0.75 0.00 0.00 64.21 63.18 2gpq n SER 124 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2gpq h ASP 125 N -0.69 0.00 -0.36 -3.46 3.58 0.24 -3.20 116.42 112.53 2gpq h ASP 125 Ca -0.51 -0.25 0.06 0.00 0.42 0.00 0.00 57.03 56.75 2gpq h ASP 125 Cb 1.61 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 42.58 2gpq h ASP 125 CO -0.22 1.04 -0.50 0.25 -2.88 0.00 0.00 179.24 176.93 2gpq h LEU 126 N -1.00 -1.66 -1.11 2.28 7.12 -0.73 1.29 115.31 121.50 2gpq h LEU 126 Ca -0.14 0.23 -0.09 0.00 0.13 0.00 0.00 57.88 58.01 2gpq h LEU 126 Cb 0.81 0.69 -0.01 0.00 -0.53 0.00 0.00 40.66 41.62 2gpq h LEU 126 CO -0.08 -0.40 -0.40 -2.24 -0.13 0.00 0.00 178.44 175.18 2gpq h ASP 127 N -0.40 0.09 0.12 1.25 2.03 -1.69 -0.76 116.42 117.05 2gpq h ASP 127 Ca 0.09 -0.03 -0.01 0.00 -0.73 0.00 0.00 57.03 56.36 2gpq h ASP 127 Cb 0.61 -0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.08 2gpq h ASP 127 CO -0.56 0.48 -0.06 -0.09 -1.03 0.00 0.00 179.24 177.98 2gpq h ARG 128 N 0.07 -0.16 -0.91 4.15 9.65 -1.23 -2.68 114.38 123.27 2gpq h ARG 128 Ca 0.01 0.01 0.02 0.00 -1.10 0.00 0.00 59.98 58.92 2gpq h ARG 128 Cb 0.74 0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 29.31 2gpq h ARG 128 CO 0.06 -0.04 0.60 0.35 2.80 0.00 0.00 179.97 183.74 2gpq h PHE 129 N -1.03 1.12 0.28 2.20 3.04 0.15 -1.53 116.94 121.17 2gpq h PHE 129 Ca -0.02 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 2gpq h PHE 129 Cb 0.19 -0.38 0.00 0.00 2.56 0.00 0.00 35.95 38.33 2gpq h PHE 129 CO 0.02 0.68 -0.13 2.35 -2.02 0.00 0.00 178.31 179.21 2gpq h TRP 130 N 1.19 -0.35 -0.97 0.41 2.91 -1.23 -1.18 115.95 116.73 2gpq h TRP 130 Ca 0.35 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.44 2gpq h TRP 130 Cb -0.07 0.12 -0.07 0.00 -0.51 0.00 0.00 29.16 28.62 2gpq h TRP 130 CO -0.00 -0.10 0.63 1.25 -1.03 0.00 0.00 178.44 179.18 2gpq h LEU 131 N -0.55 0.97 -0.83 0.65 6.46 -1.27 -1.09 115.31 119.64 2gpq h LEU 131 Ca -0.04 0.02 -0.07 0.00 -0.12 0.00 0.00 57.88 57.67 2gpq h LEU 131 Cb 0.40 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.12 2gpq h LEU 131 CO 0.06 0.59 0.07 1.05 -0.62 0.00 0.00 178.44 179.59 2gpq h GLU 132 N 1.08 0.94 0.21 1.25 4.11 -1.12 -2.29 114.58 118.76 2gpq h GLU 132 Ca 0.44 -0.24 0.00 0.00 0.07 0.00 0.00 59.36 59.63 2gpq h GLU 132 Cb 0.27 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2gpq h GLU 132 CO -0.19 0.89 -0.20 1.15 0.07 0.00 0.00 179.01 180.73 2gpq h THR 133 N 0.88 0.56 -0.35 -1.06 2.02 0.08 0.86 112.91 115.90 2gpq h THR 133 Ca 0.18 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.43 2gpq h THR 133 Cb 0.42 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2gpq h THR 133 CO 0.01 0.00 0.24 -0.07 0.37 0.00 0.00 175.52 176.08 2gpq h LEU 134 N -0.44 0.14 -0.29 2.58 -0.00 -1.39 0.35 115.31 116.26 2gpq h LEU 134 Ca -0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.79 2gpq h LEU 134 Cb 0.41 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.03 2gpq h LEU 134 CO -0.05 0.09 -0.43 -0.07 -0.00 0.00 0.00 178.44 177.98 2gpq h LEU 135 N 0.16 0.00 -0.64 1.67 -0.00 -0.56 -2.29 115.31 113.65 2gpq h LEU 135 Ca 0.16 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.95 2gpq h LEU 135 Cb 0.43 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.07 2gpq h LEU 135 CO -0.02 0.43 0.04 0.00 -0.00 0.00 0.00 178.44 178.89 2gpq h LEU 137 N 1.01 0.00 0.03 0.00 3.38 -1.46 -3.33 115.31 114.95 2gpq h LEU 137 Ca 0.19 -0.76 -0.06 0.00 0.09 0.00 0.00 57.88 57.33 2gpq h LEU 137 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2gpq h LEU 137 CO 0.02 0.97 -0.28 0.40 0.09 0.00 0.00 178.44 179.64 2gpq h ILE 138 N -1.00 1.67 0.00 1.22 2.04 -1.49 -3.45 117.51 116.50 2gpq h ILE 138 Ca -0.04 -2.38 0.00 0.00 1.00 0.00 0.00 64.86 63.44 2gpq h ILE 138 Cb 0.86 3.27 0.00 0.00 -0.74 0.00 0.00 36.82 40.21 2gpq h ILE 138 CO -0.02 0.62 0.00 0.61 0.00 0.00 0.00 178.15 179.36 2gpq n GLY 139 N 1.62 0.97 0.00 5.37 0.00 0.36 -5.04 105.19 108.48 2gpq n GLY 139 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2gpq n GLY 139 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gpq n GLU 140 N 0.00 0.00 0.00 1.61 -0.58 0.14 -4.91 120.64 116.90 2gpq n GLU 140 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2gpq n GLU 140 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2gpq n GLU 140 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2gpq n SER 141 N 0.00 0.00 0.00 1.62 7.64 -1.26 -2.42 113.62 119.20 2gpq n SER 141 Ca 0.00 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.02 2gpq n SER 141 Cb 0.00 0.00 0.77 0.00 -1.01 0.00 0.00 64.21 63.97 2gpq n SER 141 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2gpq n PHE 142 N 0.00 0.00 -4.79 1.43 3.72 -1.25 -4.95 117.46 111.62 2gpq n PHE 142 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2gpq n PHE 142 Cb 0.00 -0.17 0.00 0.00 -0.94 0.00 0.00 39.48 38.37 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 -1.17 -2.95 0.22 4.37 8.00 -1.01 -3.00 116.55 121.00 2gpq n ASP 143 Ca 0.17 0.00 0.18 0.00 0.71 0.00 0.00 54.79 55.85 2gpq n ASP 143 Cb 0.17 0.00 0.84 0.00 -0.02 0.00 0.00 41.12 42.11 2gpq n ASP 143 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2gpq h ASP 144 N 0.00 0.00 -0.34 -2.24 3.32 -1.94 -0.75 116.42 114.46 2gpq h ASP 144 Ca 0.00 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.15 2gpq h ASP 144 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2gpq h ASP 144 CO 0.00 0.00 0.43 1.88 -1.72 0.00 0.00 179.24 179.83 2gpq h TYR 145 N 0.00 0.00 -0.56 4.55 0.05 -1.92 0.41 116.97 119.50 2gpq h TYR 145 Ca 0.09 0.00 0.16 0.00 0.05 0.00 0.00 58.73 59.03 2gpq h TYR 145 Cb 0.65 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.37 2gpq h TYR 145 CO 0.00 0.00 0.40 1.03 -1.05 0.00 0.00 178.16 178.54 2gpq h SER 146 N 0.00 0.00 -0.35 3.88 0.87 -1.24 0.75 113.55 117.46 2gpq h SER 146 Ca 0.16 0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.80 2gpq h SER 146 Cb 1.01 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.95 2gpq h SER 146 CO -0.00 0.00 0.25 -0.78 -0.53 0.00 0.00 176.83 175.76 2gpq h ASP 147 N 0.00 0.13 1.27 6.23 1.82 -1.15 -0.08 116.42 124.65 2gpq h ASP 147 Ca 0.27 0.00 -0.15 0.00 -0.39 0.00 0.00 57.03 56.75 2gpq h ASP 147 Cb 1.07 -0.03 -0.02 0.00 0.68 0.00 0.00 39.33 41.03 2gpq h ASP 147 CO -0.00 0.08 -0.74 0.44 -1.61 0.00 0.00 179.24 177.42 2gpq h ASP 148 N 0.15 0.00 -2.59 2.28 5.19 -1.04 -3.45 116.42 116.96 2gpq h ASP 148 Ca 0.16 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 56.02 2gpq h ASP 148 Cb 0.45 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.95 2gpq h ASP 148 CO -0.02 0.72 1.14 -0.69 -3.12 0.00 0.00 179.24 177.27 2gpq s VAL 149 N -2.85 3.52 0.14 -1.35 1.01 -0.04 0.13 120.40 120.96 2gpq s VAL 149 Ca 0.03 0.62 -0.14 0.00 0.00 0.00 0.00 61.98 62.48 2gpq s VAL 149 Cb 0.09 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 33.01 2gpq s VAL 149 CO 0.78 -0.13 1.64 0.00 0.00 0.00 0.00 175.10 177.39 2gpq n GLY 151 N -0.58 -0.64 3.22 0.00 0.00 -1.07 -2.48 105.19 103.63 2gpq n GLY 151 Ca 0.00 -0.77 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 2gpq n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gpq s ALA 152 N -1.00 1.33 -0.00 4.61 0.00 0.79 -1.21 121.76 126.28 2gpq s ALA 152 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.62 2gpq s ALA 152 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.14 2gpq s ALA 152 CO 0.00 -0.04 -0.00 0.54 0.00 0.00 0.00 175.76 176.26 2gpq s VAL 153 N -2.79 0.05 -0.19 0.00 0.11 0.48 0.15 120.40 118.21 2gpq s VAL 153 Ca 0.11 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.14 2gpq s VAL 153 Cb -0.01 -0.07 0.06 0.00 -1.53 0.00 0.00 36.38 34.83 2gpq s VAL 153 CO 0.01 0.03 0.02 0.68 -3.33 0.00 0.00 175.10 172.51 2gpq s VAL 154 N 0.16 0.69 -0.18 2.04 -7.23 0.27 0.14 120.40 116.29 2gpq s VAL 154 Ca -0.01 -0.62 0.01 0.00 -1.81 0.00 0.00 61.98 59.54 2gpq s VAL 154 Cb -0.02 -1.13 0.02 0.00 0.56 0.00 0.00 36.38 35.80 2gpq s VAL 154 CO -0.00 -0.15 -0.19 0.54 -0.31 0.00 0.00 175.10 174.99 2gpq s ASN 155 N 1.79 3.24 -0.23 4.85 2.20 0.17 -1.48 114.94 125.47 2gpq s ASN 155 Ca -0.01 -0.62 -0.11 0.00 -0.94 0.00 0.00 52.86 51.17 2gpq s ASN 155 Cb -0.17 -1.50 -0.05 0.00 -2.00 0.00 0.00 41.25 37.53 2gpq s ASN 155 CO -0.08 0.01 0.20 -0.69 -2.94 0.00 0.00 177.10 173.60 2gpq s VAL 156 N 1.25 5.34 0.07 3.54 1.01 -0.98 -0.71 120.40 129.91 2gpq s VAL 156 Ca 0.04 0.28 -0.20 0.00 0.00 0.00 0.00 61.98 62.10 2gpq s VAL 156 Cb -0.13 -3.54 -0.07 0.00 0.00 0.00 0.00 36.38 32.64 2gpq s VAL 156 CO -0.11 0.34 0.58 -0.13 0.00 0.00 0.00 175.10 175.78 2gpq s ARG 157 N 1.02 4.23 0.66 2.72 1.81 0.49 -2.19 118.95 127.69 2gpq s ARG 157 Ca 0.10 0.76 0.27 0.00 -1.72 0.00 0.00 55.73 55.13 2gpq s ARG 157 Cb -0.13 -3.26 1.44 0.00 -0.45 0.00 0.00 34.95 32.55 2gpq s ARG 157 CO 0.04 0.60 1.81 0.00 -0.68 0.00 0.00 175.30 177.07 2gpq h ALA 158 N 4.69 1.49 -0.37 2.13 0.00 -1.95 0.90 119.26 126.16 2gpq h ALA 158 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2gpq h ALA 158 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2gpq h ALA 158 CO 0.64 -0.45 0.00 1.63 0.00 0.00 0.00 179.25 181.07 2gpq n LYS 159 N -2.92 2.33 0.00 0.00 4.01 -1.26 -5.02 118.16 115.30 2gpq n LYS 159 Ca -0.01 -2.10 0.00 0.00 -0.51 0.00 0.00 58.31 55.69 2gpq n LYS 159 Cb 0.48 -1.41 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 1.11 2.63 3.85 0.72 0.00 0.31 -4.77 105.19 109.05 2gpq n GLY 160 Ca 0.16 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 45.14 2gpq n GLY 160 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2gpq s ASP 161 N 0.00 6.77 -0.01 1.61 1.01 0.21 0.18 116.67 126.44 2gpq s ASP 161 Ca 0.00 1.23 -0.01 0.00 0.71 0.00 0.00 52.55 54.47 2gpq s ASP 161 Cb 0.00 -2.35 0.00 0.00 1.01 0.00 0.00 42.92 41.58 2gpq s ASP 161 CO 0.00 -0.16 0.03 -0.75 0.21 0.00 0.00 175.17 174.50 2gpq s LYS 162 N -2.86 0.05 -0.02 8.23 2.20 0.11 0.81 119.74 128.26 2gpq s LYS 162 Ca 0.52 0.02 -0.05 0.00 -0.36 0.00 0.00 55.97 56.10 2gpq s LYS 162 Cb -0.11 0.02 0.00 0.00 -1.51 0.00 0.00 37.83 36.24 2gpq s LYS 162 CO 0.18 -0.01 0.11 0.42 -0.36 0.00 0.00 175.35 175.70 2gpq s ILE 163 N -0.03 0.04 0.04 5.43 1.09 0.25 0.42 121.20 128.43 2gpq s ILE 163 Ca -0.01 -0.34 0.02 0.00 -1.10 0.00 0.00 60.65 59.23 2gpq s ILE 163 Cb -0.01 -0.27 -0.02 0.00 -1.06 0.00 0.00 42.46 41.10 2gpq s ILE 163 CO 0.00 -0.19 -0.08 0.00 -0.10 0.00 0.00 174.94 174.58 2gpq s ALA 164 N -0.60 0.57 -0.00 9.38 0.00 0.37 0.57 121.76 132.06 2gpq s ALA 164 Ca -0.07 -0.70 0.07 0.00 0.00 0.00 0.00 51.96 51.27 2gpq s ALA 164 Cb -0.04 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 2gpq s ALA 164 CO 0.00 0.01 -0.21 0.42 0.00 0.00 0.00 175.76 175.98 2gpq s ILE 165 N -1.19 1.70 -0.16 0.00 1.01 -0.99 0.18 121.20 121.76 2gpq s ILE 165 Ca -0.08 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 59.55 2gpq s ILE 165 Cb -0.09 -1.43 -0.02 0.00 0.01 0.00 0.00 42.46 40.93 2gpq s ILE 165 CO 0.00 0.42 -0.05 0.26 0.00 0.00 0.00 174.94 175.57 2gpq s TRP 166 N -0.57 2.99 0.29 3.97 0.52 -0.35 -2.05 118.94 123.74 2gpq s TRP 166 Ca 0.08 -0.38 0.00 0.00 0.02 0.00 0.00 56.10 55.82 2gpq s TRP 166 Cb -0.08 -1.95 -0.04 0.00 -1.15 0.00 0.00 33.47 30.25 2gpq s TRP 166 CO -0.00 -0.09 0.48 0.99 0.02 0.00 0.00 176.95 178.35 2gpq s THR 167 N 0.44 5.14 -0.03 2.01 2.01 0.36 0.16 115.64 125.72 2gpq s THR 167 Ca -0.05 -0.43 -0.21 0.00 0.31 0.00 0.00 61.69 61.31 2gpq s THR 167 Cb -0.14 -3.81 -0.29 0.00 0.01 0.00 0.00 72.50 68.27 2gpq s THR 167 CO 0.03 -0.40 0.96 0.00 -0.69 0.00 0.00 174.62 174.52 2gpq h THR 168 N 1.09 1.50 -3.38 -0.82 1.03 0.84 -2.60 112.91 110.56 2gpq h THR 168 Ca -0.49 -2.38 -0.63 0.00 -0.01 0.00 0.00 66.41 62.89 2gpq h THR 168 Cb 1.21 3.02 -0.40 0.00 -1.07 0.00 0.00 68.15 70.91 2gpq h THR 168 CO 0.64 0.68 -0.72 -1.61 -0.01 0.00 0.00 175.52 174.50 2gpq s GLU 169 N -2.67 1.35 0.60 0.00 2.02 -1.26 -3.37 118.70 115.36 2gpq s GLU 169 Ca -0.14 -1.84 0.30 0.00 0.02 0.00 0.00 54.97 53.31 2gpq s GLU 169 Cb 0.02 -2.77 1.62 0.00 0.10 0.00 0.00 34.13 33.09 2gpq s GLU 169 CO 0.82 -1.02 1.90 0.00 0.02 0.00 0.00 175.26 176.98 2gpq h GLU 171 N 0.00 0.00 -5.01 0.00 4.11 -1.91 -3.40 114.58 108.37 2gpq h GLU 171 Ca 0.00 0.00 -0.49 0.00 0.07 0.00 0.00 59.36 58.94 2gpq h GLU 171 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2gpq h GLU 171 CO 0.00 0.14 1.68 0.09 0.07 0.00 0.00 179.01 180.99 2gpq n ASN 172 N -3.07 2.85 -0.10 3.06 3.02 0.31 -4.71 115.26 116.62 2gpq n ASN 172 Ca 0.02 -2.69 0.26 0.00 -0.03 0.00 0.00 54.58 52.14 2gpq n ASN 172 Cb 0.60 -1.44 0.61 0.00 -0.61 0.00 0.00 39.78 38.94 2gpq n ASN 172 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2gpq h ARG 173 N 8.79 0.00 -0.04 3.52 -0.00 -1.82 0.13 114.38 124.96 2gpq h ARG 173 Ca 0.32 0.00 0.03 0.00 -0.50 0.00 0.00 59.98 59.83 2gpq h ARG 173 Cb 0.81 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.75 2gpq h ARG 173 CO 1.58 0.00 -0.12 0.93 0.00 0.00 0.00 179.97 182.36 2gpq h GLU 174 N 0.00 -0.18 0.06 0.04 4.39 -1.94 0.41 114.58 117.36 2gpq h GLU 174 Ca 0.38 0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.93 2gpq h GLU 174 Cb 2.11 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 30.79 2gpq h GLU 174 CO -0.00 -0.12 -0.81 0.00 -1.16 0.00 0.00 179.01 176.92 2gpq h ALA 175 N 0.81 0.09 0.01 3.43 0.00 -1.14 -2.17 119.26 120.29 2gpq h ALA 175 Ca 0.06 -0.85 0.03 0.00 0.00 0.00 0.00 54.91 54.15 2gpq h ALA 175 Cb 0.27 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2gpq h ALA 175 CO -0.15 0.45 -0.32 0.28 0.00 0.00 0.00 179.25 179.51 2gpq h VAL 176 N -0.70 0.31 0.15 0.00 2.07 -1.21 0.15 116.25 117.02 2gpq h VAL 176 Ca -0.19 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 2gpq h VAL 176 Cb 1.39 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 2gpq h VAL 176 CO -0.00 0.00 -0.07 0.74 0.02 0.00 0.00 177.57 178.25 2gpq h THR 177 N -0.47 0.93 0.54 2.57 2.02 -0.34 -1.03 112.91 117.13 2gpq h THR 177 Ca 0.06 -1.11 -0.03 0.00 0.77 0.00 0.00 66.41 66.10 2gpq h THR 177 Cb 0.55 1.54 0.01 0.00 -1.74 0.00 0.00 68.15 68.51 2gpq h THR 177 CO -0.26 0.23 -0.26 0.45 0.37 0.00 0.00 175.52 176.06 2gpq h HIS 178 N -0.80 -0.67 -0.34 3.16 -0.00 -1.36 1.52 115.15 116.66 2gpq h HIS 178 Ca -0.02 -0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.30 2gpq h HIS 178 Cb 0.53 0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 28.15 2gpq h HIS 178 CO 0.09 -0.42 0.08 -0.84 -0.00 0.00 0.00 177.93 176.84 2gpq h ILE 179 N -0.87 1.16 -0.02 2.45 -0.00 -0.83 1.05 117.51 120.45 2gpq h ILE 179 Ca -0.07 -0.57 -0.04 0.00 -0.00 0.00 0.00 64.86 64.18 2gpq h ILE 179 Cb 0.55 0.82 0.00 0.00 -0.00 0.00 0.00 36.82 38.20 2gpq h ILE 179 CO 0.12 0.20 -0.14 1.23 -0.00 0.00 0.00 178.15 179.57 2gpq h GLY 180 N 0.71 0.15 0.87 0.16 0.00 -0.84 -2.20 103.07 101.93 2gpq h GLY 180 Ca 0.11 -0.22 -0.21 0.00 0.00 0.00 0.00 47.33 47.02 2gpq h GLY 180 CO -0.00 0.19 -0.85 -0.09 0.00 0.00 0.00 176.54 175.79 2gpq h ARG 181 N -0.48 0.43 -0.76 4.80 2.43 0.23 -2.68 114.38 118.35 2gpq h ARG 181 Ca -0.01 -0.58 -0.06 0.00 -0.81 0.00 0.00 59.98 58.53 2gpq h ARG 181 Cb 0.81 0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.52 2gpq h ARG 181 CO 0.03 1.23 0.26 0.28 -1.51 0.00 0.00 179.97 180.26 2gpq h VAL 182 N -0.09 1.26 -0.19 0.20 2.07 0.11 1.45 116.25 121.06 2gpq h VAL 182 Ca -0.13 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 2gpq h VAL 182 Cb 1.59 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 2gpq h VAL 182 CO 0.16 0.35 0.00 0.22 0.02 0.00 0.00 177.57 178.33 2gpq h TYR 183 N 1.13 0.37 0.02 1.57 3.20 -1.48 0.97 116.97 122.74 2gpq h TYR 183 Ca 0.25 -0.06 -0.25 0.00 3.14 0.00 0.00 58.73 61.81 2gpq h TYR 183 Cb 0.28 -0.10 0.01 0.00 1.54 0.00 0.00 36.73 38.46 2gpq h TYR 183 CO 0.02 0.53 -1.02 1.57 -1.64 0.00 0.00 178.16 177.63 2gpq h LYS 184 N 0.10 0.52 0.04 1.82 5.09 -1.32 -2.09 116.57 120.73 2gpq h LYS 184 Ca 0.06 -0.58 -0.00 0.00 0.09 0.00 0.00 60.65 60.21 2gpq h LYS 184 Cb 0.38 0.17 0.00 0.00 0.10 0.00 0.00 32.23 32.88 2gpq h LYS 184 CO 0.01 1.21 -0.02 1.49 -2.09 0.00 0.00 179.45 180.05 2gpq h GLU 185 N 0.28 -0.06 -0.44 0.07 4.57 0.20 0.46 114.58 119.66 2gpq h GLU 185 Ca -0.11 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.06 2gpq h GLU 185 Cb 1.67 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 30.25 2gpq h GLU 185 CO 0.19 0.57 0.23 -0.09 -1.18 0.00 0.00 179.01 178.72 2gpq h ARG 186 N -0.78 0.61 0.00 1.92 9.65 0.86 -0.85 114.38 125.80 2gpq h ARG 186 Ca -0.01 -0.06 -0.10 0.00 -1.10 0.00 0.00 59.98 58.71 2gpq h ARG 186 Cb 0.65 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 29.09 2gpq h ARG 186 CO 0.01 0.46 -0.49 1.25 2.80 0.00 0.00 179.97 184.00 2gpq h LEU 187 N 0.62 0.00 -0.45 3.80 6.46 -1.41 -3.48 115.31 120.85 2gpq h LEU 187 Ca 0.16 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 2gpq h LEU 187 Cb 0.04 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.97 2gpq h LEU 187 CO -0.02 0.49 0.00 0.61 -0.62 0.00 0.00 178.44 178.90 2gpq n GLY 188 N 0.34 0.97 0.13 3.75 0.00 -0.32 -5.03 105.19 105.02 2gpq n GLY 188 Ca -0.00 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 2gpq n GLY 188 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2gpq h LEU 189 N 0.00 0.44 -0.90 0.99 3.38 -0.35 -3.38 115.31 115.50 2gpq h LEU 189 Ca 0.00 -0.88 0.24 0.00 0.09 0.00 0.00 57.88 57.33 2gpq h LEU 189 Cb 0.44 -0.14 -0.16 0.00 0.09 0.00 0.00 40.66 40.89 2gpq h LEU 189 CO 0.00 1.62 0.10 -0.65 0.09 0.00 0.00 178.44 179.60 2gpq h PRO 190 N -0.24 0.09 -0.84 1.13 0.11 -1.66 1.02 132.00 131.61 2gpq h PRO 190 Ca -0.29 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2gpq h PRO 190 Cb 1.81 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.90 2gpq h PRO 190 CO 0.10 0.06 0.00 -0.35 -0.21 0.00 0.00 178.00 177.60 2gpq n PRO 191 N -5.37 0.95 0.00 1.05 -0.04 -1.26 -4.50 135.00 125.83 2gpq n PRO 191 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.67 2gpq n PRO 191 Cb 0.68 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 2gpq n PRO 191 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2gpq n LYS 192 N -0.04 0.00 -4.27 0.54 2.85 0.15 -5.09 118.16 112.31 2gpq n LYS 192 Ca 0.00 0.00 -0.35 0.00 -1.05 0.00 0.00 58.31 56.91 2gpq n LYS 192 Cb 0.21 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 34.50 2gpq n LYS 192 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2gpq s ILE 193 N -0.62 4.55 -0.33 0.58 -1.09 0.31 -5.09 121.20 119.50 2gpq s ILE 193 Ca 0.00 -0.15 -0.11 0.00 -2.23 0.00 0.00 60.65 58.15 2gpq s ILE 193 Cb 0.00 -2.94 -0.01 0.00 -1.58 0.00 0.00 42.46 37.94 2gpq s ILE 193 CO 0.00 0.60 0.20 0.68 -1.23 0.00 0.00 174.94 175.19 2gpq s VAL 194 N -0.83 4.92 -0.17 2.92 -7.23 -1.26 -3.08 120.40 115.67 2gpq s VAL 194 Ca 0.13 -0.39 -0.29 0.00 -1.81 0.00 0.00 61.98 59.61 2gpq s VAL 194 Cb -0.12 -3.55 -0.02 0.00 0.56 0.00 0.00 36.38 33.26 2gpq s VAL 194 CO 0.03 -0.01 1.35 0.27 -0.31 0.00 0.00 175.10 176.42 2gpq s ILE 195 N 1.66 4.12 0.35 -0.62 -4.36 -1.26 -4.45 121.20 116.64 2gpq s ILE 195 Ca 0.05 1.33 -0.25 0.00 -0.26 0.00 0.00 60.65 61.52 2gpq s ILE 195 Cb -0.17 -3.92 -0.10 0.00 1.25 0.00 0.00 42.46 39.52 2gpq s ILE 195 CO 0.08 -0.19 0.98 -0.83 0.24 0.00 0.00 174.94 175.22 2gpq s GLY 196 N 2.45 2.74 -0.25 6.27 0.00 -1.17 -3.53 107.32 113.85 2gpq s GLY 196 Ca 0.59 0.56 -0.10 0.00 0.00 0.00 0.00 44.72 45.77 2gpq s GLY 196 CO 0.19 0.99 0.14 -0.19 0.00 0.00 0.00 173.10 174.23 2gpq s TYR 197 N -1.68 3.24 -0.26 1.90 1.51 0.24 -0.75 117.35 121.55 2gpq s TYR 197 Ca 0.53 0.07 0.03 0.00 -1.01 0.00 0.00 57.07 56.69 2gpq s TYR 197 Cb -0.19 -2.27 0.06 0.00 -0.11 0.00 0.00 41.96 39.45 2gpq s TYR 197 CO 0.24 -0.05 -0.09 -1.14 -1.11 0.00 0.00 175.55 173.39 2gpq s GLN 198 N 1.26 2.09 -0.30 -0.62 -0.44 0.28 -2.47 119.66 119.46 2gpq s GLN 198 Ca 0.07 -1.30 -0.02 0.00 -2.50 0.00 0.00 55.36 51.61 2gpq s GLN 198 Cb -0.14 -2.84 0.05 0.00 -1.64 0.00 0.00 33.01 28.44 2gpq s GLN 198 CO 0.06 -0.59 0.00 0.45 0.50 0.00 0.00 175.29 175.71 2gpq s SER 199 N 1.15 4.89 0.35 6.67 0.15 -1.26 -1.17 113.70 124.47 2gpq s SER 199 Ca -0.08 -1.29 0.27 0.00 0.70 0.00 0.00 55.95 55.55 2gpq s SER 199 Cb -0.20 -1.71 0.92 0.00 -1.71 0.00 0.00 66.02 63.32 2gpq s SER 199 CO -0.05 -0.26 1.78 -0.74 1.20 0.00 0.00 173.24 175.16 2gpq h HIS 200 N 7.99 0.00 -0.97 3.44 2.76 -1.76 -3.25 115.15 123.36 2gpq h HIS 200 Ca -0.21 0.00 0.21 0.00 -2.20 0.00 0.00 60.37 58.17 2gpq h HIS 200 Cb 1.06 0.00 -0.11 0.00 1.55 0.00 0.00 27.41 29.91 2gpq h HIS 200 CO 0.61 0.00 0.55 0.00 -1.30 0.00 0.00 177.93 177.79 2gpq h ALA 201 N 2.22 1.63 0.00 5.26 0.00 -1.67 0.32 119.26 127.02 2gpq h ALA 201 Ca 0.00 0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 2gpq h ALA 201 Cb 0.61 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2gpq h ALA 201 CO 0.00 -0.18 -0.84 0.38 0.00 0.00 0.00 179.25 178.61 2gpq h ASP 202 N 0.62 0.15 1.15 0.00 3.04 -1.83 -3.14 116.42 116.41 2gpq h ASP 202 Ca 0.59 -0.12 -0.05 0.00 -3.24 0.00 0.00 57.03 54.20 2gpq h ASP 202 Cb 1.01 -0.04 -0.01 0.00 -1.04 0.00 0.00 39.33 39.25 2gpq h ASP 202 CO -0.44 0.92 -0.25 0.74 -2.04 0.00 0.00 179.24 178.17 2gpq h THR 203 N 0.06 0.54 0.01 1.15 2.02 -0.79 -3.08 112.91 112.83 2gpq h THR 203 Ca -0.03 -1.31 -0.00 0.00 0.77 0.00 0.00 66.41 65.84 2gpq h THR 203 Cb 1.47 1.91 -0.00 0.00 -1.74 0.00 0.00 68.15 69.79 2gpq h THR 203 CO 0.12 0.25 -0.02 0.00 0.37 0.00 0.00 175.52 176.24 2gpq h ALA 204 N 1.75 -0.73 -2.67 6.16 0.00 -0.48 -3.37 119.26 119.92 2gpq h ALA 204 Ca -0.00 -0.01 -0.61 0.00 0.00 0.00 0.00 54.91 54.29 2gpq h ALA 204 Cb 0.89 0.30 -0.41 0.00 0.00 0.00 0.00 17.79 18.58 2gpq h ALA 204 CO 0.03 -0.73 -0.67 0.25 0.00 0.00 0.00 179.25 178.14 2gpq n THR 205 N -2.40 1.32 -1.45 0.00 -2.24 -1.25 -5.07 114.28 103.19 2gpq n THR 205 Ca -0.00 -4.72 0.18 0.00 -2.27 0.00 0.00 64.05 57.23 2gpq n THR 205 Cb 0.02 -2.08 -0.09 0.00 -2.10 0.00 0.00 70.33 66.08 2gpq n THR 205 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2gpq n LYS 206 N 1.73 -3.27 -0.14 -0.78 5.02 -1.21 -4.87 118.16 114.65 2gpq n LYS 206 Ca 0.24 2.63 -0.29 0.00 -2.02 0.00 0.00 58.31 58.87 2gpq n LYS 206 Cb 0.40 -3.85 -0.10 0.00 -0.02 0.00 0.00 35.03 31.45 2gpq n LYS 206 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2gpq n SER 207 N -4.36 1.95 0.00 4.39 2.88 -1.17 -4.49 113.62 112.83 2gpq n SER 207 Ca -0.08 0.32 0.00 0.00 -1.33 0.00 0.00 58.87 57.78 2gpq n SER 207 Cb 0.68 -0.81 0.00 0.00 -0.75 0.00 0.00 64.21 63.33 2gpq n SER 207 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2gpq n GLY 208 N 1.33 0.32 3.23 0.46 0.00 -1.26 -4.14 105.19 105.13 2gpq n GLY 208 Ca -0.52 0.72 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2gpq n GLY 208 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gpq s SER 209 N -4.00 6.15 -0.67 1.61 1.04 -1.26 -5.01 113.70 111.55 2gpq s SER 209 Ca 0.00 -2.83 -0.26 0.00 0.48 0.00 0.00 55.95 53.35 2gpq s SER 209 Cb 0.00 -2.06 -0.12 0.00 0.10 0.00 0.00 66.02 63.94 2gpq s SER 209 CO 0.00 -0.47 2.42 0.35 0.98 0.00 0.00 173.24 176.52 2gpq n THR 210 N 3.67 -0.04 0.20 2.02 -2.24 -1.26 -4.82 114.28 111.81 2gpq n THR 210 Ca 0.12 -0.62 -0.08 0.00 -2.27 0.00 0.00 64.05 61.20 2gpq n THR 210 Cb 0.43 -2.25 -0.04 0.00 -2.10 0.00 0.00 70.33 66.37 2gpq n THR 210 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2gpq h THR 211 N 7.69 0.00 -0.02 4.28 2.02 -1.95 -3.45 112.91 121.48 2gpq h THR 211 Ca -0.10 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 2gpq h THR 211 Cb 1.13 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.40 2gpq h THR 211 CO 1.10 0.00 -0.04 2.29 0.37 0.00 0.00 175.52 179.24 2gpq n LYS 212 N -3.37 0.09 -3.45 6.66 2.85 -1.26 -5.14 118.16 114.54 2gpq n LYS 212 Ca -0.06 -0.65 -0.02 0.00 -1.05 0.00 0.00 58.31 56.52 2gpq n LYS 212 Cb 0.20 -0.08 -0.05 0.00 -0.65 0.00 0.00 35.03 34.45 2gpq n LYS 212 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2gpq s ASN 213 N 0.04 -0.84 0.00 -5.58 0.01 -1.26 -4.99 114.94 102.33 2gpq s ASN 213 Ca 0.25 1.03 0.00 0.00 -0.71 0.00 0.00 52.86 53.44 2gpq s ASN 213 Cb 0.19 1.89 0.00 0.00 0.41 0.00 0.00 41.25 43.74 2gpq s ASN 213 CO -0.08 -0.25 0.00 -1.14 -1.51 0.00 0.00 177.10 174.12 2gpq n ARG 214 N 5.42 0.00 -3.49 -0.60 3.00 -1.03 -4.78 116.66 115.18 2gpq n ARG 214 Ca -0.07 0.00 -0.12 0.00 -0.00 0.00 0.00 57.85 57.66 2gpq n ARG 214 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.92 2gpq n ARG 214 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 2gpq s PHE 215 N 0.00 -0.50 0.22 -0.14 -0.12 -1.22 -4.99 117.98 111.23 2gpq s PHE 215 Ca 0.00 0.54 0.11 0.00 -0.05 0.00 0.00 56.93 57.53 2gpq s PHE 215 Cb 0.00 0.50 -0.05 0.00 -0.63 0.00 0.00 43.02 42.85 2gpq s PHE 215 CO 0.00 -0.64 -0.20 0.14 -0.05 0.00 0.00 175.22 174.47 2gpq s VAL 216 N -2.59 2.55 -1.79 -2.49 -7.23 -1.26 -0.59 120.40 107.00 2gpq s VAL 216 Ca -0.01 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.06 2gpq s VAL 216 Cb -0.01 -2.27 0.00 0.00 0.56 0.00 0.00 36.38 34.66 2gpq s VAL 216 CO -0.04 -0.22 0.45 0.52 -0.31 0.00 0.00 175.10 175.50