#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sbp s ASP 2 N 0.00 5.64 0.02 4.39 1.11 -1.26 -1.02 116.67 125.55 1sbp s ASP 2 Ca 0.00 0.03 0.07 0.00 0.18 0.00 0.00 52.55 52.83 1sbp s ASP 2 Cb 0.00 -1.99 -0.02 0.00 1.07 0.00 0.00 42.92 41.98 1sbp s ASP 2 CO 0.00 0.11 -0.20 -0.63 1.18 0.00 0.00 175.17 175.63 1sbp s ILE 3 N 0.75 1.60 -0.15 0.77 1.01 0.69 -4.97 121.20 120.89 1sbp s ILE 3 Ca 0.04 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.66 1sbp s ILE 3 Cb -0.13 -1.37 0.02 0.00 0.01 0.00 0.00 42.46 40.99 1sbp s ILE 3 CO 0.02 0.29 -0.19 -1.58 0.00 0.00 0.00 174.94 173.48 1sbp s GLN 4 N -0.89 2.78 0.17 2.79 2.00 -1.26 -0.78 119.66 124.48 1sbp s GLN 4 Ca 0.07 -0.76 0.10 0.00 -2.00 0.00 0.00 55.36 52.77 1sbp s GLN 4 Cb -0.08 -2.36 -0.04 0.00 0.80 0.00 0.00 33.01 31.32 1sbp s GLN 4 CO 0.01 -0.13 -0.16 -0.51 -0.50 0.00 0.00 175.29 173.99 1sbp s LEU 5 N 1.14 2.74 -0.11 3.68 1.43 -0.10 -4.99 118.68 122.47 1sbp s LEU 5 Ca -0.00 -0.68 0.03 0.00 -1.03 0.00 0.00 54.13 52.46 1sbp s LEU 5 Cb -0.14 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.61 1sbp s LEU 5 CO -0.08 0.12 -0.22 -0.22 0.23 0.00 0.00 176.35 176.18 1sbp s LEU 6 N -2.67 2.06 -0.28 1.79 2.96 -1.26 -0.98 118.68 120.30 1sbp s LEU 6 Ca 0.22 -0.56 -0.04 0.00 -0.22 0.00 0.00 54.13 53.54 1sbp s LEU 6 Cb -0.09 -1.38 0.02 0.00 0.50 0.00 0.00 46.19 45.24 1sbp s LEU 6 CO 0.13 0.12 0.01 0.21 -1.32 0.00 0.00 176.35 175.50 1sbp s ASN 7 N 0.56 4.78 -0.37 3.68 2.47 -0.23 -1.48 114.94 124.35 1sbp s ASN 7 Ca -0.14 -0.87 -0.20 0.00 0.42 0.00 0.00 52.86 52.06 1sbp s ASN 7 Cb -0.17 -1.77 0.01 0.00 -1.45 0.00 0.00 41.25 37.87 1sbp s ASN 7 CO 0.04 -0.18 0.63 -0.69 -3.72 0.00 0.00 177.10 173.18 1sbp s VAL 8 N 1.39 4.89 0.46 -5.21 1.01 -0.92 -1.74 120.40 120.28 1sbp s VAL 8 Ca 0.00 0.50 0.03 0.00 0.00 0.00 0.00 61.98 62.51 1sbp s VAL 8 Cb -0.17 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.10 1sbp s VAL 8 CO -0.01 -0.35 0.05 -0.55 0.00 0.00 0.00 175.10 174.24 1sbp s SER 9 N 1.82 3.58 0.91 3.32 0.15 0.80 -1.14 113.70 123.14 1sbp s SER 9 Ca 0.24 -1.64 -0.09 0.00 0.70 0.00 0.00 55.95 55.16 1sbp s SER 9 Cb -0.14 0.45 0.14 0.00 -1.71 0.00 0.00 66.02 64.75 1sbp s SER 9 CO 0.15 -0.85 0.83 0.00 1.20 0.00 0.00 173.24 174.57 1sbp n TYR 10 N -1.10 -3.79 -0.03 3.44 4.11 -0.93 -3.04 117.16 115.81 1sbp n TYR 10 Ca -0.13 -0.87 -0.14 0.00 -0.00 0.00 0.00 57.90 56.76 1sbp n TYR 10 Cb 0.66 -0.64 -0.10 0.00 -0.00 0.00 0.00 39.34 39.26 1sbp n TYR 10 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.86 177.08 1sbp h ASP 11 N -0.99 0.12 0.06 9.48 3.58 -1.68 -3.32 116.42 123.66 1sbp h ASP 11 Ca -0.27 -0.64 0.00 0.00 0.42 0.00 0.00 57.03 56.54 1sbp h ASP 11 Cb 0.79 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.81 1sbp h ASP 11 CO 0.21 0.73 -0.02 -0.81 -2.88 0.00 0.00 179.24 176.48 1sbp n PRO 12 N -4.68 1.18 -0.13 0.28 -0.04 -1.26 -3.93 135.00 126.41 1sbp n PRO 12 Ca -0.09 -0.37 0.02 0.00 -0.04 0.00 0.00 63.50 63.02 1sbp n PRO 12 Cb 0.37 -1.49 0.08 0.00 -0.04 0.00 0.00 33.50 32.41 1sbp n PRO 12 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1sbp n THR 13 N -0.58 0.38 0.07 0.52 -2.24 -1.26 -4.30 114.28 106.87 1sbp n THR 13 Ca 0.21 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.61 1sbp n THR 13 Cb 0.22 -0.14 -0.06 0.00 -2.10 0.00 0.00 70.33 68.26 1sbp n THR 13 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1sbp h ARG 14 N 0.90 -0.50 -0.81 -0.78 3.08 -1.84 -1.75 114.38 112.68 1sbp h ARG 14 Ca 0.00 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1sbp h ARG 14 Cb 0.48 0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.61 1sbp h ARG 14 CO 0.05 -0.33 0.46 0.93 -1.07 0.00 0.00 179.97 180.01 1sbp h GLU 15 N -0.52 1.11 -0.05 0.04 3.07 -1.94 -2.19 114.58 114.10 1sbp h GLU 15 Ca 0.05 -0.12 0.02 0.00 -0.50 0.00 0.00 59.36 58.82 1sbp h GLU 15 Cb 0.59 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 28.25 1sbp h GLU 15 CO -0.27 0.80 -0.08 1.25 -1.40 0.00 0.00 179.01 179.32 1sbp h LEU 16 N 1.12 -0.23 -0.66 1.33 5.85 -1.78 -2.78 115.31 118.15 1sbp h LEU 16 Ca 0.29 0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.92 1sbp h LEU 16 Cb -0.00 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1sbp h LEU 16 CO -0.05 -0.11 -0.61 1.88 -0.34 0.00 0.00 178.44 179.21 1sbp h TYR 17 N -0.11 0.00 -0.36 1.25 0.05 -1.29 0.21 116.97 116.72 1sbp h TYR 17 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.83 1sbp h TYR 17 Cb 0.18 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.90 1sbp h TYR 17 CO -0.17 0.61 0.24 1.49 -1.05 0.00 0.00 178.16 179.28 1sbp h GLU 18 N 0.00 0.48 -0.04 4.88 4.81 -1.18 0.55 114.58 124.08 1sbp h GLU 18 Ca -0.01 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1sbp h GLU 18 Cb 1.16 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.43 1sbp h GLU 18 CO 0.08 0.33 -0.08 1.96 -0.73 0.00 0.00 179.01 180.56 1sbp h GLN 19 N 0.49 0.13 -0.73 1.92 4.20 -1.26 -3.27 115.11 116.59 1sbp h GLN 19 Ca 0.13 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 1sbp h GLN 19 Cb -0.05 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 1sbp h GLN 19 CO -0.03 0.67 0.27 -0.92 -0.67 0.00 0.00 178.83 178.16 1sbp h TYR 20 N -0.40 1.11 -0.67 2.96 3.20 -0.46 -2.69 116.97 120.03 1sbp h TYR 20 Ca 0.00 -0.09 -0.01 0.00 3.14 0.00 0.00 58.73 61.78 1sbp h TYR 20 Cb 0.67 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1sbp h TYR 20 CO 0.12 0.86 0.39 -0.91 -1.64 0.00 0.00 178.16 176.98 1sbp h ASN 21 N 1.06 0.81 -0.65 -2.11 2.35 -0.99 0.16 115.58 116.22 1sbp h ASN 21 Ca 0.24 -0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1sbp h ASN 21 Cb 0.23 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.37 1sbp h ASN 21 CO -0.02 0.64 0.13 0.11 -1.65 0.00 0.00 177.43 176.65 1sbp h LYS 22 N 0.91 1.05 -0.14 0.81 1.57 -1.57 -1.30 116.57 117.91 1sbp h LYS 22 Ca 0.24 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1sbp h LYS 22 Cb -0.01 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 1sbp h LYS 22 CO -0.04 0.96 -0.09 0.00 -0.57 0.00 0.00 179.45 179.71 1sbp h ALA 23 N 1.05 0.20 -0.66 3.86 0.00 -1.08 -2.23 119.26 120.40 1sbp h ALA 23 Ca 0.20 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1sbp h ALA 23 Cb 0.40 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1sbp h ALA 23 CO 0.01 0.02 0.43 0.35 0.00 0.00 0.00 179.25 180.05 1sbp h PHE 24 N -0.05 0.80 -0.79 0.00 3.57 -0.66 -1.59 116.94 118.24 1sbp h PHE 24 Ca 0.03 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.56 1sbp h PHE 24 Cb 0.58 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 39.01 1sbp h PHE 24 CO 0.07 0.49 0.52 0.77 -2.23 0.00 0.00 178.31 177.93 1sbp h SER 25 N 0.86 0.90 -0.64 0.41 0.02 -1.18 0.96 113.55 114.88 1sbp h SER 25 Ca 0.25 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 61.11 1sbp h SER 25 Cb -0.05 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.24 1sbp h SER 25 CO -0.07 0.65 0.14 0.00 -1.14 0.00 0.00 176.83 176.41 1sbp h ALA 26 N 1.29 0.84 -0.32 3.77 0.00 -1.20 -2.24 119.26 121.40 1sbp h ALA 26 Ca 0.29 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1sbp h ALA 26 Cb -0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1sbp h ALA 26 CO -0.07 0.57 -0.01 1.25 0.00 0.00 0.00 179.25 180.99 1sbp h HIS 27 N 0.95 0.63 -0.65 0.00 -0.00 -0.72 -1.99 115.15 113.37 1sbp h HIS 27 Ca 0.20 -0.11 -0.08 0.00 -0.00 0.00 0.00 60.37 60.38 1sbp h HIS 27 Cb 0.38 -0.16 -0.03 0.00 -0.00 0.00 0.00 27.41 27.60 1sbp h HIS 27 CO 0.03 0.71 0.11 2.35 -0.00 0.00 0.00 177.93 181.13 1sbp h TRP 28 N 0.38 1.13 -0.39 5.26 2.91 -0.67 -1.95 115.95 122.62 1sbp h TRP 28 Ca 0.09 -0.15 -0.11 0.00 1.13 0.00 0.00 58.89 59.85 1sbp h TRP 28 Cb 0.46 -0.31 -0.01 0.00 -0.51 0.00 0.00 29.16 28.78 1sbp h TRP 28 CO 0.04 0.95 -0.23 -0.22 -1.03 0.00 0.00 178.44 177.95 1sbp h LYS 29 N 1.00 0.77 -0.57 2.65 3.64 -1.38 -0.40 116.57 122.28 1sbp h LYS 29 Ca 0.20 -0.31 -0.04 0.00 -1.27 0.00 0.00 60.65 59.23 1sbp h LYS 29 Cb 0.42 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 1sbp h LYS 29 CO 0.01 0.92 0.20 0.37 -2.27 0.00 0.00 179.45 178.69 1sbp h GLN 30 N 0.67 0.86 0.00 1.90 4.15 -1.11 -0.53 115.11 121.06 1sbp h GLN 30 Ca 0.09 -0.17 0.00 0.00 0.77 0.00 0.00 58.65 59.34 1sbp h GLN 30 Cb 0.73 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.29 1sbp h GLN 30 CO 0.06 0.76 -0.53 0.93 -1.93 0.00 0.00 178.83 178.12 1sbp h GLU 31 N 0.79 0.00 0.00 1.69 5.08 -1.05 -3.41 114.58 117.68 1sbp h GLU 31 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1sbp h GLU 31 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1sbp h GLU 31 CO -0.01 0.00 -0.41 2.41 -1.00 0.00 0.00 179.01 179.99 1sbp n THR 32 N -2.49 0.00 -0.03 1.13 -1.04 -0.19 -5.01 114.28 106.65 1sbp n THR 32 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1sbp n THR 32 Cb 0.49 -0.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.95 1sbp n THR 32 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1sbp n GLY 33 N 1.24 1.66 3.85 3.41 0.00 -0.21 -5.00 105.19 110.14 1sbp n GLY 33 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1sbp n GLY 33 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sbp s ASP 34 N -3.13 6.37 -0.28 1.61 1.01 -1.26 -4.63 116.67 116.36 1sbp s ASP 34 Ca 0.00 1.55 -0.05 0.00 0.71 0.00 0.00 52.55 54.76 1sbp s ASP 34 Cb 0.00 -2.50 0.01 0.00 1.01 0.00 0.00 42.92 41.44 1sbp s ASP 34 CO 0.00 -0.76 0.04 0.20 0.21 0.00 0.00 175.17 174.86 1sbp s ASN 35 N -3.41 4.90 -0.09 0.27 0.02 -0.19 -3.52 114.94 112.93 1sbp s ASN 35 Ca 0.58 -0.74 0.01 0.00 -1.02 0.00 0.00 52.86 51.70 1sbp s ASN 35 Cb -0.11 -1.82 -0.02 0.00 0.02 0.00 0.00 41.25 39.32 1sbp s ASN 35 CO 0.40 -0.17 -0.12 0.54 0.02 0.00 0.00 177.10 177.76 1sbp s VAL 36 N 1.45 3.19 -0.08 1.60 0.11 -1.26 -0.23 120.40 125.18 1sbp s VAL 36 Ca 0.02 -0.65 0.04 0.00 -2.93 0.00 0.00 61.98 58.46 1sbp s VAL 36 Cb -0.17 -2.30 -0.01 0.00 -1.53 0.00 0.00 36.38 32.37 1sbp s VAL 36 CO 0.01 0.56 -0.20 0.54 -3.33 0.00 0.00 175.10 172.67 1sbp s VAL 37 N -0.23 2.48 -0.15 2.04 0.11 0.04 -4.77 120.40 119.93 1sbp s VAL 37 Ca 0.01 -0.90 0.01 0.00 -2.93 0.00 0.00 61.98 58.17 1sbp s VAL 37 Cb -0.13 -1.96 0.00 0.00 -1.53 0.00 0.00 36.38 32.76 1sbp s VAL 37 CO 0.03 0.56 -0.17 -0.63 -3.33 0.00 0.00 175.10 171.56 1sbp s ILE 38 N -0.04 2.52 0.19 7.04 1.09 -1.26 -0.93 121.20 129.81 1sbp s ILE 38 Ca -0.06 -0.82 -0.05 0.00 -1.10 0.00 0.00 60.65 58.62 1sbp s ILE 38 Cb -0.15 -2.05 -0.06 0.00 -1.06 0.00 0.00 42.46 39.14 1sbp s ILE 38 CO 0.05 0.52 0.44 -1.81 -0.10 0.00 0.00 174.94 174.04 1sbp s ASP 39 N 0.85 6.50 0.08 3.58 1.01 -0.15 -4.97 116.67 123.57 1sbp s ASP 39 Ca -0.05 0.66 0.10 0.00 0.71 0.00 0.00 52.55 53.97 1sbp s ASP 39 Cb -0.15 -2.12 -0.03 0.00 1.01 0.00 0.00 42.92 41.63 1sbp s ASP 39 CO -0.01 -0.02 -0.26 -1.10 0.21 0.00 0.00 175.17 173.98 1sbp s GLN 40 N -2.89 1.64 -0.05 8.23 -1.52 -1.26 -1.06 119.66 122.74 1sbp s GLN 40 Ca 0.43 -1.21 0.02 0.00 -1.95 0.00 0.00 55.36 52.64 1sbp s GLN 40 Cb -0.12 -1.95 0.02 0.00 -0.22 0.00 0.00 33.01 30.74 1sbp s GLN 40 CO 0.25 0.49 -0.07 0.45 -0.25 0.00 0.00 175.29 176.15 1sbp s SER 41 N -1.60 1.25 0.01 5.90 0.15 -0.71 -4.96 113.70 113.74 1sbp s SER 41 Ca 0.13 -0.19 0.04 0.00 0.70 0.00 0.00 55.95 56.63 1sbp s SER 41 Cb -0.10 -0.59 -0.02 0.00 -1.71 0.00 0.00 66.02 63.60 1sbp s SER 41 CO 0.04 -0.02 -0.14 -1.00 1.20 0.00 0.00 173.24 173.32 1sbp s HIS 42 N 0.80 1.21 -0.34 3.44 3.76 -1.26 -0.14 115.29 122.76 1sbp s HIS 42 Ca -0.13 -0.28 0.00 0.00 -0.15 0.00 0.00 55.06 54.50 1sbp s HIS 42 Cb -0.15 -0.75 0.00 0.00 1.11 0.00 0.00 32.58 32.79 1sbp s HIS 42 CO 0.02 0.01 0.00 0.41 -0.85 0.00 0.00 174.74 174.32 1sbp n GLY 43 N 2.35 -1.21 3.71 -2.22 0.00 -1.17 -4.88 105.19 101.77 1sbp n GLY 43 Ca -0.16 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.42 1sbp n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sbp n GLY 44 N -0.06 1.11 0.30 -0.02 0.00 -1.26 -1.74 105.19 103.52 1sbp n GLY 44 Ca 0.00 0.49 0.11 0.00 0.00 0.00 0.00 46.02 46.62 1sbp n GLY 44 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1sbp h SER 45 N 4.72 -0.04 0.25 1.61 0.87 -1.84 -0.95 113.55 118.16 1sbp h SER 45 Ca -0.46 0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.28 1sbp h SER 45 Cb 1.24 0.27 0.00 0.00 -0.44 0.00 0.00 62.40 63.47 1sbp h SER 45 CO 0.79 -0.14 -0.12 1.23 -0.53 0.00 0.00 176.83 178.06 1sbp h GLY 46 N 0.21 -0.35 0.74 5.77 0.00 -1.24 -1.59 103.07 106.61 1sbp h GLY 46 Ca 0.52 0.13 0.05 0.00 0.00 0.00 0.00 47.33 48.03 1sbp h GLY 46 CO -0.64 -0.13 0.42 1.70 0.00 0.00 0.00 176.54 177.89 1sbp h LYS 47 N -0.53 0.76 -0.35 4.80 3.64 -1.20 -2.00 116.57 121.69 1sbp h LYS 47 Ca -0.03 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 1sbp h LYS 47 Cb 0.39 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1sbp h LYS 47 CO 0.06 0.50 0.09 1.96 -2.27 0.00 0.00 179.45 179.79 1sbp h GLN 48 N 0.78 0.56 -0.44 1.90 1.08 -1.08 -1.59 115.11 116.32 1sbp h GLN 48 Ca 0.31 -0.13 0.03 0.00 -1.45 0.00 0.00 58.65 57.41 1sbp h GLN 48 Cb 0.14 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.46 1sbp h GLN 48 CO -0.16 0.60 0.23 0.00 -0.95 0.00 0.00 178.83 178.55 1sbp h ALA 49 N 0.94 0.56 -0.70 3.87 0.00 -1.07 -2.19 119.26 120.67 1sbp h ALA 49 Ca 0.11 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1sbp h ALA 49 Cb 0.28 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1sbp h ALA 49 CO -0.00 -0.11 0.42 1.15 0.00 0.00 0.00 179.25 180.70 1sbp h THR 50 N 0.47 1.03 -0.78 0.00 2.02 -1.21 -1.36 112.91 113.08 1sbp h THR 50 Ca 0.19 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 1sbp h THR 50 Cb 0.08 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 66.62 1sbp h THR 50 CO -0.12 0.14 0.44 0.77 0.37 0.00 0.00 175.52 177.12 1sbp h SER 51 N 0.79 0.95 -0.45 4.18 4.64 -0.76 -1.32 113.55 121.59 1sbp h SER 51 Ca 0.30 -0.07 -0.11 0.00 -0.47 0.00 0.00 61.79 61.44 1sbp h SER 51 Cb 0.11 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 1sbp h SER 51 CO -0.15 0.76 -0.13 0.58 -0.87 0.00 0.00 176.83 177.02 1sbp h VAL 52 N 1.08 1.27 -0.99 0.95 2.07 -0.71 -2.11 116.25 117.81 1sbp h VAL 52 Ca 0.28 -1.26 0.07 0.00 0.82 0.00 0.00 66.70 66.61 1sbp h VAL 52 Cb 0.00 1.16 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 1sbp h VAL 52 CO -0.05 0.43 0.64 0.40 0.02 0.00 0.00 177.57 179.01 1sbp h ILE 53 N 0.71 1.07 -0.51 4.57 2.04 -0.94 -2.61 117.51 121.85 1sbp h ILE 53 Ca 0.11 -0.39 -0.15 0.00 1.00 0.00 0.00 64.86 65.42 1sbp h ILE 53 Cb 0.68 -0.18 -0.09 0.00 -0.74 0.00 0.00 36.82 36.50 1sbp h ILE 53 CO 0.05 0.21 0.19 0.59 0.00 0.00 0.00 178.15 179.19 1sbp n ASN 54 N -4.52 3.88 0.00 1.72 3.02 -0.53 -4.89 115.26 113.93 1sbp n ASN 54 Ca 0.15 -2.82 0.00 0.00 -0.03 0.00 0.00 54.58 51.88 1sbp n ASN 54 Cb 0.20 -0.67 0.00 0.00 -0.61 0.00 0.00 39.78 38.70 1sbp n ASN 54 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1sbp n GLY 55 N -0.03 2.09 3.70 7.41 0.00 -0.98 -5.01 105.19 112.37 1sbp n GLY 55 Ca 0.28 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 1sbp n GLY 55 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sbp s ILE 56 N -2.01 2.89 -1.24 -0.61 -1.09 -0.81 -4.90 121.20 113.42 1sbp s ILE 56 Ca 0.00 0.44 -0.08 0.00 -2.23 0.00 0.00 60.65 58.78 1sbp s ILE 56 Cb 0.00 -3.28 0.19 0.00 -1.58 0.00 0.00 42.46 37.79 1sbp s ILE 56 CO 0.00 0.01 1.80 -0.62 -1.23 0.00 0.00 174.94 174.89 1sbp n GLU 57 N 5.18 3.78 -2.74 2.79 -0.58 -1.26 -4.64 120.64 123.17 1sbp n GLU 57 Ca 0.15 -3.73 -0.42 0.00 -0.42 0.00 0.00 57.16 52.75 1sbp n GLU 57 Cb 0.40 -2.85 -0.03 0.00 -0.57 0.00 0.00 31.44 28.39 1sbp n GLU 57 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1sbp s ALA 58 N -0.21 3.19 0.11 0.62 0.00 -1.26 -4.66 121.76 119.56 1sbp s ALA 58 Ca 0.38 0.52 -0.08 0.00 0.00 0.00 0.00 51.96 52.78 1sbp s ALA 58 Cb 0.09 -3.30 -0.13 0.00 0.00 0.00 0.00 23.12 19.78 1sbp s ALA 58 CO 0.02 -0.17 1.28 -0.44 0.00 0.00 0.00 175.76 176.46 1sbp h ASP 59 N 6.47 0.71 -4.77 0.00 5.19 -1.60 -3.41 116.42 119.01 1sbp h ASP 59 Ca -0.42 -0.54 -0.25 0.00 -0.62 0.00 0.00 57.03 55.20 1sbp h ASP 59 Cb 1.22 -0.22 -0.20 0.00 0.18 0.00 0.00 39.33 40.31 1sbp h ASP 59 CO 0.74 1.33 -0.72 -0.89 -3.12 0.00 0.00 179.24 176.58 1sbp s THR 60 N -3.40 0.52 -0.03 0.35 2.01 -1.13 -0.92 115.64 113.03 1sbp s THR 60 Ca -0.08 -1.23 0.07 0.00 0.31 0.00 0.00 61.69 60.76 1sbp s THR 60 Cb 0.08 -0.79 -0.02 0.00 0.01 0.00 0.00 72.50 71.79 1sbp s THR 60 CO 0.89 -0.50 -0.25 0.68 -0.69 0.00 0.00 174.62 174.75 1sbp s VAL 61 N -1.85 2.02 -0.48 3.82 -7.23 -0.00 -2.18 120.40 114.50 1sbp s VAL 61 Ca -0.06 -1.08 0.03 0.00 -1.81 0.00 0.00 61.98 59.06 1sbp s VAL 61 Cb -0.07 -1.68 0.16 0.00 0.56 0.00 0.00 36.38 35.34 1sbp s VAL 61 CO -0.01 0.57 0.33 0.42 -0.31 0.00 0.00 175.10 176.10 1sbp s THR 62 N -0.44 1.15 0.51 5.32 -4.23 -0.29 -1.46 115.64 116.20 1sbp s THR 62 Ca 0.05 -2.87 0.09 0.00 -1.18 0.00 0.00 61.69 57.78 1sbp s THR 62 Cb -0.11 -1.79 0.05 0.00 1.34 0.00 0.00 72.50 71.99 1sbp s THR 62 CO 0.01 -1.07 0.70 -0.76 -0.54 0.00 0.00 174.62 172.96 1sbp s LEU 63 N -0.07 3.34 0.10 4.79 1.43 -0.49 -2.18 118.68 125.60 1sbp s LEU 63 Ca 0.25 -0.64 0.26 0.00 -1.03 0.00 0.00 54.13 52.97 1sbp s LEU 63 Cb -0.09 -2.10 0.76 0.00 0.03 0.00 0.00 46.19 44.79 1sbp s LEU 63 CO -0.11 -1.10 1.65 0.00 0.23 0.00 0.00 176.35 177.02 1sbp n ALA 64 N -2.09 2.65 -3.50 4.21 0.00 -1.26 -1.77 120.51 118.75 1sbp n ALA 64 Ca 0.12 -0.15 -0.10 0.00 0.00 0.00 0.00 53.44 53.32 1sbp n ALA 64 Cb 0.60 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.69 1sbp n ALA 64 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1sbp s LEU 65 N -3.84 -0.41 0.30 0.00 0.05 -1.26 -3.69 118.68 109.83 1sbp s LEU 65 Ca 0.10 0.09 -0.00 0.00 0.05 0.00 0.00 54.13 54.38 1sbp s LEU 65 Cb 0.15 2.10 0.46 0.00 -2.05 0.00 0.00 46.19 46.86 1sbp s LEU 65 CO 0.63 -0.63 1.88 0.00 -0.55 0.00 0.00 176.35 177.68 1sbp h ALA 66 N 2.13 1.31 -0.83 1.48 0.00 -1.92 -3.07 119.26 118.36 1sbp h ALA 66 Ca -0.23 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 54.66 1sbp h ALA 66 Cb 1.23 -0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.70 1sbp h ALA 66 CO 0.32 0.51 0.43 -0.92 0.00 0.00 0.00 179.25 179.59 1sbp h TYR 67 N 0.83 0.76 -0.70 0.00 3.20 -1.97 -1.28 116.97 117.80 1sbp h TYR 67 Ca 0.20 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.08 1sbp h TYR 67 Cb 0.17 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 1sbp h TYR 67 CO 0.01 0.21 0.35 -0.44 -1.64 0.00 0.00 178.16 176.65 1sbp h ASP 68 N 0.64 0.89 -0.19 -2.11 3.32 -1.93 0.15 116.42 117.20 1sbp h ASP 68 Ca 0.44 -0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.35 1sbp h ASP 68 Cb 0.58 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 1sbp h ASP 68 CO -0.34 0.74 -0.11 0.58 -1.72 0.00 0.00 179.24 178.39 1sbp h VAL 69 N 0.99 1.32 -0.94 -1.35 2.07 -1.51 -3.13 116.25 113.69 1sbp h VAL 69 Ca 0.25 -1.20 0.10 0.00 0.82 0.00 0.00 66.70 66.67 1sbp h VAL 69 Cb 0.07 1.70 -0.08 0.00 -1.52 0.00 0.00 31.29 31.47 1sbp h VAL 69 CO -0.03 0.36 0.58 0.78 0.02 0.00 0.00 177.57 179.28 1sbp h ASN 70 N 0.09 0.87 -0.79 0.57 2.35 -0.65 -1.20 115.58 116.82 1sbp h ASN 70 Ca 0.04 0.04 0.05 0.00 -0.55 0.00 0.00 56.30 55.87 1sbp h ASN 70 Cb 0.61 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.79 1sbp h ASN 70 CO 0.03 0.50 0.52 0.00 -1.65 0.00 0.00 177.43 176.83 1sbp h ALA 71 N 1.49 1.57 -0.07 -0.83 0.00 -0.69 0.27 119.26 120.99 1sbp h ALA 71 Ca 0.45 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 55.10 1sbp h ALA 71 Cb 0.36 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1sbp h ALA 71 CO -0.23 0.33 -0.86 0.82 0.00 0.00 0.00 179.25 179.31 1sbp h ILE 72 N 0.93 1.32 -0.62 0.00 2.04 -1.24 -3.17 117.51 116.77 1sbp h ILE 72 Ca 0.33 -2.16 -0.09 0.00 1.00 0.00 0.00 64.86 63.93 1sbp h ILE 72 Cb 0.12 2.18 -0.02 0.00 -0.74 0.00 0.00 36.82 38.37 1sbp h ILE 72 CO -0.10 0.67 0.02 0.00 0.00 0.00 0.00 178.15 178.73 1sbp h ALA 73 N 0.63 0.83 -0.05 1.87 0.00 -0.21 -2.45 119.26 119.89 1sbp h ALA 73 Ca -0.07 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.55 1sbp h ALA 73 Cb 1.49 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1sbp h ALA 73 CO 0.16 0.66 0.04 1.49 0.00 0.00 0.00 179.25 181.61 1sbp h GLU 74 N 0.99 0.00 -0.07 0.00 4.57 -0.54 -0.22 114.58 119.30 1sbp h GLU 74 Ca 0.18 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 1sbp h GLU 74 Cb 0.54 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 1sbp h GLU 74 CO 0.03 0.00 0.00 0.54 -1.18 0.00 0.00 179.01 178.40 1sbp n ARG 75 N -4.36 1.62 -0.67 1.92 5.12 -1.02 -4.93 116.66 114.34 1sbp n ARG 75 Ca -0.02 -0.92 0.00 0.00 -1.93 0.00 0.00 57.85 54.98 1sbp n ARG 75 Cb 0.14 -1.44 0.00 0.00 -1.16 0.00 0.00 32.46 30.00 1sbp n ARG 75 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1sbp n GLY 76 N 1.13 0.65 0.13 -0.13 0.00 -0.09 -4.97 105.19 101.91 1sbp n GLY 76 Ca 0.18 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1sbp n GLY 76 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1sbp h ARG 77 N 1.76 0.00 -5.55 1.61 3.08 -1.60 -3.46 114.38 110.21 1sbp h ARG 77 Ca 0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.58 1sbp h ARG 77 Cb 0.00 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 29.82 1sbp h ARG 77 CO 0.00 0.00 -0.80 0.42 -1.07 0.00 0.00 179.97 178.52 1sbp s ILE 78 N -3.25 1.27 0.36 2.04 1.01 -1.26 -1.39 121.20 119.99 1sbp s ILE 78 Ca 0.04 -1.20 -0.28 0.00 0.00 0.00 0.00 60.65 59.21 1sbp s ILE 78 Cb 0.09 -1.17 -0.11 0.00 0.01 0.00 0.00 42.46 41.28 1sbp s ILE 78 CO 0.72 -0.05 1.49 -0.67 0.00 0.00 0.00 174.94 176.43 1sbp n ASP 79 N 1.57 3.74 0.19 3.58 -0.08 -1.26 -4.42 116.55 119.87 1sbp n ASP 79 Ca -0.19 1.21 0.09 0.00 -1.51 0.00 0.00 54.79 54.39 1sbp n ASP 79 Cb 0.54 -1.61 0.61 0.00 2.34 0.00 0.00 41.12 43.01 1sbp n ASP 79 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1sbp h LYS 80 N 3.24 0.08 -0.97 -0.67 1.63 -1.98 -2.63 116.57 115.28 1sbp h LYS 80 Ca -0.50 -0.00 -0.54 0.00 -0.85 0.00 0.00 60.65 58.75 1sbp h LYS 80 Cb 1.24 -0.02 -0.30 0.00 -0.60 0.00 0.00 32.23 32.56 1sbp h LYS 80 CO 0.67 0.05 0.66 0.09 -3.45 0.00 0.00 179.45 177.47 1sbp n ASN 81 N -4.51 4.68 0.14 4.20 3.02 -1.26 -4.68 115.26 116.84 1sbp n ASN 81 Ca -0.01 -3.67 0.04 0.00 -0.03 0.00 0.00 54.58 50.92 1sbp n ASN 81 Cb 0.14 -0.86 0.44 0.00 -0.61 0.00 0.00 39.78 38.90 1sbp n ASN 81 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 1sbp h TRP 82 N 1.26 0.20 0.00 3.10 5.08 -1.85 -3.15 115.95 120.59 1sbp h TRP 82 Ca 0.61 -0.02 -0.03 0.00 1.08 0.00 0.00 58.89 60.53 1sbp h TRP 82 Cb 2.30 -0.06 -0.00 0.00 -3.00 0.00 0.00 29.16 28.39 1sbp h TRP 82 CO 1.53 0.29 -0.16 0.97 -1.28 0.00 0.00 178.44 179.79 1sbp h ILE 83 N 0.19 0.76 -0.00 0.12 2.10 -1.88 -1.90 117.51 116.91 1sbp h ILE 83 Ca 0.04 -0.62 0.00 0.00 1.08 0.00 0.00 64.86 65.36 1sbp h ILE 83 Cb 0.28 1.37 0.00 0.00 -1.09 0.00 0.00 36.82 37.38 1sbp h ILE 83 CO 0.01 0.15 -0.11 0.29 -1.08 0.00 0.00 178.15 177.42 1sbp n LYS 84 N -3.84 0.28 0.11 2.19 4.76 -1.19 -3.38 118.16 117.09 1sbp n LYS 84 Ca -0.02 -0.06 0.01 0.00 -2.87 0.00 0.00 58.31 55.36 1sbp n LYS 84 Cb 0.25 -1.50 0.32 0.00 -1.84 0.00 0.00 35.03 32.26 1sbp n LYS 84 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1sbp h ARG 85 N 0.15 0.23 -5.87 1.97 3.08 -1.50 -3.44 114.38 109.00 1sbp h ARG 85 Ca 0.00 -0.08 -0.51 0.00 0.07 0.00 0.00 59.98 59.47 1sbp h ARG 85 Cb 0.42 -0.02 -0.20 0.00 0.08 0.00 0.00 29.97 30.24 1sbp h ARG 85 CO 0.00 0.48 -0.80 -0.51 -1.07 0.00 0.00 179.97 178.07 1sbp s LEU 86 N -8.53 2.35 0.71 3.04 1.43 -1.26 -5.06 118.68 111.36 1sbp s LEU 86 Ca -0.05 -0.74 -0.16 0.00 -1.03 0.00 0.00 54.13 52.15 1sbp s LEU 86 Cb 0.14 -0.77 0.02 0.00 0.03 0.00 0.00 46.19 45.62 1sbp s LEU 86 CO 0.75 -0.02 1.27 -2.84 0.23 0.00 0.00 176.35 175.74 1sbp s PRO 87 N -2.23 2.21 -1.22 1.29 0.02 -1.26 -2.17 135.00 131.64 1sbp s PRO 87 Ca 0.08 1.97 -0.05 0.00 0.02 0.00 0.00 61.00 63.02 1sbp s PRO 87 Cb -0.08 -1.82 0.01 0.00 0.02 0.00 0.00 34.50 32.63 1sbp s PRO 87 CO 0.04 -1.84 1.05 -0.25 -0.33 0.00 0.00 177.00 175.68 1sbp n ASP 88 N -2.41 -4.45 -3.74 2.53 8.00 -1.26 -2.29 116.55 112.93 1sbp n ASP 88 Ca 0.15 -0.54 -0.24 0.00 0.71 0.00 0.00 54.79 54.87 1sbp n ASP 88 Cb 0.49 -4.82 0.04 0.00 -0.02 0.00 0.00 41.12 36.80 1sbp n ASP 88 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1sbp n ASP 89 N -2.87 -2.35 -2.95 -2.24 8.00 -1.24 -2.01 116.55 110.88 1sbp n ASP 89 Ca -0.11 -0.79 -0.21 0.00 0.71 0.00 0.00 54.79 54.39 1sbp n ASP 89 Cb 0.60 -4.10 0.01 0.00 -0.02 0.00 0.00 41.12 37.61 1sbp n ASP 89 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1sbp n SER 90 N -3.00 -5.07 -3.83 -2.24 7.64 -0.92 -4.84 113.62 101.35 1sbp n SER 90 Ca -0.20 -0.21 -0.30 0.00 1.01 0.00 0.00 58.87 59.17 1sbp n SER 90 Cb 0.63 -4.16 -0.14 0.00 -1.01 0.00 0.00 64.21 59.54 1sbp n SER 90 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sbp s ALA 91 N -3.00 2.44 0.20 -0.43 0.00 -0.85 -1.23 121.76 118.89 1sbp s ALA 91 Ca 0.25 -2.55 0.35 0.00 0.00 0.00 0.00 51.96 50.01 1sbp s ALA 91 Cb -0.12 -1.91 1.65 0.00 0.00 0.00 0.00 23.12 22.74 1sbp s ALA 91 CO 0.30 -1.90 2.06 -1.00 0.00 0.00 0.00 175.76 175.23 1sbp h PRO 92 N 7.13 0.00 -3.89 0.00 0.13 -1.81 -3.45 132.00 130.10 1sbp h PRO 92 Ca -0.06 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.97 1sbp h PRO 92 Cb 0.96 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.96 1sbp h PRO 92 CO 0.54 0.00 -0.32 1.52 -0.23 0.00 0.00 178.00 179.50 1sbp s TYR 93 N -3.77 0.41 0.37 1.56 -0.85 -1.26 -4.20 117.35 109.60 1sbp s TYR 93 Ca -0.01 -0.77 0.04 0.00 -0.52 0.00 0.00 57.07 55.81 1sbp s TYR 93 Cb 0.10 -0.06 -0.05 0.00 0.38 0.00 0.00 41.96 42.33 1sbp s TYR 93 CO 0.47 -0.72 0.07 0.95 -1.52 0.00 0.00 175.55 174.79 1sbp s THR 94 N -3.97 1.05 0.14 -3.49 -4.23 -0.65 -4.33 115.64 100.15 1sbp s THR 94 Ca 0.18 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.66 1sbp s THR 94 Cb 0.03 -2.62 0.01 0.00 1.34 0.00 0.00 72.50 71.27 1sbp s THR 94 CO 0.00 0.00 0.24 -0.24 -0.54 0.00 0.00 174.62 174.08 1sbp n SER 95 N -0.94 -0.67 -2.66 3.99 2.88 -0.45 -1.41 113.62 114.36 1sbp n SER 95 Ca -0.05 -1.69 -0.12 0.00 -1.33 0.00 0.00 58.87 55.69 1sbp n SER 95 Cb 0.66 1.18 -0.02 0.00 -0.75 0.00 0.00 64.21 65.29 1sbp n SER 95 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1sbp n THR 96 N -0.22 0.00 -4.35 2.46 5.66 -1.26 -1.10 114.28 115.47 1sbp n THR 96 Ca -0.01 -1.39 -0.34 0.00 -3.05 0.00 0.00 64.05 59.26 1sbp n THR 96 Cb 0.23 0.91 -0.14 0.00 -1.55 0.00 0.00 70.33 69.78 1sbp n THR 96 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1sbp s ILE 97 N -2.67 3.06 0.39 1.09 -1.09 -1.26 -0.80 121.20 119.93 1sbp s ILE 97 Ca 0.23 -0.63 0.04 0.00 -2.23 0.00 0.00 60.65 58.06 1sbp s ILE 97 Cb -0.01 -2.33 -0.02 0.00 -1.58 0.00 0.00 42.46 38.51 1sbp s ILE 97 CO 0.16 0.49 0.16 0.68 -1.23 0.00 0.00 174.94 175.20 1sbp s VAL 98 N 0.90 0.47 0.07 2.92 -7.23 -0.24 -4.78 120.40 112.51 1sbp s VAL 98 Ca -0.02 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.19 1sbp s VAL 98 Cb -0.15 -2.37 -0.04 0.00 0.56 0.00 0.00 36.38 34.39 1sbp s VAL 98 CO -0.00 0.00 -0.03 -0.36 -0.31 0.00 0.00 175.10 174.40 1sbp s PHE 99 N -3.26 2.94 -0.13 2.82 0.08 -0.61 -0.73 117.98 119.09 1sbp s PHE 99 Ca 0.27 -0.04 0.02 0.00 0.12 0.00 0.00 56.93 57.30 1sbp s PHE 99 Cb 0.02 -1.54 -0.00 0.00 -0.57 0.00 0.00 43.02 40.93 1sbp s PHE 99 CO 0.17 0.45 -0.19 -1.17 -0.10 0.00 0.00 175.22 174.38 1sbp s LEU 100 N -2.08 2.33 0.41 -0.37 2.96 -0.22 -1.05 118.68 120.66 1sbp s LEU 100 Ca 0.23 -0.50 0.04 0.00 -0.22 0.00 0.00 54.13 53.69 1sbp s LEU 100 Cb -0.11 -1.50 -0.05 0.00 0.50 0.00 0.00 46.19 45.02 1sbp s LEU 100 CO 0.15 0.13 0.03 0.68 -1.32 0.00 0.00 176.35 176.02 1sbp s VAL 101 N 0.56 1.44 0.40 1.68 -7.23 0.57 -1.49 120.40 116.33 1sbp s VAL 101 Ca -0.11 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 57.88 1sbp s VAL 101 Cb -0.16 -2.68 -0.10 0.00 0.56 0.00 0.00 36.38 34.00 1sbp s VAL 101 CO 0.04 0.00 0.86 -0.13 -0.31 0.00 0.00 175.10 175.56 1sbp s ARG 102 N -3.79 4.08 -0.03 4.82 0.52 -1.26 -1.00 118.95 122.29 1sbp s ARG 102 Ca 0.27 0.89 -0.38 0.00 -0.52 0.00 0.00 55.73 55.98 1sbp s ARG 102 Cb 0.07 -2.28 -0.17 0.00 0.52 0.00 0.00 34.95 33.09 1sbp s ARG 102 CO 0.13 0.01 1.39 1.17 0.02 0.00 0.00 175.30 178.02 1sbp n LYS 103 N -0.72 0.92 -0.25 3.54 3.00 0.03 -0.30 118.16 124.38 1sbp n LYS 103 Ca 0.05 0.33 0.00 0.00 -0.00 0.00 0.00 58.31 58.70 1sbp n LYS 103 Cb 0.54 -1.96 0.00 0.00 0.00 0.00 0.00 35.03 33.61 1sbp n LYS 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1sbp n GLY 104 N 2.77 1.06 4.00 3.14 0.00 -1.26 -4.58 105.19 110.31 1sbp n GLY 104 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 1sbp n GLY 104 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1sbp n ASN 105 N 0.00 -4.39 0.30 1.61 5.15 0.58 -4.84 115.26 113.67 1sbp n ASN 105 Ca 0.00 -1.23 0.16 0.00 -0.60 0.00 0.00 54.58 52.91 1sbp n ASN 105 Cb 0.00 -1.91 0.92 0.00 -0.53 0.00 0.00 39.78 38.26 1sbp n ASN 105 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1sbp h PRO 106 N -2.32 0.00 -0.16 1.20 0.13 -1.81 -1.94 132.00 127.10 1sbp h PRO 106 Ca -0.70 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 1sbp h PRO 106 Cb 1.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.53 1sbp h PRO 106 CO 0.50 0.03 0.00 1.63 -0.23 0.00 0.00 178.00 179.93 1sbp n LYS 107 N -3.59 2.10 -3.67 0.86 4.76 -1.26 -4.98 118.16 112.38 1sbp n LYS 107 Ca -0.03 -1.64 -0.27 0.00 -2.87 0.00 0.00 58.31 53.51 1sbp n LYS 107 Cb 0.13 -1.46 0.04 0.00 -1.84 0.00 0.00 35.03 31.89 1sbp n LYS 107 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1sbp n GLN 108 N 0.91 -2.30 -2.71 1.97 6.02 -0.73 -4.94 117.38 115.60 1sbp n GLN 108 Ca 0.17 0.53 -0.43 0.00 -0.01 0.00 0.00 57.00 57.26 1sbp n GLN 108 Cb 0.49 -4.56 -0.03 0.00 1.02 0.00 0.00 30.24 27.16 1sbp n GLN 108 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1sbp s ILE 109 N -3.56 4.75 0.00 5.09 -1.09 -1.26 -4.90 121.20 120.22 1sbp s ILE 109 Ca 0.32 1.95 0.00 0.00 -2.23 0.00 0.00 60.65 60.69 1sbp s ILE 109 Cb -0.10 -4.28 0.00 0.00 -1.58 0.00 0.00 42.46 36.50 1sbp s ILE 109 CO 0.84 -0.09 0.00 1.41 -1.23 0.00 0.00 174.94 175.87 1sbp n HIS 110 N 5.79 0.00 -3.91 3.97 8.25 -1.26 -4.98 115.22 123.07 1sbp n HIS 110 Ca 0.10 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.45 1sbp n HIS 110 Cb 0.47 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.58 1sbp n HIS 110 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1sbp s ASP 111 N -2.57 0.25 0.28 0.41 2.15 -1.26 -4.62 116.67 111.30 1sbp s ASP 111 Ca 0.00 -1.18 0.01 0.00 0.43 0.00 0.00 52.55 51.81 1sbp s ASP 111 Cb 0.00 0.76 0.63 0.00 -0.30 0.00 0.00 42.92 44.01 1sbp s ASP 111 CO 0.00 -1.50 1.71 -0.50 -0.17 0.00 0.00 175.17 174.72 1sbp h TRP 112 N 2.05 0.62 -0.07 -5.34 4.06 -1.97 -0.53 115.95 114.77 1sbp h TRP 112 Ca -0.29 0.04 0.02 0.00 2.06 0.00 0.00 58.89 60.72 1sbp h TRP 112 Cb 1.25 -0.14 -0.00 0.00 -1.00 0.00 0.00 29.16 29.26 1sbp h TRP 112 CO 1.24 0.00 0.07 -2.95 -3.56 0.00 0.00 178.44 173.25 1sbp h ASN 113 N 0.43 0.00 1.02 -3.49 -1.07 -2.00 -2.04 115.58 108.43 1sbp h ASN 113 Ca 0.51 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.85 1sbp h ASN 113 Cb 0.90 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.14 1sbp h ASN 113 CO -0.48 0.00 -0.15 0.44 0.07 0.00 0.00 177.43 177.31 1sbp h ASP 114 N 0.00 0.00 0.79 6.14 3.32 -1.48 -3.18 116.42 122.00 1sbp h ASP 114 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1sbp h ASP 114 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1sbp h ASP 114 CO -0.00 0.15 0.00 -0.07 -1.72 0.00 0.00 179.24 177.60 1sbp h LEU 115 N 0.00 0.00 -1.30 1.55 3.38 -1.48 -3.05 115.31 114.41 1sbp h LEU 115 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1sbp h LEU 115 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1sbp h LEU 115 CO 0.02 0.00 -0.09 2.30 0.09 0.00 0.00 178.44 180.76 1sbp n ILE 116 N -2.81 0.00 -1.93 1.22 -5.35 -1.20 -4.81 119.36 104.48 1sbp n ILE 116 Ca 0.01 -0.34 -0.38 0.00 -0.27 0.00 0.00 62.75 61.76 1sbp n ILE 116 Cb 0.25 0.98 0.02 0.00 -1.74 0.00 0.00 39.64 39.14 1sbp n ILE 116 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1sbp s LYS 117 N -2.11 3.46 0.44 6.28 1.02 -1.15 -4.89 119.74 122.79 1sbp s LYS 117 Ca 0.30 2.15 -0.26 0.00 0.02 0.00 0.00 55.97 58.18 1sbp s LYS 117 Cb 0.20 -2.41 -0.09 0.00 -0.52 0.00 0.00 37.83 35.01 1sbp s LYS 117 CO 0.37 -0.90 1.43 -2.14 -0.92 0.00 0.00 175.35 173.19 1sbp s PRO 118 N -2.71 3.74 0.00 -1.68 0.02 -1.26 -2.54 135.00 130.56 1sbp s PRO 118 Ca 0.66 2.43 0.00 0.00 0.02 0.00 0.00 61.00 64.11 1sbp s PRO 118 Cb -0.38 -2.69 0.00 0.00 0.02 0.00 0.00 34.50 31.45 1sbp s PRO 118 CO 0.46 -0.78 0.00 0.41 -0.33 0.00 0.00 177.00 176.76 1sbp n GLY 119 N 0.57 1.58 3.72 0.52 0.00 -1.26 -5.02 105.19 105.29 1sbp n GLY 119 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1sbp n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sbp s VAL 120 N -3.05 5.07 -0.27 1.61 1.01 -1.05 -5.03 120.40 118.68 1sbp s VAL 120 Ca 0.00 1.30 -0.11 0.00 0.00 0.00 0.00 61.98 63.17 1sbp s VAL 120 Cb 0.00 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 1sbp s VAL 120 CO 0.00 0.29 0.20 -0.55 0.00 0.00 0.00 175.10 175.04 1sbp s SER 121 N 0.64 6.06 -0.02 3.32 0.15 -1.26 -4.78 113.70 117.81 1sbp s SER 121 Ca 0.34 0.04 0.01 0.00 0.70 0.00 0.00 55.95 57.04 1sbp s SER 121 Cb -0.17 -2.12 -0.03 0.00 -1.71 0.00 0.00 66.02 61.98 1sbp s SER 121 CO 0.16 -0.03 -0.01 -0.69 1.20 0.00 0.00 173.24 173.87 1sbp s VAL 122 N 1.61 4.11 -0.18 4.45 1.01 -0.37 0.13 120.40 131.17 1sbp s VAL 122 Ca 0.08 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1sbp s VAL 122 Cb -0.15 -2.80 0.01 0.00 0.00 0.00 0.00 36.38 33.43 1sbp s VAL 122 CO 0.09 0.44 -0.16 -0.63 0.00 0.00 0.00 175.10 174.84 1sbp s ILE 123 N -1.02 2.47 -0.07 2.22 -1.09 0.40 -0.75 121.20 123.35 1sbp s ILE 123 Ca 0.18 -0.81 -0.19 0.00 -2.23 0.00 0.00 60.65 57.59 1sbp s ILE 123 Cb -0.11 -2.05 0.04 0.00 -1.58 0.00 0.00 42.46 38.75 1sbp s ILE 123 CO 0.08 0.51 0.45 0.28 -1.23 0.00 0.00 174.94 175.03 1sbp s THR 124 N 1.13 0.03 1.04 2.92 -1.32 -1.24 -1.43 115.64 116.77 1sbp s THR 124 Ca 0.01 -0.21 -0.17 0.00 -1.21 0.00 0.00 61.69 60.11 1sbp s THR 124 Cb -0.14 -0.72 0.22 0.00 -1.51 0.00 0.00 72.50 70.34 1sbp s THR 124 CO -0.06 -0.12 1.22 -2.16 -2.21 0.00 0.00 174.62 171.30 1sbp s PRO 125 N -0.80 0.06 -0.30 7.08 0.04 -1.26 -4.01 135.00 135.81 1sbp s PRO 125 Ca -0.09 -0.20 -0.26 0.00 0.04 0.00 0.00 61.00 60.50 1sbp s PRO 125 Cb -0.03 -1.76 0.01 0.00 0.04 0.00 0.00 34.50 32.76 1sbp s PRO 125 CO 0.05 -2.84 0.91 1.21 0.04 0.00 0.00 177.00 176.37 1sbp s ASN 126 N -4.43 6.81 0.50 6.66 3.84 0.47 -4.68 114.94 124.11 1sbp s ASN 126 Ca 0.71 0.90 0.31 0.00 0.21 0.00 0.00 52.86 54.99 1sbp s ASN 126 Cb -0.07 -2.47 1.68 0.00 -0.55 0.00 0.00 41.25 39.84 1sbp s ASN 126 CO 0.54 -0.70 1.94 -0.65 -2.79 0.00 0.00 177.10 175.44 1sbp h PRO 127 N 8.00 0.00 0.00 0.43 0.11 -1.83 -0.05 132.00 138.66 1sbp h PRO 127 Ca -0.22 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.88 1sbp h PRO 127 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1sbp h PRO 127 CO 0.94 0.00 -0.02 0.87 -0.21 0.00 0.00 178.00 179.59 1sbp h LYS 128 N 0.00 0.00 0.00 1.05 1.79 -1.93 -3.37 116.57 114.11 1sbp h LYS 128 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1sbp h LYS 128 Cb 0.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 1sbp h LYS 128 CO 0.00 0.02 -0.48 -1.13 -1.08 0.00 0.00 179.45 176.77 1sbp n SER 129 N -3.11 2.41 -4.88 0.86 3.41 -0.68 -4.72 113.62 106.91 1sbp n SER 129 Ca 0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.27 1sbp n SER 129 Cb 0.40 0.31 -0.06 0.00 -0.26 0.00 0.00 64.21 64.60 1sbp n SER 129 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1sbp s SER 130 N -1.70 6.50 -0.09 4.04 0.15 -0.12 -0.75 113.70 121.73 1sbp s SER 130 Ca 0.00 0.57 -0.20 0.00 0.70 0.00 0.00 55.95 57.02 1sbp s SER 130 Cb 0.00 -2.10 -0.17 0.00 -1.71 0.00 0.00 66.02 62.04 1sbp s SER 130 CO 0.00 0.32 0.69 1.23 1.20 0.00 0.00 173.24 176.67 1sbp h GLY 131 N 4.42 -0.08 0.58 9.45 0.00 -1.89 -3.18 103.07 112.36 1sbp h GLY 131 Ca -0.52 0.03 0.13 0.00 0.00 0.00 0.00 47.33 46.97 1sbp h GLY 131 CO 0.63 -0.03 0.58 -1.33 0.00 0.00 0.00 176.54 176.39 1sbp h GLY 132 N -0.92 1.27 1.39 4.60 0.00 -1.96 -0.43 103.07 107.03 1sbp h GLY 132 Ca -0.01 -0.33 0.01 0.00 0.00 0.00 0.00 47.33 47.00 1sbp h GLY 132 CO 0.01 0.13 0.40 0.00 0.00 0.00 0.00 176.54 177.08 1sbp h ALA 133 N 1.58 1.57 0.10 3.60 0.00 -1.83 0.61 119.26 124.90 1sbp h ALA 133 Ca 0.44 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 55.06 1sbp h ALA 133 Cb 0.61 -0.24 0.03 0.00 0.00 0.00 0.00 17.79 18.18 1sbp h ALA 133 CO -0.20 0.39 -1.05 0.00 0.00 0.00 0.00 179.25 178.38 1sbp h ARG 134 N 0.82 0.54 -0.87 0.00 3.08 -1.10 -1.91 114.38 114.93 1sbp h ARG 134 Ca 0.22 -0.71 0.02 0.00 0.07 0.00 0.00 59.98 59.58 1sbp h ARG 134 Cb -0.08 0.23 -0.05 0.00 0.08 0.00 0.00 29.97 30.15 1sbp h ARG 134 CO -0.05 1.31 0.57 -1.49 -1.07 0.00 0.00 179.97 179.24 1sbp h TRP 135 N 0.10 1.07 -0.39 3.04 4.06 -0.89 -1.42 115.95 121.52 1sbp h TRP 135 Ca -0.16 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 60.81 1sbp h TRP 135 Cb 1.76 -0.36 -0.02 0.00 -1.00 0.00 0.00 29.16 29.54 1sbp h TRP 135 CO 0.14 0.65 0.24 -0.91 -3.56 0.00 0.00 178.44 174.99 1sbp h ASN 136 N 1.13 0.47 -0.03 -3.49 2.35 -0.85 0.41 115.58 115.56 1sbp h ASN 136 Ca 0.33 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1sbp h ASN 136 Cb -0.06 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.19 1sbp h ASN 136 CO -0.09 0.38 0.02 0.22 -1.65 0.00 0.00 177.43 176.31 1sbp h TYR 137 N 0.51 0.04 -0.61 1.19 5.03 -0.97 -1.91 116.97 120.25 1sbp h TYR 137 Ca 0.14 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.42 1sbp h TYR 137 Cb -0.00 -0.01 -0.03 0.00 1.55 0.00 0.00 36.73 38.24 1sbp h TYR 137 CO -0.04 0.04 0.28 -0.07 -1.32 0.00 0.00 178.16 177.05 1sbp h LEU 138 N 0.02 0.78 -0.31 2.82 3.38 -1.07 -1.33 115.31 119.60 1sbp h LEU 138 Ca 0.01 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1sbp h LEU 138 Cb 0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1sbp h LEU 138 CO -0.00 0.68 0.18 0.00 0.09 0.00 0.00 178.44 179.39 1sbp h ALA 139 N 1.45 0.39 -0.53 1.53 0.00 -0.64 -0.37 119.26 121.08 1sbp h ALA 139 Ca 0.21 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1sbp h ALA 139 Cb 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1sbp h ALA 139 CO -0.03 -0.11 0.04 0.00 0.00 0.00 0.00 179.25 179.16 1sbp h ALA 140 N 1.07 0.71 -0.05 0.00 0.00 -1.11 -1.56 119.26 118.32 1sbp h ALA 140 Ca 0.11 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1sbp h ALA 140 Cb 0.02 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1sbp h ALA 140 CO -0.02 0.49 0.01 2.35 0.00 0.00 0.00 179.25 182.08 1sbp h TRP 141 N 0.79 0.08 -0.44 0.00 2.91 -1.02 -1.22 115.95 117.04 1sbp h TRP 141 Ca 0.16 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.25 1sbp h TRP 141 Cb 0.47 -0.02 -0.07 0.00 -0.51 0.00 0.00 29.16 29.03 1sbp h TRP 141 CO 0.03 0.26 0.03 0.78 -1.03 0.00 0.00 178.44 178.51 1sbp h GLY 142 N -0.12 0.48 0.67 2.65 0.00 -1.03 -0.90 103.07 104.82 1sbp h GLY 142 Ca 0.02 0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.40 1sbp h GLY 142 CO -0.00 -0.10 -0.08 -1.82 0.00 0.00 0.00 176.54 174.54 1sbp h TYR 143 N 0.14 -0.20 -0.18 5.60 5.03 -1.12 -1.23 116.97 125.02 1sbp h TYR 143 Ca 0.22 0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.59 1sbp h TYR 143 Cb 0.31 0.10 -0.04 0.00 1.55 0.00 0.00 36.73 38.65 1sbp h TYR 143 CO -0.26 -0.13 -0.09 0.00 -1.32 0.00 0.00 178.16 176.36 1sbp h ALA 144 N 0.97 0.06 -0.38 1.82 0.00 -0.70 -1.46 119.26 119.58 1sbp h ALA 144 Ca 0.06 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1sbp h ALA 144 Cb 0.19 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.14 1sbp h ALA 144 CO -0.15 -0.52 0.03 -0.07 0.00 0.00 0.00 179.25 178.54 1sbp h LEU 145 N -0.07 -0.08 -1.99 0.00 3.38 -0.95 -0.49 115.31 115.12 1sbp h LEU 145 Ca 0.10 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 1sbp h LEU 145 Cb 0.22 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 1sbp h LEU 145 CO -0.23 -0.01 -0.02 0.45 0.09 0.00 0.00 178.44 178.73 1sbp h HIS 146 N 0.14 0.00 -0.07 1.13 3.86 -0.87 -0.76 115.15 118.58 1sbp h HIS 146 Ca 0.18 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.39 1sbp h HIS 146 Cb 0.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.71 1sbp h HIS 146 CO -0.23 0.02 0.00 0.72 0.86 0.00 0.00 177.93 179.30 1sbp n HIS 147 N -3.16 0.07 -2.05 2.45 8.25 -0.58 -4.50 115.22 115.70 1sbp n HIS 147 Ca -0.01 -0.06 0.05 0.00 -0.26 0.00 0.00 57.72 57.45 1sbp n HIS 147 Cb 0.23 -0.00 0.12 0.00 1.12 0.00 0.00 29.99 31.45 1sbp n HIS 147 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1sbp n ASN 148 N 0.89 1.36 -3.78 0.41 3.02 -0.25 -5.01 115.26 111.90 1sbp n ASN 148 Ca 0.10 -2.96 -0.28 0.00 -0.03 0.00 0.00 54.58 51.41 1sbp n ASN 148 Cb 0.41 -0.42 0.04 0.00 -0.61 0.00 0.00 39.78 39.20 1sbp n ASN 148 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1sbp n ASN 149 N -0.31 -5.18 -1.72 6.41 5.15 -1.12 -1.92 115.26 116.56 1sbp n ASN 149 Ca 0.13 -0.68 -0.20 0.00 -0.60 0.00 0.00 54.58 53.22 1sbp n ASN 149 Cb 0.92 -4.13 -0.07 0.00 -0.53 0.00 0.00 39.78 35.98 1sbp n ASN 149 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1sbp n ASN 150 N -2.82 -5.48 -4.59 1.20 3.02 -0.34 -4.93 115.26 101.32 1sbp n ASN 150 Ca 0.03 0.36 -0.43 0.00 -0.03 0.00 0.00 54.58 54.51 1sbp n ASN 150 Cb 0.54 -4.67 -0.02 0.00 -0.61 0.00 0.00 39.78 35.01 1sbp n ASN 150 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1sbp s ASP 151 N -2.61 6.56 0.42 6.41 -1.08 -0.81 -4.92 116.67 120.63 1sbp s ASP 151 Ca 0.00 0.31 0.13 0.00 -0.52 0.00 0.00 52.55 52.47 1sbp s ASP 151 Cb 0.00 -2.54 0.89 0.00 -1.46 0.00 0.00 42.92 39.81 1sbp s ASP 151 CO 0.00 -1.31 1.94 1.56 0.52 0.00 0.00 175.17 177.87 1sbp h GLN 152 N 9.32 0.04 -0.35 4.34 1.08 -1.91 -1.84 115.11 125.79 1sbp h GLN 152 Ca -0.24 -0.01 -0.11 0.00 -1.45 0.00 0.00 58.65 56.84 1sbp h GLN 152 Cb 1.06 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.48 1sbp h GLN 152 CO 1.14 0.26 -0.21 0.00 -0.95 0.00 0.00 178.83 179.08 1sbp h ALA 153 N 1.74 0.50 -0.41 3.87 0.00 -1.99 -0.67 119.26 122.30 1sbp h ALA 153 Ca 0.01 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 1sbp h ALA 153 Cb 0.41 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1sbp h ALA 153 CO 0.03 0.45 -0.11 0.87 0.00 0.00 0.00 179.25 180.49 1sbp h LYS 154 N 0.54 0.72 -0.46 0.00 1.57 -1.89 -1.17 116.57 115.88 1sbp h LYS 154 Ca 0.07 -0.23 -0.11 0.00 -1.87 0.00 0.00 60.65 58.51 1sbp h LYS 154 Cb 0.76 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 1sbp h LYS 154 CO 0.06 0.81 -0.12 0.00 -0.57 0.00 0.00 179.45 179.63 1sbp h ALA 155 N 1.22 0.64 -0.75 3.86 0.00 -1.16 -1.28 119.26 121.79 1sbp h ALA 155 Ca 0.11 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1sbp h ALA 155 Cb 0.57 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1sbp h ALA 155 CO 0.04 0.55 0.23 1.49 0.00 0.00 0.00 179.25 181.56 1sbp h GLU 156 N 0.74 1.16 -0.95 0.00 4.81 -0.78 -1.50 114.58 118.07 1sbp h GLU 156 Ca 0.12 -0.25 0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1sbp h GLU 156 Cb 0.67 -0.17 -0.05 0.00 0.63 0.00 0.00 28.75 29.83 1sbp h GLU 156 CO 0.05 0.98 0.62 -0.44 -0.73 0.00 0.00 179.01 179.50 1sbp h ASP 157 N 1.11 1.06 -0.02 1.04 3.32 -0.99 -0.04 116.42 121.90 1sbp h ASP 157 Ca 0.24 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 1sbp h ASP 157 Cb 0.31 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 1sbp h ASP 157 CO -0.01 0.75 0.01 0.15 -1.72 0.00 0.00 179.24 178.42 1sbp h PHE 158 N 1.24 0.03 -0.25 4.55 3.57 -0.71 -1.71 116.94 123.67 1sbp h PHE 158 Ca 0.36 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.75 1sbp h PHE 158 Cb -0.07 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1sbp h PHE 158 CO -0.01 0.20 -0.30 0.28 -2.23 0.00 0.00 178.31 176.26 1sbp h VAL 159 N -0.15 1.28 -0.53 1.41 2.07 -1.03 -0.88 116.25 118.42 1sbp h VAL 159 Ca 0.01 -1.37 0.02 0.00 0.82 0.00 0.00 66.70 66.18 1sbp h VAL 159 Cb 0.19 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1sbp h VAL 159 CO -0.00 0.43 0.32 0.50 0.02 0.00 0.00 177.57 178.84 1sbp h LYS 160 N 0.43 0.62 -0.30 1.57 3.64 -0.89 -0.88 116.57 120.76 1sbp h LYS 160 Ca 0.06 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 1sbp h LYS 160 Cb 0.74 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.41 1sbp h LYS 160 CO 0.06 0.41 -0.17 0.00 -2.27 0.00 0.00 179.45 177.48 1sbp h ALA 161 N 1.23 1.16 -0.25 5.00 0.00 -0.81 -1.18 119.26 124.41 1sbp h ALA 161 Ca 0.21 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1sbp h ALA 161 Cb 0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1sbp h ALA 161 CO -0.09 0.53 -0.00 1.25 0.00 0.00 0.00 179.25 180.94 1sbp h LEU 162 N 0.48 0.43 -1.51 0.00 5.85 -0.67 -3.10 115.31 116.79 1sbp h LEU 162 Ca 0.08 -0.31 -0.05 0.00 0.84 0.00 0.00 57.88 58.44 1sbp h LEU 162 Cb 0.57 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1sbp h LEU 162 CO 0.04 0.64 -0.24 -0.26 -0.34 0.00 0.00 178.44 178.27 1sbp h PHE 163 N 0.21 0.00 0.00 1.25 -1.00 -0.87 -1.94 116.94 114.59 1sbp h PHE 163 Ca 0.07 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.82 1sbp h PHE 163 Cb 0.42 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.97 1sbp h PHE 163 CO 0.04 0.24 -0.12 0.87 -1.61 0.00 0.00 178.31 177.73 1sbp h LYS 164 N 0.00 0.00 -0.00 1.51 1.79 -1.14 -2.17 116.57 116.55 1sbp h LYS 164 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1sbp h LYS 164 Cb 0.52 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 1sbp h LYS 164 CO 0.03 0.12 -0.23 0.09 -1.08 0.00 0.00 179.45 178.38 1sbp n ASN 165 N -4.22 0.52 -4.66 0.86 5.03 -0.73 -4.90 115.26 107.16 1sbp n ASN 165 Ca -0.03 -0.38 -0.43 0.00 0.87 0.00 0.00 54.58 54.62 1sbp n ASN 165 Cb 0.20 -0.01 -0.02 0.00 -1.02 0.00 0.00 39.78 38.93 1sbp n ASN 165 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1sbp s VAL 166 N -2.71 4.41 -0.04 2.41 1.01 -0.82 -1.24 120.40 123.42 1sbp s VAL 166 Ca 0.21 1.69 -0.11 0.00 0.00 0.00 0.00 61.98 63.76 1sbp s VAL 166 Cb 0.19 -4.13 -0.31 0.00 0.00 0.00 0.00 36.38 32.13 1sbp s VAL 166 CO 0.56 -0.19 0.70 -0.08 0.00 0.00 0.00 175.10 176.08 1sbp h GLU 167 N 8.05 0.40 -3.54 2.72 4.81 -1.28 -3.47 114.58 122.28 1sbp h GLU 167 Ca -0.24 -0.69 -0.30 0.00 -0.13 0.00 0.00 59.36 58.00 1sbp h GLU 167 Cb 1.09 0.26 -0.34 0.00 0.63 0.00 0.00 28.75 30.39 1sbp h GLU 167 CO 0.98 1.33 -0.73 0.08 -0.73 0.00 0.00 179.01 179.94 1sbp s VAL 168 N -2.58 -0.04 -0.62 0.32 1.01 -1.26 -5.10 120.40 112.13 1sbp s VAL 168 Ca -0.15 0.20 -0.05 0.00 0.00 0.00 0.00 61.98 61.97 1sbp s VAL 168 Cb 0.05 -0.09 0.16 0.00 0.00 0.00 0.00 36.38 36.50 1sbp s VAL 168 CO 0.86 0.09 0.46 -0.76 0.00 0.00 0.00 175.10 175.75 1sbp s LEU 169 N 1.02 5.55 0.67 3.92 1.43 -1.26 -3.61 118.68 126.39 1sbp s LEU 169 Ca -0.09 -2.63 -0.13 0.00 -1.03 0.00 0.00 54.13 50.26 1sbp s LEU 169 Cb -0.12 -1.93 -0.00 0.00 0.03 0.00 0.00 46.19 44.16 1sbp s LEU 169 CO -0.03 -0.46 1.06 -1.81 0.23 0.00 0.00 176.35 175.35 1sbp s ASP 170 N 1.29 5.43 0.44 2.29 1.01 -1.26 -4.50 116.67 121.38 1sbp s ASP 170 Ca 0.15 1.72 0.24 0.00 0.71 0.00 0.00 52.55 55.36 1sbp s ASP 170 Cb -0.20 -2.51 0.46 0.00 1.01 0.00 0.00 42.92 41.69 1sbp s ASP 170 CO -0.04 -1.41 1.65 0.77 0.21 0.00 0.00 175.17 176.35 1sbp h SER 171 N -0.33 0.00 -4.88 0.27 4.64 -1.96 0.13 113.55 111.42 1sbp h SER 171 Ca -0.45 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.66 1sbp h SER 171 Cb 1.22 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.11 1sbp h SER 171 CO 0.56 0.05 -0.71 -0.83 -0.87 0.00 0.00 176.83 175.03 1sbp s GLY 172 N -4.23 0.43 0.44 -0.77 0.00 -1.26 -3.39 107.32 98.53 1sbp s GLY 172 Ca 0.06 -0.81 0.12 0.00 0.00 0.00 0.00 44.72 44.09 1sbp s GLY 172 CO 0.66 -0.88 2.01 0.00 0.00 0.00 0.00 173.10 174.89 1sbp h ALA 173 N 4.24 1.70 -0.09 3.20 0.00 -1.91 -1.61 119.26 124.79 1sbp h ALA 173 Ca -0.34 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.31 1sbp h ALA 173 Cb 1.19 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1sbp h ALA 173 CO 0.46 0.23 -0.55 -0.09 0.00 0.00 0.00 179.25 179.29 1sbp h ARG 174 N 0.17 0.27 -0.37 0.00 9.65 -1.98 -1.11 114.38 121.01 1sbp h ARG 174 Ca 0.04 -0.17 -0.00 0.00 -1.10 0.00 0.00 59.98 58.74 1sbp h ARG 174 Cb 0.21 0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.79 1sbp h ARG 174 CO 0.01 0.75 0.21 0.78 2.80 0.00 0.00 179.97 184.53 1sbp h GLY 175 N 1.38 0.54 0.87 2.80 0.00 -1.71 -1.22 103.07 105.74 1sbp h GLY 175 Ca 0.00 -0.24 0.02 0.00 0.00 0.00 0.00 47.33 47.12 1sbp h GLY 175 CO 0.09 0.23 0.31 1.76 0.00 0.00 0.00 176.54 178.92 1sbp h SER 176 N 0.48 0.50 -0.63 0.19 0.02 -0.97 0.32 113.55 113.45 1sbp h SER 176 Ca 0.13 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.05 1sbp h SER 176 Cb 0.03 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 1sbp h SER 176 CO -0.02 0.35 0.25 0.74 -1.14 0.00 0.00 176.83 177.01 1sbp h THR 177 N 0.61 1.23 -0.58 -2.27 2.02 -1.00 -2.46 112.91 110.48 1sbp h THR 177 Ca 0.21 -0.73 -0.09 0.00 0.77 0.00 0.00 66.41 66.57 1sbp h THR 177 Cb 0.02 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1sbp h THR 177 CO -0.09 0.29 0.01 0.78 0.37 0.00 0.00 175.52 176.87 1sbp h ASN 178 N 0.88 0.99 -0.48 4.18 2.35 -0.79 0.17 115.58 122.88 1sbp h ASN 178 Ca 0.21 -0.30 0.04 0.00 -0.55 0.00 0.00 56.30 55.70 1sbp h ASN 178 Cb 0.20 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.27 1sbp h ASN 178 CO -0.02 1.05 0.25 0.74 -1.65 0.00 0.00 177.43 177.80 1sbp h THR 179 N 0.90 0.97 0.34 2.81 2.02 -0.70 0.11 112.91 119.36 1sbp h THR 179 Ca 0.16 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 1sbp h THR 179 Cb 0.54 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1sbp h THR 179 CO 0.03 0.09 -0.16 0.15 0.37 0.00 0.00 175.52 175.99 1sbp h PHE 180 N 0.49 -0.42 0.01 3.16 3.57 -1.24 -2.22 116.94 120.28 1sbp h PHE 180 Ca 0.21 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 1sbp h PHE 180 Cb 0.11 0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.99 1sbp h PHE 180 CO -0.10 -0.13 -0.00 0.28 -2.23 0.00 0.00 178.31 176.13 1sbp h VAL 181 N -1.02 1.57 0.18 1.41 2.07 -0.98 -3.02 116.25 116.46 1sbp h VAL 181 Ca -0.05 -1.82 -0.28 0.00 0.82 0.00 0.00 66.70 65.37 1sbp h VAL 181 Cb 0.48 2.79 0.02 0.00 -1.52 0.00 0.00 31.29 33.06 1sbp h VAL 181 CO 0.08 0.46 -1.33 -0.08 0.02 0.00 0.00 177.57 176.72 1sbp h GLU 182 N -0.80 0.38 -0.00 1.57 4.57 -0.98 -3.37 114.58 115.94 1sbp h GLU 182 Ca -0.00 -0.65 0.00 0.00 -1.18 0.00 0.00 59.36 57.53 1sbp h GLU 182 Cb 0.77 0.24 0.00 0.00 -0.16 0.00 0.00 28.75 29.60 1sbp h GLU 182 CO 0.00 1.31 -0.40 0.54 -1.18 0.00 0.00 179.01 179.29 1sbp n ARG 183 N -3.86 0.36 -2.90 1.92 1.74 -0.66 -4.98 116.66 108.28 1sbp n ARG 183 Ca -0.19 -0.21 -0.21 0.00 -0.77 0.00 0.00 57.85 56.46 1sbp n ARG 183 Cb 0.97 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.95 1sbp n ARG 183 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sbp n GLY 184 N 1.43 -0.46 3.78 -0.13 0.00 -1.07 -4.97 105.19 103.78 1sbp n GLY 184 Ca 0.08 0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1sbp n GLY 184 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sbp s ILE 185 N -3.13 5.29 0.00 -0.61 1.01 -0.86 -5.00 121.20 117.89 1sbp s ILE 185 Ca 0.25 0.14 0.00 0.00 0.00 0.00 0.00 60.65 61.04 1sbp s ILE 185 Cb -0.11 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 39.01 1sbp s ILE 185 CO 0.31 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.39 1sbp n GLY 186 N 2.77 2.27 0.12 6.18 0.00 -1.26 -3.90 105.19 111.37 1sbp n GLY 186 Ca -0.18 -1.82 -0.15 0.00 0.00 0.00 0.00 46.02 43.87 1sbp n GLY 186 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sbp n ASP 187 N 0.00 1.35 -3.82 1.61 8.00 0.12 -4.96 116.55 118.85 1sbp n ASP 187 Ca 0.00 0.10 -0.13 0.00 0.71 0.00 0.00 54.79 55.47 1sbp n ASP 187 Cb 0.00 -0.15 -0.14 0.00 -0.02 0.00 0.00 41.12 40.82 1sbp n ASP 187 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1sbp s VAL 188 N -2.54 -0.01 -0.20 2.53 0.11 -0.88 -4.00 120.40 115.41 1sbp s VAL 188 Ca -0.20 0.04 -0.07 0.00 -2.93 0.00 0.00 61.98 58.82 1sbp s VAL 188 Cb 0.07 -0.14 -0.03 0.00 -1.53 0.00 0.00 36.38 34.75 1sbp s VAL 188 CO 0.74 0.02 0.04 -0.22 -3.33 0.00 0.00 175.10 172.35 1sbp s LEU 189 N 0.26 3.54 -0.57 2.54 2.96 -0.56 -0.46 118.68 126.39 1sbp s LEU 189 Ca -0.02 -0.08 -0.24 0.00 -0.22 0.00 0.00 54.13 53.57 1sbp s LEU 189 Cb -0.03 -1.91 0.04 0.00 0.50 0.00 0.00 46.19 44.80 1sbp s LEU 189 CO -0.01 0.09 0.96 -0.63 -1.32 0.00 0.00 176.35 175.44 1sbp s ILE 190 N 0.87 4.34 0.22 6.68 1.01 -0.51 -1.05 121.20 132.75 1sbp s ILE 190 Ca 0.03 0.21 0.10 0.00 0.00 0.00 0.00 60.65 60.99 1sbp s ILE 190 Cb -0.14 -4.58 -0.04 0.00 0.01 0.00 0.00 42.46 37.71 1sbp s ILE 190 CO 0.02 -1.20 -0.13 0.00 0.00 0.00 0.00 174.94 173.64 1sbp s ALA 191 N 4.06 2.86 0.38 9.38 0.00 0.09 -4.78 121.76 133.75 1sbp s ALA 191 Ca 0.30 -1.61 -0.27 0.00 0.00 0.00 0.00 51.96 50.38 1sbp s ALA 191 Cb -0.13 -0.57 -0.09 0.00 0.00 0.00 0.00 23.12 22.32 1sbp s ALA 191 CO 0.18 0.39 1.33 -1.58 0.00 0.00 0.00 175.76 176.08 1sbp s TRP 192 N -1.95 2.83 0.30 0.00 0.52 -1.26 -1.08 118.94 118.29 1sbp s TRP 192 Ca 0.26 1.37 0.03 0.00 0.02 0.00 0.00 56.10 57.78 1sbp s TRP 192 Cb -0.07 -3.73 0.62 0.00 -1.15 0.00 0.00 33.47 29.13 1sbp s TRP 192 CO 0.15 -2.19 1.83 1.49 0.02 0.00 0.00 176.95 178.25 1sbp h GLU 193 N 2.88 0.89 -0.82 4.98 4.81 -1.32 -0.77 114.58 125.24 1sbp h GLU 193 Ca -0.50 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.66 1sbp h GLU 193 Cb 1.24 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 1sbp h GLU 193 CO 0.63 0.59 0.44 -2.95 -0.73 0.00 0.00 179.01 176.99 1sbp h ASN 194 N 0.92 1.02 -0.48 1.04 -1.07 -1.84 -1.17 115.58 113.99 1sbp h ASN 194 Ca 0.50 -0.09 -0.11 0.00 0.07 0.00 0.00 56.30 56.67 1sbp h ASN 194 Cb 0.58 -0.26 -0.01 0.00 -2.07 0.00 0.00 38.32 36.55 1sbp h ASN 194 CO -0.27 0.82 -0.14 -0.33 0.07 0.00 0.00 177.43 177.58 1sbp h GLU 195 N 1.14 0.94 -0.40 4.14 4.39 -1.52 -0.98 114.58 122.29 1sbp h GLU 195 Ca 0.29 -0.37 -0.02 0.00 0.34 0.00 0.00 59.36 59.59 1sbp h GLU 195 Cb 0.04 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 1sbp h GLU 195 CO -0.05 1.04 0.16 0.00 -1.16 0.00 0.00 179.01 179.00 1sbp h ALA 196 N 0.88 0.52 -0.32 3.43 0.00 -0.90 -0.35 119.26 122.52 1sbp h ALA 196 Ca 0.12 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 1sbp h ALA 196 Cb 0.70 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1sbp h ALA 196 CO 0.05 0.13 -0.39 -0.07 0.00 0.00 0.00 179.25 178.98 1sbp h LEU 197 N 0.50 0.81 -0.62 0.00 3.38 -1.20 -1.79 115.31 116.40 1sbp h LEU 197 Ca 0.13 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 1sbp h LEU 197 Cb 0.20 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1sbp h LEU 197 CO -0.01 1.10 0.18 0.25 0.09 0.00 0.00 178.44 180.05 1sbp h LEU 198 N 0.63 0.92 -0.58 1.67 5.85 -1.02 -0.90 115.31 121.89 1sbp h LEU 198 Ca 0.05 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.49 1sbp h LEU 198 Cb 0.94 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 1sbp h LEU 198 CO 0.09 0.90 0.11 0.00 -0.34 0.00 0.00 178.44 179.19 1sbp h ALA 199 N 1.06 0.76 0.00 1.25 0.00 -0.80 0.18 119.26 121.72 1sbp h ALA 199 Ca 0.20 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1sbp h ALA 199 Cb 0.32 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1sbp h ALA 199 CO -0.00 0.50 -0.00 1.79 0.00 0.00 0.00 179.25 181.53 1sbp h THR 200 N 0.84 0.00 0.00 0.00 1.35 -1.24 -1.73 112.91 112.14 1sbp h THR 200 Ca 0.18 -0.95 -0.37 0.00 -0.55 0.00 0.00 66.41 64.72 1sbp h THR 200 Cb 0.39 1.95 -0.07 0.00 -1.73 0.00 0.00 68.15 68.69 1sbp h THR 200 CO 0.01 0.00 -2.38 0.59 -0.25 0.00 0.00 175.52 173.50 1sbp n ASN 201 N -3.10 0.26 0.04 5.36 4.13 -0.35 -4.19 115.26 117.42 1sbp n ASN 201 Ca 0.04 -0.01 0.00 0.00 1.68 0.00 0.00 54.58 56.28 1sbp n ASN 201 Cb 0.50 0.86 0.00 0.00 -1.54 0.00 0.00 39.78 39.61 1sbp n ASN 201 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1sbp n GLU 202 N -2.78 0.00 0.00 3.52 1.02 0.60 -4.71 120.64 118.29 1sbp n GLU 202 Ca -0.34 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.80 1sbp n GLU 202 Cb 1.13 -0.18 0.00 0.00 -0.02 0.00 0.00 31.44 32.38 1sbp n GLU 202 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1sbp n LEU 203 N -3.02 0.00 0.00 -4.62 4.77 -0.96 -4.24 117.00 108.92 1sbp n LEU 203 Ca 0.00 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1sbp n LEU 203 Cb 0.00 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1sbp n LEU 203 CO 0.00 -0.27 0.00 0.61 -1.33 0.00 0.00 177.39 176.40 1sbp n GLY 204 N -1.23 -1.85 3.75 -0.72 0.00 -0.65 -4.96 105.19 99.53 1sbp n GLY 204 Ca 0.00 0.80 -0.38 0.00 0.00 0.00 0.00 46.02 46.45 1sbp n GLY 204 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sbp s LYS 205 N 0.00 3.21 0.00 1.61 -2.85 -1.26 -3.14 119.74 117.32 1sbp s LYS 205 Ca 0.00 2.06 0.00 0.00 -1.00 0.00 0.00 55.97 57.03 1sbp s LYS 205 Cb 0.00 -2.21 0.00 0.00 -2.06 0.00 0.00 37.83 33.56 1sbp s LYS 205 CO 0.00 -1.08 0.00 -0.25 0.10 0.00 0.00 175.35 174.12 1sbp n ASP 206 N -1.05 -3.98 -0.03 0.03 8.00 -1.26 -4.77 116.55 113.48 1sbp n ASP 206 Ca 0.11 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.59 1sbp n ASP 206 Cb 0.47 -2.32 -0.08 0.00 -0.02 0.00 0.00 41.12 39.17 1sbp n ASP 206 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1sbp n LYS 207 N -0.69 1.64 -4.32 -1.24 5.02 -1.19 -4.87 118.16 112.51 1sbp n LYS 207 Ca 0.00 -0.04 -0.18 0.00 -2.02 0.00 0.00 58.31 56.07 1sbp n LYS 207 Cb 0.26 -1.25 -0.10 0.00 -0.02 0.00 0.00 35.03 33.92 1sbp n LYS 207 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1sbp s PHE 208 N -2.42 1.62 0.01 2.13 0.08 -1.25 -0.79 117.98 117.36 1sbp s PHE 208 Ca -0.04 -0.59 0.02 0.00 0.12 0.00 0.00 56.93 56.43 1sbp s PHE 208 Cb 0.04 -0.77 -0.01 0.00 -0.57 0.00 0.00 43.02 41.71 1sbp s PHE 208 CO 0.42 0.29 -0.06 -1.21 -0.10 0.00 0.00 175.22 174.56 1sbp s GLU 209 N -3.49 0.47 0.07 0.44 2.02 -0.17 -4.74 118.70 113.31 1sbp s GLU 209 Ca 0.20 -0.32 -0.20 0.00 0.02 0.00 0.00 54.97 54.67 1sbp s GLU 209 Cb -0.01 -0.42 -0.07 0.00 0.10 0.00 0.00 34.13 33.74 1sbp s GLU 209 CO 0.05 0.11 0.60 0.42 0.02 0.00 0.00 175.26 176.46 1sbp s ILE 210 N -0.39 4.72 -0.21 -1.63 1.01 -1.26 -0.32 121.20 123.13 1sbp s ILE 210 Ca -0.00 1.28 -0.02 0.00 0.00 0.00 0.00 60.65 61.90 1sbp s ILE 210 Cb -0.04 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1sbp s ILE 210 CO -0.00 0.53 -0.09 -0.69 0.00 0.00 0.00 174.94 174.69 1sbp s VAL 211 N -0.98 2.98 -0.23 2.92 1.01 -0.22 -4.98 120.40 120.89 1sbp s VAL 211 Ca 0.30 -0.63 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 1sbp s VAL 211 Cb -0.20 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1sbp s VAL 211 CO 0.20 0.46 0.56 -0.89 0.00 0.00 0.00 175.10 175.42 1sbp s THR 212 N 1.42 5.05 1.00 3.92 2.01 -1.26 -1.58 115.64 126.20 1sbp s THR 212 Ca 0.06 1.01 -0.13 0.00 0.31 0.00 0.00 61.69 62.94 1sbp s THR 212 Cb -0.14 -3.88 0.19 0.00 0.01 0.00 0.00 72.50 68.68 1sbp s THR 212 CO -0.06 0.10 1.12 -2.16 -0.69 0.00 0.00 174.62 172.93 1sbp s PRO 213 N 2.11 0.44 0.35 4.92 0.04 -1.26 -4.89 135.00 136.71 1sbp s PRO 213 Ca 0.24 0.32 0.09 0.00 0.04 0.00 0.00 61.00 61.70 1sbp s PRO 213 Cb -0.16 -1.76 0.66 0.00 0.04 0.00 0.00 34.50 33.28 1sbp s PRO 213 CO 0.09 -2.68 1.82 0.66 0.04 0.00 0.00 177.00 176.93 1sbp h SER 214 N -1.85 0.18 -5.05 6.66 4.64 -1.95 -3.45 113.55 112.74 1sbp h SER 214 Ca -0.52 -0.06 -0.07 0.00 -0.47 0.00 0.00 61.79 60.67 1sbp h SER 214 Cb 1.33 -0.05 -0.16 0.00 -0.31 0.00 0.00 62.40 63.21 1sbp h SER 214 CO 0.56 0.47 -0.11 -1.83 -0.87 0.00 0.00 176.83 175.05 1sbp s GLU 215 N -4.40 0.95 0.15 4.77 -1.05 -1.26 -3.65 118.70 114.21 1sbp s GLU 215 Ca -0.04 -0.47 -0.02 0.00 -0.15 0.00 0.00 54.97 54.29 1sbp s GLU 215 Cb 0.14 0.42 0.01 0.00 -0.44 0.00 0.00 34.13 34.26 1sbp s GLU 215 CO 0.74 -0.34 0.22 0.45 0.95 0.00 0.00 175.26 177.29 1sbp n SER 216 N 0.31 -0.63 -4.78 0.83 2.88 0.04 -4.97 113.62 107.30 1sbp n SER 216 Ca -0.18 -1.75 -0.30 0.00 -1.33 0.00 0.00 58.87 55.31 1sbp n SER 216 Cb 0.61 1.14 -0.06 0.00 -0.75 0.00 0.00 64.21 65.14 1sbp n SER 216 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1sbp s ILE 217 N -2.60 4.56 -0.35 2.46 2.07 -1.26 -1.06 121.20 125.03 1sbp s ILE 217 Ca 0.11 -0.80 -0.25 0.00 -1.41 0.00 0.00 60.65 58.30 1sbp s ILE 217 Cb -0.01 -3.22 0.01 0.00 0.13 0.00 0.00 42.46 39.38 1sbp s ILE 217 CO 0.08 0.09 0.89 -0.22 -1.91 0.00 0.00 174.94 173.87 1sbp s LEU 218 N -2.49 4.03 -0.14 8.50 2.96 -0.23 -4.10 118.68 127.22 1sbp s LEU 218 Ca 0.30 0.63 -0.14 0.00 -0.22 0.00 0.00 54.13 54.70 1sbp s LEU 218 Cb -0.12 -3.22 -0.05 0.00 0.50 0.00 0.00 46.19 43.30 1sbp s LEU 218 CO 0.22 -0.78 0.30 0.00 -1.32 0.00 0.00 176.35 174.77 1sbp s ALA 219 N 3.32 3.62 -0.45 5.97 0.00 -0.25 -4.66 121.76 129.30 1sbp s ALA 219 Ca 0.37 -0.43 0.02 0.00 0.00 0.00 0.00 51.96 51.92 1sbp s ALA 219 Cb -0.13 -2.37 0.14 0.00 0.00 0.00 0.00 23.12 20.76 1sbp s ALA 219 CO 0.16 0.17 0.26 -1.21 0.00 0.00 0.00 175.76 175.14 1sbp s GLU 220 N 0.19 1.31 0.42 0.00 2.02 -1.26 -1.34 118.70 120.04 1sbp s GLU 220 Ca 0.18 -2.06 -0.26 0.00 0.02 0.00 0.00 54.97 52.85 1sbp s GLU 220 Cb -0.13 -2.32 -0.09 0.00 0.10 0.00 0.00 34.13 31.69 1sbp s GLU 220 CO 0.05 -1.18 1.37 -2.14 0.02 0.00 0.00 175.26 173.38 1sbp s PRO 221 N 0.27 3.86 0.04 0.39 0.02 -1.24 -4.34 135.00 134.00 1sbp s PRO 221 Ca 0.19 2.31 0.06 0.00 0.02 0.00 0.00 61.00 63.58 1sbp s PRO 221 Cb -0.22 -2.74 -0.02 0.00 0.02 0.00 0.00 34.50 31.54 1sbp s PRO 221 CO -0.02 -0.63 -0.18 0.95 -0.33 0.00 0.00 177.00 176.79 1sbp s THR 222 N -1.22 1.45 0.23 0.99 -4.23 -0.73 -4.33 115.64 107.81 1sbp s THR 222 Ca 0.58 -1.12 0.11 0.00 -1.18 0.00 0.00 61.69 60.08 1sbp s THR 222 Cb -0.41 -1.28 -0.05 0.00 1.34 0.00 0.00 72.50 72.10 1sbp s THR 222 CO 0.53 0.13 -0.16 0.68 -0.54 0.00 0.00 174.62 175.27 1sbp s VAL 223 N -0.81 2.77 -0.10 2.29 -7.23 -0.36 -1.40 120.40 115.56 1sbp s VAL 223 Ca 0.05 -2.05 -0.31 0.00 -1.81 0.00 0.00 61.98 57.87 1sbp s VAL 223 Cb -0.08 -2.40 0.10 0.00 0.56 0.00 0.00 36.38 34.55 1sbp s VAL 223 CO 0.02 -0.25 0.84 -0.55 -0.31 0.00 0.00 175.10 174.84 1sbp s SER 224 N -3.14 -0.52 0.33 4.85 0.15 -0.53 -4.84 113.70 110.00 1sbp s SER 224 Ca 0.26 0.55 -0.26 0.00 0.70 0.00 0.00 55.95 57.20 1sbp s SER 224 Cb -0.07 0.42 -0.09 0.00 -1.71 0.00 0.00 66.02 64.57 1sbp s SER 224 CO 0.14 -0.48 1.00 -0.69 1.20 0.00 0.00 173.24 174.41 1sbp s VAL 225 N -1.18 3.92 -0.63 4.45 1.01 -1.26 -0.82 120.40 125.88 1sbp s VAL 225 Ca -0.06 1.64 -0.17 0.00 0.00 0.00 0.00 61.98 63.39 1sbp s VAL 225 Cb -0.00 -3.94 0.13 0.00 0.00 0.00 0.00 36.38 32.57 1sbp s VAL 225 CO 0.06 0.18 0.69 -0.69 0.00 0.00 0.00 175.10 175.33 1sbp s VAL 226 N -1.50 5.03 0.17 2.92 1.01 -0.10 -4.86 120.40 123.08 1sbp s VAL 226 Ca 0.50 -1.38 -0.23 0.00 0.00 0.00 0.00 61.98 60.88 1sbp s VAL 226 Cb -0.23 -4.47 0.08 0.00 0.00 0.00 0.00 36.38 31.76 1sbp s VAL 226 CO 0.29 -1.07 1.59 0.44 0.00 0.00 0.00 175.10 176.35 1sbp h ASP 227 N 8.89 -1.18 0.05 3.32 3.32 -1.82 -1.52 116.42 127.48 1sbp h ASP 227 Ca -0.21 0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1sbp h ASP 227 Cb 1.08 0.56 -0.00 0.00 0.22 0.00 0.00 39.33 41.19 1sbp h ASP 227 CO 1.04 -0.32 -0.07 0.11 -1.72 0.00 0.00 179.24 178.27 1sbp h LYS 228 N -0.22 0.05 0.01 3.56 6.56 -1.55 -1.49 116.57 123.50 1sbp h LYS 228 Ca 0.19 -0.01 -0.03 0.00 -1.06 0.00 0.00 60.65 59.75 1sbp h LYS 228 Cb 0.55 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.20 1sbp h LYS 228 CO -0.61 0.13 -0.13 0.28 -2.06 0.00 0.00 179.45 177.06 1sbp h VAL 229 N 0.05 1.68 -0.07 0.50 2.07 -1.56 -3.19 116.25 115.73 1sbp h VAL 229 Ca 0.01 -2.17 -0.02 0.00 0.82 0.00 0.00 66.70 65.35 1sbp h VAL 229 Cb 0.17 3.13 -0.01 0.00 -1.52 0.00 0.00 31.29 33.07 1sbp h VAL 229 CO 0.01 0.57 -0.04 -0.37 0.02 0.00 0.00 177.57 177.77 1sbp h VAL 230 N -0.79 1.07 0.00 2.57 -1.51 -1.20 0.78 116.25 117.18 1sbp h VAL 230 Ca -0.02 -0.31 -0.02 0.00 -1.23 0.00 0.00 66.70 65.12 1sbp h VAL 230 Cb 1.02 1.07 -0.00 0.00 -2.13 0.00 0.00 31.29 31.24 1sbp h VAL 230 CO 0.03 0.10 -0.11 -0.33 -1.23 0.00 0.00 177.57 176.02 1sbp h GLU 231 N 0.10 0.00 0.06 5.19 5.08 -1.36 -1.18 114.58 122.47 1sbp h GLU 231 Ca 0.02 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.06 1sbp h GLU 231 Cb 0.13 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1sbp h GLU 231 CO 0.01 0.11 -1.82 1.17 -1.00 0.00 0.00 179.01 177.47 1sbp n LYS 232 N -3.26 0.66 0.00 2.33 4.81 -0.64 -4.45 118.16 117.61 1sbp n LYS 232 Ca 0.00 0.37 0.13 0.00 -0.87 0.00 0.00 58.31 57.95 1sbp n LYS 232 Cb 0.36 -1.69 0.50 0.00 0.02 0.00 0.00 35.03 34.23 1sbp n LYS 232 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1sbp n LYS 233 N -3.88 0.47 -3.42 1.64 5.02 0.17 -4.95 118.16 113.21 1sbp n LYS 233 Ca -0.35 -0.19 -0.17 0.00 -2.02 0.00 0.00 58.31 55.58 1sbp n LYS 233 Cb 0.89 -1.50 0.09 0.00 -0.02 0.00 0.00 35.03 34.50 1sbp n LYS 233 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1sbp n ASP 234 N -1.10 -2.36 -0.22 4.39 2.03 -0.48 -4.95 116.55 113.86 1sbp n ASP 234 Ca 0.11 -0.63 0.05 0.00 0.52 0.00 0.00 54.79 54.84 1sbp n ASP 234 Cb 0.31 -5.11 0.07 0.00 -0.72 0.00 0.00 41.12 35.67 1sbp n ASP 234 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1sbp n THR 235 N -4.07 1.05 -0.07 5.18 -2.24 -0.97 -4.86 114.28 108.30 1sbp n THR 235 Ca -0.27 -1.24 -0.10 0.00 -2.27 0.00 0.00 64.05 60.17 1sbp n THR 235 Cb 0.67 0.14 -0.03 0.00 -2.10 0.00 0.00 70.33 69.01 1sbp n THR 235 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1sbp h LYS 236 N 0.00 0.33 -0.36 -0.78 3.11 -1.93 0.21 116.57 117.15 1sbp h LYS 236 Ca 0.00 -0.03 0.07 0.00 -2.81 0.00 0.00 60.65 57.88 1sbp h LYS 236 Cb 1.11 -0.07 -0.06 0.00 -1.00 0.00 0.00 32.23 32.21 1sbp h LYS 236 CO 0.00 0.27 -0.02 0.00 -2.81 0.00 0.00 179.45 176.89 1sbp h ALA 237 N 1.04 0.31 -0.13 5.00 0.00 -1.95 -0.84 119.26 122.69 1sbp h ALA 237 Ca 0.09 0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.93 1sbp h ALA 237 Cb 0.02 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1sbp h ALA 237 CO -0.02 -0.41 -0.65 -0.24 0.00 0.00 0.00 179.25 177.93 1sbp h VAL 238 N 0.08 1.34 -0.22 0.00 3.04 -1.89 -2.06 116.25 116.54 1sbp h VAL 238 Ca 0.18 -1.97 -0.05 0.00 -1.01 0.00 0.00 66.70 63.85 1sbp h VAL 238 Cb 0.25 1.95 -0.01 0.00 -2.01 0.00 0.00 31.29 31.47 1sbp h VAL 238 CO -0.31 0.60 -0.04 0.00 -1.01 0.00 0.00 177.57 176.81 1sbp h ALA 239 N 0.92 0.30 -0.41 3.17 0.00 -0.74 0.82 119.26 123.32 1sbp h ALA 239 Ca -0.02 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.67 1sbp h ALA 239 Cb 1.22 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1sbp h ALA 239 CO 0.12 0.08 0.22 1.49 0.00 0.00 0.00 179.25 181.16 1sbp h GLU 240 N 0.16 0.43 -0.83 0.00 4.81 -1.18 -2.49 114.58 115.48 1sbp h GLU 240 Ca 0.06 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1sbp h GLU 240 Cb 0.49 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 1sbp h GLU 240 CO 0.02 0.28 0.40 0.00 -0.73 0.00 0.00 179.01 178.98 1sbp h ALA 241 N 1.20 1.07 -0.39 2.92 0.00 -1.13 -0.27 119.26 122.66 1sbp h ALA 241 Ca 0.17 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1sbp h ALA 241 Cb 0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1sbp h ALA 241 CO -0.10 0.63 0.26 -0.92 0.00 0.00 0.00 179.25 179.11 1sbp h TYR 242 N 1.18 0.49 -0.18 0.00 3.20 -0.49 -1.37 116.97 119.79 1sbp h TYR 242 Ca 0.28 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 62.03 1sbp h TYR 242 Cb 0.12 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.22 1sbp h TYR 242 CO 0.01 0.31 -0.42 -0.07 -1.64 0.00 0.00 178.16 176.35 1sbp h LEU 243 N 0.52 0.69 -1.49 2.82 3.38 -1.25 -3.24 115.31 116.75 1sbp h LEU 243 Ca 0.14 -0.56 0.02 0.00 0.09 0.00 0.00 57.88 57.56 1sbp h LEU 243 Cb -0.06 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 1sbp h LEU 243 CO -0.03 1.13 0.36 0.11 0.09 0.00 0.00 178.44 180.10 1sbp h LYS 244 N 0.28 0.67 0.00 1.13 1.57 -0.83 -2.00 116.57 117.39 1sbp h LYS 244 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1sbp h LYS 244 Cb 1.03 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1sbp h LYS 244 CO 0.09 0.44 0.00 -0.92 -0.57 0.00 0.00 179.45 178.50 1sbp h TYR 245 N 0.69 0.00 0.00 -1.35 3.20 -1.27 -1.38 116.97 116.86 1sbp h TYR 245 Ca 0.21 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 1sbp h TYR 245 Cb -0.02 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.25 1sbp h TYR 245 CO -0.00 0.00 -0.08 -0.07 -1.64 0.00 0.00 178.16 176.37 1sbp h LEU 246 N 0.00 0.00 -0.75 2.82 3.38 -1.45 -2.30 115.31 117.01 1sbp h LEU 246 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1sbp h LEU 246 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1sbp h LEU 246 CO 0.00 0.08 -0.23 -1.22 0.09 0.00 0.00 178.44 177.15 1sbp n TYR 247 N -3.47 0.00 -1.63 1.13 4.02 -0.52 -3.42 117.16 113.27 1sbp n TYR 247 Ca -0.02 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.56 1sbp n TYR 247 Cb 0.22 -0.07 0.05 0.00 -0.02 0.00 0.00 39.34 39.52 1sbp n TYR 247 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1sbp s SER 248 N -2.38 5.15 0.37 7.72 1.04 -0.86 -4.79 113.70 119.95 1sbp s SER 248 Ca 0.26 1.81 0.10 0.00 0.48 0.00 0.00 55.95 58.60 1sbp s SER 248 Cb 0.19 -2.52 0.85 0.00 0.10 0.00 0.00 66.02 64.64 1sbp s SER 248 CO 0.48 -1.60 1.91 -0.65 0.98 0.00 0.00 173.24 174.36 1sbp h PRO 249 N -0.40 0.63 -0.23 4.02 0.11 -1.92 0.12 132.00 134.33 1sbp h PRO 249 Ca -0.45 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 1sbp h PRO 249 Cb 1.23 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1sbp h PRO 249 CO 0.55 0.41 -0.11 1.49 -0.21 0.00 0.00 178.00 180.13 1sbp h GLU 250 N 0.65 0.48 -0.48 1.05 4.81 -1.92 -1.87 114.58 117.29 1sbp h GLU 250 Ca 0.39 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1sbp h GLU 250 Cb 0.61 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 1sbp h GLU 250 CO -0.15 0.76 0.22 0.78 -0.73 0.00 0.00 179.01 179.88 1sbp h GLY 251 N 0.19 0.76 1.02 1.92 0.00 -1.50 -1.86 103.07 103.60 1sbp h GLY 251 Ca 0.05 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 1sbp h GLY 251 CO 0.03 0.37 0.36 1.46 0.00 0.00 0.00 176.54 178.76 1sbp h GLN 252 N 0.64 1.11 -0.56 4.80 1.08 -0.68 -0.71 115.11 120.78 1sbp h GLN 252 Ca 0.16 -0.17 -0.11 0.00 -1.45 0.00 0.00 58.65 57.08 1sbp h GLN 252 Cb 0.14 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 1sbp h GLN 252 CO -0.02 0.87 -0.09 1.49 -0.95 0.00 0.00 178.83 180.13 1sbp h GLU 253 N 1.08 1.05 -0.62 1.46 4.81 -1.11 -0.71 114.58 120.54 1sbp h GLU 253 Ca 0.26 -0.38 -0.04 0.00 -0.13 0.00 0.00 59.36 59.07 1sbp h GLU 253 Cb 0.13 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1sbp h GLU 253 CO -0.03 1.07 0.24 0.82 -0.73 0.00 0.00 179.01 180.38 1sbp h ILE 254 N 0.93 1.24 0.28 2.32 2.04 -1.16 -0.02 117.51 123.13 1sbp h ILE 254 Ca 0.15 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1sbp h ILE 254 Cb 0.66 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1sbp h ILE 254 CO 0.05 0.29 -0.15 0.00 0.00 0.00 0.00 178.15 178.34 1sbp h ALA 255 N 1.09 -0.39 -0.59 1.87 0.00 -0.71 -2.49 119.26 118.04 1sbp h ALA 255 Ca 0.21 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1sbp h ALA 255 Cb 0.22 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1sbp h ALA 255 CO -0.01 -0.73 0.24 0.00 0.00 0.00 0.00 179.25 178.75 1sbp h ALA 256 N 0.32 0.76 -0.04 0.00 0.00 -0.91 -1.86 119.26 117.53 1sbp h ALA 256 Ca -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1sbp h ALA 256 Cb 0.32 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1sbp h ALA 256 CO 0.05 -0.15 -0.02 0.87 0.00 0.00 0.00 179.25 180.00 1sbp h LYS 257 N 0.45 0.05 -0.63 0.00 1.57 -0.88 -1.50 116.57 115.62 1sbp h LYS 257 Ca 0.29 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1sbp h LYS 257 Cb 0.30 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1sbp h LYS 257 CO -0.26 0.08 0.00 0.09 -0.57 0.00 0.00 179.45 178.79 1sbp n ASN 258 N -4.48 3.87 -0.70 0.86 4.13 -0.83 -4.95 115.26 113.16 1sbp n ASN 258 Ca -0.02 -2.40 -0.06 0.00 1.68 0.00 0.00 54.58 53.77 1sbp n ASN 258 Cb 0.13 -0.53 -0.01 0.00 -1.54 0.00 0.00 39.78 37.83 1sbp n ASN 258 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1sbp n PHE 259 N 0.73 -0.27 -4.22 3.10 3.72 -0.57 -4.92 117.46 115.04 1sbp n PHE 259 Ca 0.20 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.25 1sbp n PHE 259 Cb 0.75 -1.85 -0.08 0.00 -0.94 0.00 0.00 39.48 37.36 1sbp n PHE 259 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 1sbp s TYR 260 N -2.31 3.24 -0.18 1.38 2.02 -0.76 -3.79 117.35 116.95 1sbp s TYR 260 Ca 0.00 0.23 -0.29 0.00 -0.37 0.00 0.00 57.07 56.64 1sbp s TYR 260 Cb 0.00 -1.78 -0.01 0.00 -0.40 0.00 0.00 41.96 39.78 1sbp s TYR 260 CO 0.00 0.53 1.17 1.03 -1.57 0.00 0.00 175.55 176.71 1sbp s ARG 261 N -1.24 4.26 0.59 -0.62 0.52 -0.50 -3.52 118.95 118.44 1sbp s ARG 261 Ca 0.17 1.54 -0.14 0.00 -0.52 0.00 0.00 55.73 56.79 1sbp s ARG 261 Cb -0.12 -3.69 -0.05 0.00 0.52 0.00 0.00 34.95 31.62 1sbp s ARG 261 CO 0.07 -0.64 1.02 -1.25 0.02 0.00 0.00 175.30 174.53 1sbp s PRO 262 N 3.21 3.56 -0.10 3.54 0.04 -1.26 -1.64 135.00 142.35 1sbp s PRO 262 Ca 0.51 0.94 0.01 0.00 0.04 0.00 0.00 61.00 62.50 1sbp s PRO 262 Cb -0.19 -2.08 -0.25 0.00 0.04 0.00 0.00 34.50 32.02 1sbp s PRO 262 CO 0.12 -0.60 0.43 0.54 0.04 0.00 0.00 177.00 177.54 1sbp n ARG 263 N -2.26 0.71 -1.77 4.56 1.74 -1.26 -4.80 116.66 113.57 1sbp n ARG 263 Ca 0.07 0.26 -0.42 0.00 -0.77 0.00 0.00 57.85 56.99 1sbp n ARG 263 Cb 0.54 -1.72 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 1sbp n ARG 263 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1sbp s ASP 264 N -6.64 6.34 0.30 0.55 -1.08 -1.26 -4.88 116.67 110.00 1sbp s ASP 264 Ca -0.16 2.37 0.03 0.00 -0.52 0.00 0.00 52.55 54.27 1sbp s ASP 264 Cb 0.07 -2.53 0.63 0.00 -1.46 0.00 0.00 42.92 39.64 1sbp s ASP 264 CO 0.78 -1.18 1.84 0.00 0.52 0.00 0.00 175.17 177.13 1sbp h ALA 265 N 11.05 1.61 -0.66 3.66 0.00 -1.99 -0.74 119.26 132.20 1sbp h ALA 265 Ca -0.45 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 1sbp h ALA 265 Cb 1.22 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1sbp h ALA 265 CO 0.95 0.14 0.21 -0.44 0.00 0.00 0.00 179.25 180.11 1sbp h ASP 266 N 0.91 0.93 -0.02 0.00 3.32 -2.00 -1.81 116.42 117.75 1sbp h ASP 266 Ca 0.49 -0.16 -0.19 0.00 0.02 0.00 0.00 57.03 57.19 1sbp h ASP 266 Cb 0.57 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.89 1sbp h ASP 266 CO -0.26 0.87 -0.71 0.58 -1.72 0.00 0.00 179.24 178.00 1sbp h VAL 267 N 0.97 1.37 -1.01 -1.35 2.07 -1.67 -2.97 116.25 113.66 1sbp h VAL 267 Ca 0.22 -2.08 0.05 0.00 0.82 0.00 0.00 66.70 65.70 1sbp h VAL 267 Cb 0.27 2.44 -0.06 0.00 -1.52 0.00 0.00 31.29 32.42 1sbp h VAL 267 CO -0.01 0.62 0.66 0.00 0.02 0.00 0.00 177.57 178.86 1sbp h ALA 268 N 0.38 1.36 -0.50 1.67 0.00 -1.03 -1.50 119.26 119.63 1sbp h ALA 268 Ca -0.08 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1sbp h ALA 268 Cb 1.40 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 1sbp h ALA 268 CO 0.14 0.53 -0.01 -0.22 0.00 0.00 0.00 179.25 179.69 1sbp h LYS 269 N 1.25 0.89 -0.35 0.00 3.11 -1.38 -0.70 116.57 119.38 1sbp h LYS 269 Ca 0.41 -0.29 -0.07 0.00 -2.81 0.00 0.00 60.65 57.89 1sbp h LYS 269 Cb 0.05 -0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 31.19 1sbp h LYS 269 CO -0.14 0.92 -0.09 -0.22 -2.81 0.00 0.00 179.45 177.11 1sbp h LYS 270 N 0.75 0.60 -0.15 1.90 3.64 -1.26 -3.27 116.57 118.77 1sbp h LYS 270 Ca 0.14 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 1sbp h LYS 270 Cb 0.53 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 1sbp h LYS 270 CO 0.03 0.68 -0.07 0.66 -2.27 0.00 0.00 179.45 178.49 1sbp n TYR 271 N -4.20 0.53 -0.15 1.91 4.01 -0.61 -4.82 117.16 113.83 1sbp n TYR 271 Ca 0.01 -1.11 -0.11 0.00 -0.16 0.00 0.00 57.90 56.53 1sbp n TYR 271 Cb 0.32 -0.28 -0.08 0.00 -0.31 0.00 0.00 39.34 38.99 1sbp n TYR 271 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 1sbp h ASP 272 N 0.92 -1.58 0.00 7.72 1.82 -1.18 -2.85 116.42 121.27 1sbp h ASP 272 Ca 0.04 0.21 0.00 0.00 -0.39 0.00 0.00 57.03 56.89 1sbp h ASP 272 Cb 1.28 0.66 0.00 0.00 0.68 0.00 0.00 39.33 41.94 1sbp h ASP 272 CO 0.15 -0.32 0.13 -0.90 -1.61 0.00 0.00 179.24 176.69 1sbp n ASP 273 N -4.91 0.40 0.10 2.28 5.75 -1.26 -2.82 116.55 116.08 1sbp n ASP 273 Ca -0.02 0.63 -0.03 0.00 -0.01 0.00 0.00 54.79 55.36 1sbp n ASP 273 Cb 0.27 -0.65 -0.05 0.00 -1.03 0.00 0.00 41.12 39.67 1sbp n ASP 273 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1sbp h ALA 274 N 1.63 0.50 -3.05 2.12 0.00 -1.90 -3.46 119.26 115.11 1sbp h ALA 274 Ca 0.00 -0.72 -0.64 0.00 0.00 0.00 0.00 54.91 53.56 1sbp h ALA 274 Cb 0.26 -0.13 -0.19 0.00 0.00 0.00 0.00 17.79 17.73 1sbp h ALA 274 CO 0.00 0.98 -0.59 -0.06 0.00 0.00 0.00 179.25 179.58 1sbp s PHE 275 N -2.84 3.16 0.80 0.00 0.08 -1.13 -5.08 117.98 112.97 1sbp s PHE 275 Ca 0.02 -0.17 -0.14 0.00 0.12 0.00 0.00 56.93 56.77 1sbp s PHE 275 Cb 0.09 -2.21 0.07 0.00 -0.57 0.00 0.00 43.02 40.40 1sbp s PHE 275 CO 0.79 -0.16 1.11 -0.35 -0.10 0.00 0.00 175.22 176.51 1sbp n PRO 276 N 4.48 0.19 -4.20 0.24 -0.04 -1.26 -4.99 135.00 129.42 1sbp n PRO 276 Ca -0.16 0.14 -0.35 0.00 -0.04 0.00 0.00 63.50 63.09 1sbp n PRO 276 Cb 0.52 -2.36 -0.09 0.00 -0.04 0.00 0.00 33.50 31.52 1sbp n PRO 276 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 1sbp s LYS 277 N -3.95 3.47 0.15 0.54 2.20 -1.26 -5.08 119.74 115.81 1sbp s LYS 277 Ca 0.72 -0.37 -0.24 0.00 -0.36 0.00 0.00 55.97 55.73 1sbp s LYS 277 Cb -0.30 -3.00 0.07 0.00 -1.51 0.00 0.00 37.83 33.10 1sbp s LYS 277 CO 0.52 0.50 0.67 -0.48 -0.36 0.00 0.00 175.35 176.20 1sbp s LEU 278 N -0.31 -0.49 0.05 5.43 2.34 -1.26 -5.06 118.68 119.38 1sbp s LEU 278 Ca 0.07 -0.08 -0.31 0.00 0.06 0.00 0.00 54.13 53.88 1sbp s LEU 278 Cb -0.12 2.51 -0.06 0.00 -0.56 0.00 0.00 46.19 47.96 1sbp s LEU 278 CO 0.02 -0.96 1.27 -0.75 -1.06 0.00 0.00 176.35 174.88 1sbp s LYS 279 N -3.65 4.37 -0.04 1.48 2.20 -1.24 -4.96 119.74 117.90 1sbp s LYS 279 Ca 0.03 1.86 0.07 0.00 -0.36 0.00 0.00 55.97 57.57 1sbp s LYS 279 Cb -0.02 -3.39 -0.01 0.00 -1.51 0.00 0.00 37.83 32.90 1sbp s LYS 279 CO -0.10 -0.37 -0.24 -0.51 -0.36 0.00 0.00 175.35 173.77 1sbp s LEU 280 N 1.42 2.04 0.30 5.43 1.43 -1.26 -0.78 118.68 127.26 1sbp s LEU 280 Ca 0.61 -0.47 0.08 0.00 -1.03 0.00 0.00 54.13 53.32 1sbp s LEU 280 Cb -0.31 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.59 1sbp s LEU 280 CO 0.28 0.26 0.10 0.72 0.23 0.00 0.00 176.35 177.94 1sbp s PHE 281 N -0.32 2.79 0.39 0.29 -0.12 -0.22 -4.87 117.98 115.91 1sbp s PHE 281 Ca 0.02 -0.27 0.08 0.00 -0.05 0.00 0.00 56.93 56.71 1sbp s PHE 281 Cb -0.12 -1.43 -0.05 0.00 -0.63 0.00 0.00 43.02 40.79 1sbp s PHE 281 CO 0.02 0.47 0.18 0.95 -0.05 0.00 0.00 175.22 176.79 1sbp s THR 282 N -2.33 2.58 0.28 -4.49 -4.23 -1.26 -1.06 115.64 105.13 1sbp s THR 282 Ca 0.35 -1.67 0.06 0.00 -1.18 0.00 0.00 61.69 59.24 1sbp s THR 282 Cb -0.05 -2.98 0.02 0.00 1.34 0.00 0.00 72.50 70.83 1sbp s THR 282 CO 0.22 -0.07 1.66 -0.29 -0.54 0.00 0.00 174.62 175.61 1sbp h ILE 283 N 1.44 1.33 -0.31 2.99 2.10 -1.99 -1.81 117.51 121.26 1sbp h ILE 283 Ca -0.43 -1.65 -0.10 0.00 1.08 0.00 0.00 64.86 63.76 1sbp h ILE 283 Cb 1.25 1.78 -0.01 0.00 -1.09 0.00 0.00 36.82 38.75 1sbp h ILE 283 CO 0.66 0.49 -0.20 0.44 -1.08 0.00 0.00 178.15 178.47 1sbp h ASP 284 N 0.19 0.71 -0.05 2.19 3.32 -1.91 0.53 116.42 121.39 1sbp h ASP 284 Ca 0.01 -0.43 -0.21 0.00 0.02 0.00 0.00 57.03 56.43 1sbp h ASP 284 Cb 0.90 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 40.26 1sbp h ASP 284 CO 0.07 0.99 -0.77 1.05 -1.72 0.00 0.00 179.24 178.86 1sbp h GLU 285 N 0.44 0.62 0.04 3.56 4.11 -1.94 -2.72 114.58 118.69 1sbp h GLU 285 Ca 0.06 -0.60 -0.31 0.00 0.07 0.00 0.00 59.36 58.59 1sbp h GLU 285 Cb 0.74 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 30.11 1sbp h GLU 285 CO 0.05 1.21 -1.73 0.28 0.07 0.00 0.00 179.01 178.89 1sbp h VAL 286 N 0.26 0.86 -0.01 -1.06 2.07 -1.38 -3.41 116.25 113.58 1sbp h VAL 286 Ca -0.08 -2.66 0.00 0.00 0.82 0.00 0.00 66.70 64.78 1sbp h VAL 286 Cb 1.44 2.49 0.00 0.00 -1.52 0.00 0.00 31.29 33.69 1sbp h VAL 286 CO 0.16 0.63 0.00 0.49 0.02 0.00 0.00 177.57 178.87 1sbp n PHE 287 N -3.19 0.01 -1.10 1.57 3.72 0.14 -5.01 117.46 113.58 1sbp n PHE 287 Ca -0.20 -0.03 -0.02 0.00 -0.05 0.00 0.00 57.45 57.16 1sbp n PHE 287 Cb 1.05 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.58 1sbp n PHE 287 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sbp n GLY 288 N 0.10 0.51 0.00 1.37 0.00 -0.95 -4.06 105.19 102.16 1sbp n GLY 288 Ca 0.01 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1sbp n GLY 288 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sbp n GLY 289 N -2.69 0.00 0.37 -0.02 0.00 -1.01 -4.49 105.19 97.34 1sbp n GLY 289 Ca -0.02 -1.76 0.04 0.00 0.00 0.00 0.00 46.02 44.28 1sbp n GLY 289 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1sbp h TRP 290 N 0.00 1.05 -0.18 1.61 4.06 -1.90 -1.55 115.95 119.04 1sbp h TRP 290 Ca 0.00 0.03 0.02 0.00 2.06 0.00 0.00 58.89 60.99 1sbp h TRP 290 Cb 0.00 -0.35 -0.02 0.00 -1.00 0.00 0.00 29.16 27.80 1sbp h TRP 290 CO 0.00 0.56 0.07 0.00 -3.56 0.00 0.00 178.44 175.50 1sbp h ALA 291 N 1.51 0.20 0.05 1.49 0.00 -1.96 0.12 119.26 120.67 1sbp h ALA 291 Ca 0.39 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 1sbp h ALA 291 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1sbp h ALA 291 CO -0.14 -0.36 -0.02 -0.22 0.00 0.00 0.00 179.25 178.50 1sbp h LYS 292 N 0.16 -0.06 -0.08 0.00 3.64 -1.76 -2.54 116.57 115.93 1sbp h LYS 292 Ca 0.08 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.48 1sbp h LYS 292 Cb 0.04 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1sbp h LYS 292 CO -0.07 0.32 -0.04 0.00 -2.27 0.00 0.00 179.45 177.38 1sbp h ALA 293 N 0.47 0.03 -0.57 5.00 0.00 -1.18 -0.79 119.26 122.21 1sbp h ALA 293 Ca -0.01 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1sbp h ALA 293 Cb 0.41 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.24 1sbp h ALA 293 CO 0.01 -0.51 0.28 0.37 0.00 0.00 0.00 179.25 179.41 1sbp h GLN 294 N -0.04 0.52 0.57 0.00 5.75 -0.99 0.77 115.11 121.70 1sbp h GLN 294 Ca 0.04 -0.03 -0.02 0.00 -0.15 0.00 0.00 58.65 58.49 1sbp h GLN 294 Cb 0.10 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 1sbp h GLN 294 CO -0.10 0.34 -0.36 -0.22 -2.65 0.00 0.00 178.83 175.84 1sbp h LYS 295 N 0.53 -0.86 -0.42 1.69 3.64 -0.98 0.69 116.57 120.86 1sbp h LYS 295 Ca 0.26 0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1sbp h LYS 295 Cb 0.20 0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.19 1sbp h LYS 295 CO -0.19 -0.57 0.26 -0.44 -2.27 0.00 0.00 179.45 176.23 1sbp h ASP 296 N -0.89 0.43 0.00 4.20 3.32 -1.07 -3.32 116.42 119.08 1sbp h ASP 296 Ca -0.07 -0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.67 1sbp h ASP 296 Cb 0.73 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 40.13 1sbp h ASP 296 CO 0.06 0.31 -2.19 1.41 -1.72 0.00 0.00 179.24 177.11 1sbp n HIS 297 N -4.83 0.00 0.34 4.55 8.25 0.26 -1.54 115.22 122.24 1sbp n HIS 297 Ca 0.01 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.51 1sbp n HIS 297 Cb 0.05 -0.82 -0.04 0.00 1.12 0.00 0.00 29.99 30.30 1sbp n HIS 297 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1sbp n PHE 298 N -2.97 0.00 -1.59 4.41 3.72 0.07 -1.26 117.46 119.84 1sbp n PHE 298 Ca -0.35 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 56.76 1sbp n PHE 298 Cb 0.94 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 39.57 1sbp n PHE 298 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1sbp s ALA 299 N -1.66 2.28 0.10 4.37 0.00 -0.25 -4.87 121.76 121.73 1sbp s ALA 299 Ca 0.03 -0.25 -0.35 0.00 0.00 0.00 0.00 51.96 51.38 1sbp s ALA 299 Cb 0.05 -3.09 -0.15 0.00 0.00 0.00 0.00 23.12 19.94 1sbp s ALA 299 CO 0.29 -1.72 1.51 -0.25 0.00 0.00 0.00 175.76 175.60 1sbp n ASP 300 N -3.42 2.54 -0.29 0.00 9.92 -1.26 -1.19 116.55 122.85 1sbp n ASP 300 Ca 0.07 1.09 -0.04 0.00 -0.53 0.00 0.00 54.79 55.38 1sbp n ASP 300 Cb 0.57 -1.32 -0.02 0.00 -0.64 0.00 0.00 41.12 39.71 1sbp n ASP 300 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1sbp n GLY 301 N 3.17 0.66 0.21 0.44 0.00 -1.26 -5.03 105.19 103.38 1sbp n GLY 301 Ca 0.18 -0.51 -0.02 0.00 0.00 0.00 0.00 46.02 45.68 1sbp n GLY 301 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sbp n GLY 302 N -2.13 -1.41 0.22 -0.02 0.00 -0.33 -4.74 105.19 96.77 1sbp n GLY 302 Ca -0.04 -1.63 -0.02 0.00 0.00 0.00 0.00 46.02 44.34 1sbp n GLY 302 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1sbp h THR 303 N -1.15 0.84 -0.28 2.61 2.02 -1.26 -1.63 112.91 114.06 1sbp h THR 303 Ca -0.02 -0.15 0.03 0.00 0.77 0.00 0.00 66.41 67.04 1sbp h THR 303 Cb 0.07 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 66.81 1sbp h THR 303 CO 0.02 0.08 0.10 0.15 0.37 0.00 0.00 175.52 176.24 1sbp h PHE 304 N 0.43 0.19 -0.95 3.16 3.57 -1.46 -1.37 116.94 120.50 1sbp h PHE 304 Ca 0.27 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.79 1sbp h PHE 304 Cb 0.28 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.93 1sbp h PHE 304 CO -0.15 0.09 0.63 -0.44 -2.23 0.00 0.00 178.31 176.21 1sbp h ASP 305 N 0.23 1.10 0.09 0.41 3.32 -1.68 -2.36 116.42 117.53 1sbp h ASP 305 Ca 0.12 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 1sbp h ASP 305 Cb 0.08 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.36 1sbp h ASP 305 CO -0.12 0.80 -0.04 1.56 -1.72 0.00 0.00 179.24 179.72 1sbp h GLN 306 N 1.30 -0.11 0.00 3.56 4.20 -0.74 -2.87 115.11 120.45 1sbp h GLN 306 Ca 0.35 0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.07 1sbp h GLN 306 Cb -0.14 0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.67 1sbp h GLN 306 CO -0.07 0.04 0.00 -0.84 -0.67 0.00 0.00 178.83 177.28 1sbp h ILE 307 N -0.24 0.00 0.00 2.54 3.07 -1.14 -2.98 117.51 118.76 1sbp h ILE 307 Ca -0.01 -0.52 -0.18 0.00 1.55 0.00 0.00 64.86 65.70 1sbp h ILE 307 Cb 0.20 1.45 -0.03 0.00 -0.27 0.00 0.00 36.82 38.17 1sbp h ILE 307 CO 0.02 0.00 -0.86 0.28 -1.05 0.00 0.00 178.15 176.54 1sbp h SER 308 N 0.00 0.00 -0.00 2.16 0.02 -1.36 -3.46 113.55 110.90 1sbp h SER 308 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1sbp h SER 308 Cb 0.64 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1sbp h SER 308 CO 0.00 0.83 0.00 0.29 -1.14 0.00 0.00 176.83 176.81