#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gbx s ASN -1 N 0.00 5.58 0.00 -3.46 0.01 -1.26 -5.08 114.94 110.72 3gbx s ASN -1 Ca 0.00 -1.73 0.00 0.00 -0.71 0.00 0.00 52.86 50.42 3gbx s ASN -1 Cb 0.00 -1.96 0.00 0.00 0.41 0.00 0.00 41.25 39.70 3gbx s ASN -1 CO 0.00 -0.59 0.00 0.00 -1.51 0.00 0.00 177.10 175.00 3gbx n ALA 0 N 4.85 0.81 0.00 0.60 0.00 -1.26 -2.29 120.51 123.23 3gbx n ALA 0 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3gbx n ALA 0 Cb 0.42 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.28 3gbx n ALA 0 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gbx n LEU 2 N 0.68 0.00 -4.77 0.00 4.77 -1.26 -4.97 117.00 111.45 3gbx n LEU 2 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 3gbx n LEU 2 Cb 0.00 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 3gbx n LEU 2 CO 0.00 0.00 0.84 -1.59 -1.33 0.00 0.00 177.39 175.31 3gbx s LYS 3 N 0.00 3.75 0.01 3.23 -2.85 -0.97 -4.93 119.74 117.97 3gbx s LYS 3 Ca 0.00 1.80 0.29 0.00 -1.00 0.00 0.00 55.97 57.06 3gbx s LYS 3 Cb 0.00 -2.41 1.21 0.00 -2.06 0.00 0.00 37.83 34.57 3gbx s LYS 3 CO 0.00 -0.57 1.91 2.89 0.10 0.00 0.00 175.35 179.68 3gbx n ARG 4 N -0.48 0.01 0.00 1.78 1.85 -1.26 -4.98 116.66 113.58 3gbx n ARG 4 Ca 0.07 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.93 3gbx n ARG 4 Cb 0.48 -1.51 0.00 0.00 -1.05 0.00 0.00 32.46 30.38 3gbx n ARG 4 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 3gbx n GLU 5 N -1.53 0.00 -2.82 2.89 0.28 -1.26 -5.07 120.64 113.13 3gbx n GLU 5 Ca 0.07 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 57.06 3gbx n GLU 5 Cb 0.34 -0.54 0.01 0.00 1.43 0.00 0.00 31.44 32.69 3gbx n GLU 5 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 3gbx n ASN 7 N 0.00 -0.94 -0.20 -1.84 0.23 -1.26 -5.05 115.26 106.20 3gbx n ASN 7 Ca 0.00 -1.47 -0.08 0.00 -0.53 0.00 0.00 54.58 52.50 3gbx n ASN 7 Cb 0.00 1.52 0.05 0.00 -2.08 0.00 0.00 39.78 39.27 3gbx n ASN 7 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 3gbx h ILE 8 N 1.55 1.26 -1.00 1.53 2.04 -1.97 -1.35 117.51 119.58 3gbx h ILE 8 Ca -0.15 -1.13 0.02 0.00 1.00 0.00 0.00 64.86 64.61 3gbx h ILE 8 Cb 0.67 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 3gbx h ILE 8 CO 0.20 0.41 0.66 0.00 0.00 0.00 0.00 178.15 179.42 3gbx h ALA 9 N 1.04 1.30 -0.17 1.87 0.00 -1.95 0.12 119.26 121.46 3gbx h ALA 9 Ca 0.17 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 3gbx h ALA 9 Cb 0.54 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3gbx h ALA 9 CO 0.03 0.60 -0.51 -0.44 0.00 0.00 0.00 179.25 178.92 3gbx h ASP 10 N 1.30 0.53 0.16 0.00 3.32 -1.88 -3.36 116.42 116.49 3gbx h ASP 10 Ca 0.38 -0.27 -0.35 0.00 0.02 0.00 0.00 57.03 56.81 3gbx h ASP 10 Cb -0.07 -0.15 -0.05 0.00 0.22 0.00 0.00 39.33 39.28 3gbx h ASP 10 CO -0.10 0.95 -2.14 0.00 -1.72 0.00 0.00 179.24 176.23 3gbx n TYR 11 N -3.97 0.59 -3.07 4.55 9.36 -0.54 -4.81 117.16 119.28 3gbx n TYR 11 Ca -0.03 0.16 -0.18 0.00 3.32 0.00 0.00 57.90 61.18 3gbx n TYR 11 Cb 0.58 -1.09 -0.04 0.00 -0.63 0.00 0.00 39.34 38.16 3gbx n TYR 11 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 3gbx n ASP 12 N -3.15 -1.26 0.04 2.98 -0.08 0.37 -4.99 116.55 110.46 3gbx n ASP 12 Ca -0.32 -2.79 0.01 0.00 -1.51 0.00 0.00 54.79 50.18 3gbx n ASP 12 Cb 1.06 0.32 0.32 0.00 2.34 0.00 0.00 41.12 45.17 3gbx n ASP 12 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3gbx h ALA 13 N 4.56 1.40 -0.51 -1.67 0.00 -1.71 -0.70 119.26 120.63 3gbx h ALA 13 Ca 0.07 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 3gbx h ALA 13 Cb 0.96 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3gbx h ALA 13 CO 0.34 0.42 -0.06 1.49 0.00 0.00 0.00 179.25 181.44 3gbx h GLU 14 N 0.41 0.94 -0.23 0.00 4.81 -1.93 -0.21 114.58 118.37 3gbx h GLU 14 Ca 0.09 -0.33 -0.03 0.00 -0.13 0.00 0.00 59.36 58.95 3gbx h GLU 14 Cb 0.36 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 3gbx h GLU 14 CO 0.02 0.99 0.02 1.25 -0.73 0.00 0.00 179.01 180.55 3gbx h LEU 15 N 0.80 0.39 -0.75 1.64 5.85 -1.77 -2.83 115.31 118.65 3gbx h LEU 15 Ca 0.14 -0.29 0.07 0.00 0.84 0.00 0.00 57.88 58.64 3gbx h LEU 15 Cb 0.60 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.47 3gbx h LEU 15 CO 0.04 0.58 0.43 -0.25 -0.34 0.00 0.00 178.44 178.89 3gbx h TRP 16 N 0.18 0.79 -0.39 1.25 2.91 -0.82 -2.03 115.95 117.84 3gbx h TRP 16 Ca 0.07 0.03 -0.09 0.00 1.13 0.00 0.00 58.89 60.03 3gbx h TRP 16 Cb 0.37 -0.24 -0.02 0.00 -0.51 0.00 0.00 29.16 28.76 3gbx h TRP 16 CO 0.03 0.37 -0.12 1.96 -1.03 0.00 0.00 178.44 179.65 3gbx h GLN 17 N 0.77 0.68 -1.28 2.65 1.08 -1.00 0.71 115.11 118.73 3gbx h GLN 17 Ca 0.34 -0.22 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 3gbx h GLN 17 Cb 0.23 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 3gbx h GLN 17 CO -0.20 0.78 0.00 0.00 -0.95 0.00 0.00 178.83 178.47 3gbx n ALA 18 N -2.48 1.82 0.00 3.87 0.00 -0.76 -1.51 120.51 121.45 3gbx n ALA 18 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 3gbx n ALA 18 Cb 0.35 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.80 3gbx n ALA 18 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3gbx n GLU 20 N 0.67 0.00 0.10 0.00 -0.58 0.24 -2.57 120.64 118.51 3gbx n GLU 20 Ca 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 56.72 3gbx n GLU 20 Cb 0.18 0.00 0.22 0.00 -0.57 0.00 0.00 31.44 31.27 3gbx n GLU 20 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 3gbx h GLN 21 N 0.00 0.20 -0.53 3.49 4.20 -1.51 -2.01 115.11 118.95 3gbx h GLN 21 Ca 0.00 -0.10 -0.12 0.00 0.06 0.00 0.00 58.65 58.49 3gbx h GLN 21 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 3gbx h GLN 21 CO 0.00 0.61 -0.13 1.49 -0.67 0.00 0.00 178.83 180.13 3gbx h GLU 22 N 0.17 1.02 -0.32 1.46 4.57 -1.77 0.13 114.58 119.83 3gbx h GLU 22 Ca 0.01 -0.39 0.04 0.00 -1.18 0.00 0.00 59.36 57.85 3gbx h GLU 22 Cb 0.84 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.33 3gbx h GLU 22 CO 0.07 1.07 0.07 -0.22 -1.18 0.00 0.00 179.01 178.82 3gbx h LYS 23 N 0.90 0.19 -0.35 1.92 3.64 -1.82 -0.90 116.57 120.15 3gbx h LYS 23 Ca 0.14 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.36 3gbx h LYS 23 Cb 0.70 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 3gbx h LYS 23 CO 0.05 0.12 -0.35 0.28 -2.27 0.00 0.00 179.45 177.28 3gbx h VAL 24 N 0.19 1.28 -0.96 2.00 2.07 -1.12 -2.56 116.25 117.15 3gbx h VAL 24 Ca 0.15 -1.52 0.06 0.00 0.82 0.00 0.00 66.70 66.21 3gbx h VAL 24 Cb 0.16 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.25 3gbx h VAL 24 CO -0.19 0.50 0.62 -0.09 0.02 0.00 0.00 177.57 178.42 3gbx h ARG 25 N 0.67 1.10 -0.30 1.57 2.43 -0.67 -0.30 114.38 118.88 3gbx h ARG 25 Ca 0.06 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 3gbx h ARG 25 Cb 0.91 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 3gbx h ARG 25 CO 0.08 0.73 -0.06 1.96 -1.51 0.00 0.00 179.97 181.17 3gbx h GLN 26 N 1.13 0.48 -0.22 0.20 4.20 -0.78 -2.44 115.11 117.68 3gbx h GLN 26 Ca 0.41 -0.12 -0.21 0.00 0.06 0.00 0.00 58.65 58.80 3gbx h GLN 26 Cb 0.14 -0.06 0.01 0.00 0.30 0.00 0.00 27.48 27.86 3gbx h GLN 26 CO -0.16 0.56 -0.67 0.93 -0.67 0.00 0.00 178.83 178.82 3gbx h GLU 27 N 0.45 0.84 -0.09 1.46 4.39 -1.03 -3.39 114.58 117.22 3gbx h GLU 27 Ca 0.09 -0.61 0.00 0.00 0.34 0.00 0.00 59.36 59.18 3gbx h GLU 27 Cb 0.40 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 3gbx h GLU 27 CO 0.02 1.23 0.00 0.39 -1.16 0.00 0.00 179.01 179.49 3gbx n GLU 28 N -3.97 2.00 -4.49 2.33 1.02 -0.21 -4.72 120.64 112.60 3gbx n GLU 28 Ca -0.06 -1.47 -0.28 0.00 -0.02 0.00 0.00 57.16 55.33 3gbx n GLU 28 Cb 0.69 -1.46 -0.13 0.00 -0.02 0.00 0.00 31.44 30.51 3gbx n GLU 28 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3gbx s HIS 29 N -1.91 2.18 -0.27 -0.32 3.76 -0.94 -4.75 115.29 113.04 3gbx s HIS 29 Ca 0.34 -0.39 -0.23 0.00 -0.15 0.00 0.00 55.06 54.63 3gbx s HIS 29 Cb 0.20 -1.22 -0.01 0.00 1.11 0.00 0.00 32.58 32.67 3gbx s HIS 29 CO 0.31 0.25 0.76 0.42 -0.85 0.00 0.00 174.74 175.63 3gbx s ILE 30 N -1.01 4.85 -0.34 0.60 1.01 -0.13 -4.90 121.20 121.29 3gbx s ILE 30 Ca 0.12 1.28 -0.13 0.00 0.00 0.00 0.00 60.65 61.92 3gbx s ILE 30 Cb -0.10 -4.08 -0.02 0.00 0.01 0.00 0.00 42.46 38.27 3gbx s ILE 30 CO 0.05 -0.13 0.24 -1.61 0.00 0.00 0.00 174.94 173.48 3gbx s GLU 31 N 2.81 3.52 -0.03 2.79 2.02 -1.26 -1.08 118.70 127.47 3gbx s GLU 31 Ca 0.31 -0.63 0.04 0.00 0.02 0.00 0.00 54.97 54.71 3gbx s GLU 31 Cb -0.15 -3.80 0.06 0.00 0.10 0.00 0.00 34.13 30.35 3gbx s GLU 31 CO 0.10 -0.43 1.03 1.28 0.02 0.00 0.00 175.26 177.26 3gbx n LEU 32 N 5.10 2.09 -4.67 1.80 4.77 0.50 -3.94 117.00 122.65 3gbx n LEU 32 Ca -0.13 -2.21 -0.42 0.00 -0.03 0.00 0.00 56.01 53.22 3gbx n LEU 32 Cb 0.50 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 3gbx n LEU 32 CO 0.36 0.54 1.30 -0.63 -1.33 0.00 0.00 177.39 177.64 3gbx s ILE 33 N -1.37 3.56 0.30 -0.08 1.01 -1.10 -0.48 121.20 123.04 3gbx s ILE 33 Ca 0.07 0.79 0.35 0.00 0.00 0.00 0.00 60.65 61.85 3gbx s ILE 33 Cb 0.06 -3.51 0.38 0.00 0.01 0.00 0.00 42.46 39.40 3gbx s ILE 33 CO 0.01 -0.05 2.08 0.00 0.00 0.00 0.00 174.94 176.98 3gbx h ALA 34 N 8.97 1.05 -0.01 9.38 0.00 -1.83 -1.41 119.26 135.40 3gbx h ALA 34 Ca -0.39 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3gbx h ALA 34 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3gbx h ALA 34 CO 0.94 0.05 -0.05 -1.13 0.00 0.00 0.00 179.25 179.06 3gbx n SER 35 N -3.21 1.18 -4.89 0.00 3.41 -1.26 -4.76 113.62 104.10 3gbx n SER 35 Ca -0.01 -1.27 -0.32 0.00 -0.26 0.00 0.00 58.87 57.01 3gbx n SER 35 Cb 0.25 0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.17 3gbx n SER 35 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3gbx s GLU 36 N -2.12 3.68 0.38 4.33 2.02 -0.53 -3.81 118.70 122.65 3gbx s GLU 36 Ca 0.36 0.04 -0.10 0.00 0.02 0.00 0.00 54.97 55.28 3gbx s GLU 36 Cb 0.21 -2.85 0.04 0.00 0.10 0.00 0.00 34.13 31.62 3gbx s GLU 36 CO 0.38 0.47 0.68 1.21 0.02 0.00 0.00 175.26 178.02 3gbx s ASN 37 N -2.25 0.39 -0.27 -0.19 3.84 -1.26 -3.89 114.94 111.31 3gbx s ASN 37 Ca 0.40 -1.31 0.03 0.00 0.21 0.00 0.00 52.86 52.19 3gbx s ASN 37 Cb -0.12 0.79 0.07 0.00 -0.55 0.00 0.00 41.25 41.44 3gbx s ASN 37 CO 0.22 -1.57 -0.08 -0.31 -2.79 0.00 0.00 177.10 172.57 3gbx s TYR 38 N -2.48 3.18 0.66 0.43 2.02 -1.26 -5.00 117.35 114.91 3gbx s TYR 38 Ca 0.21 -2.32 -0.11 0.00 -0.37 0.00 0.00 57.07 54.48 3gbx s TYR 38 Cb -0.03 -1.99 -0.01 0.00 -0.40 0.00 0.00 41.96 39.52 3gbx s TYR 38 CO 0.15 -0.87 1.05 -0.08 -1.57 0.00 0.00 175.55 174.23 3gbx s THR 39 N 1.13 4.26 0.70 -0.71 -1.32 -1.26 -4.95 115.64 113.49 3gbx s THR 39 Ca -0.06 0.75 -0.11 0.00 -1.21 0.00 0.00 61.69 61.06 3gbx s THR 39 Cb -0.20 -3.56 0.01 0.00 -1.51 0.00 0.00 72.50 67.24 3gbx s THR 39 CO -0.06 -0.95 1.06 -0.94 -2.21 0.00 0.00 174.62 171.53 3gbx s SER 40 N -3.88 5.30 0.63 8.08 1.04 -1.26 -4.91 113.70 118.70 3gbx s SER 40 Ca 0.57 1.62 0.35 0.00 0.48 0.00 0.00 55.95 58.97 3gbx s SER 40 Cb -0.13 -2.48 2.00 0.00 0.10 0.00 0.00 66.02 65.51 3gbx s SER 40 CO 0.54 -1.50 2.23 -0.65 0.98 0.00 0.00 173.24 174.84 3gbx h PRO 41 N -0.75 0.00 -0.10 4.02 0.11 -2.00 -1.70 132.00 131.58 3gbx h PRO 41 Ca -0.44 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.46 3gbx h PRO 41 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3gbx h PRO 41 CO 0.57 0.00 -0.79 0.00 -0.21 0.00 0.00 178.00 177.57 3gbx h ARG 42 N 0.00 0.58 -0.34 1.05 3.08 -2.00 -0.29 114.38 116.47 3gbx h ARG 42 Ca 0.02 -0.50 0.00 0.00 0.07 0.00 0.00 59.98 59.57 3gbx h ARG 42 Cb 0.19 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.35 3gbx h ARG 42 CO -0.00 1.12 0.00 0.28 -1.07 0.00 0.00 179.97 180.30 3gbx n VAL 43 N -3.87 0.01 0.00 2.04 0.31 -0.64 -1.78 118.33 114.40 3gbx n VAL 43 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 3gbx n VAL 43 Cb 0.75 -0.12 0.00 0.00 -0.91 0.00 0.00 33.84 33.55 3gbx n VAL 43 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 3gbx n GLN 45 N 0.50 0.00 -0.21 5.55 7.27 -0.12 -1.43 117.38 128.94 3gbx n GLN 45 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 57.02 3gbx n GLN 45 Cb 0.03 0.00 0.04 0.00 2.41 0.00 0.00 30.24 32.73 3gbx n GLN 45 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3gbx h ALA 46 N 0.00 0.76 0.00 1.69 0.00 -1.62 -2.56 119.26 117.53 3gbx h ALA 46 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3gbx h ALA 46 Cb 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3gbx h ALA 46 CO 0.00 0.15 -0.06 1.96 0.00 0.00 0.00 179.25 181.30 3gbx h GLN 47 N 0.77 0.00 -0.42 0.00 4.20 -1.35 -2.39 115.11 115.92 3gbx h GLN 47 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 3gbx h GLN 47 Cb -0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.74 3gbx h GLN 47 CO -0.07 0.06 0.00 0.41 -0.67 0.00 0.00 178.83 178.56 3gbx n GLY 48 N -0.23 1.20 3.98 3.46 0.00 -0.99 -4.88 105.19 107.73 3gbx n GLY 48 Ca -0.00 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.24 3gbx n GLY 48 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gbx s SER 49 N -1.18 4.83 0.00 1.61 1.04 -0.90 -4.98 113.70 114.12 3gbx s SER 49 Ca 0.34 -0.15 0.11 0.00 0.48 0.00 0.00 55.95 56.73 3gbx s SER 49 Cb 0.18 -0.49 0.49 0.00 0.10 0.00 0.00 66.02 66.31 3gbx s SER 49 CO 0.25 -1.50 1.34 0.00 0.98 0.00 0.00 173.24 174.31 3gbx n GLN 50 N -2.60 0.03 0.24 4.02 6.02 -1.26 -2.96 117.38 120.87 3gbx n GLN 50 Ca 0.11 0.28 0.16 0.00 -0.01 0.00 0.00 57.00 57.55 3gbx n GLN 50 Cb 0.60 -1.50 0.85 0.00 1.02 0.00 0.00 30.24 31.21 3gbx n GLN 50 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3gbx h LEU 51 N 0.00 0.00 -2.64 1.08 4.07 -1.94 -0.34 115.31 115.54 3gbx h LEU 51 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3gbx h LEU 51 Cb 0.17 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.91 3gbx h LEU 51 CO 0.00 0.00 0.01 0.00 -1.08 0.00 0.00 178.44 177.37 3gbx h THR 52 N 0.00 0.33 -0.00 0.22 1.03 -1.88 -2.28 112.91 110.32 3gbx h THR 52 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.40 3gbx h THR 52 Cb 0.02 0.99 0.00 0.00 -1.07 0.00 0.00 68.15 68.09 3gbx h THR 52 CO 0.00 0.00 -0.14 0.59 -0.01 0.00 0.00 175.52 175.96 3gbx n ASN 53 N -3.56 0.33 -4.74 0.00 3.02 -0.14 -4.91 115.26 105.26 3gbx n ASN 53 Ca -0.03 -0.22 -0.41 0.00 -0.03 0.00 0.00 54.58 53.90 3gbx n ASN 53 Cb 0.09 -0.14 -0.05 0.00 -0.61 0.00 0.00 39.78 39.08 3gbx n ASN 53 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3gbx s LYS 54 N -2.70 4.70 0.03 3.52 2.20 -0.86 -5.20 119.74 121.42 3gbx s LYS 54 Ca 0.22 1.39 0.26 0.00 -0.36 0.00 0.00 55.97 57.47 3gbx s LYS 54 Cb 0.19 -3.35 0.63 0.00 -1.51 0.00 0.00 37.83 33.80 3gbx s LYS 54 CO 0.53 0.31 1.51 0.98 -0.36 0.00 0.00 175.35 178.32 3gbx n TYR 55 N 2.43 0.14 0.00 4.03 4.19 -1.26 -4.98 117.16 121.71 3gbx n TYR 55 Ca 0.00 0.04 0.00 0.00 3.31 0.00 0.00 57.90 61.25 3gbx n TYR 55 Cb 0.49 -0.40 0.00 0.00 0.49 0.00 0.00 39.34 39.92 3gbx n TYR 55 CO 0.00 0.00 0.00 -3.47 0.91 0.00 0.00 176.86 174.30 3gbx n ASP 72 N -1.64 0.00 -0.33 2.98 -0.08 -1.26 -4.98 116.55 111.24 3gbx n ASP 72 Ca 0.05 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.46 3gbx n ASP 72 Cb 0.36 0.05 0.31 0.00 2.34 0.00 0.00 41.12 44.17 3gbx n ASP 72 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 3gbx h VAL 73 N 0.00 0.64 -0.01 5.18 2.07 -2.05 0.35 116.25 122.43 3gbx h VAL 73 Ca 0.00 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3gbx h VAL 73 Cb 0.00 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 29.72 3gbx h VAL 73 CO 0.00 0.12 0.01 0.58 0.02 0.00 0.00 177.57 178.29 3gbx h VAL 74 N 0.63 1.06 -0.75 2.57 2.07 -2.00 -0.54 116.25 119.30 3gbx h VAL 74 Ca 0.56 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.93 3gbx h VAL 74 Cb 0.93 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 3gbx h VAL 74 CO -0.42 0.05 0.47 -0.08 0.02 0.00 0.00 177.57 177.60 3gbx h GLU 75 N -0.06 0.87 -0.93 1.57 4.81 -1.85 -2.47 114.58 116.52 3gbx h GLU 75 Ca 0.00 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3gbx h GLU 75 Cb 0.08 -0.20 -0.05 0.00 0.63 0.00 0.00 28.75 29.22 3gbx h GLU 75 CO -0.00 0.57 0.61 0.37 -0.73 0.00 0.00 179.01 179.83 3gbx h GLN 76 N 0.89 1.22 -0.47 1.92 5.75 -0.56 0.05 115.11 123.90 3gbx h GLN 76 Ca 0.31 -0.08 0.01 0.00 -0.15 0.00 0.00 58.65 58.75 3gbx h GLN 76 Cb 0.07 -0.27 -0.03 0.00 1.07 0.00 0.00 27.48 28.32 3gbx h GLN 76 CO -0.13 0.81 0.30 -0.07 -2.65 0.00 0.00 178.83 177.09 3gbx h LEU 77 N 1.26 0.51 -0.02 -2.39 3.38 -0.77 0.15 115.31 117.42 3gbx h LEU 77 Ca 0.34 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.30 3gbx h LEU 77 Cb -0.14 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.48 3gbx h LEU 77 CO -0.07 0.37 0.01 0.00 0.09 0.00 0.00 178.44 178.84 3gbx h ALA 78 N 1.18 0.03 -0.17 1.53 0.00 -1.00 -1.31 119.26 119.53 3gbx h ALA 78 Ca 0.18 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.10 3gbx h ALA 78 Cb -0.05 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 3gbx h ALA 78 CO -0.05 -0.44 -0.20 0.82 0.00 0.00 0.00 179.25 179.38 3gbx h ILE 79 N -0.03 0.49 -0.74 0.00 2.04 -0.86 -0.10 117.51 118.30 3gbx h ILE 79 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 3gbx h ILE 79 Cb 0.07 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.60 3gbx h ILE 79 CO -0.00 0.00 0.42 0.44 0.00 0.00 0.00 178.15 179.01 3gbx h ASP 80 N -0.23 0.91 0.14 1.72 3.32 -0.86 -1.28 116.42 120.14 3gbx h ASP 80 Ca 0.11 -0.08 -0.17 0.00 0.02 0.00 0.00 57.03 56.91 3gbx h ASP 80 Cb 0.40 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3gbx h ASP 80 CO -0.30 0.73 -0.62 0.03 -1.72 0.00 0.00 179.24 177.36 3gbx h ARG 81 N 1.02 0.47 -0.40 3.56 3.08 -1.02 -0.89 114.38 120.20 3gbx h ARG 81 Ca 0.26 -0.33 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 3gbx h ARG 81 Cb 0.01 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3gbx h ARG 81 CO -0.05 0.94 0.13 0.00 -1.07 0.00 0.00 179.97 179.93 3gbx h ALA 82 N 0.98 0.52 -0.66 0.04 0.00 -0.76 -1.08 119.26 118.29 3gbx h ALA 82 Ca -0.01 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3gbx h ALA 82 Cb 1.17 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 3gbx h ALA 82 CO 0.11 0.16 0.24 0.87 0.00 0.00 0.00 179.25 180.63 3gbx h LYS 83 N 0.50 1.00 -0.50 0.00 1.57 -1.10 -2.31 116.57 115.73 3gbx h LYS 83 Ca 0.13 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 3gbx h LYS 83 Cb 0.25 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 3gbx h LYS 83 CO -0.00 0.85 -0.01 1.49 -0.57 0.00 0.00 179.45 181.21 3gbx h GLU 84 N 0.94 0.89 -0.38 3.15 4.81 -0.98 0.73 114.58 123.74 3gbx h GLU 84 Ca 0.22 -0.29 -0.13 0.00 -0.13 0.00 0.00 59.36 59.03 3gbx h GLU 84 Cb 0.24 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 3gbx h GLU 84 CO -0.01 0.93 -0.29 1.25 -0.73 0.00 0.00 179.01 180.16 3gbx h LEU 85 N 0.75 0.84 -1.12 1.64 5.85 -1.07 -3.18 115.31 119.04 3gbx h LEU 85 Ca 0.14 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.52 3gbx h LEU 85 Cb 0.53 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.33 3gbx h LEU 85 CO 0.03 1.07 -0.39 0.49 -0.34 0.00 0.00 178.44 179.30 3gbx n PHE 86 N -4.09 0.00 -3.33 1.25 3.72 -0.88 -4.80 117.46 109.33 3gbx n PHE 86 Ca -0.01 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.21 3gbx n PHE 86 Cb 0.48 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.08 3gbx n PHE 86 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gbx n GLY 87 N 1.37 -0.23 3.72 1.37 0.00 0.13 -4.90 105.19 106.66 3gbx n GLY 87 Ca 0.10 0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 3gbx n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gbx s ALA 88 N -3.26 3.34 -1.43 4.61 0.00 -0.49 -4.89 121.76 119.64 3gbx s ALA 88 Ca 0.38 -1.44 0.13 0.00 0.00 0.00 0.00 51.96 51.03 3gbx s ALA 88 Cb -0.17 -1.06 0.23 0.00 0.00 0.00 0.00 23.12 22.12 3gbx s ALA 88 CO 0.58 0.36 1.10 -0.40 0.00 0.00 0.00 175.76 177.40 3gbx n ASP 89 N -0.65 2.57 -3.83 0.00 5.68 -0.70 -4.64 116.55 114.99 3gbx n ASP 89 Ca -0.08 -1.76 -0.14 0.00 -0.50 0.00 0.00 54.79 52.31 3gbx n ASP 89 Cb 0.57 -0.13 -0.15 0.00 -1.14 0.00 0.00 41.12 40.27 3gbx n ASP 89 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 3gbx s TYR 90 N -1.07 0.11 -0.00 2.11 5.04 -0.40 -5.00 117.35 118.14 3gbx s TYR 90 Ca 0.21 0.04 -0.02 0.00 -2.44 0.00 0.00 57.07 54.87 3gbx s TYR 90 Cb 0.13 -0.19 -0.00 0.00 0.35 0.00 0.00 41.96 42.24 3gbx s TYR 90 CO 0.18 -0.06 0.03 0.00 -1.34 0.00 0.00 175.55 174.36 3gbx s ALA 91 N 0.57 -0.05 -0.14 3.97 0.00 -1.26 -1.74 121.76 123.10 3gbx s ALA 91 Ca -0.05 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 51.76 3gbx s ALA 91 Cb -0.07 0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.09 3gbx s ALA 91 CO -0.01 -0.09 -0.15 1.21 0.00 0.00 0.00 175.76 176.71 3gbx s ASN 92 N -0.65 2.68 0.00 0.00 3.84 0.10 -4.93 114.94 115.98 3gbx s ASN 92 Ca -0.07 -0.49 0.18 0.00 0.21 0.00 0.00 52.86 52.69 3gbx s ASN 92 Cb -0.04 -1.19 0.41 0.00 -0.55 0.00 0.00 41.25 39.87 3gbx s ASN 92 CO -0.00 -0.03 1.33 1.33 -2.79 0.00 0.00 177.10 176.94 3gbx n VAL 93 N 4.59 0.73 0.14 -5.21 0.24 -1.26 -1.38 118.33 116.18 3gbx n VAL 93 Ca -0.18 -0.87 0.02 0.00 -2.04 0.00 0.00 64.34 61.27 3gbx n VAL 93 Cb 0.50 0.74 0.05 0.00 -1.47 0.00 0.00 33.84 33.65 3gbx n VAL 93 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 3gbx h GLN 94 N 3.40 0.00 -6.93 7.34 4.20 -1.96 -3.46 115.11 117.70 3gbx h GLN 94 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 3gbx h GLN 94 Cb 0.85 0.00 0.09 0.00 0.30 0.00 0.00 27.48 28.72 3gbx h GLN 94 CO 0.00 0.54 0.72 -2.14 -0.67 0.00 0.00 178.83 177.28 3gbx s PRO 95 N -3.01 4.12 0.42 1.46 0.02 -1.26 -4.65 135.00 132.11 3gbx s PRO 95 Ca 0.03 2.42 0.28 0.00 0.02 0.00 0.00 61.00 63.76 3gbx s PRO 95 Cb 0.08 -2.95 1.06 0.00 0.02 0.00 0.00 34.50 32.71 3gbx s PRO 95 CO 0.75 -0.46 1.83 0.45 -0.33 0.00 0.00 177.00 179.24 3gbx h HIS 96 N 3.01 0.00 -3.04 6.54 3.86 -1.91 -1.28 115.15 122.33 3gbx h HIS 96 Ca -0.50 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 58.73 3gbx h HIS 96 Cb 1.24 0.00 -0.08 0.00 1.06 0.00 0.00 27.41 29.63 3gbx h HIS 96 CO 0.54 0.00 0.20 -1.54 0.86 0.00 0.00 177.93 177.98 3gbx s SER 97 N -5.22 -0.38 0.23 2.45 1.04 -1.26 -4.01 113.70 106.54 3gbx s SER 97 Ca 0.04 -0.36 -0.08 0.00 0.48 0.00 0.00 55.95 56.03 3gbx s SER 97 Cb 0.09 0.66 0.20 0.00 0.10 0.00 0.00 66.02 67.07 3gbx s SER 97 CO 0.52 -1.17 1.88 1.23 0.98 0.00 0.00 173.24 176.69 3gbx h GLY 98 N 2.03 1.24 0.95 7.32 0.00 -1.80 -1.76 103.07 111.04 3gbx h GLY 98 Ca -0.26 -0.49 0.02 0.00 0.00 0.00 0.00 47.33 46.59 3gbx h GLY 98 CO 0.31 0.48 0.45 1.76 0.00 0.00 0.00 176.54 179.54 3gbx h SER 99 N 1.18 0.76 -0.26 0.19 0.02 -1.94 -1.04 113.55 112.46 3gbx h SER 99 Ca 0.31 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.18 3gbx h SER 99 Cb -0.09 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 3gbx h SER 99 CO -0.06 0.54 -0.08 -0.61 -1.14 0.00 0.00 176.83 175.48 3gbx h GLN 100 N 0.90 0.64 -0.24 3.45 4.15 -1.90 -0.49 115.11 121.62 3gbx h GLN 100 Ca 0.26 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.50 3gbx h GLN 100 Cb -0.06 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 3gbx h GLN 100 CO -0.08 0.71 0.16 0.00 -1.93 0.00 0.00 178.83 177.69 3gbx h ALA 101 N 1.33 0.30 -0.41 3.38 0.00 -0.79 -1.15 119.26 121.92 3gbx h ALA 101 Ca 0.11 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3gbx h ALA 101 Cb 0.49 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3gbx h ALA 101 CO 0.03 -0.22 0.25 -0.91 0.00 0.00 0.00 179.25 178.40 3gbx h ASN 102 N 0.32 0.49 -0.95 0.00 4.21 -0.87 -2.53 115.58 116.25 3gbx h ASN 102 Ca 0.09 -0.05 0.04 0.00 1.21 0.00 0.00 56.30 57.59 3gbx h ASN 102 Cb -0.03 -0.12 -0.06 0.00 -1.12 0.00 0.00 38.32 36.99 3gbx h ASN 102 CO -0.02 0.39 0.62 0.15 -1.29 0.00 0.00 177.43 177.29 3gbx h PHE 103 N 0.55 1.16 -0.77 1.19 3.57 -0.96 -1.24 116.94 120.45 3gbx h PHE 103 Ca 0.15 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 3gbx h PHE 103 Cb -0.01 -0.39 -0.04 0.00 2.79 0.00 0.00 35.95 38.31 3gbx h PHE 103 CO -0.04 0.66 0.43 0.00 -2.23 0.00 0.00 178.31 177.14 3gbx h ALA 104 N 1.45 0.98 -0.40 2.41 0.00 -0.81 -0.82 119.26 122.06 3gbx h ALA 104 Ca 0.38 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 3gbx h ALA 104 Cb 0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3gbx h ALA 104 CO -0.12 0.48 0.03 0.28 0.00 0.00 0.00 179.25 179.92 3gbx h VAL 105 N 1.06 1.25 -0.36 0.00 2.07 -0.94 -0.06 116.25 119.27 3gbx h VAL 105 Ca 0.27 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 3gbx h VAL 105 Cb 0.01 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 3gbx h VAL 105 CO -0.05 0.32 0.17 1.88 0.02 0.00 0.00 177.57 179.92 3gbx h TYR 106 N 0.53 0.52 0.00 1.57 0.05 -1.02 -1.88 116.97 116.75 3gbx h TYR 106 Ca 0.12 -0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.80 3gbx h TYR 106 Cb 0.43 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 37.99 3gbx h TYR 106 CO 0.03 0.44 -0.36 1.79 -1.05 0.00 0.00 178.16 179.02 3gbx h THR 107 N 0.44 0.69 -0.21 -2.88 1.35 -1.02 0.16 112.91 111.45 3gbx h THR 107 Ca 0.12 -1.69 -0.10 0.00 -0.55 0.00 0.00 66.41 64.19 3gbx h THR 107 Cb 0.12 2.13 -0.00 0.00 -1.73 0.00 0.00 68.15 68.67 3gbx h THR 107 CO -0.02 0.35 -0.27 0.00 -0.25 0.00 0.00 175.52 175.33 3gbx h ALA 108 N 1.64 0.32 0.00 6.62 0.00 -0.86 -3.39 119.26 123.59 3gbx h ALA 108 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3gbx h ALA 108 Cb 1.10 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3gbx h ALA 108 CO 0.05 0.31 -1.50 1.28 0.00 0.00 0.00 179.25 179.39 3gbx n LEU 109 N -4.36 0.06 -4.69 0.00 4.77 -0.72 -4.97 117.00 107.10 3gbx n LEU 109 Ca -0.05 -0.05 -0.25 0.00 -0.03 0.00 0.00 56.01 55.62 3gbx n LEU 109 Cb 0.46 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.48 3gbx n LEU 109 CO 0.43 0.02 -0.30 -0.76 -1.33 0.00 0.00 177.39 175.45 3gbx s LEU 110 N -3.78 3.40 -0.01 2.23 1.43 0.55 -5.08 118.68 117.42 3gbx s LEU 110 Ca -0.04 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 3gbx s LEU 110 Cb 0.09 -2.00 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 3gbx s LEU 110 CO 0.55 0.05 0.05 -1.10 0.23 0.00 0.00 176.35 176.13 3gbx s GLN 111 N -3.25 2.97 0.13 1.70 -1.52 -1.26 -4.69 119.66 113.74 3gbx s GLN 111 Ca 0.29 -0.52 -0.32 0.00 -1.95 0.00 0.00 55.36 52.86 3gbx s GLN 111 Cb -0.08 -2.79 -0.18 0.00 -0.22 0.00 0.00 33.01 29.73 3gbx s GLN 111 CO 0.20 0.64 0.71 -2.30 -0.25 0.00 0.00 175.29 174.30 3gbx n PRO 112 N 1.31 0.01 -0.91 2.91 -0.02 -1.26 -1.04 135.00 136.01 3gbx n PRO 112 Ca -0.14 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 3gbx n PRO 112 Cb 0.53 -1.18 0.00 0.00 -0.02 0.00 0.00 33.50 32.83 3gbx n PRO 112 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gbx n GLY 113 N 1.83 0.70 3.74 -1.23 0.00 0.57 -4.99 105.19 105.80 3gbx n GLY 113 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 3gbx n GLY 113 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gbx s ASP 114 N -2.62 4.49 -0.00 1.61 1.01 -0.20 -4.22 116.67 116.74 3gbx s ASP 114 Ca 0.00 2.20 -0.18 0.00 0.71 0.00 0.00 52.55 55.28 3gbx s ASP 114 Cb 0.00 -2.57 -0.06 0.00 1.01 0.00 0.00 42.92 41.30 3gbx s ASP 114 CO 0.00 -2.05 0.52 -0.89 0.21 0.00 0.00 175.17 172.96 3gbx s THR 115 N -2.16 4.94 0.03 -1.27 2.01 -1.26 -0.83 115.64 117.10 3gbx s THR 115 Ca 0.71 1.09 0.05 0.00 0.31 0.00 0.00 61.69 63.85 3gbx s THR 115 Cb -0.25 -3.85 -0.02 0.00 0.01 0.00 0.00 72.50 68.39 3gbx s THR 115 CO 0.44 0.48 -0.14 -0.69 -0.69 0.00 0.00 174.62 174.02 3gbx s VAL 116 N -0.50 1.07 -0.16 3.82 1.01 0.12 -1.10 120.40 124.66 3gbx s VAL 116 Ca 0.28 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3gbx s VAL 116 Cb -0.18 -0.95 -0.01 0.00 0.00 0.00 0.00 36.38 35.24 3gbx s VAL 116 CO 0.16 0.07 -0.12 -0.22 0.00 0.00 0.00 175.10 174.99 3gbx s LEU 117 N -0.92 2.66 0.00 3.92 2.96 -1.26 0.79 118.68 126.83 3gbx s LEU 117 Ca 0.02 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.53 3gbx s LEU 117 Cb -0.07 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 45.00 3gbx s LEU 117 CO 0.01 0.09 0.00 0.61 -1.32 0.00 0.00 176.35 175.73 3gbx n GLY 118 N 4.07 5.02 0.00 7.98 0.00 -0.80 -0.05 105.19 121.41 3gbx n GLY 118 Ca -0.19 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.16 3gbx n GLY 118 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3gbx n ASN 120 N 0.00 0.00 0.00 1.61 2.04 -0.06 0.55 115.26 119.40 3gbx n ASN 120 Ca 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.14 3gbx n ASN 120 Cb 0.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 3gbx n ASN 120 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 3gbx n LEU 139 N 0.00 0.00 -4.15 -4.53 4.32 -1.26 -2.14 117.00 109.24 3gbx n LEU 139 Ca 0.00 0.00 -0.26 0.00 -0.02 0.00 0.00 56.01 55.73 3gbx n LEU 139 Cb 0.00 0.00 -0.16 0.00 -1.62 0.00 0.00 43.42 41.64 3gbx n LEU 139 CO 0.00 0.00 -0.51 -0.31 -1.22 0.00 0.00 177.39 175.35 3gbx s TYR 140 N 0.00 1.71 -0.51 -1.77 2.02 -1.26 0.21 117.35 117.75 3gbx s TYR 140 Ca 0.00 -0.44 -0.26 0.00 -0.37 0.00 0.00 57.07 55.99 3gbx s TYR 140 Cb 0.00 -1.14 -0.07 0.00 -0.40 0.00 0.00 41.96 40.36 3gbx s TYR 140 CO 0.00 -0.13 2.36 1.21 -1.57 0.00 0.00 175.55 177.42 3gbx s ASN 141 N -0.10 4.49 -0.21 2.29 2.47 -0.01 -4.89 114.94 118.99 3gbx s ASN 141 Ca -0.01 0.99 -0.10 0.00 0.42 0.00 0.00 52.86 54.17 3gbx s ASN 141 Cb -0.10 -2.50 -0.05 0.00 -1.45 0.00 0.00 41.25 37.14 3gbx s ASN 141 CO 0.01 -2.86 0.13 -0.51 -3.72 0.00 0.00 177.10 170.16 3gbx s ILE 142 N 11.99 5.34 -0.29 -5.21 2.07 -1.26 0.14 121.20 133.97 3gbx s ILE 142 Ca 0.95 0.17 -0.09 0.00 -1.41 0.00 0.00 60.65 60.27 3gbx s ILE 142 Cb -0.16 -3.45 -0.01 0.00 0.13 0.00 0.00 42.46 38.97 3gbx s ILE 142 CO 0.25 0.41 0.12 -0.69 -1.91 0.00 0.00 174.94 173.13 3gbx s VAL 143 N 0.56 4.45 0.16 4.00 1.01 0.24 -4.93 120.40 125.89 3gbx s VAL 143 Ca 0.07 -0.41 -0.15 0.00 0.00 0.00 0.00 61.98 61.50 3gbx s VAL 143 Cb -0.12 -3.23 -0.07 0.00 0.00 0.00 0.00 36.38 32.96 3gbx s VAL 143 CO -0.00 0.13 0.58 -2.16 0.00 0.00 0.00 175.10 173.64 3gbx s PRO 144 N 1.60 4.01 -0.11 2.72 0.04 -1.26 -1.90 135.00 140.10 3gbx s PRO 144 Ca 0.05 0.54 -0.00 0.00 0.04 0.00 0.00 61.00 61.62 3gbx s PRO 144 Cb -0.17 -2.91 -0.02 0.00 0.04 0.00 0.00 34.50 31.44 3gbx s PRO 144 CO 0.05 0.46 -0.09 1.52 0.04 0.00 0.00 177.00 178.98 3gbx s TYR 145 N -1.49 2.89 -0.29 0.56 -0.85 0.19 -4.87 117.35 113.49 3gbx s TYR 145 Ca 0.39 -0.29 0.03 0.00 -0.52 0.00 0.00 57.07 56.68 3gbx s TYR 145 Cb -0.15 -1.81 0.07 0.00 0.38 0.00 0.00 41.96 40.45 3gbx s TYR 145 CO 0.19 0.05 -0.06 0.20 -1.52 0.00 0.00 175.55 174.41 3gbx s GLY 146 N -0.12 1.75 0.29 5.49 0.00 -1.26 -0.88 107.32 112.59 3gbx s GLY 146 Ca 0.00 -2.03 -0.28 0.00 0.00 0.00 0.00 44.72 42.42 3gbx s GLY 146 CO 0.03 0.72 0.97 4.51 0.00 0.00 0.00 173.10 179.33 3gbx n ILE 147 N 4.37 2.01 -1.29 0.90 3.06 -0.91 -4.97 119.36 122.54 3gbx n ILE 147 Ca -0.08 -0.50 -0.14 0.00 -2.50 0.00 0.00 62.75 59.53 3gbx n ILE 147 Cb 0.42 -0.94 0.11 0.00 0.54 0.00 0.00 39.64 39.77 3gbx n ILE 147 CO 0.00 0.00 0.00 -0.90 -2.50 0.00 0.00 176.55 173.15 3gbx n ASP 148 N 1.24 -0.33 0.24 9.51 5.75 -1.26 -4.88 116.55 126.82 3gbx n ASP 148 Ca 0.10 -1.14 0.09 0.00 -0.01 0.00 0.00 54.79 53.84 3gbx n ASP 148 Cb 0.32 -0.49 0.58 0.00 -1.03 0.00 0.00 41.12 40.50 3gbx n ASP 148 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 3gbx h GLU 149 N 0.00 0.00 0.00 0.11 4.11 -1.94 -2.08 114.58 114.78 3gbx h GLU 149 Ca -0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.22 3gbx h GLU 149 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3gbx h GLU 149 CO 0.14 0.20 0.00 0.66 0.07 0.00 0.00 179.01 180.08 3gbx h SER 150 N 0.00 0.00 -0.58 3.06 4.64 -1.99 -3.42 113.55 115.26 3gbx h SER 150 Ca -0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.09 3gbx h SER 150 Cb 0.47 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.47 3gbx h SER 150 CO 0.03 0.00 -0.21 0.61 -0.87 0.00 0.00 176.83 176.39 3gbx n GLY 151 N -0.89 1.15 3.28 -0.77 0.00 -0.78 -3.55 105.19 103.62 3gbx n GLY 151 Ca -0.02 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.19 3gbx n GLY 151 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gbx s LYS 152 N -3.02 1.76 0.17 1.61 1.02 -1.26 -4.48 119.74 115.54 3gbx s LYS 152 Ca 0.00 -0.91 -0.31 0.00 0.02 0.00 0.00 55.97 54.77 3gbx s LYS 152 Cb 0.00 -1.79 -0.10 0.00 -0.52 0.00 0.00 37.83 35.43 3gbx s LYS 152 CO 0.00 0.48 1.54 0.42 -0.92 0.00 0.00 175.35 176.86 3gbx s ILE 153 N -0.65 2.68 -0.54 2.17 1.01 -1.26 -4.14 121.20 120.48 3gbx s ILE 153 Ca 0.09 0.50 -0.17 0.00 0.00 0.00 0.00 60.65 61.07 3gbx s ILE 153 Cb -0.09 -3.32 0.11 0.00 0.01 0.00 0.00 42.46 39.17 3gbx s ILE 153 CO 0.00 0.04 0.53 -0.62 0.00 0.00 0.00 174.94 174.90 3gbx s ASP 154 N 1.03 6.18 0.37 3.58 -1.08 -1.26 -4.92 116.67 120.58 3gbx s ASP 154 Ca 0.68 -1.56 0.11 0.00 -0.52 0.00 0.00 52.55 51.26 3gbx s ASP 154 Cb -0.43 -2.23 0.73 0.00 -1.46 0.00 0.00 42.92 39.53 3gbx s ASP 154 CO 0.33 -0.88 1.84 1.88 0.52 0.00 0.00 175.17 178.86 3gbx h TYR 155 N 8.94 0.08 -0.30 -5.34 0.05 -2.03 -2.67 116.97 115.70 3gbx h TYR 155 Ca -0.29 -0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.39 3gbx h TYR 155 Cb 1.10 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.80 3gbx h TYR 155 CO 0.74 0.38 -0.14 -0.44 -1.05 0.00 0.00 178.16 177.65 3gbx h ASP 156 N 0.06 0.50 0.00 3.88 3.32 -2.03 -0.16 116.42 122.00 3gbx h ASP 156 Ca 0.01 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.92 3gbx h ASP 156 Cb 0.59 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.01 3gbx h ASP 156 CO 0.04 0.67 0.00 1.21 -1.72 0.00 0.00 179.24 179.44 3gbx n GLU 157 N -4.19 0.77 0.00 3.56 4.07 -1.01 -1.17 120.64 122.68 3gbx n GLU 157 Ca 0.01 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.11 3gbx n GLU 157 Cb 0.34 -1.11 0.00 0.00 -0.06 0.00 0.00 31.44 30.60 3gbx n GLU 157 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3gbx n ALA 159 N 0.73 0.00 -0.06 4.31 0.00 -0.07 -1.62 120.51 123.80 3gbx n ALA 159 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3gbx n ALA 159 Cb 0.39 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.82 3gbx n ALA 159 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3gbx h LYS 160 N 0.00 0.09 -0.41 0.00 3.64 -1.40 0.12 116.57 118.61 3gbx h LYS 160 Ca 0.00 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 3gbx h LYS 160 Cb 0.00 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 3gbx h LYS 160 CO 0.00 0.06 0.12 -0.07 -2.27 0.00 0.00 179.45 177.28 3gbx h LEU 161 N 0.09 0.60 -0.70 5.20 3.38 -1.59 -1.45 115.31 120.85 3gbx h LEU 161 Ca 0.11 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 3gbx h LEU 161 Cb 0.14 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3gbx h LEU 161 CO -0.18 0.66 0.25 0.00 0.09 0.00 0.00 178.44 179.26 3gbx h ALA 162 N 0.97 0.91 0.00 1.53 0.00 -1.76 -1.26 119.26 119.65 3gbx h ALA 162 Ca 0.13 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 3gbx h ALA 162 Cb 0.28 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3gbx h ALA 162 CO -0.00 0.56 -0.82 0.87 0.00 0.00 0.00 179.25 179.86 3gbx h LYS 163 N 1.01 0.00 0.01 0.00 1.57 -0.87 -0.66 116.57 117.63 3gbx h LYS 163 Ca 0.23 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3gbx h LYS 163 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 3gbx h LYS 163 CO -0.01 0.62 -0.01 1.49 -0.57 0.00 0.00 179.45 180.98 3gbx h GLU 164 N 0.00 -0.01 0.00 3.15 4.81 -1.23 -3.39 114.58 117.91 3gbx h GLU 164 Ca -0.04 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.13 3gbx h GLU 164 Cb 1.55 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.93 3gbx h GLU 164 CO 0.08 0.74 -0.98 0.45 -0.73 0.00 0.00 179.01 178.58 3gbx h HIS 165 N -0.81 0.00 -5.70 0.92 3.86 -1.31 -3.49 115.15 108.63 3gbx h HIS 165 Ca -0.00 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 58.88 3gbx h HIS 165 Cb 0.76 0.00 0.15 0.00 1.06 0.00 0.00 27.41 29.39 3gbx h HIS 165 CO 0.19 0.22 -0.81 1.63 0.86 0.00 0.00 177.93 180.02 3gbx n LYS 166 N -2.84 -4.87 -1.29 2.45 5.02 -0.26 -4.94 118.16 111.44 3gbx n LYS 166 Ca -0.02 0.80 -0.33 0.00 -2.02 0.00 0.00 58.31 56.73 3gbx n LYS 166 Cb 0.65 -5.66 0.11 0.00 -0.02 0.00 0.00 35.03 30.11 3gbx n LYS 166 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3gbx s PRO 167 N -5.23 1.95 0.00 1.97 0.04 -1.26 -4.91 135.00 127.57 3gbx s PRO 167 Ca 0.15 1.66 0.07 0.00 0.04 0.00 0.00 61.00 62.92 3gbx s PRO 167 Cb -0.02 -1.82 0.40 0.00 0.04 0.00 0.00 34.50 33.09 3gbx s PRO 167 CO 0.75 -1.96 1.17 1.17 0.04 0.00 0.00 177.00 178.17 3gbx n LYS 168 N -3.06 0.90 -3.71 4.56 4.81 -0.26 -4.59 118.16 116.82 3gbx n LYS 168 Ca 0.13 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.45 3gbx n LYS 168 Cb 0.51 -1.12 -0.12 0.00 0.02 0.00 0.00 35.03 34.32 3gbx n LYS 168 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 3gbx s ILE 170 N -2.00 -0.09 -0.23 3.15 1.01 0.60 -0.82 121.20 122.81 3gbx s ILE 170 Ca 0.10 0.14 -0.06 0.00 0.00 0.00 0.00 60.65 60.82 3gbx s ILE 170 Cb 0.05 -0.50 -0.02 0.00 0.01 0.00 0.00 42.46 41.99 3gbx s ILE 170 CO 0.08 0.06 0.04 -0.63 0.00 0.00 0.00 174.94 174.48 3gbx s ILE 171 N 1.48 4.09 0.26 2.92 1.01 0.93 -0.97 121.20 130.92 3gbx s ILE 171 Ca -0.08 -0.25 0.08 0.00 0.00 0.00 0.00 60.65 60.39 3gbx s ILE 171 Cb -0.10 -2.89 -0.04 0.00 0.01 0.00 0.00 42.46 39.45 3gbx s ILE 171 CO -0.11 0.38 0.15 -0.83 0.00 0.00 0.00 174.94 174.53 3gbx s GLY 172 N 1.43 1.50 0.00 6.18 0.00 0.11 -4.43 107.32 112.12 3gbx s GLY 172 Ca 0.05 -1.50 0.00 0.00 0.00 0.00 0.00 44.72 43.27 3gbx s GLY 172 CO 0.02 -1.54 0.00 0.61 0.00 0.00 0.00 173.10 172.19 3gbx n GLY 173 N -1.12 2.47 3.51 0.20 0.00 -1.26 -0.93 105.19 108.07 3gbx n GLY 173 Ca -0.07 -1.31 -0.16 0.00 0.00 0.00 0.00 46.02 44.48 3gbx n GLY 173 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3gbx s PHE 174 N 0.00 -0.64 -0.09 1.61 5.36 -1.26 -4.85 117.98 118.10 3gbx s PHE 174 Ca 0.00 1.33 0.22 0.00 -0.96 0.00 0.00 56.93 57.53 3gbx s PHE 174 Cb 0.00 0.30 0.59 0.00 -0.34 0.00 0.00 43.02 43.57 3gbx s PHE 174 CO 0.00 -0.47 1.68 0.66 -1.46 0.00 0.00 175.22 175.64 3gbx h SER 175 N 4.06 0.00 0.00 6.13 4.64 -1.98 -3.15 113.55 123.25 3gbx h SER 175 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 3gbx h SER 175 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3gbx h SER 175 CO 0.25 0.22 -0.00 0.00 -0.87 0.00 0.00 176.83 176.43 3gbx n ALA 176 N -2.18 2.23 -2.64 5.18 0.00 -1.26 -5.02 120.51 116.82 3gbx n ALA 176 Ca 0.02 -2.42 -0.39 0.00 0.00 0.00 0.00 53.44 50.65 3gbx n ALA 176 Cb 0.53 -0.33 -0.08 0.00 0.00 0.00 0.00 19.45 19.57 3gbx n ALA 176 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3gbx s TYR 177 N -2.63 3.31 -1.98 0.00 5.04 -1.19 -4.69 117.35 115.21 3gbx s TYR 177 Ca 0.28 0.63 0.25 0.00 -2.44 0.00 0.00 57.07 55.79 3gbx s TYR 177 Cb 0.24 -2.64 0.38 0.00 0.35 0.00 0.00 41.96 40.29 3gbx s TYR 177 CO 0.03 -0.17 1.33 -1.13 -1.34 0.00 0.00 175.55 174.27 3gbx n SER 178 N 5.07 1.61 -4.83 4.32 3.41 -1.26 -4.94 113.62 117.00 3gbx n SER 178 Ca -0.06 -1.27 -0.22 0.00 -0.26 0.00 0.00 58.87 57.06 3gbx n SER 178 Cb 0.50 0.29 0.07 0.00 -0.26 0.00 0.00 64.21 64.82 3gbx n SER 178 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3gbx s GLY 179 N -2.45 1.79 0.36 5.00 0.00 -1.26 0.40 107.32 111.15 3gbx s GLY 179 Ca 0.22 -1.64 -0.15 0.00 0.00 0.00 0.00 44.72 43.15 3gbx s GLY 179 CO 0.53 -1.19 0.78 -1.34 0.00 0.00 0.00 173.10 171.88 3gbx s VAL 180 N -2.93 4.64 -0.09 1.40 -7.23 -1.26 -4.84 120.40 110.09 3gbx s VAL 180 Ca 0.62 1.00 0.01 0.00 -1.81 0.00 0.00 61.98 61.81 3gbx s VAL 180 Cb -0.07 -3.62 -0.02 0.00 0.56 0.00 0.00 36.38 33.22 3gbx s VAL 180 CO 0.41 -0.26 -0.12 -0.69 -0.31 0.00 0.00 175.10 174.13 3gbx s VAL 181 N -2.08 3.22 -1.08 1.32 1.01 -1.26 -4.97 120.40 116.56 3gbx s VAL 181 Ca 0.55 -0.64 -0.19 0.00 0.00 0.00 0.00 61.98 61.71 3gbx s VAL 181 Cb -0.10 -2.31 0.11 0.00 0.00 0.00 0.00 36.38 34.08 3gbx s VAL 181 CO 0.19 0.56 1.39 -0.62 0.00 0.00 0.00 175.10 176.62 3gbx s ASP 182 N -0.32 6.72 0.30 3.32 -1.08 -1.26 -4.85 116.67 119.51 3gbx s ASP 182 Ca 0.03 -2.15 -0.00 0.00 -0.52 0.00 0.00 52.55 49.91 3gbx s ASP 182 Cb -0.13 -2.48 0.46 0.00 -1.46 0.00 0.00 42.92 39.32 3gbx s ASP 182 CO 0.03 -1.14 1.89 -0.50 0.52 0.00 0.00 175.17 175.96 3gbx h TRP 183 N 8.54 0.86 -0.55 -5.34 -0.00 -1.96 -2.28 115.95 115.23 3gbx h TRP 183 Ca 0.25 -0.04 0.05 0.00 -0.00 0.00 0.00 58.89 59.15 3gbx h TRP 183 Cb 0.96 -0.27 -0.05 0.00 -0.00 0.00 0.00 29.16 29.81 3gbx h TRP 183 CO 1.23 0.66 0.29 0.00 -0.00 0.00 0.00 178.44 180.62 3gbx h ALA 184 N 1.42 0.71 0.00 1.49 0.00 -1.93 -0.89 119.26 120.07 3gbx h ALA 184 Ca 0.21 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3gbx h ALA 184 Cb 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3gbx h ALA 184 CO -0.02 -0.05 0.00 1.17 0.00 0.00 0.00 179.25 180.35 3gbx n LYS 185 N -4.85 0.14 0.00 0.00 3.00 -0.86 -1.51 118.16 114.08 3gbx n LYS 185 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.36 3gbx n LYS 185 Cb 0.14 -1.43 0.00 0.00 0.00 0.00 0.00 35.03 33.74 3gbx n LYS 185 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 3gbx n ARG 187 N 0.94 0.00 -0.18 1.64 3.00 -0.34 -1.36 116.66 120.36 3gbx n ARG 187 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.85 57.78 3gbx n ARG 187 Cb 0.07 0.00 0.03 0.00 0.00 0.00 0.00 32.46 32.56 3gbx n ARG 187 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 3gbx h GLU 188 N 0.00 0.67 0.14 -0.14 5.08 -1.54 0.35 114.58 119.14 3gbx h GLU 188 Ca 0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3gbx h GLU 188 Cb 0.00 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.10 3gbx h GLU 188 CO 0.00 0.44 -0.07 0.82 -1.00 0.00 0.00 179.01 179.20 3gbx h ILE 189 N 0.69 0.89 -0.37 3.13 2.04 -1.50 -0.88 117.51 121.50 3gbx h ILE 189 Ca 0.19 -0.11 0.05 0.00 1.00 0.00 0.00 64.86 65.99 3gbx h ILE 189 Cb -0.06 0.96 -0.05 0.00 -0.74 0.00 0.00 36.82 36.93 3gbx h ILE 189 CO -0.05 0.03 0.08 0.00 0.00 0.00 0.00 178.15 178.21 3gbx h ALA 190 N 0.60 0.40 -0.43 1.87 0.00 -1.76 -2.37 119.26 117.57 3gbx h ALA 190 Ca -0.02 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3gbx h ALA 190 Cb 0.19 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3gbx h ALA 190 CO 0.03 -0.32 0.21 -0.44 0.00 0.00 0.00 179.25 178.73 3gbx h ASP 191 N 0.21 0.52 0.24 0.00 3.32 -0.15 0.35 116.42 120.91 3gbx h ASP 191 Ca 0.17 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 3gbx h ASP 191 Cb 0.19 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 3gbx h ASP 191 CO -0.22 0.45 -0.12 0.77 -1.72 0.00 0.00 179.24 178.40 3gbx h SER 192 N 0.59 0.00 -0.18 6.45 4.64 -0.61 -2.99 113.55 121.45 3gbx h SER 192 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 3gbx h SER 192 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 3gbx h SER 192 CO -0.02 0.12 0.00 2.30 -0.87 0.00 0.00 176.83 178.35 3gbx n ILE 193 N -3.90 0.95 -1.93 0.95 -5.35 -0.81 -4.99 119.36 104.28 3gbx n ILE 193 Ca -0.02 -0.97 -0.09 0.00 -0.27 0.00 0.00 62.75 61.39 3gbx n ILE 193 Cb 0.21 0.53 -0.01 0.00 -1.74 0.00 0.00 39.64 38.63 3gbx n ILE 193 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3gbx n GLY 194 N 0.06 0.28 3.94 3.28 0.00 -0.55 -4.96 105.19 107.23 3gbx n GLY 194 Ca 0.06 -0.54 -0.26 0.00 0.00 0.00 0.00 46.02 45.28 3gbx n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gbx s ALA 195 N -2.42 3.91 0.37 4.61 0.00 0.00 -4.99 121.76 123.25 3gbx s ALA 195 Ca 0.00 -0.98 -0.25 0.00 0.00 0.00 0.00 51.96 50.74 3gbx s ALA 195 Cb 0.00 -1.86 -0.09 0.00 0.00 0.00 0.00 23.12 21.16 3gbx s ALA 195 CO 0.00 0.45 1.02 0.71 0.00 0.00 0.00 175.76 177.93 3gbx s TYR 196 N -1.84 3.40 -0.30 0.00 2.02 0.00 -4.38 117.35 116.25 3gbx s TYR 196 Ca 0.36 1.68 -0.08 0.00 -0.37 0.00 0.00 57.07 58.67 3gbx s TYR 196 Cb -0.11 -3.06 0.00 0.00 -0.40 0.00 0.00 41.96 38.40 3gbx s TYR 196 CO 0.29 -0.36 0.10 -1.17 -1.57 0.00 0.00 175.55 172.84 3gbx s LEU 197 N -2.46 3.91 -0.18 -1.29 2.96 -1.26 -0.29 118.68 120.06 3gbx s LEU 197 Ca 0.55 -0.65 -0.04 0.00 -0.22 0.00 0.00 54.13 53.78 3gbx s LEU 197 Cb -0.21 -1.92 -0.02 0.00 0.50 0.00 0.00 46.19 44.55 3gbx s LEU 197 CO 0.26 -0.19 -0.03 0.12 -1.32 0.00 0.00 176.35 175.20 3gbx s PHE 198 N 1.53 3.01 -0.17 5.38 5.36 -0.14 -0.77 117.98 132.18 3gbx s PHE 198 Ca 0.03 -0.47 -0.02 0.00 -0.96 0.00 0.00 56.93 55.51 3gbx s PHE 198 Cb -0.17 -2.03 -0.01 0.00 -0.34 0.00 0.00 43.02 40.47 3gbx s PHE 198 CO 0.03 -0.21 -0.10 0.08 -1.46 0.00 0.00 175.22 173.57 3gbx s VAL 199 N 0.80 3.08 0.52 3.12 1.01 -0.85 0.08 120.40 128.17 3gbx s VAL 199 Ca -0.01 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.37 3gbx s VAL 199 Cb -0.14 -2.34 0.03 0.00 0.00 0.00 0.00 36.38 33.92 3gbx s VAL 199 CO 0.02 0.48 0.74 -0.62 0.00 0.00 0.00 175.10 175.73 3gbx s ASP 200 N 0.92 5.40 0.00 3.32 2.15 -0.11 -0.92 116.67 127.44 3gbx s ASP 200 Ca -0.02 0.02 0.00 0.00 0.43 0.00 0.00 52.55 52.98 3gbx s ASP 200 Cb -0.15 -0.98 0.00 0.00 -0.30 0.00 0.00 42.92 41.49 3gbx s ASP 200 CO -0.00 -1.04 0.00 0.00 -0.17 0.00 0.00 175.17 173.96 3gbx n ALA 202 N -2.26 0.00 1.64 3.66 0.00 -1.24 -4.22 120.51 118.08 3gbx n ALA 202 Ca 0.07 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.66 3gbx n ALA 202 Cb 0.59 0.00 0.74 0.00 0.00 0.00 0.00 19.45 20.78 3gbx n ALA 202 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3gbx n HIS 203 N 0.00 0.00 -1.58 0.00 8.25 -1.26 -3.89 115.22 116.74 3gbx n HIS 203 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3gbx n HIS 203 Cb 0.00 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.02 3gbx n HIS 203 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 3gbx n VAL 204 N -0.80 0.00 -0.28 1.59 0.24 -1.26 -4.91 118.33 112.91 3gbx n VAL 204 Ca 0.19 0.00 -0.02 0.00 -2.04 0.00 0.00 64.34 62.46 3gbx n VAL 204 Cb 0.23 0.61 0.14 0.00 -1.47 0.00 0.00 33.84 33.35 3gbx n VAL 204 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3gbx h ALA 205 N 0.00 1.25 -0.33 2.33 0.00 -1.94 -1.65 119.26 118.93 3gbx h ALA 205 Ca 0.00 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 3gbx h ALA 205 Cb 1.15 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3gbx h ALA 205 CO 0.00 0.61 -0.31 0.78 0.00 0.00 0.00 179.25 180.32 3gbx h GLY 206 N 1.17 0.77 1.04 0.00 0.00 -1.90 -0.05 103.07 104.10 3gbx h GLY 206 Ca 0.29 -0.71 -0.09 0.00 0.00 0.00 0.00 47.33 46.82 3gbx h GLY 206 CO -0.05 0.65 -0.00 1.41 0.00 0.00 0.00 176.54 178.55 3gbx h LEU 207 N 0.60 0.93 -0.56 3.11 4.07 -1.68 -2.08 115.31 119.70 3gbx h LEU 207 Ca 0.07 -0.31 0.03 0.00 0.08 0.00 0.00 57.88 57.75 3gbx h LEU 207 Cb 0.83 -0.25 -0.04 0.00 1.08 0.00 0.00 40.66 42.28 3gbx h LEU 207 CO 0.07 1.01 0.33 0.40 -1.08 0.00 0.00 178.44 179.17 3gbx h ILE 208 N 0.82 1.04 -0.53 1.22 2.04 -1.05 -1.67 117.51 119.39 3gbx h ILE 208 Ca 0.15 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 3gbx h ILE 208 Cb 0.53 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 3gbx h ILE 208 CO 0.03 0.12 0.27 0.00 0.00 0.00 0.00 178.15 178.56 3gbx h ALA 209 N 1.26 1.47 -0.01 1.87 0.00 -0.75 -1.69 119.26 121.41 3gbx h ALA 209 Ca 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3gbx h ALA 209 Cb 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3gbx h ALA 209 CO -0.11 0.43 -0.04 0.00 0.00 0.00 0.00 179.25 179.53 3gbx n ALA 210 N -2.46 2.68 -1.00 0.00 0.00 -0.80 -4.89 120.51 114.03 3gbx n ALA 210 Ca 0.05 -0.33 -0.00 0.00 0.00 0.00 0.00 53.44 53.16 3gbx n ALA 210 Cb 0.12 -1.31 -0.00 0.00 0.00 0.00 0.00 19.45 18.26 3gbx n ALA 210 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gbx n GLY 211 N 1.15 0.40 0.50 0.00 0.00 -0.64 -4.92 105.19 101.69 3gbx n GLY 211 Ca 0.19 -0.97 0.07 0.00 0.00 0.00 0.00 46.02 45.31 3gbx n GLY 211 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3gbx n VAL 212 N -3.00 2.14 -3.64 1.61 0.24 -0.68 -4.95 118.33 110.05 3gbx n VAL 212 Ca -0.00 -2.52 -0.15 0.00 -2.04 0.00 0.00 64.34 59.62 3gbx n VAL 212 Cb 0.00 -0.25 -0.08 0.00 -1.47 0.00 0.00 33.84 32.04 3gbx n VAL 212 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 3gbx s TYR 213 N -3.02 -0.54 0.18 6.34 5.04 -1.23 -4.89 117.35 119.23 3gbx s TYR 213 Ca 0.37 1.10 -0.33 0.00 -2.44 0.00 0.00 57.07 55.77 3gbx s TYR 213 Cb 0.33 0.26 -0.14 0.00 0.35 0.00 0.00 41.96 42.76 3gbx s TYR 213 CO 0.01 -0.44 1.45 -2.30 -1.34 0.00 0.00 175.55 172.93 3gbx n PRO 214 N 1.73 1.90 -3.01 4.97 -0.02 -1.26 -4.45 135.00 134.86 3gbx n PRO 214 Ca -0.17 0.68 -0.41 0.00 -2.02 0.00 0.00 63.50 61.58 3gbx n PRO 214 Cb 0.56 -2.37 -0.05 0.00 -0.02 0.00 0.00 33.50 31.62 3gbx n PRO 214 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3gbx s ASN 215 N 0.56 6.74 0.34 2.55 2.47 -1.26 -4.88 114.94 121.45 3gbx s ASN 215 Ca 0.75 0.91 0.23 0.00 0.42 0.00 0.00 52.86 55.16 3gbx s ASN 215 Cb -0.72 -2.39 0.20 0.00 -1.45 0.00 0.00 41.25 36.89 3gbx s ASN 215 CO 0.44 -0.41 1.38 1.55 -3.72 0.00 0.00 177.10 176.35 3gbx h PRO 216 N 7.67 0.00 -0.88 0.43 0.13 -1.97 -3.38 132.00 134.00 3gbx h PRO 216 Ca -0.27 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.98 3gbx h PRO 216 Cb 1.12 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.17 3gbx h PRO 216 CO 0.82 0.01 0.50 0.28 -0.23 0.00 0.00 178.00 179.38 3gbx h VAL 217 N 0.00 0.87 0.00 1.56 2.07 -1.91 0.73 116.25 119.57 3gbx h VAL 217 Ca -0.00 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.24 3gbx h VAL 217 Cb 1.01 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 3gbx h VAL 217 CO 0.00 0.15 0.00 -2.65 0.02 0.00 0.00 177.57 175.09 3gbx n PRO 218 N -4.74 0.02 -0.01 1.57 -0.02 -1.26 -3.86 135.00 126.69 3gbx n PRO 218 Ca 0.16 0.23 -0.01 0.00 -2.02 0.00 0.00 63.50 61.86 3gbx n PRO 218 Cb 0.34 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.29 3gbx n PRO 218 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3gbx n HIS 219 N -1.48 0.00 -2.75 6.00 8.25 0.02 -5.02 115.22 120.24 3gbx n HIS 219 Ca 0.04 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.19 3gbx n HIS 219 Cb 0.17 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.11 3gbx n HIS 219 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3gbx s ALA 220 N -2.08 3.25 0.25 -1.41 0.00 0.03 -4.69 121.76 117.11 3gbx s ALA 220 Ca -0.01 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 51.93 3gbx s ALA 220 Cb 0.01 -2.86 0.30 0.00 0.00 0.00 0.00 23.12 20.57 3gbx s ALA 220 CO 0.12 -0.03 1.64 0.45 0.00 0.00 0.00 175.76 177.94 3gbx h HIS 221 N 1.30 0.57 -2.42 0.00 3.86 -1.29 -3.44 115.15 113.74 3gbx h HIS 221 Ca -0.47 -0.15 -0.08 0.00 -1.16 0.00 0.00 60.37 58.50 3gbx h HIS 221 Cb 1.18 -0.13 -0.21 0.00 1.06 0.00 0.00 27.41 29.32 3gbx h HIS 221 CO 0.62 0.79 -0.03 0.54 0.86 0.00 0.00 177.93 180.70 3gbx s VAL 222 N -4.28 0.01 0.07 2.45 0.11 -1.19 -4.54 120.40 113.03 3gbx s VAL 222 Ca -0.07 -0.11 0.05 0.00 -2.93 0.00 0.00 61.98 58.92 3gbx s VAL 222 Cb 0.13 -0.81 -0.03 0.00 -1.53 0.00 0.00 36.38 34.14 3gbx s VAL 222 CO 0.81 -0.06 -0.14 -0.69 -3.33 0.00 0.00 175.10 171.68 3gbx s VAL 223 N -0.54 1.13 0.24 2.04 1.01 -0.17 -2.02 120.40 122.09 3gbx s VAL 223 Ca -0.07 -1.28 0.05 0.00 0.00 0.00 0.00 61.98 60.69 3gbx s VAL 223 Cb -0.03 -1.08 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 3gbx s VAL 223 CO 0.04 -0.19 -0.05 0.42 0.00 0.00 0.00 175.10 175.32 3gbx s THR 224 N -1.22 1.33 0.13 3.92 -4.23 -0.09 -1.07 115.64 114.41 3gbx s THR 224 Ca -0.01 -2.09 -0.21 0.00 -1.18 0.00 0.00 61.69 58.20 3gbx s THR 224 Cb -0.10 -2.30 0.06 0.00 1.34 0.00 0.00 72.50 71.50 3gbx s THR 224 CO 0.02 -0.39 0.53 0.28 -0.54 0.00 0.00 174.62 174.52 3gbx s THR 225 N -3.22 0.02 0.69 3.99 -1.32 -0.77 -3.72 115.64 111.31 3gbx s THR 225 Ca 0.27 -0.20 -0.09 0.00 -1.21 0.00 0.00 61.69 60.45 3gbx s THR 225 Cb 0.04 -1.05 0.03 0.00 -1.51 0.00 0.00 72.50 70.01 3gbx s THR 225 CO 0.09 -0.11 1.04 0.42 -2.21 0.00 0.00 174.62 173.85 3gbx s THR 226 N -3.56 3.09 -1.23 5.08 -4.23 -1.26 -0.94 115.64 112.59 3gbx s THR 226 Ca 0.01 0.15 0.11 0.00 -1.18 0.00 0.00 61.69 60.78 3gbx s THR 226 Cb -0.00 -3.32 0.05 0.00 1.34 0.00 0.00 72.50 70.58 3gbx s THR 226 CO -0.11 -0.38 0.78 0.35 -0.54 0.00 0.00 174.62 174.72 3gbx n THR 227 N -2.93 0.00 -1.25 3.99 -2.24 -0.71 -4.85 114.28 106.28 3gbx n THR 227 Ca 0.07 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 3gbx n THR 227 Cb 0.58 1.19 0.00 0.00 -2.10 0.00 0.00 70.33 70.00 3gbx n THR 227 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gbx n HIS 228 N 0.28 0.00 -2.77 4.78 1.44 -1.05 -0.28 115.22 117.63 3gbx n HIS 228 Ca 0.06 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.77 3gbx n HIS 228 Cb 0.26 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.37 3gbx n HIS 228 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3gbx n LYS 229 N 0.00 0.00 0.14 -1.40 5.02 -1.25 -3.08 118.16 117.59 3gbx n LYS 229 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.41 3gbx n LYS 229 Cb 0.00 0.00 0.50 0.00 -0.02 0.00 0.00 35.03 35.51 3gbx n LYS 229 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3gbx n THR 230 N 0.00 0.81 0.44 -0.18 -2.24 -1.26 -1.12 114.28 110.72 3gbx n THR 230 Ca 0.00 0.20 0.13 0.00 -2.27 0.00 0.00 64.05 62.11 3gbx n THR 230 Cb 0.00 -1.15 0.36 0.00 -2.10 0.00 0.00 70.33 67.44 3gbx n THR 230 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3gbx h LEU 231 N 0.00 0.00 2.81 3.22 3.38 -1.78 -3.38 115.31 119.55 3gbx h LEU 231 Ca 0.00 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.55 3gbx h LEU 231 Cb 0.39 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3gbx h LEU 231 CO 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 178.44 178.01 3gbx n ALA 232 N -1.92 -0.59 -2.58 1.53 0.00 -0.27 -4.91 120.51 111.77 3gbx n ALA 232 Ca 0.04 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.66 3gbx n ALA 232 Cb 0.43 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.70 3gbx n ALA 232 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gbx n GLY 233 N -0.97 3.38 3.78 0.00 0.00 0.62 -4.17 105.19 107.83 3gbx n GLY 233 Ca -0.24 -2.07 -0.29 0.00 0.00 0.00 0.00 46.02 43.41 3gbx n GLY 233 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gbx s PRO 234 N 1.17 1.53 0.15 1.61 0.04 -1.25 -4.20 135.00 134.05 3gbx s PRO 234 Ca 0.00 0.51 -0.30 0.00 0.04 0.00 0.00 61.00 61.25 3gbx s PRO 234 Cb 0.00 -1.87 -0.07 0.00 0.04 0.00 0.00 34.50 32.60 3gbx s PRO 234 CO 0.00 -1.98 1.11 1.03 0.04 0.00 0.00 177.00 177.20 3gbx s ARG 235 N -5.17 4.56 0.00 4.56 0.52 -1.26 -2.53 118.95 119.63 3gbx s ARG 235 Ca 0.62 1.71 0.00 0.00 -0.52 0.00 0.00 55.73 57.55 3gbx s ARG 235 Cb -0.15 -3.30 0.00 0.00 0.52 0.00 0.00 34.95 32.02 3gbx s ARG 235 CO 0.54 0.01 0.00 0.41 0.02 0.00 0.00 175.30 176.29 3gbx n GLY 236 N 2.27 0.95 3.61 -3.53 0.00 -1.26 -4.89 105.19 102.35 3gbx n GLY 236 Ca 0.04 -1.09 -0.25 0.00 0.00 0.00 0.00 46.02 44.71 3gbx n GLY 236 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gbx s GLY 237 N 0.00 2.19 -0.08 -0.02 0.00 -0.48 -1.74 107.32 107.18 3gbx s GLY 237 Ca 0.00 -2.06 -0.09 0.00 0.00 0.00 0.00 44.72 42.57 3gbx s GLY 237 CO 0.00 -1.97 0.25 -2.27 0.00 0.00 0.00 173.10 169.11 3gbx s LEU 238 N -3.70 1.06 -0.06 0.66 2.96 -0.12 -4.03 118.68 115.45 3gbx s LEU 238 Ca 0.35 0.42 0.05 0.00 -0.22 0.00 0.00 54.13 54.72 3gbx s LEU 238 Cb 0.02 0.88 -0.02 0.00 0.50 0.00 0.00 46.19 47.58 3gbx s LEU 238 CO 0.19 -0.14 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.24 3gbx s ILE 239 N -0.10 2.49 0.06 6.68 1.01 -0.48 -1.86 121.20 129.01 3gbx s ILE 239 Ca -0.02 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.73 3gbx s ILE 239 Cb -0.03 -1.95 -0.03 0.00 0.01 0.00 0.00 42.46 40.47 3gbx s ILE 239 CO 0.01 0.57 -0.07 -0.76 0.00 0.00 0.00 174.94 174.69 3gbx s LEU 240 N -0.31 2.37 0.12 2.97 1.43 -0.23 0.01 118.68 125.04 3gbx s LEU 240 Ca 0.01 -0.75 -0.25 0.00 -1.03 0.00 0.00 54.13 52.11 3gbx s LEU 240 Cb -0.13 -0.10 0.08 0.00 0.03 0.00 0.00 46.19 46.07 3gbx s LEU 240 CO 0.02 -0.33 0.68 0.00 0.23 0.00 0.00 176.35 176.95 3gbx s ALA 241 N -2.42 -1.66 0.07 4.21 0.00 -0.71 -1.00 121.76 120.25 3gbx s ALA 241 Ca -0.01 0.63 0.01 0.00 0.00 0.00 0.00 51.96 52.59 3gbx s ALA 241 Cb -0.03 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.81 3gbx s ALA 241 CO -0.02 -0.75 -0.05 -1.59 0.00 0.00 0.00 175.76 173.35 3gbx s LYS 242 N -3.57 0.68 0.00 0.00 0.00 -1.26 -1.28 119.74 114.31 3gbx s LYS 242 Ca 0.02 -1.18 0.00 0.00 0.00 0.00 0.00 55.97 54.80 3gbx s LYS 242 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 37.83 37.80 3gbx s LYS 242 CO -0.12 -0.05 0.00 0.41 0.00 0.00 0.00 175.35 175.59 3gbx n GLY 243 N 0.27 0.43 3.98 0.59 0.00 -1.26 -4.93 105.19 104.27 3gbx n GLY 243 Ca -0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 3gbx n GLY 243 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gbx s GLY 244 N -2.00 1.83 0.56 -0.02 0.00 -1.26 -5.12 107.32 101.31 3gbx s GLY 244 Ca 0.00 -1.61 0.03 0.00 0.00 0.00 0.00 44.72 43.14 3gbx s GLY 244 CO 0.00 -1.48 0.78 0.51 0.00 0.00 0.00 173.10 172.91 3gbx s ASP 245 N -4.23 5.15 0.43 1.64 1.47 -1.26 -4.98 116.67 114.89 3gbx s ASP 245 Ca 0.49 -0.25 0.18 0.00 1.18 0.00 0.00 52.55 54.16 3gbx s ASP 245 Cb -0.09 -0.54 0.97 0.00 -0.34 0.00 0.00 42.92 42.92 3gbx s ASP 245 CO 0.31 -1.23 1.91 -0.33 0.68 0.00 0.00 175.17 176.51 3gbx h GLU 246 N 0.08 0.00 -0.21 2.11 4.39 -1.99 -1.99 114.58 116.97 3gbx h GLU 246 Ca -0.39 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.33 3gbx h GLU 246 Cb 1.29 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.91 3gbx h GLU 246 CO 0.47 0.27 0.06 1.49 -1.16 0.00 0.00 179.01 180.14 3gbx h GLU 247 N 0.00 0.14 -0.45 2.33 4.22 -1.99 0.11 114.58 118.94 3gbx h GLU 247 Ca -0.00 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.43 3gbx h GLU 247 Cb 0.56 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 3gbx h GLU 247 CO 0.04 0.09 0.29 1.25 -2.18 0.00 0.00 179.01 178.49 3gbx h LEU 248 N 0.15 0.53 -0.75 1.64 5.85 -1.76 -2.38 115.31 118.58 3gbx h LEU 248 Ca 0.09 -0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 3gbx h LEU 248 Cb 0.07 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 3gbx h LEU 248 CO -0.11 0.41 0.11 1.88 -0.34 0.00 0.00 178.44 180.39 3gbx h TYR 249 N 0.61 1.12 -0.81 1.25 0.05 -1.22 -1.43 116.97 116.53 3gbx h TYR 249 Ca 0.16 -0.15 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 3gbx h TYR 249 Cb -0.04 -0.31 -0.04 0.00 1.01 0.00 0.00 36.73 37.35 3gbx h TYR 249 CO -0.04 0.94 0.46 0.87 -1.05 0.00 0.00 178.16 179.34 3gbx h LYS 250 N 0.99 1.11 -0.71 4.88 1.57 -0.68 -0.99 116.57 122.76 3gbx h LYS 250 Ca 0.20 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 3gbx h LYS 250 Cb 0.42 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 3gbx h LYS 250 CO 0.01 0.80 0.20 0.87 -0.57 0.00 0.00 179.45 180.76 3gbx h LYS 251 N 1.13 1.11 -0.23 3.15 1.57 -0.82 -0.98 116.57 121.50 3gbx h LYS 251 Ca 0.29 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 3gbx h LYS 251 Cb -0.01 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 3gbx h LYS 251 CO -0.05 0.97 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.71 3gbx h LEU 252 N 1.05 0.42 -0.38 2.94 3.38 -1.05 -2.01 115.31 119.66 3gbx h LEU 252 Ca 0.22 -0.33 0.06 0.00 0.09 0.00 0.00 57.88 57.92 3gbx h LEU 252 Cb 0.34 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 3gbx h LEU 252 CO -0.00 0.65 0.07 0.78 0.09 0.00 0.00 178.44 180.02 3gbx h ASN 253 N 0.18 0.00 0.13 -0.43 2.35 -1.01 -2.30 115.58 114.50 3gbx h ASN 253 Ca 0.06 0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.85 3gbx h ASN 253 Cb 0.44 0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.90 3gbx h ASN 253 CO 0.02 0.04 -0.11 0.77 -1.65 0.00 0.00 177.43 176.49 3gbx h SER 254 N 0.20 0.00 1.76 5.81 4.64 -1.06 -2.85 113.55 122.05 3gbx h SER 254 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 3gbx h SER 254 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3gbx h SER 254 CO -0.24 0.11 0.00 0.00 -0.87 0.00 0.00 176.83 175.83 3gbx h ALA 255 N 1.89 1.00 -0.06 5.18 0.00 -0.78 -3.38 119.26 123.10 3gbx h ALA 255 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3gbx h ALA 255 Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3gbx h ALA 255 CO 0.01 0.00 0.04 0.28 0.00 0.00 0.00 179.25 179.58 3gbx h VAL 256 N 0.00 1.06 -3.55 0.00 2.07 -1.39 -3.35 116.25 111.09 3gbx h VAL 256 Ca 0.00 -0.16 -0.71 0.00 0.82 0.00 0.00 66.70 66.65 3gbx h VAL 256 Cb 0.88 1.05 -0.25 0.00 -1.52 0.00 0.00 31.29 31.45 3gbx h VAL 256 CO 0.00 0.05 -0.50 -0.36 0.02 0.00 0.00 177.57 176.78 3gbx s PHE 257 N -5.97 3.26 -1.00 1.57 0.40 -1.26 -4.87 117.98 110.11 3gbx s PHE 257 Ca -0.13 -1.10 0.16 0.00 -0.60 0.00 0.00 56.93 55.26 3gbx s PHE 257 Cb 0.06 -2.57 0.70 0.00 0.51 0.00 0.00 43.02 41.72 3gbx s PHE 257 CO 0.67 -0.70 1.52 -0.35 0.70 0.00 0.00 175.22 177.06 3gbx n PRO 258 N 4.98 0.00 0.00 0.24 -0.05 -1.26 -5.02 135.00 133.90 3gbx n PRO 258 Ca -0.11 0.22 0.00 0.00 -0.05 0.00 0.00 63.50 63.56 3gbx n PRO 258 Cb 0.45 -1.50 0.00 0.00 -0.05 0.00 0.00 33.50 32.40 3gbx n PRO 258 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 3gbx n GLY 262 N 0.18 5.19 3.83 0.55 0.00 -1.26 -5.16 105.19 108.53 3gbx n GLY 262 Ca 0.04 -1.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.14 3gbx n GLY 262 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gbx s GLY 263 N 0.00 1.64 0.77 -0.02 0.00 -1.26 -5.03 107.32 103.42 3gbx s GLY 263 Ca 0.00 -0.11 -0.11 0.00 0.00 0.00 0.00 44.72 44.50 3gbx s GLY 263 CO 0.00 0.25 1.08 2.56 0.00 0.00 0.00 173.10 176.99 3gbx s PRO 264 N -5.15 2.32 0.70 2.90 0.04 -1.26 -5.05 135.00 129.49 3gbx s PRO 264 Ca 0.59 1.05 -0.06 0.00 0.04 0.00 0.00 61.00 62.62 3gbx s PRO 264 Cb -0.13 -1.91 0.06 0.00 0.04 0.00 0.00 34.50 32.56 3gbx s PRO 264 CO 0.54 -1.57 1.01 -0.51 0.04 0.00 0.00 177.00 176.51 3gbx s LEU 265 N -5.85 2.83 0.00 -3.56 1.43 -1.26 -4.97 118.68 107.29 3gbx s LEU 265 Ca 0.61 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 54.14 3gbx s LEU 265 Cb -0.16 -3.08 0.00 0.00 0.03 0.00 0.00 46.19 42.98 3gbx s LEU 265 CO 0.56 -1.60 0.00 0.00 0.23 0.00 0.00 176.35 175.53 3gbx n HIS 267 N -2.92 0.00 -0.16 0.29 -0.00 -1.24 -1.46 115.22 109.73 3gbx n HIS 267 Ca 0.08 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.71 3gbx n HIS 267 Cb 0.60 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.64 3gbx n HIS 267 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 3gbx h VAL 268 N 0.00 1.27 -0.39 0.61 2.07 -1.90 -2.05 116.25 115.85 3gbx h VAL 268 Ca 0.00 -1.24 -0.08 0.00 0.82 0.00 0.00 66.70 66.20 3gbx h VAL 268 Cb 0.00 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 3gbx h VAL 268 CO 0.00 0.43 -0.09 0.40 0.02 0.00 0.00 177.57 178.33 3gbx h ILE 269 N 0.86 1.25 -0.88 4.57 2.04 -1.59 0.35 117.51 124.10 3gbx h ILE 269 Ca 0.14 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 3gbx h ILE 269 Cb 0.65 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 3gbx h ILE 269 CO 0.04 0.37 0.46 0.00 0.00 0.00 0.00 178.15 179.03 3gbx h ALA 270 N 1.27 1.15 -0.63 1.87 0.00 -1.81 0.16 119.26 121.28 3gbx h ALA 270 Ca 0.11 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3gbx h ALA 270 Cb 0.53 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3gbx h ALA 270 CO 0.03 0.67 0.38 0.78 0.00 0.00 0.00 179.25 181.11 3gbx h GLY 271 N 1.25 0.90 0.98 0.00 0.00 -0.46 -1.86 103.07 103.89 3gbx h GLY 271 Ca 0.31 -0.28 0.01 0.00 0.00 0.00 0.00 47.33 47.36 3gbx h GLY 271 CO -0.05 0.23 0.33 0.50 0.00 0.00 0.00 176.54 177.55 3gbx h LYS 272 N 0.74 0.65 -0.30 4.80 1.57 0.41 -0.95 116.57 123.49 3gbx h LYS 272 Ca 0.26 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 59.03 3gbx h LYS 272 Cb 0.04 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.17 3gbx h LYS 272 CO -0.11 0.43 0.12 0.00 -0.57 0.00 0.00 179.45 179.31 3gbx h ALA 273 N 1.19 0.35 -0.10 3.86 0.00 -0.46 0.45 119.26 124.55 3gbx h ALA 273 Ca 0.19 0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.92 3gbx h ALA 273 Cb -0.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3gbx h ALA 273 CO -0.05 -0.28 -0.77 -0.24 0.00 0.00 0.00 179.25 177.91 3gbx h VAL 274 N 0.26 1.34 -0.79 0.00 3.04 -1.25 -2.06 116.25 116.79 3gbx h VAL 274 Ca 0.13 -2.10 0.00 0.00 -1.01 0.00 0.00 66.70 63.73 3gbx h VAL 274 Cb 0.09 2.09 -0.04 0.00 -2.01 0.00 0.00 31.29 31.42 3gbx h VAL 274 CO -0.12 0.64 0.51 0.00 -1.01 0.00 0.00 177.57 177.59 3gbx h ALA 275 N 0.77 1.40 -0.25 3.17 0.00 -1.00 -0.83 119.26 122.53 3gbx h ALA 275 Ca -0.04 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 3gbx h ALA 275 Cb 1.37 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 3gbx h ALA 275 CO 0.14 0.54 -0.57 -0.07 0.00 0.00 0.00 179.25 179.29 3gbx h LEU 276 N 1.08 0.87 -0.67 0.00 3.38 -0.77 -1.15 115.31 118.05 3gbx h LEU 276 Ca 0.29 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3gbx h LEU 276 Cb -0.10 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.37 3gbx h LEU 276 CO -0.06 1.25 0.37 0.50 0.09 0.00 0.00 178.44 180.59 3gbx h LYS 277 N 0.59 0.94 -0.67 1.13 3.64 -1.19 -2.35 116.57 118.66 3gbx h LYS 277 Ca 0.01 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 3gbx h LYS 277 Cb 1.16 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.77 3gbx h LYS 277 CO 0.12 0.70 0.36 0.93 -2.27 0.00 0.00 179.45 179.29 3gbx h GLU 278 N 0.92 0.94 -2.33 1.90 5.08 -0.93 -3.21 114.58 116.95 3gbx h GLU 278 Ca 0.24 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 3gbx h GLU 278 Cb 0.04 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 3gbx h GLU 278 CO -0.04 0.70 0.05 0.00 -1.00 0.00 0.00 179.01 178.72 3gbx n ALA 279 N -2.44 3.25 -1.34 3.43 0.00 -0.45 -4.58 120.51 118.38 3gbx n ALA 279 Ca 0.07 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.96 3gbx n ALA 279 Cb 0.11 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.56 3gbx n ALA 279 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3gbx n GLU 281 N 2.39 -2.32 0.10 0.00 -0.58 -1.22 -4.71 120.64 114.30 3gbx n GLU 281 Ca 0.13 1.76 0.13 0.00 -0.42 0.00 0.00 57.16 58.76 3gbx n GLU 281 Cb 0.37 -2.33 0.63 0.00 -0.57 0.00 0.00 31.44 29.53 3gbx n GLU 281 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 3gbx h PRO 282 N 0.78 0.09 -0.09 3.49 0.13 -1.97 -1.30 132.00 133.13 3gbx h PRO 282 Ca 0.00 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.15 3gbx h PRO 282 Cb 0.23 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.34 3gbx h PRO 282 CO 0.00 0.06 0.07 0.93 -0.23 0.00 0.00 178.00 178.83 3gbx h GLU 283 N 0.09 0.00 -0.39 0.86 3.07 -1.96 -2.33 114.58 113.92 3gbx h GLU 283 Ca 0.14 0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.86 3gbx h GLU 283 Cb 0.45 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 3gbx h GLU 283 CO -0.01 0.00 -0.30 0.35 -1.40 0.00 0.00 179.01 177.64 3gbx h PHE 284 N 0.00 1.01 -0.65 4.33 3.57 -1.48 -0.19 116.94 123.54 3gbx h PHE 284 Ca 0.04 -0.27 -0.07 0.00 3.53 0.00 0.00 57.97 61.20 3gbx h PHE 284 Cb 0.18 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 3gbx h PHE 284 CO 0.00 1.06 0.12 -0.22 -2.23 0.00 0.00 178.31 177.04 3gbx h LYS 285 N 0.73 1.07 -0.68 1.11 3.64 -1.49 -0.73 116.57 120.22 3gbx h LYS 285 Ca 0.08 -0.28 0.03 0.00 -1.27 0.00 0.00 60.65 59.21 3gbx h LYS 285 Cb 0.86 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.51 3gbx h LYS 285 CO 0.08 0.98 0.41 0.28 -2.27 0.00 0.00 179.45 178.93 3gbx h VAL 286 N 0.99 1.07 -0.14 2.00 2.07 -1.25 -0.31 116.25 120.68 3gbx h VAL 286 Ca 0.20 -0.28 0.04 0.00 0.82 0.00 0.00 66.70 67.48 3gbx h VAL 286 Cb 0.42 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.34 3gbx h VAL 286 CO 0.01 0.15 -0.13 0.22 0.02 0.00 0.00 177.57 177.84 3gbx h TYR 287 N 0.80 -0.31 -0.18 1.57 3.20 -0.75 -1.07 116.97 120.23 3gbx h TYR 287 Ca 0.28 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.09 3gbx h TYR 287 Cb 0.05 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 3gbx h TYR 287 CO -0.05 -0.19 -0.21 1.96 -1.64 0.00 0.00 178.16 178.03 3gbx h GLN 288 N -0.14 0.32 -0.79 1.82 1.08 -0.67 0.97 115.11 117.69 3gbx h GLN 288 Ca 0.09 -0.10 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 3gbx h GLN 288 Cb 0.28 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.64 3gbx h GLN 288 CO -0.23 0.52 0.37 1.96 -0.95 0.00 0.00 178.83 180.50 3gbx h GLN 289 N 0.29 1.15 -0.32 1.46 4.20 -0.76 -1.75 115.11 119.38 3gbx h GLN 289 Ca 0.05 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.49 3gbx h GLN 289 Cb 0.54 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 3gbx h GLN 289 CO 0.04 0.90 -0.20 0.37 -0.67 0.00 0.00 178.83 179.27 3gbx h GLN 290 N 1.13 0.59 -0.09 1.46 5.75 -0.36 -1.13 115.11 122.46 3gbx h GLN 290 Ca 0.27 -0.21 0.02 0.00 -0.15 0.00 0.00 58.65 58.59 3gbx h GLN 290 Cb 0.14 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.62 3gbx h GLN 290 CO -0.03 0.75 -0.06 0.28 -2.65 0.00 0.00 178.83 177.12 3gbx h VAL 291 N 0.53 0.82 -0.46 2.39 2.07 -0.45 0.93 116.25 122.07 3gbx h VAL 291 Ca 0.08 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 3gbx h VAL 291 Cb 0.64 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 3gbx h VAL 291 CO 0.05 0.00 0.12 0.00 0.02 0.00 0.00 177.57 177.75 3gbx h ALA 292 N 1.03 0.61 -0.28 1.67 0.00 -1.21 -1.30 119.26 119.77 3gbx h ALA 292 Ca 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3gbx h ALA 292 Cb 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3gbx h ALA 292 CO -0.13 0.29 0.14 0.87 0.00 0.00 0.00 179.25 180.42 3gbx h LYS 293 N 0.62 0.41 -0.80 0.00 1.57 -1.00 -2.21 116.57 115.16 3gbx h LYS 293 Ca 0.15 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 3gbx h LYS 293 Cb 0.32 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 3gbx h LYS 293 CO 0.00 0.39 0.39 -0.91 -0.57 0.00 0.00 179.45 178.75 3gbx h ASN 294 N 0.32 1.04 -0.47 0.86 2.35 -0.67 -0.25 115.58 118.77 3gbx h ASN 294 Ca 0.10 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 3gbx h ASN 294 Cb 0.12 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 3gbx h ASN 294 CO -0.01 0.88 0.23 0.00 -1.65 0.00 0.00 177.43 176.88 3gbx h ALA 295 N 1.20 0.60 -0.79 -0.83 0.00 -1.08 -2.80 119.26 115.55 3gbx h ALA 295 Ca 0.27 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3gbx h ALA 295 Cb 0.11 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 3gbx h ALA 295 CO -0.04 0.16 0.39 0.87 0.00 0.00 0.00 179.25 180.64 3gbx h LYS 296 N 0.61 1.14 -0.48 0.00 1.57 -1.10 -1.58 116.57 116.73 3gbx h LYS 296 Ca 0.16 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3gbx h LYS 296 Cb 0.11 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3gbx h LYS 296 CO -0.02 0.87 0.00 0.00 -0.57 0.00 0.00 179.45 179.73 3gbx n ALA 297 N -2.40 1.13 0.00 3.86 0.00 -0.13 -1.73 120.51 121.24 3gbx n ALA 297 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3gbx n ALA 297 Cb 0.13 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.58 3gbx n ALA 297 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3gbx n VAL 299 N 0.62 0.00 -0.37 0.00 0.31 -0.59 -2.70 118.33 115.59 3gbx n VAL 299 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 3gbx n VAL 299 Cb 0.00 0.00 0.11 0.00 -0.91 0.00 0.00 33.84 33.05 3gbx n VAL 299 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3gbx h GLU 300 N 0.00 1.28 -0.17 5.55 4.81 -1.62 -0.74 114.58 123.69 3gbx h GLU 300 Ca 0.00 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 3gbx h GLU 300 Cb 0.00 -0.29 -0.01 0.00 0.63 0.00 0.00 28.75 29.08 3gbx h GLU 300 CO 0.00 0.85 0.08 0.28 -0.73 0.00 0.00 179.01 179.49 3gbx h VAL 301 N 1.32 1.13 -0.42 0.32 2.07 -1.80 -0.89 116.25 117.98 3gbx h VAL 301 Ca 0.37 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3gbx h VAL 301 Cb -0.12 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3gbx h VAL 301 CO -0.09 0.12 0.27 -0.26 0.02 0.00 0.00 177.57 177.64 3gbx h PHE 302 N 0.15 0.54 -0.44 1.57 0.04 -1.77 -0.35 116.94 116.69 3gbx h PHE 302 Ca 0.06 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 3gbx h PHE 302 Cb 0.12 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 3gbx h PHE 302 CO -0.03 0.35 0.26 -0.07 -0.60 0.00 0.00 178.31 178.22 3gbx h LEU 303 N 0.57 0.54 -0.37 1.54 3.38 -1.08 -0.44 115.31 119.44 3gbx h LEU 303 Ca 0.15 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3gbx h LEU 303 Cb -0.05 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.57 3gbx h LEU 303 CO -0.03 0.45 0.00 0.59 0.09 0.00 0.00 178.44 179.54 3gbx n ASN 304 N -4.72 0.37 -1.04 -0.43 3.02 -0.34 -2.17 115.26 109.95 3gbx n ASN 304 Ca 0.01 0.59 0.10 0.00 -0.03 0.00 0.00 54.58 55.25 3gbx n ASN 304 Cb 0.06 -0.67 0.23 0.00 -0.61 0.00 0.00 39.78 38.79 3gbx n ASN 304 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3gbx n ARG 305 N -1.91 2.56 -0.69 3.52 5.12 -0.18 -4.97 116.66 120.11 3gbx n ARG 305 Ca 0.03 -2.29 0.00 0.00 -1.93 0.00 0.00 57.85 53.65 3gbx n ARG 305 Cb 0.21 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 30.06 3gbx n ARG 305 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3gbx n GLY 306 N 1.22 0.61 3.90 -0.13 0.00 -0.92 -5.05 105.19 104.82 3gbx n GLY 306 Ca 0.18 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 3gbx n GLY 306 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gbx s TYR 307 N -2.00 3.52 -0.13 1.61 1.51 -0.21 -5.03 117.35 116.61 3gbx s TYR 307 Ca 0.00 0.50 -0.14 0.00 -1.01 0.00 0.00 57.07 56.42 3gbx s TYR 307 Cb 0.00 -1.95 -0.05 0.00 -0.11 0.00 0.00 41.96 39.86 3gbx s TYR 307 CO 0.00 0.52 0.31 0.15 -1.11 0.00 0.00 175.55 175.42 3gbx s LYS 308 N -2.34 4.16 -0.21 -0.62 1.02 -1.26 -4.05 119.74 116.44 3gbx s LYS 308 Ca 0.35 0.14 -0.05 0.00 0.02 0.00 0.00 55.97 56.43 3gbx s LYS 308 Cb -0.13 -3.38 -0.02 0.00 -0.52 0.00 0.00 37.83 33.78 3gbx s LYS 308 CO 0.23 0.33 -0.00 0.08 -0.92 0.00 0.00 175.35 175.07 3gbx s VAL 309 N 0.17 3.87 0.21 3.17 1.01 -1.26 -0.77 120.40 126.79 3gbx s VAL 309 Ca 0.18 -0.34 -0.32 0.00 0.00 0.00 0.00 61.98 61.50 3gbx s VAL 309 Cb -0.13 -2.76 -0.13 0.00 0.00 0.00 0.00 36.38 33.36 3gbx s VAL 309 CO 0.05 0.42 1.60 0.52 0.00 0.00 0.00 175.10 177.70 3gbx n VAL 310 N 4.42 0.31 -0.27 2.92 0.31 -0.14 -0.37 118.33 125.50 3gbx n VAL 310 Ca -0.17 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 3gbx n VAL 310 Cb 0.52 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.70 3gbx n VAL 310 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3gbx n SER 311 N 3.20 0.00 0.00 4.52 3.41 -1.23 -4.01 113.62 119.51 3gbx n SER 311 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 3gbx n SER 311 Cb 0.32 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 3gbx n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gbx n GLY 312 N -2.00 0.77 0.00 5.00 0.00 0.50 -4.93 105.19 104.53 3gbx n GLY 312 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3gbx n GLY 312 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gbx n GLY 313 N -2.31 -1.35 3.18 -0.02 0.00 -1.26 -4.94 105.19 98.48 3gbx n GLY 313 Ca 0.00 -1.00 -0.19 0.00 0.00 0.00 0.00 46.02 44.83 3gbx n GLY 313 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3gbx s THR 314 N -2.92 1.17 -0.16 2.61 -1.32 -1.26 -4.82 115.64 108.93 3gbx s THR 314 Ca 0.00 -1.27 0.16 0.00 -1.21 0.00 0.00 61.69 59.37 3gbx s THR 314 Cb 0.00 -1.10 0.32 0.00 -1.51 0.00 0.00 72.50 70.21 3gbx s THR 314 CO 0.00 -0.16 1.21 -0.62 -2.21 0.00 0.00 174.62 172.83 3gbx n GLU 315 N 1.38 1.93 0.00 7.08 1.02 0.16 -4.88 120.64 127.34 3gbx n GLU 315 Ca -0.20 -2.51 0.00 0.00 -0.02 0.00 0.00 57.16 54.42 3gbx n GLU 315 Cb 0.54 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 3gbx n GLU 315 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 3gbx n ASN 316 N -1.03 1.66 -0.44 1.62 0.23 -1.21 -4.80 115.26 111.29 3gbx n ASN 316 Ca 0.16 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.32 3gbx n ASN 316 Cb 0.65 0.00 0.13 0.00 -2.08 0.00 0.00 39.78 38.49 3gbx n ASN 316 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3gbx n HIS 317 N 0.00 0.00 -4.27 -2.53 1.44 -1.26 -4.60 115.22 104.01 3gbx n HIS 317 Ca 0.00 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.57 3gbx n HIS 317 Cb 0.00 -0.04 -0.10 0.00 0.12 0.00 0.00 29.99 29.97 3gbx n HIS 317 CO 0.00 0.00 0.00 -0.48 -2.81 0.00 0.00 176.34 173.05 3gbx s LEU 318 N -2.45 1.75 0.20 2.39 0.05 -1.26 -1.43 118.68 117.93 3gbx s LEU 318 Ca 0.21 -1.30 -0.23 0.00 0.05 0.00 0.00 54.13 52.87 3gbx s LEU 318 Cb 0.19 0.06 0.05 0.00 -2.05 0.00 0.00 46.19 44.43 3gbx s LEU 318 CO 0.54 -0.69 0.67 0.72 -0.55 0.00 0.00 176.35 177.04 3gbx s PHE 319 N -3.79 -0.38 -0.14 3.48 -0.12 -0.02 -4.61 117.98 112.40 3gbx s PHE 319 Ca 0.32 0.07 0.02 0.00 -0.05 0.00 0.00 56.93 57.30 3gbx s PHE 319 Cb 0.07 0.62 0.01 0.00 -0.63 0.00 0.00 43.02 43.09 3gbx s PHE 319 CO 0.09 -0.99 -0.22 -1.17 -0.05 0.00 0.00 175.22 172.89 3gbx s LEU 320 N -2.81 2.14 -0.02 -1.99 2.96 -1.26 -1.40 118.68 116.31 3gbx s LEU 320 Ca 0.05 -0.59 -0.22 0.00 -0.22 0.00 0.00 54.13 53.16 3gbx s LEU 320 Cb -0.03 -1.45 -0.05 0.00 0.50 0.00 0.00 46.19 45.16 3gbx s LEU 320 CO -0.05 0.09 0.64 -0.76 -1.32 0.00 0.00 176.35 174.95 3gbx s LEU 321 N 0.78 4.39 -0.40 -0.68 1.43 0.06 -0.97 118.68 123.30 3gbx s LEU 321 Ca -0.08 1.19 -0.12 0.00 -1.03 0.00 0.00 54.13 54.09 3gbx s LEU 321 Cb -0.16 -2.99 0.04 0.00 0.03 0.00 0.00 46.19 43.11 3gbx s LEU 321 CO -0.01 0.03 0.26 -0.62 0.23 0.00 0.00 176.35 176.24 3gbx s ASP 322 N 0.10 5.88 0.00 2.29 -1.08 0.05 -2.28 116.67 121.63 3gbx s ASP 322 Ca 0.33 -1.07 0.20 0.00 -0.52 0.00 0.00 52.55 51.50 3gbx s ASP 322 Cb -0.18 -2.08 0.54 0.00 -1.46 0.00 0.00 42.92 39.74 3gbx s ASP 322 CO 0.18 -0.45 1.45 0.18 0.52 0.00 0.00 175.17 177.05 3gbx n LEU 323 N 5.06 3.18 -0.19 -1.34 4.77 0.12 -4.18 117.00 124.42 3gbx n LEU 323 Ca -0.11 -1.51 -0.01 0.00 -0.03 0.00 0.00 56.01 54.34 3gbx n LEU 323 Cb 0.46 -0.34 0.09 0.00 -2.33 0.00 0.00 43.42 41.30 3gbx n LEU 323 CO 0.39 0.76 0.95 0.58 -1.33 0.00 0.00 177.39 178.74 3gbx h VAL 324 N 3.69 0.74 0.00 4.08 2.07 -1.78 -0.82 116.25 124.24 3gbx h VAL 324 Ca 0.00 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.41 3gbx h VAL 324 Cb 0.83 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 3gbx h VAL 324 CO 0.00 0.06 0.00 -0.90 0.02 0.00 0.00 177.57 176.75 3gbx n ASP 325 N -5.05 0.00 -0.89 0.57 5.68 -1.26 -1.76 116.55 113.84 3gbx n ASP 325 Ca 0.08 0.39 0.12 0.00 -0.50 0.00 0.00 54.79 54.87 3gbx n ASP 325 Cb 0.27 -0.44 0.12 0.00 -1.14 0.00 0.00 41.12 39.93 3gbx n ASP 325 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3gbx n LYS 326 N -1.44 2.19 -3.84 0.11 4.76 -0.32 -4.97 118.16 114.65 3gbx n LYS 326 Ca 0.04 -1.78 -0.28 0.00 -2.87 0.00 0.00 58.31 53.41 3gbx n LYS 326 Cb 0.15 -1.46 0.04 0.00 -1.84 0.00 0.00 35.03 31.91 3gbx n LYS 326 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 3gbx n ASN 327 N 1.15 -4.94 -4.40 4.39 5.15 -0.72 -4.98 115.26 110.91 3gbx n ASN 327 Ca 0.14 -0.73 -0.30 0.00 -0.60 0.00 0.00 54.58 53.09 3gbx n ASN 327 Cb 0.57 -4.14 -0.13 0.00 -0.53 0.00 0.00 39.78 35.55 3gbx n ASN 327 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3gbx s LEU 328 N -7.26 2.39 0.23 1.20 1.43 -1.16 -5.09 118.68 110.43 3gbx s LEU 328 Ca 0.61 -0.58 -0.05 0.00 -1.03 0.00 0.00 54.13 53.08 3gbx s LEU 328 Cb -0.30 -1.36 -0.05 0.00 0.03 0.00 0.00 46.19 44.50 3gbx s LEU 328 CO 0.81 0.23 0.48 0.42 0.23 0.00 0.00 176.35 178.52 3gbx s THR 329 N -0.94 5.08 0.22 5.49 -4.23 -1.26 -4.47 115.64 115.53 3gbx s THR 329 Ca 0.14 0.03 -0.08 0.00 -1.18 0.00 0.00 61.69 60.59 3gbx s THR 329 Cb -0.10 -3.69 0.17 0.00 1.34 0.00 0.00 72.50 70.22 3gbx s THR 329 CO 0.05 -0.18 1.83 1.23 -0.54 0.00 0.00 174.62 177.01 3gbx h GLY 330 N 2.11 1.23 0.74 3.99 0.00 -0.99 -1.41 103.07 108.75 3gbx h GLY 330 Ca -0.47 -0.56 0.04 0.00 0.00 0.00 0.00 47.33 46.34 3gbx h GLY 330 CO 0.68 0.54 0.25 1.70 0.00 0.00 0.00 176.54 179.71 3gbx h LYS 331 N 1.14 0.47 -0.16 4.80 3.64 -1.59 0.21 116.57 125.09 3gbx h LYS 331 Ca 0.29 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 59.47 3gbx h LYS 331 Cb 0.04 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 3gbx h LYS 331 CO -0.05 0.31 -0.59 1.05 -2.27 0.00 0.00 179.45 177.91 3gbx h GLU 332 N 0.49 0.51 -0.31 1.90 4.11 -1.82 -1.80 114.58 117.66 3gbx h GLU 332 Ca 0.22 -0.34 -0.04 0.00 0.07 0.00 0.00 59.36 59.27 3gbx h GLU 332 Cb 0.12 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3gbx h GLU 332 CO -0.15 0.95 0.05 0.00 0.07 0.00 0.00 179.01 179.93 3gbx h ALA 333 N 0.97 0.42 -0.44 1.06 0.00 -1.03 -0.13 119.26 120.11 3gbx h ALA 333 Ca -0.00 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.79 3gbx h ALA 333 Cb 1.13 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 3gbx h ALA 333 CO 0.11 0.11 0.02 0.22 0.00 0.00 0.00 179.25 179.71 3gbx h ASP 334 N 0.34 -0.14 -0.51 0.00 -0.00 -0.87 -0.72 116.42 114.52 3gbx h ASP 334 Ca 0.09 0.10 -0.07 0.00 -0.00 0.00 0.00 57.03 57.15 3gbx h ASP 334 Cb 0.35 0.16 -0.02 0.00 -0.00 0.00 0.00 39.33 39.82 3gbx h ASP 334 CO 0.01 -0.03 0.05 0.00 -0.00 0.00 0.00 179.24 179.26 3gbx h ALA 335 N 1.38 0.68 -0.28 -0.78 0.00 -1.05 -0.55 119.26 118.66 3gbx h ALA 335 Ca 0.22 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3gbx h ALA 335 Cb 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3gbx h ALA 335 CO -0.35 0.45 0.08 0.00 0.00 0.00 0.00 179.25 179.44 3gbx h ALA 336 N 0.96 0.37 -0.65 0.00 0.00 -0.73 -2.14 119.26 117.07 3gbx h ALA 336 Ca 0.15 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3gbx h ALA 336 Cb 0.45 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3gbx h ALA 336 CO 0.02 0.01 0.11 -0.07 0.00 0.00 0.00 179.25 179.32 3gbx h LEU 337 N 0.29 1.01 -2.00 0.00 3.38 -1.04 -2.31 115.31 114.64 3gbx h LEU 337 Ca 0.09 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.87 3gbx h LEU 337 Cb 0.25 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3gbx h LEU 337 CO -0.00 1.00 0.10 1.23 0.09 0.00 0.00 178.44 180.86 3gbx h GLY 338 N 1.05 0.00 2.00 0.83 0.00 -0.64 0.03 103.07 106.33 3gbx h GLY 338 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.52 3gbx h GLY 338 CO 0.01 0.00 -0.07 3.21 0.00 0.00 0.00 176.54 179.69 3gbx h ARG 339 N 0.00 0.00 -0.43 4.80 3.08 -0.80 -1.67 114.38 119.36 3gbx h ARG 339 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3gbx h ARG 339 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 3gbx h ARG 339 CO -0.00 0.07 0.00 0.00 -1.07 0.00 0.00 179.97 178.97 3gbx n ALA 340 N -2.18 3.43 -2.35 0.04 0.00 -0.07 -4.84 120.51 114.53 3gbx n ALA 340 Ca -0.01 -2.08 -0.16 0.00 0.00 0.00 0.00 53.44 51.18 3gbx n ALA 340 Cb 0.23 -0.92 -0.00 0.00 0.00 0.00 0.00 19.45 18.75 3gbx n ALA 340 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3gbx n ASN 341 N 0.12 -4.73 -4.19 0.00 4.13 -0.63 -4.18 115.26 105.79 3gbx n ASN 341 Ca 0.25 -0.03 -0.34 0.00 1.68 0.00 0.00 54.58 56.14 3gbx n ASN 341 Cb 1.04 -3.83 -0.15 0.00 -1.54 0.00 0.00 39.78 35.30 3gbx n ASN 341 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3gbx s ILE 342 N -2.81 2.49 -0.29 2.41 1.01 -0.78 -0.95 121.20 122.28 3gbx s ILE 342 Ca 0.02 -0.79 -0.10 0.00 0.00 0.00 0.00 60.65 59.77 3gbx s ILE 342 Cb -0.01 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.34 3gbx s ILE 342 CO 0.03 0.50 0.17 -0.89 0.00 0.00 0.00 174.94 174.75 3gbx s THR 343 N 1.31 5.06 0.43 2.92 2.01 -0.24 -2.26 115.64 124.86 3gbx s THR 343 Ca 0.04 -0.00 0.04 0.00 0.31 0.00 0.00 61.69 62.08 3gbx s THR 343 Cb -0.14 -3.45 -0.02 0.00 0.01 0.00 0.00 72.50 68.91 3gbx s THR 343 CO -0.09 0.21 0.14 0.68 -0.69 0.00 0.00 174.62 174.87 3gbx s VAL 344 N 1.71 0.54 0.05 3.82 -7.23 -1.26 -0.37 120.40 117.67 3gbx s VAL 344 Ca 0.07 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.28 3gbx s VAL 344 Cb -0.16 -2.29 -0.03 0.00 0.56 0.00 0.00 36.38 34.47 3gbx s VAL 344 CO 0.09 0.00 -0.12 0.54 -0.31 0.00 0.00 175.10 175.30 3gbx s ASN 345 N -3.63 1.43 0.72 4.85 4.22 -1.22 -4.85 114.94 116.46 3gbx s ASN 345 Ca 0.22 -0.55 -0.13 0.00 -2.14 0.00 0.00 52.86 50.26 3gbx s ASN 345 Cb 0.02 -0.04 0.03 0.00 1.28 0.00 0.00 41.25 42.54 3gbx s ASN 345 CO 0.14 -0.08 1.12 -1.59 -2.04 0.00 0.00 177.10 174.66 3gbx s LYS 346 N -1.51 2.40 -0.27 3.55 -2.85 -1.26 -1.31 119.74 118.49 3gbx s LYS 346 Ca -0.03 1.38 -0.22 0.00 -1.00 0.00 0.00 55.97 56.10 3gbx s LYS 346 Cb -0.09 -1.90 0.08 0.00 -2.06 0.00 0.00 37.83 33.86 3gbx s LYS 346 CO 0.01 -1.56 0.73 1.21 0.10 0.00 0.00 175.35 175.85 3gbx s ASN 347 N -2.76 -0.79 0.52 0.03 2.47 -0.07 -4.66 114.94 109.67 3gbx s ASN 347 Ca 0.66 1.42 -0.22 0.00 0.42 0.00 0.00 52.86 55.14 3gbx s ASN 347 Cb -0.21 1.40 -0.06 0.00 -1.45 0.00 0.00 41.25 40.94 3gbx s ASN 347 CO 0.48 -0.24 1.33 -0.44 -3.72 0.00 0.00 177.10 174.51 3gbx s SER 348 N 0.80 5.53 0.42 -4.21 0.01 -1.26 -2.02 113.70 112.97 3gbx s SER 348 Ca -0.03 2.70 0.08 0.00 1.31 0.00 0.00 55.95 60.00 3gbx s SER 348 Cb -0.05 -2.63 -0.00 0.00 0.21 0.00 0.00 66.02 63.54 3gbx s SER 348 CO -0.07 -1.39 0.48 0.68 0.41 0.00 0.00 173.24 173.36 3gbx s VAL 349 N -1.33 2.85 0.28 3.43 -7.23 -1.26 -4.86 120.40 112.28 3gbx s VAL 349 Ca 0.68 -1.16 -0.30 0.00 -1.81 0.00 0.00 61.98 59.40 3gbx s VAL 349 Cb -0.39 -3.00 -0.11 0.00 0.56 0.00 0.00 36.38 33.44 3gbx s VAL 349 CO 0.46 -0.00 1.55 -2.84 -0.31 0.00 0.00 175.10 173.96 3gbx s PRO 350 N -4.25 4.16 -1.45 4.82 0.02 -1.26 -2.15 135.00 134.89 3gbx s PRO 350 Ca 0.52 2.50 -0.09 0.00 0.02 0.00 0.00 61.00 63.95 3gbx s PRO 350 Cb -0.07 -3.05 0.03 0.00 0.02 0.00 0.00 34.50 31.44 3gbx s PRO 350 CO 0.31 -0.57 0.90 0.09 -0.33 0.00 0.00 177.00 177.40 3gbx n ASN 351 N 2.15 -5.79 -4.70 2.53 3.02 -1.26 -4.86 115.26 106.35 3gbx n ASN 351 Ca 0.07 -0.49 -0.42 0.00 -0.03 0.00 0.00 54.58 53.71 3gbx n ASN 351 Cb 0.38 -4.62 -0.03 0.00 -0.61 0.00 0.00 39.78 34.90 3gbx n ASN 351 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3gbx s ASP 352 N -3.06 6.39 0.28 6.41 3.68 -0.91 -4.85 116.67 124.61 3gbx s ASP 352 Ca 0.50 2.82 0.25 0.00 2.13 0.00 0.00 52.55 58.25 3gbx s ASP 352 Cb -0.23 -2.58 0.92 0.00 -1.45 0.00 0.00 42.92 39.58 3gbx s ASP 352 CO 0.62 -1.00 1.76 1.55 0.13 0.00 0.00 175.17 178.22 3gbx h PRO 353 N 8.01 0.00 -6.29 4.34 0.13 -1.91 -3.45 132.00 132.84 3gbx h PRO 353 Ca -0.45 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.17 3gbx h PRO 353 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 3gbx h PRO 353 CO 0.95 0.00 -0.32 0.15 -0.23 0.00 0.00 178.00 178.56 3gbx s LYS 354 N -3.27 3.50 0.82 0.86 -0.14 -1.26 -5.10 119.74 115.15 3gbx s LYS 354 Ca 0.06 -0.41 -0.15 0.00 -1.36 0.00 0.00 55.97 54.12 3gbx s LYS 354 Cb 0.10 -2.80 0.00 0.00 -1.68 0.00 0.00 37.83 33.45 3gbx s LYS 354 CO 0.50 0.34 0.55 0.45 -0.76 0.00 0.00 175.35 176.43 3gbx n SER 355 N -1.06 -1.32 0.23 2.83 2.88 -1.26 -4.48 113.62 111.44 3gbx n SER 355 Ca -0.05 0.49 0.16 0.00 -1.33 0.00 0.00 58.87 58.14 3gbx n SER 355 Cb 0.55 -1.24 0.69 0.00 -0.75 0.00 0.00 64.21 63.46 3gbx n SER 355 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 3gbx h PRO 356 N -0.86 0.00 -0.01 -1.46 0.11 -1.98 0.45 132.00 128.26 3gbx h PRO 356 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3gbx h PRO 356 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3gbx h PRO 356 CO 0.40 0.00 -0.16 1.19 -0.21 0.00 0.00 178.00 179.22 3gbx n PHE 357 N -2.76 0.00 0.05 0.65 3.01 -1.26 -4.46 117.46 112.69 3gbx n PHE 357 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3gbx n PHE 357 Cb 0.23 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 3gbx n PHE 357 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3gbx n VAL 358 N -0.85 1.18 -0.79 -4.37 0.31 -0.51 -4.89 118.33 108.40 3gbx n VAL 358 Ca 0.14 0.39 0.10 0.00 -0.01 0.00 0.00 64.34 64.96 3gbx n VAL 358 Cb 0.30 -1.56 -0.04 0.00 -0.91 0.00 0.00 33.84 31.63 3gbx n VAL 358 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3gbx n THR 359 N -3.49 -0.23 -0.93 2.52 -2.24 0.15 -1.86 114.28 108.20 3gbx n THR 359 Ca 0.00 0.38 0.09 0.00 -2.27 0.00 0.00 64.05 62.25 3gbx n THR 359 Cb 0.01 -0.65 0.13 0.00 -2.10 0.00 0.00 70.33 67.72 3gbx n THR 359 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3gbx n SER 360 N -3.41 2.37 -4.12 3.42 7.64 -1.26 -0.93 113.62 117.33 3gbx n SER 360 Ca -0.04 -2.95 -0.09 0.00 1.01 0.00 0.00 58.87 56.81 3gbx n SER 360 Cb 0.37 -0.38 -0.10 0.00 -1.01 0.00 0.00 64.21 63.09 3gbx n SER 360 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3gbx s GLY 361 N -2.60 0.76 0.02 0.23 0.00 -0.86 0.11 107.32 104.98 3gbx s GLY 361 Ca 0.28 -1.36 0.05 0.00 0.00 0.00 0.00 44.72 43.69 3gbx s GLY 361 CO 0.03 -1.35 -0.14 -0.26 0.00 0.00 0.00 173.10 171.39 3gbx s ILE 362 N -3.98 1.09 -0.18 0.90 -4.36 -0.97 -0.89 121.20 112.80 3gbx s ILE 362 Ca 0.16 -0.86 -0.08 0.00 -0.26 0.00 0.00 60.65 59.62 3gbx s ILE 362 Cb 0.08 -0.96 -0.04 0.00 1.25 0.00 0.00 42.46 42.78 3gbx s ILE 362 CO -0.04 0.10 0.08 -0.60 0.24 0.00 0.00 174.94 174.72 3gbx s ARG 363 N -0.87 4.01 -0.04 0.37 3.52 -0.43 -0.76 118.95 124.75 3gbx s ARG 363 Ca 0.03 -0.31 0.04 0.00 -0.13 0.00 0.00 55.73 55.36 3gbx s ARG 363 Cb -0.07 -3.25 -0.00 0.00 -1.56 0.00 0.00 34.95 30.06 3gbx s ARG 363 CO 0.01 0.29 -0.17 0.42 -0.81 0.00 0.00 175.30 175.04 3gbx s ILE 364 N 0.33 1.39 0.04 4.11 1.01 -0.49 -3.40 121.20 124.19 3gbx s ILE 364 Ca 0.04 -0.70 0.03 0.00 0.00 0.00 0.00 60.65 60.03 3gbx s ILE 364 Cb -0.12 -1.20 -0.02 0.00 0.01 0.00 0.00 42.46 41.13 3gbx s ILE 364 CO -0.00 0.40 -0.10 -0.83 0.00 0.00 0.00 174.94 174.41 3gbx s GLY 365 N 0.02 0.59 0.00 6.18 0.00 0.37 -0.84 107.32 113.63 3gbx s GLY 365 Ca -0.03 -0.72 0.28 0.00 0.00 0.00 0.00 44.72 44.25 3gbx s GLY 365 CO 0.02 -0.73 1.73 -1.14 0.00 0.00 0.00 173.10 172.98 3gbx n SER 366 N 1.82 1.35 -0.26 1.64 3.41 -0.51 -4.49 113.62 116.57 3gbx n SER 366 Ca -0.19 -1.35 -0.04 0.00 -0.26 0.00 0.00 58.87 57.02 3gbx n SER 366 Cb 0.55 0.02 0.07 0.00 -0.26 0.00 0.00 64.21 64.59 3gbx n SER 366 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3gbx h PRO 367 N 2.04 0.93 -0.05 4.33 0.11 -1.86 -1.96 132.00 135.54 3gbx h PRO 367 Ca 0.00 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.00 3gbx h PRO 367 Cb 0.48 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.38 3gbx h PRO 367 CO 0.00 0.62 -0.20 0.00 -0.21 0.00 0.00 178.00 178.21 3gbx h ALA 368 N 1.28 0.09 -0.50 -0.75 0.00 -1.80 -1.03 119.26 116.55 3gbx h ALA 368 Ca 0.27 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3gbx h ALA 368 Cb -0.08 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3gbx h ALA 368 CO -0.07 0.06 0.25 -0.39 0.00 0.00 0.00 179.25 179.09 3gbx h VAL 369 N -0.33 1.17 -0.33 0.00 -1.51 -1.67 -1.84 116.25 111.73 3gbx h VAL 369 Ca -0.01 -0.45 -0.14 0.00 -1.23 0.00 0.00 66.70 64.87 3gbx h VAL 369 Cb 0.85 0.52 -0.01 0.00 -2.13 0.00 0.00 31.29 30.52 3gbx h VAL 369 CO 0.04 0.19 -0.35 0.74 -1.23 0.00 0.00 177.57 176.96 3gbx h THR 370 N 0.70 1.28 -0.74 7.19 2.02 -1.30 -1.33 112.91 120.73 3gbx h THR 370 Ca 0.18 -1.50 0.02 0.00 0.77 0.00 0.00 66.41 65.87 3gbx h THR 370 Cb 0.06 1.40 -0.04 0.00 -1.74 0.00 0.00 68.15 67.83 3gbx h THR 370 CO -0.03 0.49 0.48 -0.09 0.37 0.00 0.00 175.52 176.74 3gbx h ARG 371 N 0.62 0.92 -0.05 6.66 9.65 -0.39 -1.85 114.38 129.95 3gbx h ARG 371 Ca 0.06 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 3gbx h ARG 371 Cb 0.88 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 29.25 3gbx h ARG 371 CO 0.08 0.61 0.00 2.89 2.80 0.00 0.00 179.97 186.35 3gbx n ARG 372 N -4.61 1.31 0.00 0.20 1.85 -0.86 -4.90 116.66 109.66 3gbx n ARG 372 Ca 0.08 -0.46 0.00 0.00 -1.00 0.00 0.00 57.85 56.46 3gbx n ARG 372 Cb 0.06 -1.40 0.00 0.00 -1.05 0.00 0.00 32.46 30.07 3gbx n ARG 372 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3gbx n GLY 373 N 1.00 1.00 3.74 2.89 0.00 -0.69 -4.73 105.19 108.39 3gbx n GLY 373 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3gbx n GLY 373 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gbx s PHE 374 N -2.00 3.23 0.00 1.61 0.40 -0.53 -5.00 117.98 115.70 3gbx s PHE 374 Ca 0.00 1.25 0.00 0.00 -0.60 0.00 0.00 56.93 57.58 3gbx s PHE 374 Cb 0.00 -3.61 0.00 0.00 0.51 0.00 0.00 43.02 39.92 3gbx s PHE 374 CO 0.00 -1.87 0.00 1.63 0.70 0.00 0.00 175.22 175.68 3gbx n LYS 375 N 2.34 3.35 -0.16 0.44 5.02 -1.26 -4.44 118.16 123.45 3gbx n LYS 375 Ca 0.05 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.24 3gbx n LYS 375 Cb 0.43 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.43 3gbx n LYS 375 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3gbx h GLU 376 N 0.00 0.78 -0.55 1.97 3.07 -1.94 -2.13 114.58 115.78 3gbx h GLU 376 Ca 0.00 -0.23 0.02 0.00 -0.50 0.00 0.00 59.36 58.66 3gbx h GLU 376 Cb 0.00 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 27.79 3gbx h GLU 376 CO 0.00 0.82 0.33 0.00 -1.40 0.00 0.00 179.01 178.75 3gbx h ALA 377 N 0.93 0.70 -0.43 3.43 0.00 -1.99 -0.30 119.26 121.60 3gbx h ALA 377 Ca 0.13 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 3gbx h ALA 377 Cb 0.44 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3gbx h ALA 377 CO 0.02 0.05 -0.02 0.93 0.00 0.00 0.00 179.25 180.22 3gbx h GLU 378 N 0.65 0.78 -0.04 0.00 3.07 -1.84 -2.34 114.58 114.86 3gbx h GLU 378 Ca 0.22 -0.26 -0.11 0.00 -0.50 0.00 0.00 59.36 58.71 3gbx h GLU 378 Cb 0.02 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.85 3gbx h GLU 378 CO -0.10 0.86 -0.47 -0.39 -1.40 0.00 0.00 179.01 177.52 3gbx h VAL 379 N 0.61 1.34 -0.34 3.13 -1.51 -1.14 -1.45 116.25 116.89 3gbx h VAL 379 Ca 0.12 -1.63 -0.05 0.00 -1.23 0.00 0.00 66.70 63.91 3gbx h VAL 379 Cb 0.52 1.84 -0.01 0.00 -2.13 0.00 0.00 31.29 31.51 3gbx h VAL 379 CO 0.03 0.47 0.02 0.11 -1.23 0.00 0.00 177.57 176.97 3gbx h LYS 380 N 0.07 0.58 -0.44 5.19 1.57 -0.93 -0.21 116.57 122.40 3gbx h LYS 380 Ca 0.00 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3gbx h LYS 380 Cb 0.86 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.09 3gbx h LYS 380 CO 0.06 0.70 0.26 0.93 -0.57 0.00 0.00 179.45 180.83 3gbx h GLU 381 N 0.40 0.60 -0.10 3.15 5.08 -1.25 -1.72 114.58 120.75 3gbx h GLU 381 Ca 0.10 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 3gbx h GLU 381 Cb 0.42 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 3gbx h GLU 381 CO 0.01 0.45 -0.07 1.25 -1.00 0.00 0.00 179.01 179.66 3gbx h LEU 382 N 0.58 -0.21 -1.47 1.33 5.85 -1.14 -1.17 115.31 119.09 3gbx h LEU 382 Ca 0.16 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.93 3gbx h LEU 382 Cb 0.01 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 3gbx h LEU 382 CO -0.03 -0.09 0.32 0.00 -0.34 0.00 0.00 178.44 178.30 3gbx h ALA 383 N 1.01 1.61 -0.35 1.25 0.00 -0.78 -2.32 119.26 119.68 3gbx h ALA 383 Ca 0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3gbx h ALA 383 Cb 0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3gbx h ALA 383 CO -0.14 0.35 0.11 0.78 0.00 0.00 0.00 179.25 180.35 3gbx h GLY 384 N 0.71 0.59 -1.97 0.00 0.00 -0.72 -1.55 103.07 100.14 3gbx h GLY 384 Ca 0.18 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.16 3gbx h GLY 384 CO -0.04 0.33 0.00 0.79 0.00 0.00 0.00 176.54 177.62 3gbx n TRP 385 N -4.64 0.00 0.00 5.60 8.01 -0.50 -0.82 117.44 125.09 3gbx n TRP 385 Ca -0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.18 3gbx n TRP 385 Cb 0.18 -0.09 0.00 0.00 -2.01 0.00 0.00 31.31 29.39 3gbx n TRP 385 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3gbx h ASP 388 N 0.00 0.41 0.20 0.00 3.32 -1.25 0.61 116.42 119.71 3gbx h ASP 388 Ca 0.00 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3gbx h ASP 388 Cb 0.00 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3gbx h ASP 388 CO 0.00 0.28 -0.10 0.58 -1.72 0.00 0.00 179.24 178.29 3gbx h VAL 389 N 0.53 0.88 0.00 -1.35 2.07 -1.55 -3.23 116.25 113.60 3gbx h VAL 389 Ca 0.22 -0.48 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 3gbx h VAL 389 Cb 0.09 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 3gbx h VAL 389 CO -0.13 0.11 -0.29 -0.07 0.02 0.00 0.00 177.57 177.21 3gbx h LEU 390 N -0.51 0.00 -1.74 2.57 3.38 -1.81 -1.03 115.31 116.17 3gbx h LEU 390 Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 3gbx h LEU 390 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 3gbx h LEU 390 CO 0.05 0.29 -0.16 0.44 0.09 0.00 0.00 178.44 179.14 3gbx h ASP 391 N 0.00 0.00 -0.95 -0.43 3.32 -0.89 -3.37 116.42 114.09 3gbx h ASP 391 Ca -0.00 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 56.76 3gbx h ASP 391 Cb 0.66 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.00 3gbx h ASP 391 CO 0.04 0.16 -0.63 0.59 -1.72 0.00 0.00 179.24 177.67 3gbx n ASN 392 N -4.17 -2.43 0.27 6.45 3.02 -0.49 -5.01 115.26 112.92 3gbx n ASN 392 Ca -0.02 -2.96 0.11 0.00 -0.03 0.00 0.00 54.58 51.68 3gbx n ASN 392 Cb 0.23 1.19 0.76 0.00 -0.61 0.00 0.00 39.78 41.35 3gbx n ASN 392 CO 0.00 0.00 0.00 0.16 -2.62 0.00 0.00 177.26 174.80 3gbx h ILE 393 N 3.87 0.78 -0.21 2.41 -2.65 -1.48 -1.41 117.51 118.82 3gbx h ILE 393 Ca 0.01 -0.07 0.00 0.00 1.03 0.00 0.00 64.86 65.84 3gbx h ILE 393 Cb 1.03 1.04 0.00 0.00 -2.05 0.00 0.00 36.82 36.84 3gbx h ILE 393 CO 0.23 0.02 0.00 -0.46 0.03 0.00 0.00 178.15 177.96 3gbx n ASN 394 N -4.17 1.82 -4.47 2.16 6.94 -1.26 -4.71 115.26 111.58 3gbx n ASN 394 Ca -0.03 -1.77 -0.43 0.00 -0.02 0.00 0.00 54.58 52.33 3gbx n ASN 394 Cb 0.10 -0.13 -0.03 0.00 -2.36 0.00 0.00 39.78 37.36 3gbx n ASN 394 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3gbx s ASP 395 N -1.48 6.37 0.44 0.53 2.15 -0.53 -4.87 116.67 119.28 3gbx s ASP 395 Ca 0.32 -1.39 0.12 0.00 0.43 0.00 0.00 52.55 52.02 3gbx s ASP 395 Cb 0.17 -2.43 0.98 0.00 -0.30 0.00 0.00 42.92 41.34 3gbx s ASP 395 CO 0.25 -1.33 2.03 1.05 -0.17 0.00 0.00 175.17 177.00 3gbx h GLU 396 N 9.34 0.19 -0.95 4.34 9.09 -1.87 -1.41 114.58 133.31 3gbx h GLU 396 Ca -0.08 -0.03 0.02 0.00 0.05 0.00 0.00 59.36 59.33 3gbx h GLU 396 Cb 1.05 -0.04 -0.05 0.00 -1.65 0.00 0.00 28.75 28.06 3gbx h GLU 396 CO 1.18 0.23 0.62 0.00 0.05 0.00 0.00 179.01 181.09 3gbx h ALA 397 N 1.80 1.23 -0.17 1.06 0.00 -1.97 0.18 119.26 121.39 3gbx h ALA 397 Ca 0.04 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3gbx h ALA 397 Cb 0.17 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 3gbx h ALA 397 CO 0.00 0.54 -0.19 1.15 0.00 0.00 0.00 179.25 180.76 3gbx h THR 398 N 1.24 1.34 -0.31 0.00 2.02 -1.65 -0.98 112.91 114.57 3gbx h THR 398 Ca 0.37 -1.37 0.05 0.00 0.77 0.00 0.00 66.41 66.23 3gbx h THR 398 Cb -0.06 1.85 -0.05 0.00 -1.74 0.00 0.00 68.15 68.15 3gbx h THR 398 CO -0.10 0.41 0.03 0.40 0.37 0.00 0.00 175.52 176.63 3gbx h ILE 399 N 0.07 0.81 -0.39 3.11 1.08 -0.97 -0.36 117.51 120.86 3gbx h ILE 399 Ca 0.02 -0.04 -0.10 0.00 -0.39 0.00 0.00 64.86 64.35 3gbx h ILE 399 Cb 0.74 0.67 -0.02 0.00 -3.07 0.00 0.00 36.82 35.14 3gbx h ILE 399 CO 0.05 0.02 -0.18 -0.33 -0.69 0.00 0.00 178.15 177.02 3gbx h GLU 400 N 0.13 0.74 -0.32 2.37 4.39 -0.90 -0.34 114.58 120.65 3gbx h GLU 400 Ca 0.15 -0.27 -0.05 0.00 0.34 0.00 0.00 59.36 59.53 3gbx h GLU 400 Cb 0.18 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 3gbx h GLU 400 CO -0.22 0.86 0.02 -0.09 -1.16 0.00 0.00 179.01 178.43 3gbx h ARG 401 N 0.65 0.55 -0.30 2.33 2.43 -0.70 -2.16 114.38 117.20 3gbx h ARG 401 Ca 0.10 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 3gbx h ARG 401 Cb 0.66 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 3gbx h ARG 401 CO 0.05 0.66 0.07 0.28 -1.51 0.00 0.00 179.97 179.52 3gbx h VAL 402 N 0.36 1.22 -0.55 0.20 2.07 -0.95 -2.44 116.25 116.16 3gbx h VAL 402 Ca 0.09 -0.72 0.10 0.00 0.82 0.00 0.00 66.70 67.00 3gbx h VAL 402 Cb 0.40 1.12 -0.08 0.00 -1.52 0.00 0.00 31.29 31.21 3gbx h VAL 402 CO 0.01 0.24 0.06 0.50 0.02 0.00 0.00 177.57 178.40 3gbx h LYS 403 N 0.31 0.18 -0.73 1.57 3.64 -1.02 0.20 116.57 120.72 3gbx h LYS 403 Ca 0.09 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.43 3gbx h LYS 403 Cb 0.29 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 3gbx h LYS 403 CO 0.00 0.12 0.32 0.00 -2.27 0.00 0.00 179.45 177.62 3gbx h ALA 404 N 1.46 0.95 -0.61 5.00 0.00 -1.23 -0.79 119.26 124.03 3gbx h ALA 404 Ca 0.28 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3gbx h ALA 404 Cb 0.42 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3gbx h ALA 404 CO -0.41 0.54 0.14 0.87 0.00 0.00 0.00 179.25 180.40 3gbx h LYS 405 N 1.04 0.99 -0.29 0.00 1.57 -0.80 -1.11 116.57 117.96 3gbx h LYS 405 Ca 0.25 -0.24 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 3gbx h LYS 405 Cb 0.17 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3gbx h LYS 405 CO -0.03 0.91 0.14 0.28 -0.57 0.00 0.00 179.45 180.18 3gbx h VAL 406 N 0.90 0.98 -0.53 0.50 2.07 -0.31 -0.98 116.25 118.88 3gbx h VAL 406 Ca 0.19 -0.10 -0.06 0.00 0.82 0.00 0.00 66.70 67.55 3gbx h VAL 406 Cb 0.37 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 3gbx h VAL 406 CO 0.00 0.05 0.11 -0.07 0.02 0.00 0.00 177.57 177.69 3gbx h LEU 407 N 0.29 0.83 -0.82 2.57 3.38 -0.94 0.50 115.31 121.12 3gbx h LEU 407 Ca 0.12 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 57.90 3gbx h LEU 407 Cb 0.05 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.52 3gbx h LEU 407 CO -0.09 0.86 0.51 0.44 0.09 0.00 0.00 178.44 180.24 3gbx h ASP 408 N 0.76 0.81 0.05 -0.43 3.32 -1.08 -1.05 116.42 118.79 3gbx h ASP 408 Ca 0.17 0.01 -0.28 0.00 0.02 0.00 0.00 57.03 56.95 3gbx h ASP 408 Cb 0.36 -0.16 0.02 0.00 0.22 0.00 0.00 39.33 39.78 3gbx h ASP 408 CO 0.00 0.53 -1.12 -0.29 -1.72 0.00 0.00 179.24 176.64 3gbx h ILE 409 N 0.94 1.28 -0.97 0.35 6.09 -0.75 -2.68 117.51 121.76 3gbx h ILE 409 Ca 0.35 -2.33 0.12 0.00 -1.37 0.00 0.00 64.86 61.64 3gbx h ILE 409 Cb 0.13 2.50 -0.09 0.00 0.47 0.00 0.00 36.82 39.83 3gbx h ILE 409 CO -0.16 0.72 0.60 0.00 -3.07 0.00 0.00 178.15 176.24 3gbx h ALA 411 N 1.54 1.68 -0.16 0.00 0.00 -0.86 -2.25 119.26 119.20 3gbx h ALA 411 Ca 0.49 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3gbx h ALA 411 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3gbx h ALA 411 CO -0.28 0.24 0.00 2.89 0.00 0.00 0.00 179.25 182.10 3gbx n ARG 412 N -4.31 2.33 -3.01 0.00 1.85 -0.87 -4.27 116.66 108.38 3gbx n ARG 412 Ca -0.02 -1.96 -0.25 0.00 -1.00 0.00 0.00 57.85 54.61 3gbx n ARG 412 Cb 0.25 -1.48 -0.04 0.00 -1.05 0.00 0.00 32.46 30.14 3gbx n ARG 412 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3gbx n PHE 413 N 1.28 3.33 -1.83 2.89 3.72 -0.85 -5.10 117.46 120.91 3gbx n PHE 413 Ca 0.16 -3.97 -0.40 0.00 -0.05 0.00 0.00 57.45 53.20 3gbx n PHE 413 Cb 0.58 -0.48 0.02 0.00 -0.94 0.00 0.00 39.48 38.65 3gbx n PHE 413 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3gbx s PRO 414 N -3.23 3.69 -0.10 -1.08 0.04 -1.22 -4.88 135.00 128.22 3gbx s PRO 414 Ca 0.47 2.37 -0.27 0.00 0.04 0.00 0.00 61.00 63.61 3gbx s PRO 414 Cb 0.29 -2.65 -0.26 0.00 0.04 0.00 0.00 34.50 31.92 3gbx s PRO 414 CO -0.12 -0.79 0.86 0.28 0.04 0.00 0.00 177.00 177.26 3gbx h VAL 415 N 2.28 1.69 -3.99 -0.36 2.07 -1.90 -3.47 116.25 112.57 3gbx h VAL 415 Ca -0.51 -2.27 -0.58 0.00 0.82 0.00 0.00 66.70 64.17 3gbx h VAL 415 Cb 1.26 3.21 -0.23 0.00 -1.52 0.00 0.00 31.29 34.02 3gbx h VAL 415 CO 0.61 0.60 -0.83 -0.31 0.02 0.00 0.00 177.57 177.66 3gbx s TYR 416 N -2.49 1.84 0.00 1.57 1.51 -1.26 -5.01 117.35 113.51 3gbx s TYR 416 Ca -0.17 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.48 3gbx s TYR 416 Cb -0.02 -1.03 0.00 0.00 -0.11 0.00 0.00 41.96 40.80 3gbx s TYR 416 CO 0.72 0.19 0.00 0.00 -1.11 0.00 0.00 175.55 175.35