#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l7x s VAL 21 N 0.00 4.31 0.00 1.61 1.01 -1.26 -3.74 120.40 122.34 1l7x s VAL 21 Ca 0.00 1.73 0.00 0.00 0.00 0.00 0.00 61.98 63.71 1l7x s VAL 21 Cb 0.00 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.29 1l7x s VAL 21 CO 0.00 0.37 0.00 1.21 0.00 0.00 0.00 175.10 176.68 1l7x n GLU 22 N 1.18 -0.86 0.02 2.72 2.13 -1.26 -4.81 120.64 119.76 1l7x n GLU 22 Ca -0.03 0.21 -0.21 0.00 0.66 0.00 0.00 57.16 57.80 1l7x n GLU 22 Cb 0.49 -4.22 -0.14 0.00 0.27 0.00 0.00 31.44 27.84 1l7x n GLU 22 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1l7x h ASN 23 N 0.00 0.43 -0.07 4.31 2.35 -2.00 -3.13 115.58 117.47 1l7x h ASN 23 Ca 0.00 -0.86 -0.06 0.00 -0.55 0.00 0.00 56.30 54.83 1l7x h ASN 23 Cb 0.43 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1l7x h ASN 23 CO 0.00 1.76 -0.18 0.58 -1.65 0.00 0.00 177.43 177.95 1l7x h VAL 24 N 0.07 1.42 -0.96 2.81 2.07 -1.85 -2.01 116.25 117.81 1l7x h VAL 24 Ca -0.39 -1.52 0.09 0.00 0.82 0.00 0.00 66.70 65.70 1l7x h VAL 24 Cb 2.05 2.24 -0.07 0.00 -1.52 0.00 0.00 31.29 33.99 1l7x h VAL 24 CO 0.11 0.43 0.60 0.00 0.02 0.00 0.00 177.57 178.73 1l7x h ALA 25 N 0.47 1.36 -0.05 1.67 0.00 -1.94 0.18 119.26 120.96 1l7x h ALA 25 Ca -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 1l7x h ALA 25 Cb 0.78 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1l7x h ALA 25 CO 0.04 0.30 -0.76 0.93 0.00 0.00 0.00 179.25 179.76 1l7x h GLU 26 N 1.04 0.31 -0.66 0.00 4.39 -1.55 -1.18 114.58 116.92 1l7x h GLU 26 Ca 0.44 -0.28 -0.08 0.00 0.34 0.00 0.00 59.36 59.79 1l7x h GLU 26 Cb 0.29 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 1l7x h GLU 26 CO -0.21 0.94 0.12 -0.07 -1.16 0.00 0.00 179.01 178.62 1l7x h LEU 27 N 0.21 1.04 0.15 1.33 3.38 -0.51 -0.42 115.31 120.49 1l7x h LEU 27 Ca -0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1l7x h LEU 27 Cb 1.34 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1l7x h LEU 27 CO 0.12 1.03 -0.07 0.11 0.09 0.00 0.00 178.44 179.72 1l7x h LYS 28 N 1.01 -0.19 0.08 1.13 1.57 -0.52 0.53 116.57 120.18 1l7x h LYS 28 Ca 0.20 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.02 1l7x h LYS 28 Cb 0.43 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.74 1l7x h LYS 28 CO 0.01 -0.03 -0.32 0.87 -0.57 0.00 0.00 179.45 179.41 1l7x h LYS 29 N -0.32 -0.51 -0.81 3.15 1.57 -1.09 -1.08 116.57 117.49 1l7x h LYS 29 Ca -0.02 0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.91 1l7x h LYS 29 Cb 0.25 0.12 -0.08 0.00 0.08 0.00 0.00 32.23 32.60 1l7x h LYS 29 CO 0.03 -0.34 0.42 1.03 -0.57 0.00 0.00 179.45 180.03 1l7x h SER 30 N -0.53 0.54 -0.54 0.86 0.87 -0.98 0.24 113.55 114.02 1l7x h SER 30 Ca 0.04 0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.68 1l7x h SER 30 Cb 0.57 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.49 1l7x h SER 30 CO -0.21 0.27 0.36 0.15 -0.53 0.00 0.00 176.83 176.87 1l7x h PHE 31 N 0.66 0.68 -0.09 2.24 3.04 -0.24 -1.03 116.94 122.19 1l7x h PHE 31 Ca 0.42 0.02 -0.09 0.00 3.98 0.00 0.00 57.97 62.30 1l7x h PHE 31 Cb 0.50 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.77 1l7x h PHE 31 CO -0.09 0.43 -0.34 -0.91 -2.02 0.00 0.00 178.31 175.38 1l7x h ASN 32 N 0.73 0.18 -0.47 0.41 2.35 -0.22 -2.01 115.58 116.55 1l7x h ASN 32 Ca 0.20 -0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.83 1l7x h ASN 32 Cb -0.08 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 1l7x h ASN 32 CO -0.04 0.51 0.08 -0.09 -1.65 0.00 0.00 177.43 176.23 1l7x h ARG 33 N 0.15 0.78 -0.39 0.81 2.43 -0.07 -2.41 114.38 115.68 1l7x h ARG 33 Ca 0.02 -0.21 -0.15 0.00 -0.81 0.00 0.00 59.98 58.83 1l7x h ARG 33 Cb 0.67 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 1l7x h ARG 33 CO 0.05 0.79 -0.33 0.45 -1.51 0.00 0.00 179.97 179.42 1l7x h HIS 34 N 0.65 1.08 -0.99 2.20 3.86 -0.97 -0.15 115.15 120.83 1l7x h HIS 34 Ca 0.14 -0.31 0.02 0.00 -1.16 0.00 0.00 60.37 59.07 1l7x h HIS 34 Cb 0.39 -0.23 -0.05 0.00 1.06 0.00 0.00 27.41 28.57 1l7x h HIS 34 CO 0.03 1.12 0.66 1.25 0.86 0.00 0.00 177.93 181.85 1l7x h LEU 35 N 0.72 1.12 0.29 2.43 5.85 -1.32 0.44 115.31 124.83 1l7x h LEU 35 Ca 0.07 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1l7x h LEU 35 Cb 0.91 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1l7x h LEU 35 CO 0.08 0.79 -0.14 -0.74 -0.34 0.00 0.00 178.44 178.10 1l7x h HIS 36 N 1.31 -0.36 0.05 1.25 2.76 -1.31 -1.11 115.15 117.74 1l7x h HIS 36 Ca 0.38 -0.01 -0.23 0.00 -2.20 0.00 0.00 60.37 58.31 1l7x h HIS 36 Cb -0.09 0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.98 1l7x h HIS 36 CO -0.00 -0.22 -1.04 0.74 -1.30 0.00 0.00 177.93 176.11 1l7x h PHE 37 N -0.76 0.29 0.05 5.26 0.04 -1.03 -2.01 116.94 118.77 1l7x h PHE 37 Ca -0.04 -0.19 -0.33 0.00 2.80 0.00 0.00 57.97 60.21 1l7x h PHE 37 Cb 0.30 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.39 1l7x h PHE 37 CO 0.03 1.09 -1.93 2.41 -0.60 0.00 0.00 178.31 179.31 1l7x n THR 38 N -3.53 1.65 0.60 -1.55 -1.04 0.14 -4.45 114.28 106.11 1l7x n THR 38 Ca -0.04 -0.73 0.06 0.00 -2.04 0.00 0.00 64.05 61.30 1l7x n THR 38 Cb 0.92 -1.30 -0.04 0.00 -1.82 0.00 0.00 70.33 68.10 1l7x n THR 38 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1l7x n LEU 39 N -3.21 1.03 -3.71 -4.42 7.99 -0.34 -5.00 117.00 109.34 1l7x n LEU 39 Ca -0.26 -0.64 -0.23 0.00 -0.01 0.00 0.00 56.01 54.88 1l7x n LEU 39 Cb 1.06 0.00 0.04 0.00 -0.11 0.00 0.00 43.42 44.41 1l7x n LEU 39 CO 0.43 0.22 0.00 0.52 -1.51 0.00 0.00 177.39 177.05 1l7x n VAL 40 N -0.73 -4.09 -4.16 4.08 0.31 -0.76 -4.96 118.33 108.02 1l7x n VAL 40 Ca 0.04 -0.38 -0.10 0.00 -0.01 0.00 0.00 64.34 63.89 1l7x n VAL 40 Cb 0.24 -3.75 -0.10 0.00 -0.91 0.00 0.00 33.84 29.32 1l7x n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1l7x s LYS 41 N -6.05 0.81 0.39 5.55 -0.14 -0.49 -5.01 119.74 114.81 1l7x s LYS 41 Ca 0.16 -1.32 0.06 0.00 -1.36 0.00 0.00 55.97 53.51 1l7x s LYS 41 Cb -0.08 -0.16 -0.08 0.00 -1.68 0.00 0.00 37.83 35.83 1l7x s LYS 41 CO 0.80 -0.03 0.02 0.16 -0.76 0.00 0.00 175.35 175.55 1l7x s ASP 42 N -3.03 3.54 0.00 2.83 3.84 -1.26 -3.80 116.67 118.79 1l7x s ASP 42 Ca 0.11 -1.38 0.04 0.00 -0.00 0.00 0.00 52.55 51.32 1l7x s ASP 42 Cb 0.06 -0.31 0.20 0.00 -1.38 0.00 0.00 42.92 41.48 1l7x s ASP 42 CO -0.05 -0.49 0.96 0.54 -0.00 0.00 0.00 175.17 176.12 1l7x n ARG 43 N -0.91 0.05 -0.06 2.11 5.12 -1.26 -1.94 116.66 119.77 1l7x n ARG 43 Ca -0.05 0.26 -0.04 0.00 -1.93 0.00 0.00 57.85 56.09 1l7x n ARG 43 Cb 0.67 -1.50 -0.15 0.00 -1.16 0.00 0.00 32.46 30.32 1l7x n ARG 43 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1l7x n ASN 44 N -1.29 0.19 -0.37 0.55 4.13 -1.26 -4.51 115.26 112.71 1l7x n ASN 44 Ca 0.02 0.09 0.04 0.00 1.68 0.00 0.00 54.58 56.41 1l7x n ASN 44 Cb 0.03 1.00 0.05 0.00 -1.54 0.00 0.00 39.78 39.32 1l7x n ASN 44 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1l7x n VAL 45 N -2.69 0.12 -2.53 2.41 0.31 -1.00 -5.02 118.33 109.93 1l7x n VAL 45 Ca -0.22 -0.56 -0.40 0.00 -0.01 0.00 0.00 64.34 63.14 1l7x n VAL 45 Cb 0.98 1.10 -0.04 0.00 -0.91 0.00 0.00 33.84 34.97 1l7x n VAL 45 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1l7x s ALA 46 N -0.76 3.38 0.45 3.52 0.00 -0.82 -4.87 121.76 122.66 1l7x s ALA 46 Ca 0.11 0.83 -0.00 0.00 0.00 0.00 0.00 51.96 52.90 1l7x s ALA 46 Cb 0.07 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 1l7x s ALA 46 CO 0.11 -0.12 0.67 0.95 0.00 0.00 0.00 175.76 177.38 1l7x s THR 47 N -0.85 4.13 0.33 0.00 -4.23 -1.26 -4.96 115.64 108.80 1l7x s THR 47 Ca 0.46 -0.44 0.03 0.00 -1.18 0.00 0.00 61.69 60.56 1l7x s THR 47 Cb -0.30 -3.53 0.29 0.00 1.34 0.00 0.00 72.50 70.29 1l7x s THR 47 CO 0.38 -0.39 1.93 0.74 -0.54 0.00 0.00 174.62 176.74 1l7x h THR 48 N 0.40 1.05 -0.56 3.99 2.02 -2.00 -0.11 112.91 117.70 1l7x h THR 48 Ca -0.46 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.39 1l7x h THR 48 Cb 1.25 0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 1l7x h THR 48 CO 0.58 0.16 0.30 -0.09 0.37 0.00 0.00 175.52 176.84 1l7x h ARG 49 N 0.90 0.77 -0.43 6.66 2.43 -1.96 -1.22 114.38 121.54 1l7x h ARG 49 Ca 0.35 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.39 1l7x h ARG 49 Cb 0.23 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1l7x h ARG 49 CO -0.13 0.57 0.04 -0.44 -1.51 0.00 0.00 179.97 178.51 1l7x h ASP 50 N 0.78 0.71 -0.98 -3.80 3.32 -1.40 -1.28 116.42 113.77 1l7x h ASP 50 Ca 0.20 -0.28 0.01 0.00 0.02 0.00 0.00 57.03 56.98 1l7x h ASP 50 Cb 0.03 -0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.34 1l7x h ASP 50 CO -0.03 0.81 0.65 1.88 -1.72 0.00 0.00 179.24 180.83 1l7x h TYR 51 N 0.58 1.23 -0.06 4.55 0.05 -0.92 0.02 116.97 122.42 1l7x h TYR 51 Ca 0.13 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.93 1l7x h TYR 51 Cb 0.42 -0.42 -0.00 0.00 1.01 0.00 0.00 36.73 37.75 1l7x h TYR 51 CO 0.03 0.77 0.03 -0.92 -1.05 0.00 0.00 178.16 177.02 1l7x h TYR 52 N 1.32 0.09 -0.28 4.88 3.20 -0.87 -1.81 116.97 123.51 1l7x h TYR 52 Ca 0.36 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.20 1l7x h TYR 52 Cb -0.14 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 1l7x h TYR 52 CO -0.00 0.21 0.06 0.74 -1.64 0.00 0.00 178.16 177.52 1l7x h PHE 53 N -0.05 0.39 -0.45 -3.82 0.04 -0.85 -0.76 116.94 111.45 1l7x h PHE 53 Ca 0.02 -0.02 -0.13 0.00 2.80 0.00 0.00 57.97 60.65 1l7x h PHE 53 Cb 0.15 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 1l7x h PHE 53 CO -0.02 0.36 -0.22 0.00 -0.60 0.00 0.00 178.31 177.83 1l7x h ALA 54 N 1.68 0.77 -0.23 2.45 0.00 -0.75 -1.38 119.26 121.80 1l7x h ALA 54 Ca 0.09 -0.38 -0.18 0.00 0.00 0.00 0.00 54.91 54.44 1l7x h ALA 54 Cb 0.17 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1l7x h ALA 54 CO -0.00 0.66 -0.60 1.25 0.00 0.00 0.00 179.25 180.56 1l7x h LEU 55 N 0.79 0.84 -0.43 0.00 5.85 -0.86 -2.40 115.31 119.09 1l7x h LEU 55 Ca 0.10 -0.47 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 1l7x h LEU 55 Cb 0.77 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1l7x h LEU 55 CO 0.06 1.24 0.12 0.00 -0.34 0.00 0.00 178.44 179.53 1l7x h ALA 56 N 0.77 0.57 -0.34 1.25 0.00 -0.98 0.45 119.26 120.97 1l7x h ALA 56 Ca -0.00 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 1l7x h ALA 56 Cb 1.19 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1l7x h ALA 56 CO 0.12 0.23 -0.11 0.45 0.00 0.00 0.00 179.25 179.94 1l7x h HIS 57 N 0.56 0.63 -0.76 0.00 3.86 -1.27 0.45 115.15 118.62 1l7x h HIS 57 Ca 0.14 -0.10 -0.06 0.00 -1.16 0.00 0.00 60.37 59.19 1l7x h HIS 57 Cb 0.28 -0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.55 1l7x h HIS 57 CO 0.01 0.68 0.25 1.15 0.86 0.00 0.00 177.93 180.88 1l7x h THR 58 N 0.54 1.26 -0.01 2.45 2.02 -0.88 -1.55 112.91 116.75 1l7x h THR 58 Ca 0.10 -0.90 -0.11 0.00 0.77 0.00 0.00 66.41 66.27 1l7x h THR 58 Cb 0.52 0.41 0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1l7x h THR 58 CO 0.03 0.36 -0.41 0.58 0.37 0.00 0.00 175.52 176.45 1l7x h VAL 59 N 1.12 1.49 -0.92 3.16 2.07 -0.50 -3.30 116.25 119.38 1l7x h VAL 59 Ca 0.25 -1.99 0.19 0.00 0.82 0.00 0.00 66.70 65.97 1l7x h VAL 59 Cb 0.29 2.66 -0.07 0.00 -1.52 0.00 0.00 31.29 32.65 1l7x h VAL 59 CO -0.01 0.56 0.59 -0.09 0.02 0.00 0.00 177.57 178.64 1l7x h ARG 60 N -0.30 0.53 0.00 1.57 2.43 0.04 -0.92 114.38 117.72 1l7x h ARG 60 Ca -0.05 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1l7x h ARG 60 Cb 1.14 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.57 1l7x h ARG 60 CO 0.08 0.35 -0.04 -0.44 -1.51 0.00 0.00 179.97 178.41 1l7x h ASP 61 N 0.54 0.00 0.62 -3.80 3.32 -1.36 -1.79 116.42 113.96 1l7x h ASP 61 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 1l7x h ASP 61 Cb 1.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.56 1l7x h ASP 61 CO -0.22 0.04 0.00 1.41 -1.72 0.00 0.00 179.24 178.75 1l7x n HIS 62 N -3.88 0.00 -0.02 4.55 8.25 -0.35 -3.33 115.22 120.43 1l7x n HIS 62 Ca -0.03 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.33 1l7x n HIS 62 Cb 0.12 -0.33 -0.14 0.00 1.12 0.00 0.00 29.99 30.77 1l7x n HIS 62 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1l7x n LEU 63 N -1.33 1.10 -0.05 2.41 4.77 -0.67 -4.58 117.00 118.65 1l7x n LEU 63 Ca 0.12 0.36 -0.14 0.00 -0.03 0.00 0.00 56.01 56.32 1l7x n LEU 63 Cb 0.25 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.23 1l7x n LEU 63 CO 0.23 0.47 0.50 0.58 -1.33 0.00 0.00 177.39 177.83 1l7x h VAL 64 N 0.01 0.00 -0.40 4.08 2.07 -1.60 0.16 116.25 120.57 1l7x h VAL 64 Ca -0.32 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.28 1l7x h VAL 64 Cb 2.03 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 31.71 1l7x h VAL 64 CO 0.08 0.00 -0.32 1.23 0.02 0.00 0.00 177.57 178.58 1l7x h GLY 65 N -0.51 -0.23 1.55 2.17 0.00 -1.81 -0.92 103.07 103.32 1l7x h GLY 65 Ca 0.04 0.41 -0.09 0.00 0.00 0.00 0.00 47.33 47.69 1l7x h GLY 65 CO -0.48 -0.21 -0.18 3.21 0.00 0.00 0.00 176.54 178.88 1l7x h ARG 66 N -0.25 0.54 0.14 4.80 3.08 -1.76 -1.40 114.38 119.53 1l7x h ARG 66 Ca 0.17 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1l7x h ARG 66 Cb 0.53 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1l7x h ARG 66 CO -0.53 0.70 -0.07 2.35 -1.07 0.00 0.00 179.97 181.35 1l7x h TRP 67 N 0.48 -0.17 -0.26 3.04 7.01 0.19 0.61 115.95 126.86 1l7x h TRP 67 Ca 0.08 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.10 1l7x h TRP 67 Cb 0.59 0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.69 1l7x h TRP 67 CO 0.02 0.06 0.11 0.82 -2.79 0.00 0.00 178.44 176.66 1l7x h ILE 68 N -0.38 0.97 -0.47 2.65 2.04 -1.17 -2.05 117.51 119.10 1l7x h ILE 68 Ca -0.02 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 1l7x h ILE 68 Cb 0.31 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1l7x h ILE 68 CO 0.03 0.04 0.27 -0.09 0.00 0.00 0.00 178.15 178.41 1l7x h ARG 69 N 0.24 0.64 0.01 2.37 2.43 -1.10 0.18 114.38 119.15 1l7x h ARG 69 Ca 0.11 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1l7x h ARG 69 Cb 0.05 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1l7x h ARG 69 CO -0.09 0.49 -0.03 1.15 -1.51 0.00 0.00 179.97 179.97 1l7x h THR 70 N 0.62 0.91 -0.10 0.20 2.02 0.42 -0.15 112.91 116.84 1l7x h THR 70 Ca 0.17 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.24 1l7x h THR 70 Cb 0.02 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1l7x h THR 70 CO -0.03 0.00 -0.41 1.56 0.37 0.00 0.00 175.52 177.01 1l7x h GLN 71 N -0.07 0.21 -0.30 6.66 1.08 -1.26 -2.21 115.11 119.23 1l7x h GLN 71 Ca 0.01 -0.10 -0.10 0.00 -1.45 0.00 0.00 58.65 57.01 1l7x h GLN 71 Cb 0.08 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 1l7x h GLN 71 CO -0.03 0.59 -0.22 0.37 -0.95 0.00 0.00 178.83 178.59 1l7x h GLN 72 N 0.18 0.58 -0.29 1.46 5.75 -0.63 -2.66 115.11 119.50 1l7x h GLN 72 Ca 0.02 -0.21 -0.03 0.00 -0.15 0.00 0.00 58.65 58.27 1l7x h GLN 72 Cb 0.81 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.31 1l7x h GLN 72 CO 0.06 0.76 0.06 1.25 -2.65 0.00 0.00 178.83 178.31 1l7x h HIS 73 N 0.51 0.50 0.00 3.99 2.76 -0.53 -0.98 115.15 121.40 1l7x h HIS 73 Ca 0.08 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1l7x h HIS 73 Cb 0.66 -0.14 -0.00 0.00 1.55 0.00 0.00 27.41 29.48 1l7x h HIS 73 CO 0.03 0.55 -0.05 1.88 -1.30 0.00 0.00 177.93 179.04 1l7x h TYR 74 N 0.30 0.00 0.09 5.26 0.05 -1.28 0.38 116.97 121.78 1l7x h TYR 74 Ca 0.09 0.00 -0.22 0.00 0.05 0.00 0.00 58.73 58.65 1l7x h TYR 74 Cb 0.31 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.08 1l7x h TYR 74 CO 0.02 0.05 -0.91 -0.92 -1.05 0.00 0.00 178.16 175.35 1l7x h TYR 75 N 0.00 0.74 -0.20 4.88 3.20 -1.04 -2.77 116.97 121.78 1l7x h TYR 75 Ca -0.00 -0.47 -0.20 0.00 3.14 0.00 0.00 58.73 61.20 1l7x h TYR 75 Cb 0.16 -0.06 0.01 0.00 1.54 0.00 0.00 36.73 38.38 1l7x h TYR 75 CO 0.00 1.32 -0.67 -0.44 -1.64 0.00 0.00 178.16 176.73 1l7x h ASP 76 N -0.05 0.94 0.42 -2.11 3.32 -0.28 -3.32 116.42 115.34 1l7x h ASP 76 Ca -0.14 -0.60 0.00 0.00 0.02 0.00 0.00 57.03 56.32 1l7x h ASP 76 Cb 1.64 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.92 1l7x h ASP 76 CO 0.17 1.37 -0.70 0.29 -1.72 0.00 0.00 179.24 178.65 1l7x n LYS 77 N -3.99 0.08 -3.95 3.56 4.76 0.04 -5.00 118.16 113.65 1l7x n LYS 77 Ca -0.06 0.01 -0.28 0.00 -2.87 0.00 0.00 58.31 55.11 1l7x n LYS 77 Cb 0.69 -1.53 -0.02 0.00 -1.84 0.00 0.00 35.03 32.33 1l7x n LYS 77 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1l7x s PRO 79 N -6.58 2.63 0.29 0.00 0.04 -1.26 -4.95 135.00 125.17 1l7x s PRO 79 Ca 0.08 0.79 -0.29 0.00 0.04 0.00 0.00 61.00 61.62 1l7x s PRO 79 Cb -0.03 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.43 1l7x s PRO 79 CO 0.90 -1.27 1.43 0.21 0.04 0.00 0.00 177.00 178.31 1l7x s LYS 80 N -5.11 4.24 -0.04 4.56 2.20 -1.26 -4.97 119.74 119.36 1l7x s LYS 80 Ca 0.59 2.36 -0.05 0.00 -0.36 0.00 0.00 55.97 58.51 1l7x s LYS 80 Cb -0.14 -3.07 -0.04 0.00 -1.51 0.00 0.00 37.83 33.07 1l7x s LYS 80 CO 0.54 -0.41 0.18 1.03 -0.36 0.00 0.00 175.35 176.34 1l7x s ARG 81 N -1.00 3.46 -0.13 4.03 0.52 0.49 -4.60 118.95 121.73 1l7x s ARG 81 Ca 0.56 -0.22 -0.02 0.00 -0.52 0.00 0.00 55.73 55.53 1l7x s ARG 81 Cb -0.43 -3.13 -0.03 0.00 0.52 0.00 0.00 34.95 31.89 1l7x s ARG 81 CO 0.49 0.71 -0.05 0.08 0.02 0.00 0.00 175.30 176.54 1l7x s VAL 82 N -1.22 3.77 -0.29 3.52 1.01 -0.60 -1.73 120.40 124.86 1l7x s VAL 82 Ca 0.23 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.83 1l7x s VAL 82 Cb -0.13 -2.61 0.08 0.00 0.00 0.00 0.00 36.38 33.72 1l7x s VAL 82 CO 0.14 0.53 -0.03 -0.31 0.00 0.00 0.00 175.10 175.42 1l7x s TYR 83 N -0.02 3.38 -0.74 5.22 2.02 0.98 -1.52 117.35 126.67 1l7x s TYR 83 Ca 0.00 -2.56 -0.24 0.00 -0.37 0.00 0.00 57.07 53.90 1l7x s TYR 83 Cb -0.13 -2.33 0.06 0.00 -0.40 0.00 0.00 41.96 39.16 1l7x s TYR 83 CO 0.03 -0.90 1.13 -0.47 -1.57 0.00 0.00 175.55 173.76 1l7x s TYR 84 N 1.05 2.56 -0.33 2.71 5.04 -0.41 -1.26 117.35 126.71 1l7x s TYR 84 Ca 0.00 -0.47 -0.19 0.00 -2.44 0.00 0.00 57.07 53.97 1l7x s TYR 84 Cb -0.19 -4.44 -0.01 0.00 0.35 0.00 0.00 41.96 37.66 1l7x s TYR 84 CO -0.07 -1.81 0.57 -1.17 -1.34 0.00 0.00 175.55 171.73 1l7x s LEU 85 N 4.62 4.23 0.01 6.97 2.96 -0.82 -0.89 118.68 135.75 1l7x s LEU 85 Ca 0.29 0.20 -0.09 0.00 -0.22 0.00 0.00 54.13 54.31 1l7x s LEU 85 Cb -0.11 -2.70 0.00 0.00 0.50 0.00 0.00 46.19 43.88 1l7x s LEU 85 CO 0.09 -0.48 0.18 -0.55 -1.32 0.00 0.00 176.35 174.26 1l7x s SER 86 N 1.71 0.00 0.02 3.68 0.15 -0.23 -2.30 113.70 116.73 1l7x s SER 86 Ca 0.22 -0.22 0.28 0.00 0.70 0.00 0.00 55.95 56.93 1l7x s SER 86 Cb -0.15 0.24 1.06 0.00 -1.71 0.00 0.00 66.02 65.47 1l7x s SER 86 CO 0.13 -0.44 1.82 0.18 1.20 0.00 0.00 173.24 176.13 1l7x n LEU 87 N 1.18 0.17 -4.01 3.45 7.99 -1.26 -3.96 117.00 120.55 1l7x n LEU 87 Ca -0.21 0.42 -0.12 0.00 -0.01 0.00 0.00 56.01 56.08 1l7x n LEU 87 Cb 0.57 -0.44 -0.12 0.00 -0.11 0.00 0.00 43.42 43.32 1l7x n LEU 87 CO 0.21 0.00 -0.39 -1.61 -1.51 0.00 0.00 177.39 174.10 1l7x s GLU 88 N -3.01 0.40 -0.27 3.23 2.02 -1.26 -4.59 118.70 115.22 1l7x s GLU 88 Ca 0.13 -0.58 -0.01 0.00 0.02 0.00 0.00 54.97 54.54 1l7x s GLU 88 Cb 0.18 -0.16 0.16 0.00 0.10 0.00 0.00 34.13 34.41 1l7x s GLU 88 CO 0.57 0.02 0.46 -0.06 0.02 0.00 0.00 175.26 176.27 1l7x s PHE 89 N -1.14 -1.14 -0.92 1.61 0.40 -0.39 -4.68 117.98 111.72 1l7x s PHE 89 Ca -0.10 0.96 -0.15 0.00 -0.60 0.00 0.00 56.93 57.05 1l7x s PHE 89 Cb -0.08 0.14 0.20 0.00 0.51 0.00 0.00 43.02 43.79 1l7x s PHE 89 CO -0.00 -0.85 0.95 -0.47 0.70 0.00 0.00 175.22 175.55 1l7x s TYR 90 N 2.65 3.64 -0.12 0.36 6.14 -0.31 -3.06 117.35 126.65 1l7x s TYR 90 Ca 0.14 -1.93 0.14 0.00 0.64 0.00 0.00 57.07 56.06 1l7x s TYR 90 Cb -0.14 -3.98 -0.01 0.00 0.42 0.00 0.00 41.96 38.25 1l7x s TYR 90 CO -0.21 -1.14 1.31 0.52 0.64 0.00 0.00 175.55 176.67 1l7x h MET 91 N 7.88 0.00 0.00 4.97 2.86 -1.75 -3.41 114.93 125.48 1l7x h MET 91 Ca 0.14 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 1l7x h MET 91 Cb 1.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.66 1l7x h MET 91 CO 0.91 0.53 0.00 0.41 1.06 0.00 0.00 176.91 179.82 1l7x n GLY 92 N 1.27 0.09 3.81 8.32 0.00 -1.19 -4.75 105.19 112.74 1l7x n GLY 92 Ca -0.00 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.71 1l7x n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1l7x s ARG 93 N 0.00 4.35 -0.20 1.61 0.52 -1.26 -2.50 118.95 121.47 1l7x s ARG 93 Ca 0.00 1.12 0.16 0.00 -0.52 0.00 0.00 55.73 56.49 1l7x s ARG 93 Cb 0.00 -2.56 -0.23 0.00 0.52 0.00 0.00 34.95 32.68 1l7x s ARG 93 CO 0.00 0.18 0.04 2.41 0.02 0.00 0.00 175.30 177.94 1l7x n THR 94 N 0.07 1.35 0.01 0.02 -1.04 -1.26 -4.60 114.28 108.83 1l7x n THR 94 Ca 0.03 -0.80 -0.02 0.00 -2.04 0.00 0.00 64.05 61.23 1l7x n THR 94 Cb 0.52 -0.58 -0.01 0.00 -1.82 0.00 0.00 70.33 68.44 1l7x n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1l7x h LEU 95 N 0.00 -0.16 -0.86 -4.42 5.85 -1.97 0.56 115.31 114.30 1l7x h LEU 95 Ca -0.53 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.23 1l7x h LEU 95 Cb 2.17 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 43.21 1l7x h LEU 95 CO 0.02 -0.05 0.56 -0.61 -0.34 0.00 0.00 178.44 178.01 1l7x h GLN 96 N -0.07 1.07 -0.90 1.25 4.15 -1.97 -1.27 115.11 117.38 1l7x h GLN 96 Ca 0.00 -0.06 0.05 0.00 0.77 0.00 0.00 58.65 59.40 1l7x h GLN 96 Cb 0.07 -0.24 -0.06 0.00 0.21 0.00 0.00 27.48 27.47 1l7x h GLN 96 CO -0.03 0.71 0.57 -0.97 -1.93 0.00 0.00 178.83 177.18 1l7x h ASN 97 N 1.11 0.94 -0.39 -0.69 -0.73 -1.79 -0.28 115.58 113.74 1l7x h ASN 97 Ca 0.34 0.00 -0.12 0.00 1.87 0.00 0.00 56.30 58.39 1l7x h ASN 97 Cb -0.03 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.35 1l7x h ASN 97 CO -0.10 0.63 -0.24 0.74 -0.37 0.00 0.00 177.43 178.08 1l7x h THR 98 N 1.09 1.28 -0.65 -3.57 2.02 -0.09 -1.81 112.91 111.18 1l7x h THR 98 Ca 0.37 -1.40 -0.01 0.00 0.77 0.00 0.00 66.41 66.14 1l7x h THR 98 Cb 0.07 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 1l7x h THR 98 CO -0.14 0.47 0.36 0.24 0.37 0.00 0.00 175.52 176.82 1l7x h MET 99 N 0.66 0.90 -0.10 6.66 2.86 -0.70 -1.88 114.93 123.32 1l7x h MET 99 Ca 0.08 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 1l7x h MET 99 Cb 0.81 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 32.29 1l7x h MET 99 CO 0.07 0.67 -0.04 0.82 1.06 0.00 0.00 176.91 179.49 1l7x h ILE 100 N 0.88 1.30 0.00 -1.22 2.04 -0.99 0.19 117.51 119.71 1l7x h ILE 100 Ca 0.23 -1.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 1l7x h ILE 100 Cb 0.03 1.76 -0.00 0.00 -0.74 0.00 0.00 36.82 37.86 1l7x h ILE 100 CO -0.04 0.28 -0.13 0.78 0.00 0.00 0.00 178.15 179.05 1l7x h ASN 101 N -0.13 0.00 0.11 1.72 4.21 -1.26 -1.87 115.58 118.36 1l7x h ASN 101 Ca 0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.54 1l7x h ASN 101 Cb 0.46 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.66 1l7x h ASN 101 CO 0.01 0.13 -0.22 0.18 -1.29 0.00 0.00 177.43 176.24 1l7x n LEU 102 N -3.81 1.49 -0.80 1.61 4.77 -0.71 -0.48 117.00 119.07 1l7x n LEU 102 Ca -0.02 -0.47 -0.08 0.00 -0.03 0.00 0.00 56.01 55.41 1l7x n LEU 102 Cb 0.23 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.25 1l7x n LEU 102 CO 0.31 0.27 -0.09 0.61 -1.33 0.00 0.00 177.39 177.16 1l7x n GLY 103 N 1.32 0.26 0.15 -0.72 0.00 -0.70 -4.95 105.19 100.55 1l7x n GLY 103 Ca 0.13 -0.60 0.05 0.00 0.00 0.00 0.00 46.02 45.60 1l7x n GLY 103 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1l7x n LEU 104 N -1.04 0.94 0.02 0.99 4.77 0.59 -4.74 117.00 118.53 1l7x n LEU 104 Ca -0.09 -0.66 -0.12 0.00 -0.03 0.00 0.00 56.01 55.12 1l7x n LEU 104 Cb 0.50 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.54 1l7x n LEU 104 CO 0.11 0.20 0.62 -0.61 -1.33 0.00 0.00 177.39 176.38 1l7x h GLN 105 N 0.71 -0.44 -0.53 3.23 4.15 -1.84 0.16 115.11 120.55 1l7x h GLN 105 Ca 0.00 0.03 0.10 0.00 0.77 0.00 0.00 58.65 59.55 1l7x h GLN 105 Cb 0.31 0.10 -0.08 0.00 0.21 0.00 0.00 27.48 28.02 1l7x h GLN 105 CO 0.00 -0.30 0.05 -0.91 -1.93 0.00 0.00 178.83 175.74 1l7x h ASN 106 N -0.46 -0.13 -0.52 -0.69 4.21 -1.91 0.46 115.58 116.54 1l7x h ASN 106 Ca 0.08 0.11 -0.10 0.00 1.21 0.00 0.00 56.30 57.61 1l7x h ASN 106 Cb 0.59 0.18 -0.02 0.00 -1.12 0.00 0.00 38.32 37.95 1l7x h ASN 106 CO -0.34 -0.04 -0.03 0.00 -1.29 0.00 0.00 177.43 175.73 1l7x h ALA 107 N 1.45 0.90 -0.21 -0.83 0.00 -1.70 -1.92 119.26 116.95 1l7x h ALA 107 Ca 0.27 -0.31 -0.19 0.00 0.00 0.00 0.00 54.91 54.68 1l7x h ALA 107 Cb 0.40 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1l7x h ALA 107 CO -0.40 0.65 -0.63 0.00 0.00 0.00 0.00 179.25 178.86 1l7x h ASP 109 N 0.53 -0.11 0.09 0.00 3.32 -0.00 0.30 116.42 120.56 1l7x h ASP 109 Ca -0.02 0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 1l7x h ASP 109 Cb 1.25 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.93 1l7x h ASP 109 CO 0.13 -0.02 -0.17 -0.08 -1.72 0.00 0.00 179.24 177.39 1l7x h GLU 110 N 0.14 0.16 -0.08 3.56 4.57 -1.24 -1.39 114.58 120.30 1l7x h GLU 110 Ca 0.19 -0.04 -0.18 0.00 -1.18 0.00 0.00 59.36 58.15 1l7x h GLU 110 Cb 0.26 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 28.84 1l7x h GLU 110 CO -0.30 0.33 -0.67 0.00 -1.18 0.00 0.00 179.01 177.19 1l7x h ALA 111 N 1.68 0.18 -0.68 2.92 0.00 -0.18 -2.30 119.26 120.88 1l7x h ALA 111 Ca 0.03 -0.57 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 1l7x h ALA 111 Cb 0.39 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1l7x h ALA 111 CO 0.03 0.49 0.21 0.82 0.00 0.00 0.00 179.25 180.79 1l7x h ILE 112 N 0.21 1.26 0.24 0.00 1.08 -0.79 -2.07 117.51 117.43 1l7x h ILE 112 Ca -0.06 -0.89 -0.01 0.00 -0.39 0.00 0.00 64.86 63.50 1l7x h ILE 112 Cb 1.33 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 35.62 1l7x h ILE 112 CO 0.14 0.34 -0.12 0.22 -0.69 0.00 0.00 178.15 178.04 1l7x h TYR 113 N 1.00 -0.30 -0.42 1.37 3.20 -1.29 -0.32 116.97 120.22 1l7x h TYR 113 Ca 0.22 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.17 1l7x h TYR 113 Cb 0.31 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.66 1l7x h TYR 113 CO 0.02 -0.07 0.29 1.96 -1.64 0.00 0.00 178.16 178.72 1l7x h GLN 114 N -0.49 0.16 0.00 1.82 4.20 -1.33 0.43 115.11 119.90 1l7x h GLN 114 Ca -0.03 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1l7x h GLN 114 Cb 0.37 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1l7x h GLN 114 CO 0.05 0.11 0.00 1.28 -0.67 0.00 0.00 178.83 179.60 1l7x n LEU 115 N -4.45 0.00 -0.81 1.46 4.77 -0.79 -4.86 117.00 112.31 1l7x n LEU 115 Ca 0.06 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.95 1l7x n LEU 115 Cb 0.37 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.43 1l7x n LEU 115 CO 0.35 0.00 -0.10 0.61 -1.33 0.00 0.00 177.39 176.92 1l7x n GLY 116 N 0.58 0.71 3.67 -0.72 0.00 0.15 -5.03 105.19 104.55 1l7x n GLY 116 Ca 0.07 -0.58 -0.25 0.00 0.00 0.00 0.00 46.02 45.26 1l7x n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l7x s LEU 117 N -2.26 3.31 -0.55 0.99 1.43 -0.15 -5.02 118.68 116.44 1l7x s LEU 117 Ca 0.00 -0.48 -0.17 0.00 -1.03 0.00 0.00 54.13 52.45 1l7x s LEU 117 Cb 0.00 -1.90 0.11 0.00 0.03 0.00 0.00 46.19 44.42 1l7x s LEU 117 CO 0.00 0.04 0.57 -0.62 0.23 0.00 0.00 176.35 176.58 1l7x s ASP 118 N -3.32 6.18 0.44 2.29 3.68 -1.26 -3.91 116.67 120.77 1l7x s ASP 118 Ca 0.29 -1.51 0.13 0.00 2.13 0.00 0.00 52.55 53.60 1l7x s ASP 118 Cb -0.08 -2.25 1.04 0.00 -1.45 0.00 0.00 42.92 40.18 1l7x s ASP 118 CO 0.20 -0.93 2.01 -0.29 0.13 0.00 0.00 175.17 176.28 1l7x h ILE 119 N 5.88 0.93 -0.56 4.11 2.10 -1.92 -0.96 117.51 127.09 1l7x h ILE 119 Ca -0.29 -0.13 -0.08 0.00 1.08 0.00 0.00 64.86 65.43 1l7x h ILE 119 Cb 1.10 0.51 -0.02 0.00 -1.09 0.00 0.00 36.82 37.32 1l7x h ILE 119 CO 1.03 0.07 0.02 -0.08 -1.08 0.00 0.00 178.15 178.12 1l7x h GLU 120 N 0.38 0.94 -0.66 2.19 4.81 -2.00 -1.28 114.58 118.96 1l7x h GLU 120 Ca 0.24 -0.27 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1l7x h GLU 120 Cb 0.43 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.68 1l7x h GLU 120 CO -0.06 0.91 0.28 1.49 -0.73 0.00 0.00 179.01 180.90 1l7x h GLU 121 N 0.87 0.96 -0.14 1.92 4.81 -1.61 -2.72 114.58 118.68 1l7x h GLU 121 Ca 0.17 -0.15 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 1l7x h GLU 121 Cb 0.48 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1l7x h GLU 121 CO 0.02 0.78 -0.16 -0.07 -0.73 0.00 0.00 179.01 178.84 1l7x h LEU 122 N 0.95 0.39 -1.75 1.64 3.38 -1.02 -3.23 115.31 115.67 1l7x h LEU 122 Ca 0.23 -0.50 0.01 0.00 0.09 0.00 0.00 57.88 57.71 1l7x h LEU 122 Cb 0.16 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1l7x h LEU 122 CO -0.02 0.81 0.18 -0.33 0.09 0.00 0.00 178.44 179.17 1l7x h GLU 123 N -0.03 0.33 0.00 1.13 5.08 -1.13 -1.41 114.58 118.55 1l7x h GLU 123 Ca 0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1l7x h GLU 123 Cb 0.71 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1l7x h GLU 123 CO 0.04 0.22 0.00 0.93 -1.00 0.00 0.00 179.01 179.20 1l7x h GLU 124 N 0.34 0.00 -0.40 2.33 4.39 -1.50 -2.70 114.58 117.05 1l7x h GLU 124 Ca 0.10 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.66 1l7x h GLU 124 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1l7x h GLU 124 CO -0.02 0.00 -0.31 0.82 -1.16 0.00 0.00 179.01 178.34 1l7x h ILE 125 N 0.00 1.27 -2.56 3.13 1.08 -1.33 -3.45 117.51 115.66 1l7x h ILE 125 Ca 0.00 -1.47 -0.58 0.00 -0.39 0.00 0.00 64.86 62.42 1l7x h ILE 125 Cb 0.39 1.29 0.07 0.00 -3.07 0.00 0.00 36.82 35.51 1l7x h ILE 125 CO 0.00 0.49 0.69 1.21 -0.69 0.00 0.00 178.15 179.85 1l7x n GLU 126 N -4.08 2.10 -3.01 2.37 2.13 -1.02 -4.97 120.64 114.17 1l7x n GLU 126 Ca -0.01 0.75 -0.36 0.00 0.66 0.00 0.00 57.16 58.20 1l7x n GLU 126 Cb 0.50 -2.45 -0.06 0.00 0.27 0.00 0.00 31.44 29.69 1l7x n GLU 126 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 1l7x s GLU 127 N 0.05 4.34 0.21 5.31 0.41 -1.26 -4.98 118.70 122.77 1l7x s GLU 127 Ca 0.72 0.99 -0.30 0.00 -0.41 0.00 0.00 54.97 55.97 1l7x s GLU 127 Cb -0.65 -2.84 -0.08 0.00 -1.78 0.00 0.00 34.13 28.77 1l7x s GLU 127 CO 0.45 0.35 0.99 -0.51 -0.49 0.00 0.00 175.26 176.06 1l7x s ASP 128 N -1.66 7.51 -1.10 -0.19 -0.00 -1.26 -4.65 116.67 115.32 1l7x s ASP 128 Ca 0.45 1.99 -0.17 0.00 -0.00 0.00 0.00 52.55 54.82 1l7x s ASP 128 Cb -0.17 -2.61 0.13 0.00 -0.00 0.00 0.00 42.92 40.27 1l7x s ASP 128 CO 0.22 0.02 1.36 0.00 -0.00 0.00 0.00 175.17 176.77 1l7x s ALA 129 N -0.84 3.54 -1.30 5.23 0.00 -1.04 -4.89 121.76 122.45 1l7x s ALA 129 Ca 0.44 -2.96 -0.06 0.00 0.00 0.00 0.00 51.96 49.37 1l7x s ALA 129 Cb -0.27 -4.21 0.14 0.00 0.00 0.00 0.00 23.12 18.78 1l7x s ALA 129 CO 0.33 -3.01 2.22 0.41 0.00 0.00 0.00 175.76 175.71 1l7x n GLY 130 N 5.10 5.13 1.90 0.00 0.00 -1.26 -2.25 105.19 113.80 1l7x n GLY 130 Ca 0.33 -2.09 -0.16 0.00 0.00 0.00 0.00 46.02 44.10 1l7x n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1l7x n LEU 131 N 2.21 6.40 -3.68 0.99 4.77 -1.17 -0.56 117.00 125.95 1l7x n LEU 131 Ca 0.55 -3.29 -0.10 0.00 -0.03 0.00 0.00 56.01 53.15 1l7x n LEU 131 Cb 0.28 -1.07 -0.04 0.00 -2.33 0.00 0.00 43.42 40.25 1l7x n LEU 131 CO 0.72 1.24 0.19 -0.83 -1.33 0.00 0.00 177.39 177.38 1l7x s GLY 132 N 0.31 -0.18 -0.17 -0.72 0.00 -1.25 -1.26 107.32 104.06 1l7x s GLY 132 Ca 0.31 -0.14 -0.12 0.00 0.00 0.00 0.00 44.72 44.76 1l7x s GLY 132 CO -0.01 -0.31 0.25 0.70 0.00 0.00 0.00 173.10 173.72 1l7x n ASN 133 N -0.27 2.01 0.00 1.64 3.02 -1.26 -4.48 115.26 115.92 1l7x n ASN 133 Ca -0.14 0.28 0.00 0.00 -0.03 0.00 0.00 54.58 54.70 1l7x n ASN 133 Cb 0.63 -0.88 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 1l7x n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l7x n GLY 134 N 1.75 2.48 0.35 7.41 0.00 -1.26 -4.95 105.19 110.97 1l7x n GLY 134 Ca -0.34 0.08 0.16 0.00 0.00 0.00 0.00 46.02 45.92 1l7x n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1l7x h GLY 135 N 0.00 0.13 0.65 -0.02 0.00 -1.98 -1.13 103.07 100.72 1l7x h GLY 135 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 1l7x h GLY 135 CO 0.00 0.02 -0.02 -2.00 0.00 0.00 0.00 176.54 174.55 1l7x h LEU 136 N 0.09 0.09 -1.00 3.11 6.46 -1.99 -1.29 115.31 120.79 1l7x h LEU 136 Ca 0.20 -0.39 -0.10 0.00 -0.12 0.00 0.00 57.88 57.47 1l7x h LEU 136 Cb 0.69 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.59 1l7x h LEU 136 CO -0.02 0.47 -0.42 1.23 -0.62 0.00 0.00 178.44 179.07 1l7x h GLY 137 N -0.28 0.17 2.00 3.75 0.00 -1.75 -2.90 103.07 104.06 1l7x h GLY 137 Ca 0.01 -0.16 -0.13 0.00 0.00 0.00 0.00 47.33 47.04 1l7x h GLY 137 CO 0.01 0.15 -0.64 -0.09 0.00 0.00 0.00 176.54 175.96 1l7x h ARG 138 N 0.13 0.00 -0.30 4.80 9.65 -1.16 -0.75 114.38 126.76 1l7x h ARG 138 Ca 0.01 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.85 1l7x h ARG 138 Cb 0.81 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.38 1l7x h ARG 138 CO 0.06 0.64 0.01 1.25 2.80 0.00 0.00 179.97 184.73 1l7x h LEU 139 N 0.00 0.51 -0.82 3.80 5.85 -1.03 -0.66 115.31 122.95 1l7x h LEU 139 Ca -0.01 -0.30 0.09 0.00 0.84 0.00 0.00 57.88 58.50 1l7x h LEU 139 Cb 1.16 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.98 1l7x h LEU 139 CO 0.08 0.68 0.47 0.00 -0.34 0.00 0.00 178.44 179.33 1l7x h ALA 140 N 0.84 1.16 0.16 1.25 0.00 -1.44 0.18 119.26 121.40 1l7x h ALA 140 Ca 0.09 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1l7x h ALA 140 Cb 0.41 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1l7x h ALA 140 CO 0.01 0.11 -0.07 0.00 0.00 0.00 0.00 179.25 179.30 1l7x h ALA 141 N 1.44 -0.21 -0.89 0.00 0.00 -1.17 -1.24 119.26 117.20 1l7x h ALA 141 Ca 0.39 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.26 1l7x h ALA 141 Cb 0.34 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 1l7x h ALA 141 CO -0.24 -0.59 0.57 0.00 0.00 0.00 0.00 179.25 179.00 1l7x h PHE 143 N 1.11 1.08 -0.24 0.00 -1.00 -0.44 -1.57 116.94 115.88 1l7x h PHE 143 Ca 0.35 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.11 1l7x h PHE 143 Cb 0.00 -0.35 -0.01 0.00 3.61 0.00 0.00 35.95 39.20 1l7x h PHE 143 CO -0.02 0.75 0.15 -0.07 -1.61 0.00 0.00 178.31 177.52 1l7x h LEU 144 N 1.10 0.28 -0.36 1.54 3.38 -0.69 0.18 115.31 120.74 1l7x h LEU 144 Ca 0.28 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.25 1l7x h LEU 144 Cb 0.02 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1l7x h LEU 144 CO -0.05 0.22 0.19 -0.78 0.09 0.00 0.00 178.44 178.12 1l7x h ASP 145 N 0.31 0.30 -0.24 -0.43 3.58 -1.20 -1.97 116.42 116.77 1l7x h ASP 145 Ca 0.09 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.52 1l7x h ASP 145 Cb -0.02 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 40.98 1l7x h ASP 145 CO -0.02 0.22 0.03 0.28 -2.88 0.00 0.00 179.24 176.87 1l7x h SER 146 N 0.39 0.39 -0.74 2.28 0.02 -1.04 -1.20 113.55 113.66 1l7x h SER 146 Ca 0.15 -0.27 0.08 0.00 -0.84 0.00 0.00 61.79 60.91 1l7x h SER 146 Cb 0.04 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 62.43 1l7x h SER 146 CO -0.09 0.57 0.48 0.24 -1.14 0.00 0.00 176.83 176.89 1l7x h MET 147 N 0.21 0.69 -0.04 3.45 2.86 -0.47 0.13 114.93 121.75 1l7x h MET 147 Ca 0.07 -0.04 -0.18 0.00 -2.06 0.00 0.00 59.70 57.50 1l7x h MET 147 Cb 0.35 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 1l7x h MET 147 CO 0.01 0.45 -0.74 0.00 1.06 0.00 0.00 176.91 177.69 1l7x h ALA 148 N 1.61 0.65 -0.12 6.32 0.00 -1.13 0.20 119.26 126.80 1l7x h ALA 148 Ca 0.33 -0.63 -0.14 0.00 0.00 0.00 0.00 54.91 54.47 1l7x h ALA 148 Cb 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1l7x h ALA 148 CO -0.11 0.81 -0.53 1.15 0.00 0.00 0.00 179.25 180.56 1l7x h THR 149 N 0.18 1.35 -0.05 0.00 2.02 0.07 -2.32 112.91 114.15 1l7x h THR 149 Ca -0.03 -1.80 0.00 0.00 0.77 0.00 0.00 66.41 65.36 1l7x h THR 149 Cb 1.31 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.56 1l7x h THR 149 CO 0.12 0.54 0.00 0.18 0.37 0.00 0.00 175.52 176.73 1l7x n LEU 150 N -3.94 0.69 -2.07 2.58 4.77 0.34 -4.72 117.00 114.64 1l7x n LEU 150 Ca -0.02 -0.27 -0.16 0.00 -0.03 0.00 0.00 56.01 55.53 1l7x n LEU 150 Cb 0.57 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.65 1l7x n LEU 150 CO 0.44 0.13 -0.11 0.61 -1.33 0.00 0.00 177.39 177.14 1l7x n GLY 151 N 0.99 -0.26 3.83 -0.72 0.00 -0.87 -4.32 105.19 103.84 1l7x n GLY 151 Ca 0.18 -0.15 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1l7x n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1l7x s LEU 152 N -4.88 4.23 -1.29 0.99 1.43 0.02 0.11 118.68 119.29 1l7x s LEU 152 Ca 0.11 1.35 -0.17 0.00 -1.03 0.00 0.00 54.13 54.39 1l7x s LEU 152 Cb -0.05 -3.78 0.01 0.00 0.03 0.00 0.00 46.19 42.40 1l7x s LEU 152 CO 0.14 -0.06 2.03 0.00 0.23 0.00 0.00 176.35 178.69 1l7x n ALA 153 N 0.28 4.40 -2.80 4.21 0.00 -1.26 -4.66 120.51 120.68 1l7x n ALA 153 Ca -0.00 -3.72 -0.30 0.00 0.00 0.00 0.00 53.44 49.42 1l7x n ALA 153 Cb 0.52 -3.57 -0.06 0.00 0.00 0.00 0.00 19.45 16.34 1l7x n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l7x s ALA 154 N 4.33 3.65 -0.03 0.00 0.00 -1.26 -1.55 121.76 126.90 1l7x s ALA 154 Ca 0.52 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.49 1l7x s ALA 154 Cb 0.10 -1.51 0.03 0.00 0.00 0.00 0.00 23.12 21.74 1l7x s ALA 154 CO 0.00 0.76 0.05 0.71 0.00 0.00 0.00 175.76 177.28 1l7x s TYR 155 N -1.42 0.01 0.10 0.00 2.02 -0.58 -3.99 117.35 113.48 1l7x s TYR 155 Ca 0.30 0.20 -0.16 0.00 -0.37 0.00 0.00 57.07 57.05 1l7x s TYR 155 Cb -0.12 -0.27 -0.07 0.00 -0.40 0.00 0.00 41.96 41.10 1l7x s TYR 155 CO 0.23 -0.12 0.54 0.20 -1.57 0.00 0.00 175.55 174.83 1l7x s GLY 156 N 1.32 2.55 -0.11 0.71 0.00 -0.58 -1.29 107.32 109.93 1l7x s GLY 156 Ca -0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 44.72 44.56 1l7x s GLY 156 CO -0.03 0.27 0.01 -0.19 0.00 0.00 0.00 173.10 173.16 1l7x s TYR 157 N -1.27 0.81 0.00 1.90 1.51 -0.07 -0.23 117.35 120.00 1l7x s TYR 157 Ca 0.32 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.98 1l7x s TYR 157 Cb -0.17 -0.89 0.00 0.00 -0.11 0.00 0.00 41.96 40.79 1l7x s TYR 157 CO 0.18 -0.43 0.00 0.41 -1.11 0.00 0.00 175.55 174.61 1l7x n GLY 158 N 5.11 3.92 3.62 0.71 0.00 -0.98 -1.06 105.19 116.51 1l7x n GLY 158 Ca -0.08 -1.08 -0.34 0.00 0.00 0.00 0.00 46.02 44.52 1l7x n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l7x s ILE 159 N -2.13 4.10 -0.93 -0.61 1.01 -1.26 -0.87 121.20 120.52 1l7x s ILE 159 Ca 0.00 -0.32 -0.19 0.00 0.00 0.00 0.00 60.65 60.15 1l7x s ILE 159 Cb 0.00 -2.73 0.13 0.00 0.01 0.00 0.00 42.46 39.87 1l7x s ILE 159 CO 0.00 0.58 1.12 -0.60 0.00 0.00 0.00 174.94 176.04 1l7x s ARG 160 N -0.60 3.59 0.26 2.79 3.52 0.13 -4.68 118.95 123.96 1l7x s ARG 160 Ca 0.10 -1.76 -0.30 0.00 -0.13 0.00 0.00 55.73 53.64 1l7x s ARG 160 Cb -0.12 -4.90 -0.09 0.00 -1.56 0.00 0.00 34.95 28.28 1l7x s ARG 160 CO 0.02 -1.77 1.20 0.71 -0.81 0.00 0.00 175.30 174.66 1l7x s TYR 161 N 2.66 3.37 0.15 5.12 2.02 -1.26 -4.66 117.35 124.76 1l7x s TYR 161 Ca 0.32 1.49 -0.05 0.00 -0.37 0.00 0.00 57.07 58.47 1l7x s TYR 161 Cb -0.05 -3.46 -0.02 0.00 -0.40 0.00 0.00 41.96 38.03 1l7x s TYR 161 CO -0.09 -1.22 1.38 1.49 -1.57 0.00 0.00 175.55 175.54 1l7x h GLU 162 N 4.31 0.49 -4.79 -0.62 4.81 -0.97 -3.41 114.58 114.40 1l7x h GLU 162 Ca -0.46 -0.43 -0.64 0.00 -0.13 0.00 0.00 59.36 57.70 1l7x h GLU 162 Cb 1.22 0.10 -0.36 0.00 0.63 0.00 0.00 28.75 30.33 1l7x h GLU 162 CO 0.70 1.06 -0.83 0.71 -0.73 0.00 0.00 179.01 179.93 1l7x s TYR 163 N -3.57 2.66 0.00 0.92 1.51 0.62 -4.11 117.35 115.39 1l7x s TYR 163 Ca -0.07 -1.71 0.00 0.00 -1.01 0.00 0.00 57.07 54.28 1l7x s TYR 163 Cb 0.10 -1.77 0.00 0.00 -0.11 0.00 0.00 41.96 40.17 1l7x s TYR 163 CO 0.86 -0.78 0.00 0.41 -1.11 0.00 0.00 175.55 174.93 1l7x n GLY 164 N 4.63 -0.04 3.75 0.71 0.00 -1.18 -1.47 105.19 111.57 1l7x n GLY 164 Ca -0.17 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 43.93 1l7x n GLY 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1l7x s ILE 165 N 0.00 2.75 0.61 -0.61 1.10 0.27 -4.39 121.20 120.94 1l7x s ILE 165 Ca 0.00 0.64 -0.18 0.00 -0.51 0.00 0.00 60.65 60.60 1l7x s ILE 165 Cb 0.00 -3.41 -0.05 0.00 0.15 0.00 0.00 42.46 39.16 1l7x s ILE 165 CO 0.00 0.11 0.94 2.22 -2.11 0.00 0.00 174.94 176.10 1l7x n PHE 166 N 2.25 0.74 -2.86 3.50 -1.74 -1.26 -4.58 117.46 113.52 1l7x n PHE 166 Ca 0.06 0.43 -0.41 0.00 -0.56 0.00 0.00 57.45 56.97 1l7x n PHE 166 Cb 0.41 -2.13 -0.04 0.00 1.52 0.00 0.00 39.48 39.24 1l7x n PHE 166 CO 0.00 0.00 0.00 -0.80 -0.56 0.00 0.00 176.76 175.40 1l7x s ASN 167 N -1.28 7.22 -0.17 5.98 0.01 0.57 -4.86 114.94 122.40 1l7x s ASN 167 Ca 0.76 1.47 -0.08 0.00 -0.71 0.00 0.00 52.86 54.30 1l7x s ASN 167 Cb -0.41 -2.50 -0.04 0.00 0.41 0.00 0.00 41.25 38.70 1l7x s ASN 167 CO 0.47 -0.18 0.10 -1.58 -1.51 0.00 0.00 177.10 174.40 1l7x s GLN 168 N 0.82 3.91 0.13 -0.60 0.74 -1.26 -0.27 119.66 123.13 1l7x s GLN 168 Ca 0.45 -0.25 0.06 0.00 0.05 0.00 0.00 55.36 55.68 1l7x s GLN 168 Cb -0.20 -3.28 -0.04 0.00 1.10 0.00 0.00 33.01 30.60 1l7x s GLN 168 CO 0.24 0.41 -0.15 0.15 -0.55 0.00 0.00 175.29 175.39 1l7x s LYS 169 N 0.02 1.06 -0.34 1.67 1.02 0.21 -3.34 119.74 120.03 1l7x s LYS 169 Ca 0.08 -1.26 -0.09 0.00 0.02 0.00 0.00 55.97 54.73 1l7x s LYS 169 Cb -0.12 -0.97 0.03 0.00 -0.52 0.00 0.00 37.83 36.25 1l7x s LYS 169 CO 0.00 0.19 0.15 0.42 -0.92 0.00 0.00 175.35 175.19 1l7x s ILE 170 N -2.10 4.20 -0.22 2.17 -1.09 -1.26 0.61 121.20 123.52 1l7x s ILE 170 Ca 0.10 -0.89 -0.02 0.00 -2.23 0.00 0.00 60.65 57.61 1l7x s ILE 170 Cb -0.05 -3.31 0.01 0.00 -1.58 0.00 0.00 42.46 37.53 1l7x s ILE 170 CO 0.04 -0.14 -0.09 -0.13 -1.23 0.00 0.00 174.94 173.39 1l7x s ARG 171 N 1.50 3.11 -1.51 2.79 1.81 -0.18 -4.62 118.95 121.84 1l7x s ARG 171 Ca 0.01 -0.79 -0.13 0.00 -1.72 0.00 0.00 55.73 53.10 1l7x s ARG 171 Cb -0.19 -2.90 0.08 0.00 -0.45 0.00 0.00 34.95 31.49 1l7x s ARG 171 CO 0.05 -0.27 0.95 -3.47 -0.68 0.00 0.00 175.30 171.88 1l7x n ASP 172 N 4.71 -4.98 0.00 0.23 2.03 -1.26 -1.32 116.55 115.96 1l7x n ASP 172 Ca -0.18 -0.71 0.00 0.00 0.52 0.00 0.00 54.79 54.42 1l7x n ASP 172 Cb 0.49 -3.97 0.00 0.00 -0.72 0.00 0.00 41.12 36.92 1l7x n ASP 172 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l7x n GLY 173 N -1.68 2.87 3.95 0.27 0.00 -1.26 -5.02 105.19 104.32 1l7x n GLY 173 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1l7x n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1l7x s TRP 174 N -2.46 3.48 0.10 1.61 0.52 -0.44 -4.05 118.94 117.70 1l7x s TRP 174 Ca 0.00 0.13 -0.30 0.00 0.02 0.00 0.00 56.10 55.95 1l7x s TRP 174 Cb 0.00 -1.69 -0.06 0.00 -1.15 0.00 0.00 33.47 30.58 1l7x s TRP 174 CO 0.00 0.45 1.04 -1.14 0.02 0.00 0.00 176.95 177.32 1l7x s GLN 175 N -3.53 4.60 -0.04 4.98 0.74 -1.26 -1.01 119.66 124.14 1l7x s GLN 175 Ca 0.35 1.57 0.06 0.00 0.05 0.00 0.00 55.36 57.39 1l7x s GLN 175 Cb -0.10 -3.36 -0.01 0.00 1.10 0.00 0.00 33.01 30.64 1l7x s GLN 175 CO 0.29 0.05 -0.21 0.08 -0.55 0.00 0.00 175.29 174.96 1l7x s VAL 176 N 0.28 1.67 -0.16 1.34 1.01 0.20 -4.91 120.40 119.83 1l7x s VAL 176 Ca 0.50 -0.87 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 1l7x s VAL 176 Cb -0.26 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1l7x s VAL 176 CO 0.31 0.47 0.12 -1.61 0.00 0.00 0.00 175.10 174.39 1l7x s GLU 177 N -0.23 3.80 -0.06 2.72 8.01 -1.26 -0.62 118.70 131.05 1l7x s GLU 177 Ca 0.01 -0.22 0.05 0.00 0.01 0.00 0.00 54.97 54.82 1l7x s GLU 177 Cb -0.11 -3.26 -0.00 0.00 -4.31 0.00 0.00 34.13 26.45 1l7x s GLU 177 CO 0.01 0.51 -0.20 -1.21 0.01 0.00 0.00 175.26 174.38 1l7x s GLU 178 N -0.25 2.21 0.18 1.61 2.02 0.63 -4.97 118.70 120.13 1l7x s GLU 178 Ca 0.10 -0.72 -0.33 0.00 0.02 0.00 0.00 54.97 54.04 1l7x s GLU 178 Cb -0.12 -1.84 -0.15 0.00 0.10 0.00 0.00 34.13 32.13 1l7x s GLU 178 CO 0.01 0.25 1.37 0.00 0.02 0.00 0.00 175.26 176.91 1l7x n ALA 179 N 3.21 0.38 -3.08 5.21 0.00 -1.26 -0.32 120.51 124.65 1l7x n ALA 179 Ca -0.19 0.45 -0.44 0.00 0.00 0.00 0.00 53.44 53.26 1l7x n ALA 179 Cb 0.53 -2.20 -0.00 0.00 0.00 0.00 0.00 19.45 17.78 1l7x n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1l7x s ASP 180 N 0.37 7.16 -1.56 0.00 2.15 -1.26 -4.68 116.67 118.84 1l7x s ASP 180 Ca 0.74 -3.19 -0.11 0.00 0.43 0.00 0.00 52.55 50.41 1l7x s ASP 180 Cb -0.75 -2.34 -0.04 0.00 -0.30 0.00 0.00 42.92 39.49 1l7x s ASP 180 CO 0.47 -0.59 2.70 -0.67 -0.17 0.00 0.00 175.17 176.91 1l7x n ASP 181 N 4.67 7.18 0.11 -0.34 2.03 -1.26 -3.13 116.55 125.81 1l7x n ASP 181 Ca 0.32 -2.68 0.09 0.00 0.52 0.00 0.00 54.79 53.04 1l7x n ASP 181 Cb 0.42 -1.58 0.43 0.00 -0.72 0.00 0.00 41.12 39.66 1l7x n ASP 181 CO 0.00 0.00 0.00 -2.67 -1.92 0.00 0.00 177.20 172.61 1l7x n TRP 182 N 4.30 0.56 0.84 -0.67 4.27 -1.26 -2.54 117.44 122.94 1l7x n TRP 182 Ca 0.69 0.25 0.10 0.00 -3.89 0.00 0.00 57.50 54.66 1l7x n TRP 182 Cb 0.28 -0.91 0.05 0.00 -1.36 0.00 0.00 31.31 29.37 1l7x n TRP 182 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1l7x n LEU 183 N -2.04 2.32 -0.23 5.67 4.77 -1.26 -4.64 117.00 121.59 1l7x n LEU 183 Ca 0.01 -0.90 0.01 0.00 -0.03 0.00 0.00 56.01 55.09 1l7x n LEU 183 Cb 0.11 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.30 1l7x n LEU 183 CO 0.12 0.41 0.76 -0.09 -1.33 0.00 0.00 177.39 177.26 1l7x h ARG 184 N 3.19 0.03 -0.12 3.23 2.43 -1.86 -0.79 114.38 120.49 1l7x h ARG 184 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1l7x h ARG 184 Cb 0.76 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1l7x h ARG 184 CO 0.00 0.02 0.00 0.66 -1.51 0.00 0.00 179.97 179.14 1l7x n TYR 185 N -5.41 0.14 0.00 2.20 4.02 -1.26 -5.04 117.16 111.80 1l7x n TYR 185 Ca 0.09 -0.07 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 1l7x n TYR 185 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.69 1l7x n TYR 185 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1l7x n GLY 186 N 1.24 1.54 3.05 2.72 0.00 -0.30 -5.01 105.19 108.43 1l7x n GLY 186 Ca 0.17 -1.60 -0.32 0.00 0.00 0.00 0.00 46.02 44.27 1l7x n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1l7x s ASN 187 N -0.30 4.56 0.14 1.61 2.47 -1.26 -4.94 114.94 117.22 1l7x s ASN 187 Ca 0.00 -1.66 0.20 0.00 0.42 0.00 0.00 52.86 51.81 1l7x s ASN 187 Cb 0.00 -1.58 0.82 0.00 -1.45 0.00 0.00 41.25 39.05 1l7x s ASN 187 CO 0.00 -0.26 1.61 -0.81 -3.72 0.00 0.00 177.10 173.92 1l7x n PRO 188 N 4.37 0.11 0.00 0.43 -0.04 -1.26 -3.07 135.00 135.54 1l7x n PRO 188 Ca -0.08 0.34 0.13 0.00 -0.04 0.00 0.00 63.50 63.85 1l7x n PRO 188 Cb 0.42 -1.70 0.39 0.00 -0.04 0.00 0.00 33.50 32.57 1l7x n PRO 188 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1l7x n TRP 189 N -1.91 0.00 -4.02 0.54 7.02 -1.26 -4.86 117.44 112.95 1l7x n TRP 189 Ca 0.03 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.22 1l7x n TRP 189 Cb 0.21 -0.31 -0.05 0.00 -2.42 0.00 0.00 31.31 28.73 1l7x n TRP 189 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 1l7x s GLU 190 N -2.93 3.07 -0.21 -0.99 -1.05 -1.17 -4.12 118.70 111.29 1l7x s GLU 190 Ca 0.14 -0.68 -0.01 0.00 -0.15 0.00 0.00 54.97 54.27 1l7x s GLU 190 Cb 0.18 -2.80 0.06 0.00 -0.44 0.00 0.00 34.13 31.13 1l7x s GLU 190 CO 0.62 0.55 0.01 0.21 0.95 0.00 0.00 175.26 177.60 1l7x s LYS 191 N -2.72 0.99 0.49 -4.83 2.47 0.15 -4.95 119.74 111.35 1l7x s LYS 191 Ca 0.32 -0.66 -0.23 0.00 -1.56 0.00 0.00 55.97 53.84 1l7x s LYS 191 Cb -0.12 -2.28 -0.07 0.00 -1.46 0.00 0.00 37.83 33.91 1l7x s LYS 191 CO 0.24 -0.65 1.29 0.45 0.16 0.00 0.00 175.35 176.84 1l7x n SER 192 N 4.91 2.48 -3.39 1.43 2.88 -1.26 -1.05 113.62 119.62 1l7x n SER 192 Ca -0.10 1.02 -0.26 0.00 -1.33 0.00 0.00 58.87 58.21 1l7x n SER 192 Cb 0.46 -1.53 -0.09 0.00 -0.75 0.00 0.00 64.21 62.30 1l7x n SER 192 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1l7x n ARG 193 N -0.52 1.29 0.27 -1.46 5.12 -0.84 -4.84 116.66 115.68 1l7x n ARG 193 Ca 0.09 -3.80 0.11 0.00 -1.93 0.00 0.00 57.85 52.31 1l7x n ARG 193 Cb 0.43 -1.74 0.75 0.00 -1.16 0.00 0.00 32.46 30.73 1l7x n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1l7x h PRO 194 N 4.54 0.00 0.00 5.56 0.13 -1.93 -2.38 132.00 137.92 1l7x h PRO 194 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1l7x h PRO 194 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1l7x h PRO 194 CO 0.59 0.01 0.00 -0.85 -0.23 0.00 0.00 178.00 177.52 1l7x n GLU 195 N -4.23 0.09 -0.63 0.86 0.00 -1.26 -2.37 120.64 113.10 1l7x n GLU 195 Ca -0.03 0.39 0.08 0.00 0.00 0.00 0.00 57.16 57.60 1l7x n GLU 195 Cb 0.10 -1.69 0.32 0.00 0.00 0.00 0.00 31.44 30.17 1l7x n GLU 195 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1l7x n PHE 196 N -1.85 1.43 -1.75 -1.84 3.72 -0.89 -5.01 117.46 111.27 1l7x n PHE 196 Ca 0.02 -0.76 -0.36 0.00 -0.05 0.00 0.00 57.45 56.29 1l7x n PHE 196 Cb 0.15 -0.37 0.07 0.00 -0.94 0.00 0.00 39.48 38.39 1l7x n PHE 196 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 176.76 178.12 1l7x s MET 197 N -2.57 2.56 0.03 -1.08 1.75 -1.00 -4.65 119.30 114.35 1l7x s MET 197 Ca 0.47 1.98 -0.06 0.00 -1.25 0.00 0.00 55.69 56.84 1l7x s MET 197 Cb 0.36 -1.86 -0.01 0.00 2.84 0.00 0.00 34.83 36.16 1l7x s MET 197 CO 0.14 -1.57 0.10 -0.51 -0.65 0.00 0.00 175.02 172.54 1l7x s LEU 198 N -4.42 1.76 0.10 4.11 1.43 0.35 -4.94 118.68 117.07 1l7x s LEU 198 Ca 0.81 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 53.30 1l7x s LEU 198 Cb -0.35 0.62 -0.06 0.00 0.03 0.00 0.00 46.19 46.43 1l7x s LEU 198 CO 0.39 -0.49 0.45 -2.16 0.23 0.00 0.00 176.35 174.77 1l7x s PRO 199 N -2.46 3.84 -0.03 1.29 0.04 -1.26 0.90 135.00 137.32 1l7x s PRO 199 Ca -0.06 0.29 0.05 0.00 0.04 0.00 0.00 61.00 61.32 1l7x s PRO 199 Cb -0.02 -2.98 -0.01 0.00 0.04 0.00 0.00 34.50 31.53 1l7x s PRO 199 CO -0.04 0.53 -0.18 0.08 0.04 0.00 0.00 177.00 177.43 1l7x s VAL 200 N -1.42 1.49 0.06 -0.36 1.01 0.13 -4.89 120.40 116.42 1l7x s VAL 200 Ca 0.35 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.57 1l7x s VAL 200 Cb -0.14 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1l7x s VAL 200 CO 0.18 0.42 0.03 -1.00 0.00 0.00 0.00 175.10 174.74 1l7x s HIS 201 N -0.26 3.09 0.03 5.22 3.76 -1.26 -1.30 115.29 124.56 1l7x s HIS 201 Ca 0.03 0.04 -0.02 0.00 -0.15 0.00 0.00 55.06 54.96 1l7x s HIS 201 Cb -0.09 -1.60 -0.02 0.00 1.11 0.00 0.00 32.58 31.98 1l7x s HIS 201 CO 0.00 0.49 0.01 -0.06 -0.85 0.00 0.00 174.74 174.34 1l7x s PHE 202 N -1.28 0.28 0.00 1.40 0.08 -0.70 -4.99 117.98 112.77 1l7x s PHE 202 Ca 0.25 -0.59 0.00 0.00 0.12 0.00 0.00 56.93 56.71 1l7x s PHE 202 Cb -0.12 -0.21 0.00 0.00 -0.57 0.00 0.00 43.02 42.13 1l7x s PHE 202 CO 0.17 -0.28 0.00 0.66 -0.10 0.00 0.00 175.22 175.68 1l7x n TYR 203 N 1.10 0.00 -4.56 0.36 4.02 0.94 -1.46 117.16 117.56 1l7x n TYR 203 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.68 1l7x n TYR 203 Cb 0.57 0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.91 1l7x n TYR 203 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1l7x n GLY 204 N 0.00 -0.91 3.33 2.72 0.00 -1.20 -4.59 105.19 104.54 1l7x n GLY 204 Ca 0.00 -1.13 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 1l7x n GLY 204 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l7x s LYS 205 N 0.00 1.37 -0.23 1.61 -2.85 0.16 -4.82 119.74 114.98 1l7x s LYS 205 Ca 0.00 -1.56 -0.09 0.00 -1.00 0.00 0.00 55.97 53.32 1l7x s LYS 205 Cb 0.00 0.34 -0.04 0.00 -2.06 0.00 0.00 37.83 36.07 1l7x s LYS 205 CO 0.00 -0.50 0.12 0.08 0.10 0.00 0.00 175.35 175.15 1l7x s VAL 206 N -4.01 5.05 -0.17 1.79 1.01 -1.26 -0.49 120.40 122.31 1l7x s VAL 206 Ca 0.34 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.37 1l7x s VAL 206 Cb 0.04 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1l7x s VAL 206 CO 0.13 0.37 -0.09 -0.70 0.00 0.00 0.00 175.10 174.82 1l7x s GLU 207 N 0.96 3.39 -0.69 2.72 2.12 0.18 -4.96 118.70 122.42 1l7x s GLU 207 Ca 0.06 -0.65 -0.14 0.00 0.36 0.00 0.00 54.97 54.60 1l7x s GLU 207 Cb -0.13 -2.82 0.18 0.00 0.26 0.00 0.00 34.13 31.61 1l7x s GLU 207 CO 0.03 0.02 0.63 -1.01 -0.54 0.00 0.00 175.26 174.39 1l7x s HIS 208 N 0.89 3.54 0.49 5.30 3.76 -1.26 0.46 115.29 128.46 1l7x s HIS 208 Ca -0.02 -1.77 0.07 0.00 -0.15 0.00 0.00 55.06 53.20 1l7x s HIS 208 Cb -0.15 -3.76 0.02 0.00 1.11 0.00 0.00 32.58 29.80 1l7x s HIS 208 CO 0.00 -0.99 0.47 0.95 -0.85 0.00 0.00 174.74 174.32 1l7x s THR 209 N 0.75 2.26 -0.27 1.30 -4.23 -0.10 -4.98 115.64 110.38 1l7x s THR 209 Ca 0.12 -1.31 0.27 0.00 -1.18 0.00 0.00 61.69 59.59 1l7x s THR 209 Cb -0.19 -2.57 0.29 0.00 1.34 0.00 0.00 72.50 71.37 1l7x s THR 209 CO -0.04 0.00 1.80 -0.55 -0.54 0.00 0.00 174.62 175.29 1l7x h ASN 210 N 0.76 0.00 -0.42 3.99 7.08 -2.02 0.29 115.58 125.25 1l7x h ASN 210 Ca -0.38 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.84 1l7x h ASN 210 Cb 1.28 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.52 1l7x h ASN 210 CO 0.53 0.00 0.00 0.35 -2.08 0.00 0.00 177.43 176.23 1l7x n THR 211 N -2.47 1.24 -0.11 6.14 -2.24 -1.26 -5.02 114.28 110.56 1l7x n THR 211 Ca 0.01 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 1l7x n THR 211 Cb 0.22 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 1l7x n THR 211 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l7x n GLY 212 N 0.81 -1.78 3.77 3.38 0.00 0.09 -4.94 105.19 106.52 1l7x n GLY 212 Ca 0.17 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.78 1l7x n GLY 212 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l7x s THR 213 N 0.00 4.67 -0.05 2.61 2.01 -1.26 -0.92 115.64 122.71 1l7x s THR 213 Ca 0.00 1.52 0.05 0.00 0.31 0.00 0.00 61.69 63.56 1l7x s THR 213 Cb 0.00 -4.06 -0.00 0.00 0.01 0.00 0.00 72.50 68.45 1l7x s THR 213 CO 0.00 0.44 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.65 1l7x s LYS 214 N -0.50 1.91 -0.50 4.92 1.02 0.17 -4.92 119.74 121.84 1l7x s LYS 214 Ca 0.35 -0.65 -0.16 0.00 0.02 0.00 0.00 55.97 55.53 1l7x s LYS 214 Cb -0.21 -1.65 0.10 0.00 -0.52 0.00 0.00 37.83 35.55 1l7x s LYS 214 CO 0.22 0.26 0.44 -0.46 -0.92 0.00 0.00 175.35 174.89 1l7x s TRP 215 N 0.02 3.25 0.46 3.18 -0.00 -1.26 0.49 118.94 125.09 1l7x s TRP 215 Ca -0.04 -1.10 0.05 0.00 -0.00 0.00 0.00 56.10 55.01 1l7x s TRP 215 Cb -0.12 -3.45 -0.03 0.00 -0.00 0.00 0.00 33.47 29.87 1l7x s TRP 215 CO 0.03 -0.90 0.15 0.96 -0.00 0.00 0.00 176.95 177.19 1l7x s ILE 216 N 1.62 1.84 -1.58 5.86 -4.36 0.35 -4.76 121.20 120.16 1l7x s ILE 216 Ca 0.04 -1.78 -0.05 0.00 -0.26 0.00 0.00 60.65 58.60 1l7x s ILE 216 Cb -0.27 -2.61 0.01 0.00 1.25 0.00 0.00 42.46 40.83 1l7x s ILE 216 CO 0.05 0.00 0.59 0.47 0.24 0.00 0.00 174.94 176.29 1l7x n ASP 217 N -1.31 -6.16 -4.88 4.36 9.92 -1.26 0.38 116.55 117.60 1l7x n ASP 217 Ca -0.06 -0.28 -0.30 0.00 -0.53 0.00 0.00 54.79 53.61 1l7x n ASP 217 Cb 0.65 -4.98 -0.04 0.00 -0.64 0.00 0.00 41.12 36.11 1l7x n ASP 217 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1l7x s THR 218 N -3.18 4.85 -0.03 -3.53 -4.23 -1.26 -3.21 115.64 105.04 1l7x s THR 218 Ca 0.30 0.50 -0.15 0.00 -1.18 0.00 0.00 61.69 61.16 1l7x s THR 218 Cb -0.13 -3.70 -0.05 0.00 1.34 0.00 0.00 72.50 69.95 1l7x s THR 218 CO 0.37 -0.38 0.39 -1.10 -0.54 0.00 0.00 174.62 173.36 1l7x s GLN 219 N -3.55 3.96 -0.01 3.99 -0.21 -0.53 -4.91 119.66 118.39 1l7x s GLN 219 Ca 0.49 0.36 0.02 0.00 0.02 0.00 0.00 55.36 56.26 1l7x s GLN 219 Cb -0.10 -3.25 -0.03 0.00 1.00 0.00 0.00 33.01 30.62 1l7x s GLN 219 CO 0.28 0.61 -0.05 0.08 -2.12 0.00 0.00 175.29 174.09 1l7x s VAL 220 N -0.80 3.78 0.02 1.09 1.01 -1.26 -1.73 120.40 122.52 1l7x s VAL 220 Ca 0.23 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.56 1l7x s VAL 220 Cb -0.16 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 1l7x s VAL 220 CO 0.12 0.42 -0.12 -0.69 0.00 0.00 0.00 175.10 174.83 1l7x s VAL 221 N -0.99 0.93 0.15 2.92 1.01 -0.42 -4.46 120.40 119.54 1l7x s VAL 221 Ca 0.17 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 1l7x s VAL 221 Cb -0.11 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1l7x s VAL 221 CO 0.07 0.03 0.34 -0.76 0.00 0.00 0.00 175.10 174.78 1l7x s LEU 222 N -0.89 4.27 -0.19 3.92 1.43 0.62 0.21 118.68 128.05 1l7x s LEU 222 Ca 0.01 0.39 0.01 0.00 -1.03 0.00 0.00 54.13 53.51 1l7x s LEU 222 Cb -0.07 -3.13 0.03 0.00 0.03 0.00 0.00 46.19 43.05 1l7x s LEU 222 CO 0.01 0.03 -0.17 0.00 0.23 0.00 0.00 176.35 176.44 1l7x s ALA 223 N -1.74 2.28 -0.32 4.21 0.00 0.26 -1.45 121.76 125.00 1l7x s ALA 223 Ca 0.38 -1.25 -0.06 0.00 0.00 0.00 0.00 51.96 51.03 1l7x s ALA 223 Cb -0.12 -1.22 0.03 0.00 0.00 0.00 0.00 23.12 21.81 1l7x s ALA 223 CO 0.28 -0.50 0.07 -1.17 0.00 0.00 0.00 175.76 174.44 1l7x s LEU 224 N 1.30 4.07 0.44 0.00 2.96 -0.23 -0.49 118.68 126.72 1l7x s LEU 224 Ca 0.03 -1.04 -0.21 0.00 -0.22 0.00 0.00 54.13 52.69 1l7x s LEU 224 Cb -0.14 -1.84 -0.11 0.00 0.50 0.00 0.00 46.19 44.61 1l7x s LEU 224 CO -0.11 -0.27 0.96 -2.16 -1.32 0.00 0.00 176.35 173.45 1l7x s PRO 225 N 1.40 4.17 -0.09 0.98 0.04 -1.26 -0.88 135.00 139.35 1l7x s PRO 225 Ca -0.01 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1l7x s PRO 225 Cb -0.19 -2.17 0.02 0.00 0.04 0.00 0.00 34.50 32.21 1l7x s PRO 225 CO 0.02 -0.09 -0.07 0.71 0.04 0.00 0.00 177.00 177.61 1l7x s TYR 226 N -2.16 1.27 -0.11 0.56 2.02 0.13 -1.99 117.35 117.07 1l7x s TYR 226 Ca 0.63 -0.55 -0.12 0.00 -0.37 0.00 0.00 57.07 56.65 1l7x s TYR 226 Cb -0.10 -1.07 -0.05 0.00 -0.40 0.00 0.00 41.96 40.34 1l7x s TYR 226 CO 0.14 -0.40 0.28 -0.51 -1.57 0.00 0.00 175.55 173.49 1l7x s ASP 227 N 1.46 6.51 -0.07 2.29 -0.00 -0.21 -0.57 116.67 126.08 1l7x s ASP 227 Ca -0.01 0.60 0.05 0.00 -0.00 0.00 0.00 52.55 53.20 1l7x s ASP 227 Cb -0.13 -2.17 -0.01 0.00 -0.00 0.00 0.00 42.92 40.61 1l7x s ASP 227 CO -0.05 0.23 -0.23 -0.89 -0.00 0.00 0.00 175.17 174.23 1l7x s THR 228 N -0.27 2.19 0.29 -1.27 2.01 0.16 0.34 115.64 119.09 1l7x s THR 228 Ca 0.18 -1.01 -0.29 0.00 0.31 0.00 0.00 61.69 60.88 1l7x s THR 228 Cb -0.14 -1.81 -0.09 0.00 0.01 0.00 0.00 72.50 70.47 1l7x s THR 228 CO 0.06 0.57 1.08 -2.16 -0.69 0.00 0.00 174.62 173.48 1l7x s PRO 229 N -0.11 4.59 -0.40 4.92 0.04 -1.26 -1.14 135.00 141.64 1l7x s PRO 229 Ca -0.05 1.73 0.03 0.00 0.04 0.00 0.00 61.00 62.76 1l7x s PRO 229 Cb -0.14 -3.10 0.11 0.00 0.04 0.00 0.00 34.50 31.41 1l7x s PRO 229 CO 0.04 0.19 0.13 0.08 0.04 0.00 0.00 177.00 177.48 1l7x s VAL 230 N -1.24 2.16 -0.10 -0.36 1.01 0.13 -4.89 120.40 117.11 1l7x s VAL 230 Ca 0.46 -2.55 -0.30 0.00 0.00 0.00 0.00 61.98 59.59 1l7x s VAL 230 Cb -0.30 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 1l7x s VAL 230 CO 0.38 -0.69 1.16 -2.16 0.00 0.00 0.00 175.10 173.80 1l7x s PRO 231 N 0.59 4.33 0.94 2.72 0.04 -1.26 -0.24 135.00 142.11 1l7x s PRO 231 Ca 0.13 1.59 -0.12 0.00 0.04 0.00 0.00 61.00 62.64 1l7x s PRO 231 Cb -0.21 -3.60 0.15 0.00 0.04 0.00 0.00 34.50 30.87 1l7x s PRO 231 CO -0.07 -0.49 1.09 0.20 0.04 0.00 0.00 177.00 177.77 1l7x s GLY 232 N 1.48 1.61 -0.37 0.56 0.00 0.07 -4.77 107.32 105.89 1l7x s GLY 232 Ca 0.53 -0.04 -0.26 0.00 0.00 0.00 0.00 44.72 44.95 1l7x s GLY 232 CO 0.18 0.48 0.92 -0.47 0.00 0.00 0.00 173.10 174.21 1l7x s TYR 233 N -2.86 3.07 -1.60 1.90 5.04 -1.26 -4.36 117.35 117.28 1l7x s TYR 233 Ca 0.64 0.74 -0.11 0.00 -2.44 0.00 0.00 57.07 55.90 1l7x s TYR 233 Cb -0.19 -3.65 0.10 0.00 0.35 0.00 0.00 41.96 38.56 1l7x s TYR 233 CO 0.58 -0.84 0.60 -1.33 -1.34 0.00 0.00 175.55 173.22 1l7x n MET 234 N 6.78 -2.98 -0.05 4.97 2.81 0.37 -4.85 117.12 124.17 1l7x n MET 234 Ca 0.07 0.36 0.00 0.00 -1.81 0.00 0.00 57.70 56.31 1l7x n MET 234 Cb 0.48 -4.78 0.00 0.00 -0.71 0.00 0.00 33.22 28.21 1l7x n MET 234 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1l7x n ASN 235 N -2.78 0.04 0.00 7.83 6.94 -1.26 -5.01 115.26 121.02 1l7x n ASN 235 Ca -0.08 -1.12 0.00 0.00 -0.02 0.00 0.00 54.58 53.36 1l7x n ASN 235 Cb 0.57 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.97 1l7x n ASN 235 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1l7x n ASN 236 N -0.01 0.00 -4.77 0.53 3.02 -1.26 -4.97 115.26 107.79 1l7x n ASN 236 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.16 1l7x n ASN 236 Cb 0.52 -1.30 -0.06 0.00 -0.61 0.00 0.00 39.78 38.33 1l7x n ASN 236 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1l7x s THR 237 N -2.17 4.66 -0.22 3.41 2.01 -1.26 -4.79 115.64 117.28 1l7x s THR 237 Ca 0.00 1.49 -0.03 0.00 0.31 0.00 0.00 61.69 63.45 1l7x s THR 237 Cb 0.00 -4.04 0.07 0.00 0.01 0.00 0.00 72.50 68.54 1l7x s THR 237 CO 0.00 0.46 0.08 -0.69 -0.69 0.00 0.00 174.62 173.78 1l7x s VAL 238 N -0.63 0.27 0.78 3.82 1.01 -1.26 -0.76 120.40 123.63 1l7x s VAL 238 Ca 0.34 -0.56 -0.03 0.00 0.00 0.00 0.00 61.98 61.73 1l7x s VAL 238 Cb -0.21 -0.95 0.15 0.00 0.00 0.00 0.00 36.38 35.38 1l7x s VAL 238 CO 0.22 -0.37 1.07 0.20 0.00 0.00 0.00 175.10 176.22 1l7x s ASN 239 N 1.96 4.01 -0.02 3.32 0.01 0.66 -4.63 114.94 120.25 1l7x s ASN 239 Ca 0.03 -0.34 0.07 0.00 -0.71 0.00 0.00 52.86 51.90 1l7x s ASN 239 Cb -0.17 0.09 -0.02 0.00 0.41 0.00 0.00 41.25 41.57 1l7x s ASN 239 CO -0.15 -2.11 -0.22 -0.89 -1.51 0.00 0.00 177.10 172.23 1l7x s THR 240 N -3.31 1.71 -0.25 1.60 2.01 -1.26 0.20 115.64 116.35 1l7x s THR 240 Ca 0.69 -0.93 -0.01 0.00 0.31 0.00 0.00 61.69 61.75 1l7x s THR 240 Cb -0.04 -1.42 0.03 0.00 0.01 0.00 0.00 72.50 71.08 1l7x s THR 240 CO 0.46 0.48 -0.07 -0.32 -0.69 0.00 0.00 174.62 174.49 1l7x s MET 241 N -0.51 2.72 -0.32 4.92 1.75 -0.29 -1.52 119.30 126.04 1l7x s MET 241 Ca 0.08 -1.05 -0.09 0.00 -1.25 0.00 0.00 55.69 53.38 1l7x s MET 241 Cb -0.08 -2.98 0.00 0.00 2.84 0.00 0.00 34.83 34.61 1l7x s MET 241 CO -0.01 -0.44 0.14 0.50 -0.65 0.00 0.00 175.02 174.57 1l7x s ARG 242 N 1.29 3.16 -0.13 4.11 3.52 0.67 -0.67 118.95 130.90 1l7x s ARG 242 Ca -0.01 -0.83 -0.03 0.00 -0.13 0.00 0.00 55.73 54.72 1l7x s ARG 242 Cb -0.17 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.64 1l7x s ARG 242 CO -0.05 -0.48 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.43 1l7x s LEU 243 N 1.57 3.40 -0.07 -0.88 1.43 0.26 -2.31 118.68 122.08 1l7x s LEU 243 Ca 0.03 -0.01 -0.09 0.00 -1.03 0.00 0.00 54.13 53.03 1l7x s LEU 243 Cb -0.18 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 1l7x s LEU 243 CO 0.05 0.25 0.24 0.26 0.23 0.00 0.00 176.35 177.38 1l7x s TRP 244 N -0.14 3.64 -0.06 0.29 0.52 -0.05 0.23 118.94 123.37 1l7x s TRP 244 Ca 0.04 0.68 0.06 0.00 0.02 0.00 0.00 56.10 56.90 1l7x s TRP 244 Cb -0.13 -2.05 -0.01 0.00 -1.15 0.00 0.00 33.47 30.13 1l7x s TRP 244 CO 0.02 0.70 -0.25 0.45 0.02 0.00 0.00 176.95 177.90 1l7x s SER 245 N -1.10 3.04 -0.01 2.95 0.15 -0.06 0.19 113.70 118.85 1l7x s SER 245 Ca 0.19 -0.51 -0.30 0.00 0.70 0.00 0.00 55.95 56.03 1l7x s SER 245 Cb -0.14 -0.86 -0.03 0.00 -1.71 0.00 0.00 66.02 63.29 1l7x s SER 245 CO 0.08 0.24 0.97 0.00 1.20 0.00 0.00 173.24 175.73 1l7x s ALA 246 N -0.13 3.19 0.04 5.45 0.00 -1.26 -1.07 121.76 127.98 1l7x s ALA 246 Ca -0.04 0.51 0.03 0.00 0.00 0.00 0.00 51.96 52.46 1l7x s ALA 246 Cb -0.14 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 1l7x s ALA 246 CO 0.04 -0.27 -0.11 1.03 0.00 0.00 0.00 175.76 176.46 1l7x s ARG 247 N 1.11 0.70 0.25 0.00 1.81 -0.53 -4.50 118.95 117.78 1l7x s ARG 247 Ca 0.51 -0.71 -0.30 0.00 -1.72 0.00 0.00 55.73 53.52 1l7x s ARG 247 Cb -0.21 -0.61 -0.09 0.00 -0.45 0.00 0.00 34.95 33.59 1l7x s ARG 247 CO 0.27 0.14 0.96 0.00 -0.68 0.00 0.00 175.30 175.99 1l7x s ALA 248 N -1.00 3.34 0.47 2.13 0.00 -1.26 -0.27 121.76 125.17 1l7x s ALA 248 Ca -0.03 0.65 -0.21 0.00 0.00 0.00 0.00 51.96 52.36 1l7x s ALA 248 Cb -0.08 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.74 1l7x s ALA 248 CO 0.01 0.17 1.07 -1.25 0.00 0.00 0.00 175.76 175.76 1l7x s PRO 249 N -1.24 3.79 -0.52 0.00 0.04 -1.26 -4.82 135.00 130.99 1l7x s PRO 249 Ca 0.42 1.49 -0.23 0.00 0.04 0.00 0.00 61.00 62.71 1l7x s PRO 249 Cb -0.26 -2.21 0.04 0.00 0.04 0.00 0.00 34.50 32.11 1l7x s PRO 249 CO 0.33 -0.46 0.86 -0.80 0.04 0.00 0.00 177.00 176.97 1l7x s ASN 250 N -1.78 6.34 0.00 6.66 0.01 -1.26 -5.10 114.94 119.81 1l7x s ASN 250 Ca 0.66 -0.38 0.00 0.00 -0.71 0.00 0.00 52.86 52.43 1l7x s ASN 250 Cb -0.20 -2.40 0.00 0.00 0.41 0.00 0.00 41.25 39.05 1l7x s ASN 250 CO 0.24 -1.11 0.00 0.47 -1.51 0.00 0.00 177.10 175.20 1l7x n ASP 251 N 7.11 0.00 0.00 -1.22 10.43 -1.26 -5.26 116.55 126.34 1l7x n ASP 251 Ca 0.01 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.37 1l7x n ASP 251 Cb 0.47 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.43 1l7x n ASP 251 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1l7x n GLY 260 N 0.00 -0.39 3.57 0.44 0.00 -1.26 -5.20 105.19 102.35 1l7x n GLY 260 Ca 0.00 0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1l7x n GLY 260 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l7x s ASP 261 N -1.10 5.80 0.12 1.61 2.15 -1.26 -5.02 116.67 118.97 1l7x s ASP 261 Ca 0.00 -0.04 -0.31 0.00 0.43 0.00 0.00 52.55 52.64 1l7x s ASP 261 Cb 0.00 -2.07 -0.09 0.00 -0.30 0.00 0.00 42.92 40.47 1l7x s ASP 261 CO 0.00 -0.02 1.58 0.22 -0.17 0.00 0.00 175.17 176.78 1l7x h TYR 262 N 8.17 -1.24 -0.36 -5.34 3.20 -2.05 0.63 116.97 119.98 1l7x h TYR 262 Ca -0.36 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.60 1l7x h TYR 262 Cb 1.18 0.54 -0.04 0.00 1.54 0.00 0.00 36.73 39.95 1l7x h TYR 262 CO 0.72 -0.51 0.10 0.82 -1.64 0.00 0.00 178.16 177.66 1l7x h ILE 263 N -0.59 0.86 -0.34 1.81 1.08 -1.99 -1.45 117.51 116.90 1l7x h ILE 263 Ca 0.04 -0.08 0.01 0.00 -0.39 0.00 0.00 64.86 64.44 1l7x h ILE 263 Cb 0.66 0.60 -0.02 0.00 -3.07 0.00 0.00 36.82 34.99 1l7x h ILE 263 CO -0.33 0.04 0.21 -0.61 -0.69 0.00 0.00 178.15 176.78 1l7x h GLN 264 N 0.24 0.42 -0.68 2.37 5.75 -1.93 -0.72 115.11 120.56 1l7x h GLN 264 Ca 0.17 -0.03 0.09 0.00 -0.15 0.00 0.00 58.65 58.73 1l7x h GLN 264 Cb 0.17 -0.10 -0.07 0.00 1.07 0.00 0.00 27.48 28.55 1l7x h GLN 264 CO -0.20 0.28 0.33 0.00 -2.65 0.00 0.00 178.83 176.59 1l7x h ALA 265 N 1.13 0.93 -0.48 3.38 0.00 -0.43 0.32 119.26 124.11 1l7x h ALA 265 Ca 0.13 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 1l7x h ALA 265 Cb -0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1l7x h ALA 265 CO -0.04 -0.07 -0.13 0.28 0.00 0.00 0.00 179.25 179.29 1l7x h VAL 266 N 0.56 1.26 0.00 0.00 2.07 -0.87 -2.69 116.25 116.59 1l7x h VAL 266 Ca 0.34 -1.24 -0.10 0.00 0.82 0.00 0.00 66.70 66.51 1l7x h VAL 266 Cb 0.36 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1l7x h VAL 266 CO -0.27 0.43 -0.48 -0.07 0.02 0.00 0.00 177.57 177.20 1l7x h LEU 267 N 0.80 0.00 0.00 2.57 3.38 0.13 -2.69 115.31 119.49 1l7x h LEU 267 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1l7x h LEU 267 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1l7x h LEU 267 CO 0.05 0.48 0.00 0.47 0.09 0.00 0.00 178.44 179.53 1l7x n ASP 268 N -3.84 0.00 0.24 -0.43 8.00 0.99 -2.10 116.55 119.41 1l7x n ASP 268 Ca -0.01 -0.02 0.16 0.00 0.71 0.00 0.00 54.79 55.63 1l7x n ASP 268 Cb 0.52 -0.24 0.69 0.00 -0.02 0.00 0.00 41.12 42.07 1l7x n ASP 268 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1l7x h ARG 269 N 0.00 0.00 -0.16 -1.24 3.08 -1.47 -2.43 114.38 112.16 1l7x h ARG 269 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1l7x h ARG 269 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1l7x h ARG 269 CO 0.00 0.00 -0.00 -0.91 -1.07 0.00 0.00 179.97 177.99 1l7x h ASN 270 N 0.00 0.21 -0.62 7.04 2.35 -1.65 -2.84 115.58 120.07 1l7x h ASN 270 Ca 0.00 -0.02 0.05 0.00 -0.55 0.00 0.00 56.30 55.77 1l7x h ASN 270 Cb 0.40 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.66 1l7x h ASN 270 CO 0.00 0.26 0.35 -0.07 -1.65 0.00 0.00 177.43 176.32 1l7x h LEU 271 N 0.23 0.54 -0.79 1.61 3.38 -1.67 0.33 115.31 118.93 1l7x h LEU 271 Ca 0.06 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 1l7x h LEU 271 Cb 0.17 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1l7x h LEU 271 CO 0.00 0.36 -0.46 0.00 0.09 0.00 0.00 178.44 178.44 1l7x h ALA 272 N 1.31 0.97 0.00 1.53 0.00 -1.68 -2.90 119.26 118.48 1l7x h ALA 272 Ca 0.27 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1l7x h ALA 272 Cb 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1l7x h ALA 272 CO -0.15 0.64 -0.00 0.39 0.00 0.00 0.00 179.25 180.12 1l7x n GLU 273 N -3.99 0.26 0.29 0.00 1.02 -0.73 -3.12 120.64 114.37 1l7x n GLU 273 Ca -0.02 0.21 0.19 0.00 -0.02 0.00 0.00 57.16 57.52 1l7x n GLU 273 Cb 0.52 -1.80 0.87 0.00 -0.02 0.00 0.00 31.44 31.02 1l7x n GLU 273 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1l7x h ASN 274 N 0.00 0.00 0.12 1.62 2.35 -0.16 -3.02 115.58 116.50 1l7x h ASN 274 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1l7x h ASN 274 Cb 0.73 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.10 1l7x h ASN 274 CO 0.00 0.00 -0.04 0.40 -1.65 0.00 0.00 177.43 176.14 1l7x h ILE 275 N 0.00 0.54 0.00 2.81 2.04 -1.68 -2.42 117.51 118.79 1l7x h ILE 275 Ca 0.00 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 1l7x h ILE 275 Cb 0.31 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1l7x h ILE 275 CO 0.00 0.04 -0.36 -1.54 0.00 0.00 0.00 178.15 176.29 1l7x n SER 276 N -3.77 1.67 -0.02 1.72 3.41 -1.14 -4.60 113.62 110.89 1l7x n SER 276 Ca -0.03 -3.13 -0.13 0.00 -0.26 0.00 0.00 58.87 55.33 1l7x n SER 276 Cb 0.13 -0.42 -0.10 0.00 -0.26 0.00 0.00 64.21 63.56 1l7x n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1l7x h ARG 277 N 0.48 0.06 -3.59 4.33 9.65 -1.44 -2.60 114.38 121.26 1l7x h ARG 277 Ca -0.03 -0.03 -0.16 0.00 -1.10 0.00 0.00 59.98 58.66 1l7x h ARG 277 Cb 1.15 0.00 -0.22 0.00 -1.39 0.00 0.00 29.97 29.52 1l7x h ARG 277 CO 0.01 0.58 -0.55 0.54 2.80 0.00 0.00 179.97 183.35 1l7x s VAL 278 N -4.08 0.07 0.02 0.20 0.11 -1.26 -0.28 120.40 115.18 1l7x s VAL 278 Ca -0.16 -0.60 -0.30 0.00 -2.93 0.00 0.00 61.98 57.99 1l7x s VAL 278 Cb 0.02 -0.35 -0.04 0.00 -1.53 0.00 0.00 36.38 34.48 1l7x s VAL 278 CO 0.69 -0.33 1.10 -0.22 -3.33 0.00 0.00 175.10 173.02 1l7x s LEU 279 N -1.11 4.35 -0.13 2.54 2.96 -0.54 -4.97 118.68 121.79 1l7x s LEU 279 Ca -0.12 1.83 -0.29 0.00 -0.22 0.00 0.00 54.13 55.33 1l7x s LEU 279 Cb -0.07 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.00 1l7x s LEU 279 CO 0.01 -0.40 1.87 -0.31 -1.32 0.00 0.00 176.35 176.20 1l7x s TYR 280 N 1.22 1.61 -0.14 5.38 2.02 -1.26 -4.82 117.35 121.36 1l7x s TYR 280 Ca 0.55 0.20 0.00 0.00 -0.37 0.00 0.00 57.07 57.45 1l7x s TYR 280 Cb -0.25 -4.04 0.00 0.00 -0.40 0.00 0.00 41.96 37.27 1l7x s TYR 280 CO 0.27 -4.11 0.60 -0.35 -1.57 0.00 0.00 175.55 170.39 1l7x n PRO 281 N 7.84 0.64 -4.00 -1.71 -0.04 -1.26 -4.86 135.00 131.62 1l7x n PRO 281 Ca 0.22 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.33 1l7x n PRO 281 Cb 0.44 -1.20 -0.09 0.00 -0.04 0.00 0.00 33.50 32.61 1l7x n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1l7x s ASN 282 N 0.81 5.78 -0.20 3.54 0.01 -1.26 -4.45 114.94 119.18 1l7x s ASN 282 Ca 0.00 0.18 -0.03 0.00 -0.71 0.00 0.00 52.86 52.30 1l7x s ASN 282 Cb 0.00 -1.93 -0.01 0.00 0.41 0.00 0.00 41.25 39.72 1l7x s ASN 282 CO 0.00 0.24 -0.06 -0.62 -1.51 0.00 0.00 177.10 175.15 1l7x s ASP 283 N -0.04 4.25 -1.35 -1.22 -1.08 -1.26 -4.62 116.67 111.35 1l7x s ASP 283 Ca 0.07 -0.37 -0.04 0.00 -0.52 0.00 0.00 52.55 51.69 1l7x s ASP 283 Cb -0.12 -1.71 0.02 0.00 -1.46 0.00 0.00 42.92 39.65 1l7x s ASP 283 CO 0.01 0.03 0.88 0.59 0.52 0.00 0.00 175.17 177.19 1l7x n ASN 284 N 4.46 -2.81 -3.66 -0.34 3.02 -1.26 -4.98 115.26 109.70 1l7x n ASN 284 Ca -0.18 -0.74 -0.05 0.00 -0.03 0.00 0.00 54.58 53.57 1l7x n ASN 284 Cb 0.51 -4.32 -0.07 0.00 -0.61 0.00 0.00 39.78 35.30 1l7x n ASN 284 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1l7x s PHE 285 N -3.49 -1.05 -0.17 3.10 5.36 -1.26 -4.11 117.98 116.36 1l7x s PHE 285 Ca 0.23 1.96 -0.26 0.00 -0.96 0.00 0.00 56.93 57.90 1l7x s PHE 285 Cb -0.11 0.58 -0.01 0.00 -0.34 0.00 0.00 43.02 43.14 1l7x s PHE 285 CO 0.79 -0.55 0.86 0.12 -1.46 0.00 0.00 175.22 174.99 1l7x s PHE 286 N 2.33 3.42 -0.26 10.12 5.36 0.26 -4.88 117.98 134.32 1l7x s PHE 286 Ca -0.06 1.30 0.03 0.00 -0.96 0.00 0.00 56.93 57.23 1l7x s PHE 286 Cb -0.10 -3.05 0.06 0.00 -0.34 0.00 0.00 43.02 39.59 1l7x s PHE 286 CO -0.17 -0.26 -0.08 -2.00 -1.46 0.00 0.00 175.22 171.25 1l7x s GLU 287 N 2.25 2.02 -1.17 10.12 2.12 -1.26 -4.97 118.70 127.81 1l7x s GLU 287 Ca 0.40 -1.33 -0.10 0.00 0.36 0.00 0.00 54.97 54.29 1l7x s GLU 287 Cb -0.17 -2.85 -0.07 0.00 0.26 0.00 0.00 34.13 31.30 1l7x s GLU 287 CO 0.12 -0.62 2.35 0.41 -0.54 0.00 0.00 175.26 176.98 1l7x n GLY 288 N 4.46 3.53 3.88 -1.50 0.00 -1.26 -4.92 105.19 109.38 1l7x n GLY 288 Ca -0.12 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.39 1l7x n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l7x s LYS 289 N 3.25 3.72 0.15 1.61 -0.14 -1.26 -5.01 119.74 122.06 1l7x s LYS 289 Ca 0.52 0.10 -0.11 0.00 -1.36 0.00 0.00 55.97 55.12 1l7x s LYS 289 Cb 0.14 -2.86 0.01 0.00 -1.68 0.00 0.00 37.83 33.44 1l7x s LYS 289 CO -0.03 0.47 1.58 1.49 -0.76 0.00 0.00 175.35 178.10 1l7x h GLU 290 N 3.09 0.94 -0.72 1.68 4.81 -1.99 -1.70 114.58 120.69 1l7x h GLU 290 Ca -0.47 -0.35 0.01 0.00 -0.13 0.00 0.00 59.36 58.42 1l7x h GLU 290 Cb 1.18 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.46 1l7x h GLU 290 CO 0.69 1.01 0.48 1.25 -0.73 0.00 0.00 179.01 181.71 1l7x h LEU 291 N 0.80 0.82 -0.35 1.64 5.85 -1.98 0.28 115.31 122.36 1l7x h LEU 291 Ca 0.13 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1l7x h LEU 291 Cb 0.64 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 1l7x h LEU 291 CO 0.04 0.59 0.20 -0.09 -0.34 0.00 0.00 178.44 178.85 1l7x h ARG 292 N 0.97 0.49 -0.80 1.25 9.65 -1.88 0.01 114.38 124.07 1l7x h ARG 292 Ca 0.26 -0.05 0.01 0.00 -1.10 0.00 0.00 59.98 59.10 1l7x h ARG 292 Cb -0.11 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.33 1l7x h ARG 292 CO -0.06 0.39 0.53 1.25 2.80 0.00 0.00 179.97 184.88 1l7x h LEU 293 N 0.45 0.92 -0.88 3.80 5.85 -0.73 -1.06 115.31 123.66 1l7x h LEU 293 Ca 0.13 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 1l7x h LEU 293 Cb 0.04 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1l7x h LEU 293 CO -0.02 0.67 0.25 0.11 -0.34 0.00 0.00 178.44 179.11 1l7x h LYS 294 N 1.09 1.07 -0.23 1.25 1.57 -0.03 -1.14 116.57 120.14 1l7x h LYS 294 Ca 0.29 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 1l7x h LYS 294 Cb -0.12 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.01 1l7x h LYS 294 CO -0.06 0.89 0.07 1.96 -0.57 0.00 0.00 179.45 181.74 1l7x h GLN 295 N 1.04 0.36 -0.42 3.15 4.20 0.05 0.12 115.11 123.61 1l7x h GLN 295 Ca 0.23 -0.08 0.05 0.00 0.06 0.00 0.00 58.65 58.91 1l7x h GLN 295 Cb 0.25 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 1l7x h GLN 295 CO -0.01 0.46 0.15 0.93 -0.67 0.00 0.00 178.83 179.68 1l7x h GLU 296 N 0.20 0.30 -0.39 1.46 5.08 -0.87 -1.39 114.58 118.98 1l7x h GLU 296 Ca 0.07 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 1l7x h GLU 296 Cb 0.25 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1l7x h GLU 296 CO -0.00 0.20 -0.35 -0.92 -1.00 0.00 0.00 179.01 176.94 1l7x h TYR 297 N 0.31 1.06 0.05 4.33 3.20 -1.08 -2.91 116.97 121.93 1l7x h TYR 297 Ca 0.19 -0.30 0.03 0.00 3.14 0.00 0.00 58.73 61.79 1l7x h TYR 297 Cb 0.18 -0.23 -0.05 0.00 1.54 0.00 0.00 36.73 38.17 1l7x h TYR 297 CO -0.15 1.11 -0.40 0.35 -1.64 0.00 0.00 178.16 177.44 1l7x h PHE 298 N 0.74 -1.11 -0.03 -3.82 3.57 -0.13 0.20 116.94 116.35 1l7x h PHE 298 Ca 0.07 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.54 1l7x h PHE 298 Cb 0.93 0.48 -0.01 0.00 2.79 0.00 0.00 35.95 40.14 1l7x h PHE 298 CO 0.06 -0.49 -0.29 -0.24 -2.23 0.00 0.00 178.31 175.12 1l7x h VAL 299 N -0.58 1.22 -0.26 1.41 3.04 -1.33 -2.12 116.25 117.63 1l7x h VAL 299 Ca 0.04 -1.05 -0.14 0.00 -1.01 0.00 0.00 66.70 64.54 1l7x h VAL 299 Cb 0.64 1.52 -0.00 0.00 -2.01 0.00 0.00 31.29 31.44 1l7x h VAL 299 CO -0.27 0.30 -0.39 0.58 -1.01 0.00 0.00 177.57 176.78 1l7x h VAL 300 N 0.05 1.30 -0.08 1.51 2.07 -1.19 -1.64 116.25 118.27 1l7x h VAL 300 Ca 0.01 -1.58 -0.23 0.00 0.82 0.00 0.00 66.70 65.71 1l7x h VAL 300 Cb 0.54 1.69 0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1l7x h VAL 300 CO 0.04 0.50 -0.88 0.00 0.02 0.00 0.00 177.57 177.26 1l7x h ALA 301 N 0.66 0.29 -0.07 1.67 0.00 -0.47 -1.74 119.26 119.60 1l7x h ALA 301 Ca 0.02 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1l7x h ALA 301 Cb 0.98 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1l7x h ALA 301 CO 0.09 0.71 0.00 0.00 0.00 0.00 0.00 179.25 180.04 1l7x h ALA 302 N 0.56 0.10 0.01 0.00 0.00 -1.46 -2.85 119.26 115.63 1l7x h ALA 302 Ca -0.08 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1l7x h ALA 302 Cb 1.51 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1l7x h ALA 302 CO 0.17 -0.22 -0.01 1.15 0.00 0.00 0.00 179.25 180.34 1l7x h THR 303 N -0.15 1.05 -0.71 0.00 2.02 -1.31 -1.81 112.91 111.99 1l7x h THR 303 Ca 0.02 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1l7x h THR 303 Cb 0.34 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 1l7x h THR 303 CO 0.00 0.05 0.41 -0.07 0.37 0.00 0.00 175.52 176.28 1l7x h LEU 304 N -0.09 0.87 -0.64 2.58 3.38 -1.40 0.04 115.31 120.05 1l7x h LEU 304 Ca -0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1l7x h LEU 304 Cb 0.09 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1l7x h LEU 304 CO 0.00 0.69 0.36 1.56 0.09 0.00 0.00 178.44 181.14 1l7x h GLN 305 N 0.97 0.88 -0.49 1.13 4.20 -1.45 0.28 115.11 120.64 1l7x h GLN 305 Ca 0.25 -0.10 -0.13 0.00 0.06 0.00 0.00 58.65 58.74 1l7x h GLN 305 Cb -0.00 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 1l7x h GLN 305 CO -0.04 0.66 -0.18 0.22 -0.67 0.00 0.00 178.83 178.81 1l7x h ASP 306 N 0.87 1.02 -0.48 1.46 3.58 -1.01 -0.01 116.42 121.84 1l7x h ASP 306 Ca 0.23 -0.38 -0.05 0.00 0.42 0.00 0.00 57.03 57.24 1l7x h ASP 306 Cb 0.02 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 1l7x h ASP 306 CO -0.04 1.17 0.11 0.40 -2.88 0.00 0.00 179.24 178.00 1l7x h ILE 307 N 0.86 1.24 -0.54 2.25 2.04 -0.76 -0.79 117.51 121.80 1l7x h ILE 307 Ca 0.12 -0.85 -0.07 0.00 1.00 0.00 0.00 64.86 65.05 1l7x h ILE 307 Cb 0.76 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 1l7x h ILE 307 CO 0.06 0.30 0.04 0.40 0.00 0.00 0.00 178.15 178.95 1l7x h ILE 308 N 0.66 1.25 -0.32 -0.67 2.04 -0.79 -1.32 117.51 118.36 1l7x h ILE 308 Ca 0.15 -1.01 -0.11 0.00 1.00 0.00 0.00 64.86 64.89 1l7x h ILE 308 Cb 0.34 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1l7x h ILE 308 CO 0.00 0.36 -0.25 -0.09 0.00 0.00 0.00 178.15 178.18 1l7x h ARG 309 N 0.83 0.64 -0.32 2.37 2.43 -0.69 -1.99 114.38 117.65 1l7x h ARG 309 Ca 0.16 -0.26 -0.07 0.00 -0.81 0.00 0.00 59.98 59.01 1l7x h ARG 309 Cb 0.44 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1l7x h ARG 309 CO 0.02 0.83 -0.08 -0.09 -1.51 0.00 0.00 179.97 179.13 1l7x h ARG 310 N 0.56 0.62 -0.51 0.20 2.43 -0.83 -2.11 114.38 114.74 1l7x h ARG 310 Ca 0.08 -0.24 0.05 0.00 -0.81 0.00 0.00 59.98 59.06 1l7x h ARG 310 Cb 0.72 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.18 1l7x h ARG 310 CO 0.06 0.80 0.24 0.35 -1.51 0.00 0.00 179.97 179.91 1l7x h PHE 311 N 0.40 0.43 0.00 2.20 3.57 -1.05 -1.90 116.94 120.59 1l7x h PHE 311 Ca 0.08 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.52 1l7x h PHE 311 Cb 0.58 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 1l7x h PHE 311 CO 0.05 0.19 -0.39 0.87 -2.23 0.00 0.00 178.31 176.80 1l7x h LYS 312 N 0.46 0.00 0.00 1.11 1.57 -1.27 -2.90 116.57 115.54 1l7x h LYS 312 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1l7x h LYS 312 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1l7x h LYS 312 CO -0.18 0.39 -0.08 0.00 -0.57 0.00 0.00 179.45 179.01 1l7x h ALA 313 N 1.61 0.95 -3.62 3.86 0.00 -0.84 -3.40 119.26 117.82 1l7x h ALA 313 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1l7x h ALA 313 Cb 0.71 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.52 1l7x h ALA 313 CO 0.05 0.00 0.03 -1.13 0.00 0.00 0.00 179.25 178.20 1l7x n SER 314 N -2.41 0.13 -4.40 0.00 3.41 -0.76 -4.87 113.62 104.72 1l7x n SER 314 Ca 0.05 -1.13 -0.38 0.00 -0.26 0.00 0.00 58.87 57.15 1l7x n SER 314 Cb 0.45 -0.11 -0.02 0.00 -0.26 0.00 0.00 64.21 64.27 1l7x n SER 314 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1l7x n LYS 315 N -1.31 2.52 0.00 4.33 3.00 -1.26 -5.01 118.16 120.42 1l7x n LYS 315 Ca 0.02 -2.83 0.00 0.00 -0.00 0.00 0.00 58.31 55.50 1l7x n LYS 315 Cb 0.08 -3.50 0.00 0.00 0.00 0.00 0.00 35.03 31.61 1l7x n LYS 315 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.40 179.37 1l7x n PHE 316 N 9.96 0.00 0.00 5.64 1.16 -1.25 -5.09 117.46 127.89 1l7x n PHE 316 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 56.06 1l7x n PHE 316 Cb 0.45 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.32 1l7x n PHE 316 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 1l7x n VAL 325 N 0.00 0.00 0.72 1.97 0.31 -1.26 -4.93 118.33 115.14 1l7x n VAL 325 Ca 0.00 0.62 0.09 0.00 -0.01 0.00 0.00 64.34 65.03 1l7x n VAL 325 Cb 0.00 -1.30 0.07 0.00 -0.91 0.00 0.00 33.84 31.70 1l7x n VAL 325 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1l7x n PHE 326 N -0.40 0.00 -0.18 3.52 3.01 -1.26 -4.53 117.46 117.62 1l7x n PHE 326 Ca 0.00 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.62 1l7x n PHE 326 Cb 0.00 0.00 0.50 0.00 -0.01 0.00 0.00 39.48 39.97 1l7x n PHE 326 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1l7x h ASP 327 N 3.28 0.40 0.17 4.37 5.19 -2.01 -0.15 116.42 127.68 1l7x h ASP 327 Ca 0.00 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 1l7x h ASP 327 Cb 0.71 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.16 1l7x h ASP 327 CO 0.00 0.20 -0.16 0.00 -3.12 0.00 0.00 179.24 176.16 1l7x n ALA 328 N -2.52 2.88 -0.05 3.45 0.00 -1.26 -4.42 120.51 118.59 1l7x n ALA 328 Ca 0.15 -0.39 -0.09 0.00 0.00 0.00 0.00 53.44 53.11 1l7x n ALA 328 Cb 0.55 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.80 1l7x n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1l7x h PHE 329 N 1.43 -0.89 0.00 0.00 3.57 -1.31 -0.63 116.94 119.12 1l7x h PHE 329 Ca 0.00 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1l7x h PHE 329 Cb 0.48 0.43 0.00 0.00 2.79 0.00 0.00 35.95 39.64 1l7x h PHE 329 CO 0.00 -0.39 0.00 -1.35 -2.23 0.00 0.00 178.31 174.34 1l7x h PRO 330 N -0.33 0.00 0.00 6.41 0.11 -1.77 0.56 132.00 136.99 1l7x h PRO 330 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1l7x h PRO 330 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1l7x h PRO 330 CO -0.44 0.00 -0.50 -0.25 -0.21 0.00 0.00 178.00 176.61 1l7x n ASP 331 N -3.05 0.56 -0.00 -2.05 8.00 -0.31 -3.92 116.55 115.77 1l7x n ASP 331 Ca -0.02 0.03 0.04 0.00 0.71 0.00 0.00 54.79 55.55 1l7x n ASP 331 Cb 0.14 0.10 -0.06 0.00 -0.02 0.00 0.00 41.12 41.29 1l7x n ASP 331 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1l7x n GLN 332 N -1.82 0.71 -4.51 -1.24 1.13 -0.49 -4.56 117.38 106.60 1l7x n GLN 332 Ca 0.05 -0.06 -0.24 0.00 -1.94 0.00 0.00 57.00 54.80 1l7x n GLN 332 Cb 0.39 -1.14 -0.17 0.00 0.11 0.00 0.00 30.24 29.44 1l7x n GLN 332 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1l7x s VAL 333 N -2.42 1.09 -0.08 5.09 1.01 0.19 -0.38 120.40 124.90 1l7x s VAL 333 Ca -0.02 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.52 1l7x s VAL 333 Cb 0.05 -1.01 0.02 0.00 0.00 0.00 0.00 36.38 35.43 1l7x s VAL 333 CO 0.31 0.35 -0.09 0.00 0.00 0.00 0.00 175.10 175.66 1l7x s ALA 334 N 0.76 1.21 -0.23 5.51 0.00 -0.70 -4.48 121.76 123.82 1l7x s ALA 334 Ca -0.13 -0.42 0.02 0.00 0.00 0.00 0.00 51.96 51.43 1l7x s ALA 334 Cb -0.15 -0.70 0.05 0.00 0.00 0.00 0.00 23.12 22.31 1l7x s ALA 334 CO 0.03 -0.14 -0.14 0.42 0.00 0.00 0.00 175.76 175.93 1l7x s ILE 335 N 1.17 2.17 -0.22 0.00 1.01 -0.12 -0.01 121.20 125.20 1l7x s ILE 335 Ca -0.05 -1.38 -0.22 0.00 0.00 0.00 0.00 60.65 59.00 1l7x s ILE 335 Cb -0.14 -2.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.16 1l7x s ILE 335 CO -0.02 0.17 0.69 -1.58 0.00 0.00 0.00 174.94 174.20 1l7x s GLN 336 N 1.17 4.18 -0.54 2.79 2.00 -0.39 -2.31 119.66 126.56 1l7x s GLN 336 Ca -0.04 0.70 -0.20 0.00 -2.00 0.00 0.00 55.36 53.81 1l7x s GLN 336 Cb -0.18 -3.61 0.06 0.00 0.80 0.00 0.00 33.01 30.08 1l7x s GLN 336 CO -0.08 -0.36 0.73 -0.51 -0.50 0.00 0.00 175.29 174.58 1l7x s LEU 337 N 2.30 4.80 -0.74 3.68 1.43 0.25 -1.95 118.68 128.45 1l7x s LEU 337 Ca 0.30 -0.88 -0.26 0.00 -1.03 0.00 0.00 54.13 52.26 1l7x s LEU 337 Cb -0.16 -2.50 -0.02 0.00 0.03 0.00 0.00 46.19 43.55 1l7x s LEU 337 CO 0.09 -1.05 1.77 0.21 0.23 0.00 0.00 176.35 177.61 1l7x s ASN 338 N 2.95 5.45 0.51 2.29 2.47 -0.97 -2.34 114.94 125.30 1l7x s ASN 338 Ca 0.18 -0.17 0.00 0.00 0.42 0.00 0.00 52.86 53.29 1l7x s ASN 338 Cb -0.18 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.07 1l7x s ASN 338 CO 0.12 -2.34 0.00 -0.67 -3.72 0.00 0.00 177.10 170.49 1l7x n ASP 339 N 12.34 -4.39 0.03 -4.21 -0.08 -0.78 -4.19 116.55 115.27 1l7x n ASP 339 Ca 0.24 0.31 0.14 0.00 -1.51 0.00 0.00 54.79 53.97 1l7x n ASP 339 Cb 0.50 -0.87 0.53 0.00 2.34 0.00 0.00 41.12 43.62 1l7x n ASP 339 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1l7x n THR 340 N -1.85 0.17 -0.34 5.18 -2.24 -1.26 -4.25 114.28 109.68 1l7x n THR 340 Ca 0.00 -0.08 0.23 0.00 -2.27 0.00 0.00 64.05 61.93 1l7x n THR 340 Cb 0.13 -0.48 0.47 0.00 -2.10 0.00 0.00 70.33 68.36 1l7x n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1l7x h HIS 341 N 0.00 0.89 -0.69 4.78 3.86 -1.96 0.49 115.15 122.53 1l7x h HIS 341 Ca 0.00 0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 59.11 1l7x h HIS 341 Cb 0.57 -0.24 -0.08 0.00 1.06 0.00 0.00 27.41 28.72 1l7x h HIS 341 CO 0.00 -0.09 0.17 -0.35 0.86 0.00 0.00 177.93 178.51 1l7x n PRO 342 N -4.93 4.27 -0.34 2.45 -0.04 -1.26 -4.63 135.00 130.52 1l7x n PRO 342 Ca 0.30 -3.14 0.23 0.00 -0.04 0.00 0.00 63.50 60.85 1l7x n PRO 342 Cb 0.95 -2.25 0.49 0.00 -0.04 0.00 0.00 33.50 32.65 1l7x n PRO 342 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1l7x h ALA 343 N 3.27 2.17 0.00 0.55 0.00 -0.27 0.11 119.26 125.10 1l7x h ALA 343 Ca 0.16 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1l7x h ALA 343 Cb 2.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 20.05 1l7x h ALA 343 CO 0.65 -0.62 0.00 1.28 0.00 0.00 0.00 179.25 180.56 1l7x n LEU 344 N -4.70 0.00 0.21 0.00 4.77 -1.26 -1.68 117.00 114.34 1l7x n LEU 344 Ca 0.27 0.49 0.04 0.00 -0.03 0.00 0.00 56.01 56.78 1l7x n LEU 344 Cb 0.90 -0.49 0.45 0.00 -2.33 0.00 0.00 43.42 41.95 1l7x n LEU 344 CO 0.23 -0.49 0.85 0.00 -1.33 0.00 0.00 177.39 176.64 1l7x h ALA 345 N 2.00 1.60 0.65 -1.18 0.00 -1.32 -1.23 119.26 119.78 1l7x h ALA 345 Ca 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1l7x h ALA 345 Cb 0.00 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1l7x h ALA 345 CO 0.00 0.30 -0.31 0.82 0.00 0.00 0.00 179.25 180.06 1l7x h ILE 346 N 0.01 0.14 0.00 0.00 2.04 -1.54 -1.44 117.51 116.71 1l7x h ILE 346 Ca -0.00 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 1l7x h ILE 346 Cb 0.43 0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 1l7x h ILE 346 CO 0.03 0.02 -0.09 1.55 0.00 0.00 0.00 178.15 179.67 1l7x h PRO 347 N -1.15 0.00 -0.28 2.37 0.13 -1.74 -2.32 132.00 129.01 1l7x h PRO 347 Ca -0.09 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.88 1l7x h PRO 347 Cb 0.70 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.83 1l7x h PRO 347 CO 0.15 0.09 -0.47 1.49 -0.23 0.00 0.00 178.00 179.02 1l7x h GLU 348 N 0.00 0.82 -0.53 0.86 4.57 -1.16 0.13 114.58 119.27 1l7x h GLU 348 Ca -0.00 -0.50 -0.12 0.00 -1.18 0.00 0.00 59.36 57.56 1l7x h GLU 348 Cb 0.36 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 1l7x h GLU 348 CO 0.01 1.13 -0.13 1.25 -1.18 0.00 0.00 179.01 180.09 1l7x h LEU 349 N 0.58 1.03 -0.92 1.64 5.85 -0.89 -0.22 115.31 122.37 1l7x h LEU 349 Ca 0.02 -0.35 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 1l7x h LEU 349 Cb 1.07 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 1l7x h LEU 349 CO 0.11 1.15 0.54 0.24 -0.34 0.00 0.00 178.44 180.14 1l7x h MET 350 N 0.90 1.26 -0.08 1.25 2.86 -1.31 0.18 114.93 119.99 1l7x h MET 350 Ca 0.13 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1l7x h MET 350 Cb 0.70 -0.26 -0.00 0.00 0.06 0.00 0.00 31.60 32.10 1l7x h MET 350 CO 0.05 0.89 0.04 -0.09 1.06 0.00 0.00 176.91 178.87 1l7x h ARG 351 N 1.28 0.11 -0.33 1.72 2.43 -0.51 0.71 114.38 119.80 1l7x h ARG 351 Ca 0.33 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 1l7x h ARG 351 Cb -0.03 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1l7x h ARG 351 CO -0.06 0.17 0.16 0.82 -1.51 0.00 0.00 179.97 179.55 1l7x h ILE 352 N 0.03 1.16 -0.26 1.20 2.04 -0.56 0.14 117.51 121.25 1l7x h ILE 352 Ca 0.03 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.44 1l7x h ILE 352 Cb 0.09 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1l7x h ILE 352 CO -0.00 0.16 0.17 -0.26 0.00 0.00 0.00 178.15 178.22 1l7x h PHE 353 N 0.39 0.31 0.00 1.37 0.05 -0.46 0.23 116.94 118.83 1l7x h PHE 353 Ca 0.11 0.01 -0.06 0.00 3.82 0.00 0.00 57.97 61.85 1l7x h PHE 353 Cb 0.12 -0.11 -0.01 0.00 2.00 0.00 0.00 35.95 37.95 1l7x h PHE 353 CO -0.02 0.20 -0.46 0.28 -0.18 0.00 0.00 178.31 178.13 1l7x h VAL 354 N 0.34 0.75 -0.01 -0.55 2.07 -0.80 -0.49 116.25 117.57 1l7x h VAL 354 Ca 0.09 -1.70 -0.17 0.00 0.82 0.00 0.00 66.70 65.75 1l7x h VAL 354 Cb -0.03 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1l7x h VAL 354 CO -0.02 0.25 -0.77 0.44 0.02 0.00 0.00 177.57 177.49 1l7x h ASP 355 N -1.00 0.12 0.00 0.57 3.32 -0.88 -2.98 116.42 115.57 1l7x h ASP 355 Ca -0.10 -0.09 -0.13 0.00 0.02 0.00 0.00 57.03 56.74 1l7x h ASP 355 Cb 0.75 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.25 1l7x h ASP 355 CO -0.06 0.83 -1.34 -0.38 -1.72 0.00 0.00 179.24 176.58 1l7x n ILE 356 N -3.69 1.50 1.71 0.35 2.08 -0.82 -4.57 119.36 115.91 1l7x n ILE 356 Ca -0.02 0.01 0.15 0.00 0.56 0.00 0.00 62.75 63.45 1l7x n ILE 356 Cb 0.73 -2.22 0.85 0.00 -0.75 0.00 0.00 39.64 38.25 1l7x n ILE 356 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1l7x n GLU 357 N -4.43 0.72 -2.17 0.38 -0.58 0.73 -4.93 120.64 110.36 1l7x n GLU 357 Ca -0.24 -0.01 -0.19 0.00 -0.42 0.00 0.00 57.16 56.30 1l7x n GLU 357 Cb 0.59 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.93 1l7x n GLU 357 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1l7x n LYS 358 N -1.13 -1.70 -2.79 3.49 4.76 -0.77 -4.93 118.16 115.09 1l7x n LYS 358 Ca 0.19 0.98 -0.33 0.00 -2.87 0.00 0.00 58.31 56.28 1l7x n LYS 358 Cb 0.18 -5.55 -0.07 0.00 -1.84 0.00 0.00 35.03 27.76 1l7x n LYS 358 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1l7x s LEU 359 N -5.56 3.91 0.71 -0.35 1.43 -0.26 -4.97 118.68 113.59 1l7x s LEU 359 Ca 0.00 1.66 -0.14 0.00 -1.03 0.00 0.00 54.13 54.62 1l7x s LEU 359 Cb 0.00 -4.52 0.03 0.00 0.03 0.00 0.00 46.19 41.72 1l7x s LEU 359 CO 0.00 -0.38 1.13 -2.16 0.23 0.00 0.00 176.35 175.17 1l7x s PRO 360 N -3.26 2.47 0.12 1.29 0.04 -1.26 -4.36 135.00 130.03 1l7x s PRO 360 Ca 0.61 1.45 -0.27 0.00 0.04 0.00 0.00 61.00 62.83 1l7x s PRO 360 Cb -0.09 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.48 1l7x s PRO 360 CO 0.15 -1.52 1.62 2.35 0.04 0.00 0.00 177.00 179.65 1l7x h TRP 361 N -0.33 -0.80 -0.69 0.56 2.91 -1.97 -2.32 115.95 113.32 1l7x h TRP 361 Ca -0.46 0.02 0.14 0.00 1.13 0.00 0.00 58.89 59.72 1l7x h TRP 361 Cb 1.26 0.35 -0.10 0.00 -0.51 0.00 0.00 29.16 30.15 1l7x h TRP 361 CO 0.53 -0.39 0.14 0.66 -1.03 0.00 0.00 178.44 178.35 1l7x h SER 362 N -0.47 -0.03 -0.29 2.65 4.64 -1.99 0.65 113.55 118.70 1l7x h SER 362 Ca 0.05 0.14 -0.04 0.00 -0.47 0.00 0.00 61.79 61.47 1l7x h SER 362 Cb 0.53 0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.81 1l7x h SER 362 CO -0.22 -0.04 0.03 0.50 -0.87 0.00 0.00 176.83 176.24 1l7x h LYS 363 N 0.24 0.49 -0.54 4.77 1.63 -1.90 -2.58 116.57 118.69 1l7x h LYS 363 Ca 0.38 -0.14 -0.05 0.00 -0.85 0.00 0.00 60.65 59.98 1l7x h LYS 363 Cb 0.62 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.18 1l7x h LYS 363 CO -0.49 0.61 0.13 0.00 -3.45 0.00 0.00 179.45 176.25 1l7x h ALA 364 N 0.86 0.71 -0.70 5.00 0.00 -0.82 -1.48 119.26 122.83 1l7x h ALA 364 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1l7x h ALA 364 Cb 0.37 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1l7x h ALA 364 CO 0.01 0.41 0.45 2.35 0.00 0.00 0.00 179.25 182.46 1l7x h TRP 365 N 0.76 0.89 -0.30 0.00 -0.00 -0.86 -0.16 115.95 116.28 1l7x h TRP 365 Ca 0.17 0.01 -0.04 0.00 -0.00 0.00 0.00 58.89 59.03 1l7x h TRP 365 Cb 0.34 -0.30 -0.01 0.00 -0.00 0.00 0.00 29.16 29.19 1l7x h TRP 365 CO 0.02 0.58 0.03 1.49 -0.00 0.00 0.00 178.44 180.56 1l7x h GLU 366 N 0.95 0.51 -0.63 2.65 4.81 -1.05 -2.21 114.58 119.62 1l7x h GLU 366 Ca 0.25 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 1l7x h GLU 366 Cb -0.08 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 1l7x h GLU 366 CO -0.05 0.63 0.22 -0.07 -0.73 0.00 0.00 179.01 179.01 1l7x h LEU 367 N 0.32 0.87 0.50 1.64 3.38 -0.70 -2.90 115.31 118.43 1l7x h LEU 367 Ca 0.09 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1l7x h LEU 367 Cb 0.38 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1l7x h LEU 367 CO 0.01 0.81 -0.24 0.74 0.09 0.00 0.00 178.44 179.84 1l7x h THR 368 N 0.92 0.49 -0.44 0.22 2.02 -0.85 -1.86 112.91 113.41 1l7x h THR 368 Ca 0.21 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.25 1l7x h THR 368 Cb 0.23 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 1l7x h THR 368 CO -0.01 0.03 0.29 1.56 0.37 0.00 0.00 175.52 177.75 1l7x h GLN 369 N -0.76 0.58 0.00 6.66 4.20 -1.41 -1.06 115.11 123.31 1l7x h GLN 369 Ca -0.07 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.50 1l7x h GLN 369 Cb 0.56 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 1l7x h GLN 369 CO 0.11 0.38 -0.53 0.87 -0.67 0.00 0.00 178.83 179.00 1l7x h LYS 370 N 0.59 0.00 0.18 1.46 1.57 -1.41 -2.08 116.57 116.88 1l7x h LYS 370 Ca 0.16 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.66 1l7x h LYS 370 Cb -0.07 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.28 1l7x h LYS 370 CO -0.04 0.53 -1.20 1.15 -0.57 0.00 0.00 179.45 179.32 1l7x h THR 371 N 0.00 1.35 -3.38 -0.16 2.02 -0.38 -3.47 112.91 108.89 1l7x h THR 371 Ca -0.01 -2.55 -0.55 0.00 0.77 0.00 0.00 66.41 64.07 1l7x h THR 371 Cb 1.00 2.96 -0.03 0.00 -1.74 0.00 0.00 68.15 70.34 1l7x h THR 371 CO 0.07 0.76 -0.15 -0.36 0.37 0.00 0.00 175.52 176.20 1l7x s PHE 372 N -2.70 3.44 -0.04 3.16 0.40 -0.55 -0.94 117.98 120.75 1l7x s PHE 372 Ca -0.11 0.81 -0.04 0.00 -0.60 0.00 0.00 56.93 57.00 1l7x s PHE 372 Cb 0.04 -2.21 0.01 0.00 0.51 0.00 0.00 43.02 41.37 1l7x s PHE 372 CO 0.91 0.31 0.10 0.00 0.70 0.00 0.00 175.22 177.24 1l7x s ALA 373 N -1.78 -0.25 -0.07 5.36 0.00 -0.98 -2.01 121.76 122.04 1l7x s ALA 373 Ca 0.46 0.29 0.05 0.00 0.00 0.00 0.00 51.96 52.76 1l7x s ALA 373 Cb -0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 1l7x s ALA 373 CO 0.22 -0.05 -0.22 -0.47 0.00 0.00 0.00 175.76 175.24 1l7x s TYR 374 N 0.06 2.53 -0.27 0.00 5.04 -0.14 -0.58 117.35 124.00 1l7x s TYR 374 Ca -0.00 -0.67 -0.03 0.00 -2.44 0.00 0.00 57.07 53.93 1l7x s TYR 374 Cb -0.01 -1.65 0.03 0.00 0.35 0.00 0.00 41.96 40.68 1l7x s TYR 374 CO 0.00 -0.19 -0.02 0.99 -1.34 0.00 0.00 175.55 174.99 1l7x s THR 375 N -0.12 3.11 -0.03 4.34 2.01 -0.99 -1.26 115.64 122.71 1l7x s THR 375 Ca -0.04 -1.01 -0.28 0.00 0.31 0.00 0.00 61.69 60.67 1l7x s THR 375 Cb -0.14 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 1l7x s THR 375 CO 0.04 0.13 0.92 0.21 -0.69 0.00 0.00 174.62 175.23 1l7x s ASN 376 N 1.35 7.26 0.00 3.53 3.84 0.78 -1.86 114.94 129.84 1l7x s ASN 376 Ca -0.00 1.53 0.08 0.00 0.21 0.00 0.00 52.86 54.67 1l7x s ASN 376 Cb -0.17 -2.53 0.18 0.00 -0.55 0.00 0.00 41.25 38.17 1l7x s ASN 376 CO -0.03 -0.25 1.07 1.41 -2.79 0.00 0.00 177.10 176.51 1l7x n HIS 377 N 4.03 0.24 -3.63 0.43 8.25 -1.26 -4.11 115.22 119.17 1l7x n HIS 377 Ca 0.05 -0.38 -0.04 0.00 -0.26 0.00 0.00 57.72 57.09 1l7x n HIS 377 Cb 0.51 -0.03 -0.04 0.00 1.12 0.00 0.00 29.99 31.55 1l7x n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1l7x s THR 378 N -0.91 0.00 -0.31 1.59 -1.32 -1.26 -4.72 115.64 108.71 1l7x s THR 378 Ca 0.14 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.65 1l7x s THR 378 Cb 0.08 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.11 1l7x s THR 378 CO 0.11 0.00 0.77 1.33 -2.21 0.00 0.00 174.62 174.62 1l7x n VAL 379 N 0.57 0.38 -2.02 5.08 0.24 -1.26 -4.97 118.33 116.36 1l7x n VAL 379 Ca -0.02 -0.69 -0.42 0.00 -2.04 0.00 0.00 64.34 61.16 1l7x n VAL 379 Cb 0.59 0.85 -0.03 0.00 -1.47 0.00 0.00 33.84 33.78 1l7x n VAL 379 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1l7x s LEU 380 N -0.53 4.17 0.35 1.34 1.43 -1.26 -4.89 118.68 119.29 1l7x s LEU 380 Ca 0.04 2.06 0.14 0.00 -1.03 0.00 0.00 54.13 55.34 1l7x s LEU 380 Cb 0.03 -3.53 1.00 0.00 0.03 0.00 0.00 46.19 43.71 1l7x s LEU 380 CO 0.04 -1.05 1.73 -0.65 0.23 0.00 0.00 176.35 176.64 1l7x h PRO 381 N 10.08 0.46 0.00 1.29 0.11 -1.97 0.21 132.00 142.18 1l7x h PRO 381 Ca -0.38 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1l7x h PRO 381 Cb 1.17 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1l7x h PRO 381 CO 0.97 0.30 0.00 -0.85 -0.21 0.00 0.00 178.00 178.21 1l7x n GLU 382 N -4.82 0.04 0.00 1.05 0.00 -1.26 -2.59 120.64 113.06 1l7x n GLU 382 Ca 0.28 0.24 0.10 0.00 0.00 0.00 0.00 57.16 57.78 1l7x n GLU 382 Cb 0.84 -1.58 -0.06 0.00 0.00 0.00 0.00 31.44 30.64 1l7x n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1l7x n ALA 383 N -1.56 4.22 -2.40 -1.84 0.00 0.73 -0.57 120.51 119.08 1l7x n ALA 383 Ca 0.04 -0.62 -0.43 0.00 0.00 0.00 0.00 53.44 52.43 1l7x n ALA 383 Cb 0.22 -0.78 -0.02 0.00 0.00 0.00 0.00 19.45 18.86 1l7x n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1l7x s LEU 384 N -2.76 4.23 -0.15 0.00 1.43 -1.07 -4.29 118.68 116.07 1l7x s LEU 384 Ca 0.13 1.79 -0.29 0.00 -1.03 0.00 0.00 54.13 54.73 1l7x s LEU 384 Cb 0.17 -3.55 -0.02 0.00 0.03 0.00 0.00 46.19 42.83 1l7x s LEU 384 CO 0.73 -0.70 1.23 -1.61 0.23 0.00 0.00 176.35 176.24 1l7x s GLU 385 N 2.95 4.26 -0.36 1.70 2.02 -1.26 -4.78 118.70 123.23 1l7x s GLU 385 Ca 0.57 1.64 -0.00 0.00 0.02 0.00 0.00 54.97 57.20 1l7x s GLU 385 Cb -0.24 -3.71 0.13 0.00 0.10 0.00 0.00 34.13 30.41 1l7x s GLU 385 CO 0.19 -0.64 0.20 1.03 0.02 0.00 0.00 175.26 176.05 1l7x s ARG 386 N 3.19 0.67 0.18 1.61 0.52 -1.26 -2.90 118.95 120.96 1l7x s ARG 386 Ca 0.54 -1.34 -0.30 0.00 -0.52 0.00 0.00 55.73 54.11 1l7x s ARG 386 Cb -0.22 -1.56 -0.07 0.00 0.52 0.00 0.00 34.95 33.62 1l7x s ARG 386 CO 0.16 -1.16 0.97 -1.58 0.02 0.00 0.00 175.30 173.71 1l7x s TRP 387 N 1.10 3.85 0.15 -0.53 0.52 -0.99 -4.62 118.94 118.43 1l7x s TRP 387 Ca 0.16 1.82 -0.31 0.00 0.02 0.00 0.00 56.10 57.79 1l7x s TRP 387 Cb -0.22 -3.06 -0.09 0.00 -1.15 0.00 0.00 33.47 28.95 1l7x s TRP 387 CO -0.06 0.19 1.48 -2.14 0.02 0.00 0.00 176.95 176.44 1l7x s PRO 388 N -0.59 4.27 0.51 4.98 0.02 -1.26 0.13 135.00 143.05 1l7x s PRO 388 Ca 0.45 2.23 0.23 0.00 0.02 0.00 0.00 61.00 63.92 1l7x s PRO 388 Cb -0.25 -3.19 1.32 0.00 0.02 0.00 0.00 34.50 32.39 1l7x s PRO 388 CO 0.32 -0.52 2.00 -0.39 -0.33 0.00 0.00 177.00 178.08 1l7x h VAL 389 N 4.09 0.78 -0.23 3.83 -1.51 -1.37 -2.01 116.25 119.83 1l7x h VAL 389 Ca -0.43 -0.03 -0.04 0.00 -1.23 0.00 0.00 66.70 64.98 1l7x h VAL 389 Cb 1.21 0.70 -0.01 0.00 -2.13 0.00 0.00 31.29 31.06 1l7x h VAL 389 CO 0.88 0.01 -0.03 0.44 -1.23 0.00 0.00 177.57 177.65 1l7x h ASP 390 N 0.07 0.42 -0.66 4.19 3.45 -1.90 0.15 116.42 122.14 1l7x h ASP 390 Ca 0.24 -0.34 0.01 0.00 0.43 0.00 0.00 57.03 57.38 1l7x h ASP 390 Cb 0.87 -0.11 -0.04 0.00 -0.56 0.00 0.00 39.33 39.49 1l7x h ASP 390 CO -0.02 0.66 0.43 0.25 -1.57 0.00 0.00 179.24 178.99 1l7x h LEU 391 N 0.18 0.73 -0.25 1.55 5.85 -1.76 -1.77 115.31 119.83 1l7x h LEU 391 Ca 0.06 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1l7x h LEU 391 Cb 0.46 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1l7x h LEU 391 CO 0.02 0.52 -0.02 0.58 -0.34 0.00 0.00 178.44 179.20 1l7x h VAL 392 N 0.86 1.27 -0.86 1.05 2.07 -1.41 -1.62 116.25 117.62 1l7x h VAL 392 Ca 0.25 -0.97 0.07 0.00 0.82 0.00 0.00 66.70 66.87 1l7x h VAL 392 Cb -0.07 1.39 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 1l7x h VAL 392 CO -0.07 0.30 0.52 -0.08 0.02 0.00 0.00 177.57 178.27 1l7x h GLU 393 N 0.23 0.89 -0.38 1.57 4.81 -0.62 0.96 114.58 122.04 1l7x h GLU 393 Ca 0.07 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.11 1l7x h GLU 393 Cb 0.46 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1l7x h GLU 393 CO 0.02 0.59 -0.29 -0.22 -0.73 0.00 0.00 179.01 178.38 1l7x h LYS 394 N 0.92 0.87 0.12 1.92 3.64 -1.25 -2.62 116.57 120.17 1l7x h LYS 394 Ca 0.39 -0.42 -0.30 0.00 -1.27 0.00 0.00 60.65 59.04 1l7x h LYS 394 Cb 0.25 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1l7x h LYS 394 CO -0.20 1.07 -1.56 1.25 -2.27 0.00 0.00 179.45 177.74 1l7x h LEU 395 N 0.67 0.41 -5.77 5.20 5.85 -0.74 -3.38 115.31 117.55 1l7x h LEU 395 Ca 0.07 -0.87 -0.54 0.00 0.84 0.00 0.00 57.88 57.38 1l7x h LEU 395 Cb 0.87 -0.13 -0.41 0.00 0.37 0.00 0.00 40.66 41.36 1l7x h LEU 395 CO 0.08 1.68 -0.93 0.18 -0.34 0.00 0.00 178.44 179.11 1l7x n LEU 396 N -3.82 2.33 -0.28 2.25 4.77 0.33 -0.04 117.00 122.53 1l7x n LEU 396 Ca -0.26 -5.25 0.08 0.00 -0.03 0.00 0.00 56.01 50.54 1l7x n LEU 396 Cb 0.94 0.12 0.23 0.00 -2.33 0.00 0.00 43.42 42.39 1l7x n LEU 396 CO 0.42 2.26 1.02 1.55 -1.33 0.00 0.00 177.39 181.31 1l7x h PRO 397 N 3.23 0.40 -0.32 3.23 0.13 -1.45 -1.20 132.00 136.01 1l7x h PRO 397 Ca 0.12 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 65.16 1l7x h PRO 397 Cb 0.76 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.79 1l7x h PRO 397 CO 0.64 0.26 -0.06 -0.09 -0.23 0.00 0.00 178.00 178.53 1l7x h ARG 398 N 0.41 0.52 -0.01 0.86 9.65 -1.91 -2.69 114.38 121.21 1l7x h ARG 398 Ca 0.47 -0.13 -0.13 0.00 -1.10 0.00 0.00 59.98 59.09 1l7x h ARG 398 Cb 0.79 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.29 1l7x h ARG 398 CO -0.47 0.59 -0.59 0.45 2.80 0.00 0.00 179.97 182.76 1l7x h HIS 399 N 0.49 0.06 -0.22 2.20 3.86 -1.62 -2.41 115.15 117.51 1l7x h HIS 399 Ca 0.10 -0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.15 1l7x h HIS 399 Cb 0.41 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 1l7x h HIS 399 CO 0.01 0.62 -0.44 1.25 0.86 0.00 0.00 177.93 180.24 1l7x h LEU 400 N 0.03 0.57 -0.41 2.43 5.85 -1.08 -0.61 115.31 122.09 1l7x h LEU 400 Ca -0.01 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.40 1l7x h LEU 400 Cb 1.05 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 1l7x h LEU 400 CO 0.08 0.93 0.04 -0.33 -0.34 0.00 0.00 178.44 178.82 1l7x h GLU 401 N 0.43 0.70 -0.44 1.25 5.08 -1.29 -1.08 114.58 119.22 1l7x h GLU 401 Ca 0.03 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.10 1l7x h GLU 401 Cb 0.94 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1l7x h GLU 401 CO 0.08 0.75 -0.10 0.82 -1.00 0.00 0.00 179.01 179.57 1l7x h ILE 402 N 0.54 1.26 -0.58 3.13 2.04 -1.30 -1.16 117.51 121.44 1l7x h ILE 402 Ca 0.12 -1.16 -0.08 0.00 1.00 0.00 0.00 64.86 64.74 1l7x h ILE 402 Cb 0.41 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1l7x h ILE 402 CO 0.01 0.40 0.03 0.40 0.00 0.00 0.00 178.15 178.99 1l7x h ILE 403 N 0.72 1.26 0.12 -0.67 2.04 -0.90 -1.14 117.51 118.95 1l7x h ILE 403 Ca 0.12 -1.09 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 1l7x h ILE 403 Cb 0.58 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1l7x h ILE 403 CO 0.04 0.39 -0.08 1.88 0.00 0.00 0.00 178.15 180.38 1l7x h TYR 404 N 0.89 -0.21 -0.61 1.37 0.05 -0.90 -1.11 116.97 116.44 1l7x h TYR 404 Ca 0.17 -0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.98 1l7x h TYR 404 Cb 0.51 0.08 -0.03 0.00 1.01 0.00 0.00 36.73 38.29 1l7x h TYR 404 CO 0.04 -0.13 0.40 1.49 -1.05 0.00 0.00 178.16 178.91 1l7x h GLU 405 N -0.21 0.68 -0.46 4.88 4.57 -1.02 0.41 114.58 123.42 1l7x h GLU 405 Ca -0.01 -0.04 -0.13 0.00 -1.18 0.00 0.00 59.36 58.00 1l7x h GLU 405 Cb 0.18 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 1l7x h GLU 405 CO 0.00 0.45 -0.24 0.82 -1.18 0.00 0.00 179.01 178.86 1l7x h ILE 406 N 0.70 1.27 -0.42 2.32 2.04 -0.95 -1.73 117.51 120.74 1l7x h ILE 406 Ca 0.25 -1.40 -0.06 0.00 1.00 0.00 0.00 64.86 64.64 1l7x h ILE 406 Cb 0.11 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 1l7x h ILE 406 CO -0.07 0.48 0.02 -1.13 0.00 0.00 0.00 178.15 177.46 1l7x h ASN 407 N 0.83 0.70 0.16 1.72 -1.24 0.29 0.58 115.58 118.62 1l7x h ASN 407 Ca 0.10 -0.29 0.01 0.00 0.71 0.00 0.00 56.30 56.83 1l7x h ASN 407 Cb 0.81 -0.19 -0.02 0.00 0.73 0.00 0.00 38.32 39.66 1l7x h ASN 407 CO 0.07 0.82 -0.20 -0.61 -1.29 0.00 0.00 177.43 176.22 1l7x h GLN 408 N 0.56 -0.39 0.05 6.67 5.75 -0.14 0.21 115.11 127.83 1l7x h GLN 408 Ca 0.12 0.03 0.02 0.00 -0.15 0.00 0.00 58.65 58.67 1l7x h GLN 408 Cb 0.45 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.05 1l7x h GLN 408 CO 0.02 -0.26 -0.20 0.87 -2.65 0.00 0.00 178.83 176.60 1l7x h LYS 409 N -0.40 -0.34 -0.47 1.69 1.79 -1.23 -0.73 116.57 116.88 1l7x h LYS 409 Ca 0.01 0.02 0.10 0.00 -2.18 0.00 0.00 60.65 58.60 1l7x h LYS 409 Cb 0.40 0.08 -0.09 0.00 -1.58 0.00 0.00 32.23 31.03 1l7x h LYS 409 CO -0.07 -0.23 -0.13 1.25 -1.08 0.00 0.00 179.45 179.19 1l7x h HIS 410 N -0.35 -0.29 -0.03 -1.35 2.76 -0.52 -1.92 115.15 113.45 1l7x h HIS 410 Ca 0.04 0.04 -0.12 0.00 -2.20 0.00 0.00 60.37 58.14 1l7x h HIS 410 Cb 0.40 0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.55 1l7x h HIS 410 CO -0.23 -0.22 -0.54 -0.07 -1.30 0.00 0.00 177.93 175.57 1l7x h LEU 411 N -0.02 0.09 -1.72 0.26 3.38 -0.36 -2.66 115.31 114.28 1l7x h LEU 411 Ca 0.23 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 1l7x h LEU 411 Cb 0.36 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1l7x h LEU 411 CO -0.50 0.61 0.01 0.44 0.09 0.00 0.00 178.44 179.10 1l7x h ASP 412 N 0.06 0.16 -0.16 -0.43 3.32 -0.36 -0.60 116.42 118.41 1l7x h ASP 412 Ca -0.00 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.93 1l7x h ASP 412 Cb 0.98 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1l7x h ASP 412 CO 0.07 0.19 -0.29 -0.09 -1.72 0.00 0.00 179.24 177.40 1l7x h ARG 413 N 0.18 0.49 0.06 3.56 9.65 -1.11 -2.27 114.38 124.93 1l7x h ARG 413 Ca 0.05 -0.31 -0.00 0.00 -1.10 0.00 0.00 59.98 58.61 1l7x h ARG 413 Cb 0.12 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.73 1l7x h ARG 413 CO 0.00 0.91 -0.03 0.82 2.80 0.00 0.00 179.97 184.47 1l7x h ILE 414 N 0.12 0.95 -0.54 1.20 1.08 -1.15 -1.49 117.51 117.68 1l7x h ILE 414 Ca 0.01 -0.01 0.10 0.00 -0.39 0.00 0.00 64.86 64.57 1l7x h ILE 414 Cb 0.88 0.96 -0.08 0.00 -3.07 0.00 0.00 36.82 35.51 1l7x h ILE 414 CO 0.07 0.00 0.08 0.58 -0.69 0.00 0.00 178.15 178.19 1l7x h VAL 415 N -0.08 0.65 0.00 1.67 2.07 -1.17 0.41 116.25 119.80 1l7x h VAL 415 Ca -0.01 -0.07 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 1l7x h VAL 415 Cb 0.06 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 1l7x h VAL 415 CO 0.01 0.04 -0.18 0.00 0.02 0.00 0.00 177.57 177.46 1l7x h ALA 416 N 1.45 1.61 0.00 1.67 0.00 -1.06 -1.93 119.26 120.99 1l7x h ALA 416 Ca 0.28 -0.16 -0.24 0.00 0.00 0.00 0.00 54.91 54.79 1l7x h ALA 416 Cb 0.41 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1l7x h ALA 416 CO -0.39 0.23 -1.55 -0.07 0.00 0.00 0.00 179.25 177.46 1l7x h LEU 417 N 0.00 0.00 -6.27 0.00 3.38 -0.09 -3.42 115.31 108.92 1l7x h LEU 417 Ca -0.00 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 1l7x h LEU 417 Cb 0.34 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.70 1l7x h LEU 417 CO 0.02 0.84 -0.98 0.49 0.09 0.00 0.00 178.44 178.90 1l7x n PHE 418 N -3.00 -0.20 -0.33 1.13 3.01 0.13 -5.00 117.46 113.20 1l7x n PHE 418 Ca -0.13 -3.51 0.20 0.00 1.01 0.00 0.00 57.45 55.01 1l7x n PHE 418 Cb 0.96 -0.07 0.41 0.00 -0.01 0.00 0.00 39.48 40.78 1l7x n PHE 418 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1l7x h PRO 419 N 4.92 0.38 0.00 -1.08 0.11 -1.59 -3.32 132.00 131.43 1l7x h PRO 419 Ca 0.18 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1l7x h PRO 419 Cb 0.87 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1l7x h PRO 419 CO 0.45 0.25 0.00 1.63 -0.21 0.00 0.00 178.00 180.13 1l7x n LYS 420 N -5.02 0.00 -0.98 1.05 4.01 -1.26 -4.81 118.16 111.15 1l7x n LYS 420 Ca 0.28 0.00 -0.24 0.00 -0.51 0.00 0.00 58.31 57.85 1l7x n LYS 420 Cb 0.85 -0.52 -0.11 0.00 -0.51 0.00 0.00 35.03 34.73 1l7x n LYS 420 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1l7x n ASP 421 N -0.49 -0.10 0.10 4.39 4.64 -1.25 -4.74 116.55 119.10 1l7x n ASP 421 Ca 0.00 -0.00 0.05 0.00 -1.38 0.00 0.00 54.79 53.45 1l7x n ASP 421 Cb 0.00 -0.54 -0.00 0.00 -1.04 0.00 0.00 41.12 39.54 1l7x n ASP 421 CO 0.00 0.00 0.00 -0.37 -0.82 0.00 0.00 177.20 176.01 1l7x h VAL 422 N 5.06 0.43 -0.35 5.18 -1.51 -1.87 -3.33 116.25 119.87 1l7x h VAL 422 Ca -0.02 -1.71 -0.10 0.00 -1.23 0.00 0.00 66.70 63.64 1l7x h VAL 422 Cb 0.83 2.02 -0.01 0.00 -2.13 0.00 0.00 31.29 31.99 1l7x h VAL 422 CO 0.95 0.24 -0.21 -0.78 -1.23 0.00 0.00 177.57 176.54 1l7x h ASP 423 N 0.00 0.67 -0.56 4.19 -0.00 -1.99 -2.73 116.42 115.99 1l7x h ASP 423 Ca -0.06 -0.23 0.10 0.00 -0.00 0.00 0.00 57.03 56.84 1l7x h ASP 423 Cb 1.33 -0.18 -0.03 0.00 -0.00 0.00 0.00 39.33 40.44 1l7x h ASP 423 CO 0.04 0.87 0.38 -0.09 -0.00 0.00 0.00 179.24 180.44 1l7x h ARG 424 N 0.59 0.35 -0.36 0.28 2.43 -1.96 0.37 114.38 116.08 1l7x h ARG 424 Ca 0.09 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1l7x h ARG 424 Cb 0.68 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.13 1l7x h ARG 424 CO 0.05 0.23 0.16 -0.07 -1.51 0.00 0.00 179.97 178.83 1l7x h LEU 425 N 0.36 0.49 -0.90 3.80 3.38 -1.67 -0.66 115.31 120.11 1l7x h LEU 425 Ca 0.26 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 1l7x h LEU 425 Cb 0.55 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1l7x h LEU 425 CO -0.07 0.50 0.27 -0.09 0.09 0.00 0.00 178.44 179.14 1l7x h ARG 426 N 0.44 1.07 0.00 1.13 2.43 -0.99 -0.81 114.38 117.66 1l7x h ARG 426 Ca 0.12 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1l7x h ARG 426 Cb 0.15 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1l7x h ARG 426 CO -0.01 0.89 0.00 0.00 -1.51 0.00 0.00 179.97 179.33 1l7x h ARG 427 N 1.05 0.00 -0.01 0.20 3.08 -0.99 -3.30 114.38 114.40 1l7x h ARG 427 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1l7x h ARG 427 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1l7x h ARG 427 CO -0.02 0.00 -0.28 -1.33 -1.07 0.00 0.00 179.97 177.28 1l7x n MET 428 N -2.72 1.95 -2.46 0.04 2.81 -0.27 -5.02 117.12 111.44 1l7x n MET 428 Ca 0.04 -0.66 -0.37 0.00 -1.81 0.00 0.00 57.70 54.90 1l7x n MET 428 Cb 0.46 -1.16 -0.03 0.00 -0.71 0.00 0.00 33.22 31.77 1l7x n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1l7x s SER 429 N -1.62 6.72 0.42 7.83 0.15 -0.34 -4.93 113.70 121.93 1l7x s SER 429 Ca 0.10 2.15 0.28 0.00 0.70 0.00 0.00 55.95 59.19 1l7x s SER 429 Cb 0.10 -2.60 1.01 0.00 -1.71 0.00 0.00 66.02 62.83 1l7x s SER 429 CO 0.33 -0.52 1.82 -0.07 1.20 0.00 0.00 173.24 176.00 1l7x h LEU 430 N 2.65 0.00 -9.23 3.45 4.07 -1.90 -3.44 115.31 110.91 1l7x h LEU 430 Ca -0.48 0.00 -0.64 0.00 0.08 0.00 0.00 57.88 56.84 1l7x h LEU 430 Cb 1.22 0.00 -0.14 0.00 1.08 0.00 0.00 40.66 42.82 1l7x h LEU 430 CO 0.63 0.00 -0.56 -0.63 -1.08 0.00 0.00 178.44 176.79 1l7x s ILE 431 N -3.43 4.78 -0.22 1.22 -1.09 -1.26 0.30 121.20 121.50 1l7x s ILE 431 Ca 0.04 -0.05 -0.07 0.00 -2.23 0.00 0.00 60.65 58.34 1l7x s ILE 431 Cb 0.09 -3.11 -0.03 0.00 -1.58 0.00 0.00 42.46 37.82 1l7x s ILE 431 CO 0.54 0.52 0.06 -1.61 -1.23 0.00 0.00 174.94 173.22 1l7x s GLU 432 N -0.17 3.79 -0.09 2.79 2.02 0.31 -4.94 118.70 122.42 1l7x s GLU 432 Ca 0.07 -0.42 -0.05 0.00 0.02 0.00 0.00 54.97 54.58 1l7x s GLU 432 Cb -0.12 -3.26 -0.27 0.00 0.10 0.00 0.00 34.13 30.58 1l7x s GLU 432 CO 0.01 0.03 0.50 0.93 0.02 0.00 0.00 175.26 176.76 1l7x h GLU 433 N 7.50 0.27 -4.48 1.61 4.39 -1.88 -1.76 114.58 120.23 1l7x h GLU 433 Ca -0.37 -0.46 -0.52 0.00 0.34 0.00 0.00 59.36 58.35 1l7x h GLU 433 Cb 1.18 0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 29.95 1l7x h GLU 433 CO 0.63 1.16 1.23 0.39 -1.16 0.00 0.00 179.01 181.26 1l7x n GLU 434 N -3.46 0.00 0.00 2.33 4.71 -1.26 -4.18 120.64 118.78 1l7x n GLU 434 Ca -0.28 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 56.87 1l7x n GLU 434 Cb 1.05 -1.21 0.00 0.00 -1.01 0.00 0.00 31.44 30.27 1l7x n GLU 434 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1l7x n GLY 435 N 5.69 2.54 3.67 0.62 0.00 -1.26 -4.64 105.19 111.81 1l7x n GLY 435 Ca 0.49 -0.25 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1l7x n GLY 435 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1l7x s SER 436 N -4.00 6.87 0.23 1.61 1.04 -1.26 -5.00 113.70 113.18 1l7x s SER 436 Ca 0.00 1.07 -0.32 0.00 0.48 0.00 0.00 55.95 57.18 1l7x s SER 436 Cb 0.00 -2.41 -0.12 0.00 0.10 0.00 0.00 66.02 63.59 1l7x s SER 436 CO 0.00 -0.32 1.69 -0.54 0.98 0.00 0.00 173.24 175.05 1l7x s LYS 437 N 1.88 4.12 0.21 4.02 1.02 -1.26 -4.83 119.74 124.91 1l7x s LYS 437 Ca 0.35 2.60 0.04 0.00 0.02 0.00 0.00 55.97 58.98 1l7x s LYS 437 Cb -0.16 -3.06 -0.05 0.00 -0.52 0.00 0.00 37.83 34.03 1l7x s LYS 437 CO 0.13 -0.72 -0.03 1.03 -0.92 0.00 0.00 175.35 174.83 1l7x s ARG 438 N 0.80 1.29 -0.17 1.68 0.52 -0.66 -0.99 118.95 121.42 1l7x s ARG 438 Ca 0.72 -1.63 -0.06 0.00 -0.52 0.00 0.00 55.73 54.24 1l7x s ARG 438 Cb -0.49 -0.67 -0.03 0.00 0.52 0.00 0.00 34.95 34.28 1l7x s ARG 438 CO 0.36 -0.04 0.02 0.42 0.02 0.00 0.00 175.30 176.08 1l7x s ILE 439 N -3.36 4.41 -0.89 1.52 1.01 0.34 -0.53 121.20 123.71 1l7x s ILE 439 Ca 0.26 -0.17 -0.19 0.00 0.00 0.00 0.00 60.65 60.55 1l7x s ILE 439 Cb 0.05 -2.97 0.13 0.00 0.01 0.00 0.00 42.46 39.68 1l7x s ILE 439 CO 0.07 0.47 1.07 0.21 0.00 0.00 0.00 174.94 176.76 1l7x s ASN 440 N 0.39 6.58 0.57 3.58 3.84 0.15 -2.34 114.94 127.72 1l7x s ASN 440 Ca 0.00 -1.97 0.28 0.00 0.21 0.00 0.00 52.86 51.37 1l7x s ASN 440 Cb -0.13 -2.38 1.53 0.00 -0.55 0.00 0.00 41.25 39.72 1l7x s ASN 440 CO 0.01 -1.07 2.01 0.24 -2.79 0.00 0.00 177.10 175.51 1l7x h MET 441 N 8.84 0.00 -0.20 0.43 2.86 -1.82 -1.34 114.93 123.70 1l7x h MET 441 Ca 0.10 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 1l7x h MET 441 Cb 1.03 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.68 1l7x h MET 441 CO 1.09 0.00 0.09 0.00 1.06 0.00 0.00 176.91 179.15 1l7x h ALA 442 N 1.67 0.26 -0.81 6.32 0.00 -1.90 -2.37 119.26 122.43 1l7x h ALA 442 Ca 0.16 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1l7x h ALA 442 Cb 0.82 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1l7x h ALA 442 CO -0.00 -0.15 0.37 0.45 0.00 0.00 0.00 179.25 179.92 1l7x h HIS 443 N 0.18 1.18 -0.83 0.00 3.86 -1.62 -2.05 115.15 115.87 1l7x h HIS 443 Ca 0.07 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1l7x h HIS 443 Cb 0.16 -0.36 -0.04 0.00 1.06 0.00 0.00 27.41 28.23 1l7x h HIS 443 CO -0.01 0.86 0.49 1.25 0.86 0.00 0.00 177.93 181.37 1l7x h LEU 444 N 1.16 1.00 -0.71 2.43 5.85 -1.40 -2.15 115.31 121.49 1l7x h LEU 444 Ca 0.28 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 1l7x h LEU 444 Cb 0.14 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 1l7x h LEU 444 CO -0.03 0.78 0.25 0.00 -0.34 0.00 0.00 178.44 179.11 1l7x h ILE 446 N 1.03 0.86 -0.09 0.00 2.04 -0.95 -1.08 117.51 119.32 1l7x h ILE 446 Ca 0.23 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.65 1l7x h ILE 446 Cb 0.26 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1l7x h ILE 446 CO -0.01 0.08 -0.30 -0.37 0.00 0.00 0.00 178.15 177.55 1l7x h VAL 447 N -0.46 1.25 -0.00 1.67 -1.51 -1.39 -2.56 116.25 113.25 1l7x h VAL 447 Ca -0.03 -1.19 0.00 0.00 -1.23 0.00 0.00 66.70 64.25 1l7x h VAL 447 Cb 0.35 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.03 1l7x h VAL 447 CO 0.05 0.35 -0.05 0.61 -1.23 0.00 0.00 177.57 177.30 1l7x n GLY 448 N -0.51 -0.89 3.43 5.19 0.00 -0.39 -4.88 105.19 107.15 1l7x n GLY 448 Ca -0.01 -0.25 -0.26 0.00 0.00 0.00 0.00 46.02 45.49 1l7x n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1l7x s SER 449 N -2.30 3.45 0.04 1.61 0.01 -0.42 -3.70 113.70 112.40 1l7x s SER 449 Ca 0.35 -0.89 0.23 0.00 1.31 0.00 0.00 55.95 56.95 1l7x s SER 449 Cb 0.21 -0.26 0.13 0.00 0.21 0.00 0.00 66.02 66.31 1l7x s SER 449 CO 0.43 0.11 1.11 0.00 0.41 0.00 0.00 173.24 175.30 1l7x n HIS 450 N 0.13 0.22 -3.78 2.43 1.44 -0.78 -4.90 115.22 109.98 1l7x n HIS 450 Ca -0.11 0.06 -0.13 0.00 -2.01 0.00 0.00 57.72 55.53 1l7x n HIS 450 Cb 0.57 -0.38 -0.12 0.00 0.12 0.00 0.00 29.99 30.17 1l7x n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1l7x s ALA 451 N -3.14 -0.54 -0.05 1.59 0.00 -1.26 -4.66 121.76 113.70 1l7x s ALA 451 Ca 0.06 0.71 0.02 0.00 0.00 0.00 0.00 51.96 52.75 1l7x s ALA 451 Cb 0.15 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.86 1l7x s ALA 451 CO 0.78 -0.13 -0.11 0.08 0.00 0.00 0.00 175.76 176.39 1l7x s VAL 452 N 0.40 1.01 0.08 0.00 1.01 -0.68 -0.96 120.40 121.27 1l7x s VAL 452 Ca -0.02 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1l7x s VAL 452 Cb -0.04 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 1l7x s VAL 452 CO -0.02 0.32 -0.07 0.54 0.00 0.00 0.00 175.10 175.88 1l7x s ASN 453 N 0.54 1.03 0.56 3.32 4.22 -0.39 0.15 114.94 124.37 1l7x s ASN 453 Ca -0.11 -0.91 0.08 0.00 -2.14 0.00 0.00 52.86 49.78 1l7x s ASN 453 Cb -0.14 0.09 0.08 0.00 1.28 0.00 0.00 41.25 42.56 1l7x s ASN 453 CO 0.02 -0.42 0.67 0.61 -2.04 0.00 0.00 177.10 175.95 1l7x n GLY 454 N 0.28 2.20 0.58 0.45 0.00 -1.03 -0.15 105.19 107.53 1l7x n GLY 454 Ca -0.14 -2.25 0.06 0.00 0.00 0.00 0.00 46.02 43.69 1l7x n GLY 454 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1l7x n VAL 455 N -2.10 1.54 -3.63 1.61 0.24 -1.26 -2.24 118.33 112.49 1l7x n VAL 455 Ca 0.11 -1.43 -0.05 0.00 -2.04 0.00 0.00 64.34 60.92 1l7x n VAL 455 Cb 0.60 0.16 -0.06 0.00 -1.47 0.00 0.00 33.84 33.07 1l7x n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1l7x s ALA 456 N -1.82 -2.09 0.18 2.33 0.00 -1.26 -1.33 121.76 117.76 1l7x s ALA 456 Ca 0.28 1.76 -0.19 0.00 0.00 0.00 0.00 51.96 53.80 1l7x s ALA 456 Cb 0.20 -1.45 0.12 0.00 0.00 0.00 0.00 23.12 21.99 1l7x s ALA 456 CO 0.10 -0.20 1.35 1.63 0.00 0.00 0.00 175.76 178.64 1l7x n LYS 457 N 1.32 -0.26 -0.19 0.00 5.02 -1.26 -0.11 118.16 122.68 1l7x n LYS 457 Ca -0.08 1.34 -0.02 0.00 -2.02 0.00 0.00 58.31 57.52 1l7x n LYS 457 Cb 0.57 -1.98 0.19 0.00 -0.02 0.00 0.00 35.03 33.80 1l7x n LYS 457 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 1l7x h ILE 458 N 0.00 1.22 0.09 -0.18 2.10 -1.91 -1.00 117.51 117.83 1l7x h ILE 458 Ca 0.25 -0.64 -0.29 0.00 1.08 0.00 0.00 64.86 65.26 1l7x h ILE 458 Cb 0.47 0.39 0.03 0.00 -1.09 0.00 0.00 36.82 36.61 1l7x h ILE 458 CO -0.85 0.26 -1.19 -0.74 -1.08 0.00 0.00 178.15 174.55 1l7x h HIS 459 N 0.94 1.03 -0.37 2.19 2.76 -1.20 -2.42 115.15 118.10 1l7x h HIS 459 Ca 0.23 -0.62 -0.06 0.00 -2.20 0.00 0.00 60.37 57.72 1l7x h HIS 459 Cb 0.12 -0.09 -0.02 0.00 1.55 0.00 0.00 27.41 28.97 1l7x h HIS 459 CO 0.01 1.46 -0.01 0.77 -1.30 0.00 0.00 177.93 178.86 1l7x h SER 460 N 0.31 0.55 -0.37 3.26 0.02 -0.34 -0.11 113.55 116.87 1l7x h SER 460 Ca -0.17 -0.11 -0.10 0.00 -0.84 0.00 0.00 61.79 60.56 1l7x h SER 460 Cb 1.86 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 64.24 1l7x h SER 460 CO 0.23 0.63 -0.15 -0.78 -1.14 0.00 0.00 176.83 175.62 1l7x h ASP 461 N 0.56 0.78 -0.53 3.07 3.58 -1.20 -1.53 116.42 121.15 1l7x h ASP 461 Ca 0.12 -0.39 -0.01 0.00 0.42 0.00 0.00 57.03 57.16 1l7x h ASP 461 Cb 0.37 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 1l7x h ASP 461 CO 0.01 1.00 0.29 0.40 -2.88 0.00 0.00 179.24 178.05 1l7x h ILE 462 N 0.56 1.18 0.32 2.25 2.04 -0.91 0.78 117.51 123.73 1l7x h ILE 462 Ca 0.09 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 1l7x h ILE 462 Cb 0.69 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1l7x h ILE 462 CO 0.05 0.19 -0.15 0.58 0.00 0.00 0.00 178.15 178.82 1l7x h VAL 463 N 0.70 0.70 -0.33 1.67 2.07 -0.96 -0.62 116.25 119.49 1l7x h VAL 463 Ca 0.18 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 1l7x h VAL 463 Cb 0.05 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1l7x h VAL 463 CO -0.03 0.04 0.08 0.50 0.02 0.00 0.00 177.57 178.19 1l7x h LYS 464 N -0.54 0.53 0.00 1.57 3.64 -1.19 0.10 116.57 120.68 1l7x h LYS 464 Ca -0.04 -0.13 -0.02 0.00 -1.27 0.00 0.00 60.65 59.19 1l7x h LYS 464 Cb 0.40 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1l7x h LYS 464 CO 0.07 0.58 -1.43 0.25 -2.27 0.00 0.00 179.45 176.66 1l7x n THR 465 N -4.64 0.46 0.00 1.00 -2.24 0.26 -3.49 114.28 105.63 1l7x n THR 465 Ca -0.02 -0.55 -0.01 0.00 -2.27 0.00 0.00 64.05 61.20 1l7x n THR 465 Cb 0.19 -0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.17 1l7x n THR 465 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1l7x n LYS 466 N -2.54 0.07 0.01 -0.78 5.02 -0.30 -4.36 118.16 115.28 1l7x n LYS 466 Ca -0.03 0.03 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 1l7x n LYS 466 Cb 0.59 -0.43 -0.06 0.00 -0.02 0.00 0.00 35.03 35.12 1l7x n LYS 466 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1l7x h VAL 467 N -0.13 1.01 -0.81 -0.18 2.07 -1.45 -3.20 116.25 113.55 1l7x h VAL 467 Ca 0.00 -0.03 -0.58 0.00 0.82 0.00 0.00 66.70 66.91 1l7x h VAL 467 Cb 0.13 0.92 -0.40 0.00 -1.52 0.00 0.00 31.29 30.42 1l7x h VAL 467 CO 0.00 0.02 -0.45 0.49 0.02 0.00 0.00 177.57 177.64 1l7x n PHE 468 N -5.05 2.86 -0.04 1.57 3.01 0.02 -4.80 117.46 115.04 1l7x n PHE 468 Ca -0.06 -2.40 -0.08 0.00 1.01 0.00 0.00 57.45 55.92 1l7x n PHE 468 Cb 0.03 -0.58 -0.02 0.00 -0.01 0.00 0.00 39.48 38.90 1l7x n PHE 468 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1l7x h LYS 469 N 2.15 -0.05 -0.35 -1.08 3.64 -1.59 -1.52 116.57 117.76 1l7x h LYS 469 Ca 0.42 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.86 1l7x h LYS 469 Cb 1.38 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.19 1l7x h LYS 469 CO 0.94 -0.03 0.24 -0.44 -2.27 0.00 0.00 179.45 177.89 1l7x h ASP 470 N -0.05 0.19 0.04 4.20 3.32 -1.87 -2.40 116.42 119.84 1l7x h ASP 470 Ca 0.11 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.01 1l7x h ASP 470 Cb 0.21 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.74 1l7x h ASP 470 CO -0.24 0.12 -0.57 -0.26 -1.72 0.00 0.00 179.24 176.57 1l7x h PHE 471 N 0.21 0.51 -0.03 4.55 -1.00 -1.67 -3.32 116.94 116.19 1l7x h PHE 471 Ca 0.16 -0.30 -0.08 0.00 2.81 0.00 0.00 57.97 60.55 1l7x h PHE 471 Cb 0.35 -0.05 -0.01 0.00 3.61 0.00 0.00 35.95 39.85 1l7x h PHE 471 CO -0.00 1.15 -0.38 0.66 -1.61 0.00 0.00 178.31 178.13 1l7x h SER 472 N -0.28 0.06 -0.77 2.17 4.64 -1.18 -2.01 113.55 116.18 1l7x h SER 472 Ca -0.08 -0.02 0.06 0.00 -0.47 0.00 0.00 61.79 61.28 1l7x h SER 472 Cb 1.33 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 63.35 1l7x h SER 472 CO 0.11 0.43 0.46 -0.33 -0.87 0.00 0.00 176.83 176.64 1l7x h GLU 473 N 0.05 0.82 0.12 4.77 5.08 -1.54 0.18 114.58 124.06 1l7x h GLU 473 Ca 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1l7x h GLU 473 Cb 0.69 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1l7x h GLU 473 CO 0.05 0.54 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.47 1l7x h LEU 474 N 0.84 -0.14 -7.32 1.33 4.07 -1.60 -3.38 115.31 109.12 1l7x h LEU 474 Ca 0.34 -0.42 -0.67 0.00 0.08 0.00 0.00 57.88 57.21 1l7x h LEU 474 Cb 0.18 0.04 -0.38 0.00 1.08 0.00 0.00 40.66 41.58 1l7x h LEU 474 CO -0.18 0.43 -0.35 -1.61 -1.08 0.00 0.00 178.44 175.65 1l7x s GLU 475 N -3.56 2.74 0.08 1.13 2.02 -0.78 -4.95 118.70 115.38 1l7x s GLU 475 Ca -0.14 -3.06 -0.27 0.00 0.02 0.00 0.00 54.97 51.53 1l7x s GLU 475 Cb 0.01 -3.69 -0.17 0.00 0.10 0.00 0.00 34.13 30.38 1l7x s GLU 475 CO 0.54 -1.23 1.66 -1.35 0.02 0.00 0.00 175.26 174.90 1l7x h PRO 476 N 6.12 -0.33 0.00 0.39 0.11 -0.83 -3.08 132.00 134.38 1l7x h PRO 476 Ca 0.09 0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.22 1l7x h PRO 476 Cb 0.84 0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 1l7x h PRO 476 CO 0.76 -0.20 -0.00 -0.44 -0.21 0.00 0.00 178.00 177.91 1l7x h ASP 477 N -0.37 0.00 -0.37 -2.05 3.32 -1.93 -3.16 116.42 111.86 1l7x h ASP 477 Ca -0.03 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.05 1l7x h ASP 477 Cb 0.28 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 1l7x h ASP 477 CO 0.06 0.00 0.17 0.50 -1.72 0.00 0.00 179.24 178.25 1l7x h LYS 478 N 0.00 0.34 -6.68 3.56 3.64 -1.80 -3.43 116.57 112.20 1l7x h LYS 478 Ca -0.00 -0.02 -0.50 0.00 -1.27 0.00 0.00 60.65 58.85 1l7x h LYS 478 Cb 0.05 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1l7x h LYS 478 CO 0.00 0.23 0.39 -0.06 -2.27 0.00 0.00 179.45 177.73 1l7x s PHE 479 N -6.16 3.82 0.33 1.91 0.40 -1.20 -1.68 117.98 115.42 1l7x s PHE 479 Ca -0.13 1.81 0.06 0.00 -0.60 0.00 0.00 56.93 58.07 1l7x s PHE 479 Cb 0.12 -3.08 -0.03 0.00 0.51 0.00 0.00 43.02 40.54 1l7x s PHE 479 CO 0.71 0.10 0.30 -0.65 0.70 0.00 0.00 175.22 176.38 1l7x s GLN 480 N -0.67 1.78 0.08 0.44 -0.21 0.12 -4.93 119.66 116.28 1l7x s GLN 480 Ca 0.45 -2.00 0.08 0.00 0.02 0.00 0.00 55.36 53.91 1l7x s GLN 480 Cb -0.26 0.34 -0.03 0.00 1.00 0.00 0.00 33.01 34.05 1l7x s GLN 480 CO 0.33 -0.67 -0.22 1.21 -2.12 0.00 0.00 175.29 173.82 1l7x s ASN 481 N -3.36 2.65 -0.44 5.90 2.47 -1.26 -2.45 114.94 118.44 1l7x s ASN 481 Ca 0.40 -0.63 0.05 0.00 0.42 0.00 0.00 52.86 53.09 1l7x s ASN 481 Cb 0.02 -0.18 0.17 0.00 -1.45 0.00 0.00 41.25 39.81 1l7x s ASN 481 CO 0.27 0.12 0.47 -0.54 -3.72 0.00 0.00 177.10 173.70 1l7x s LYS 482 N -1.64 0.90 0.02 0.43 -0.14 -0.95 -4.90 119.74 113.47 1l7x s LYS 482 Ca 0.08 -1.51 -0.37 0.00 -1.36 0.00 0.00 55.97 52.82 1l7x s LYS 482 Cb -0.10 -0.83 -0.16 0.00 -1.68 0.00 0.00 37.83 35.07 1l7x s LYS 482 CO 0.03 -1.33 1.50 2.41 -0.76 0.00 0.00 175.35 177.21 1l7x n THR 483 N 3.18 0.10 -0.62 2.17 -1.04 -1.26 -4.36 114.28 112.44 1l7x n THR 483 Ca 0.22 -0.02 -0.30 0.00 -2.04 0.00 0.00 64.05 61.91 1l7x n THR 483 Cb 0.50 -1.12 0.19 0.00 -1.82 0.00 0.00 70.33 68.09 1l7x n THR 483 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1l7x n ASN 484 N 3.51 -0.80 -4.01 8.00 5.03 -0.44 -4.65 115.26 121.90 1l7x n ASN 484 Ca 0.20 0.18 -0.10 0.00 0.87 0.00 0.00 54.58 55.73 1l7x n ASN 484 Cb 0.21 -1.34 -0.06 0.00 -1.02 0.00 0.00 39.78 37.57 1l7x n ASN 484 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1l7x s GLY 485 N -2.44 0.72 0.14 7.41 0.00 -1.26 -4.81 107.32 107.08 1l7x s GLY 485 Ca 0.66 -1.04 0.07 0.00 0.00 0.00 0.00 44.72 44.40 1l7x s GLY 485 CO 0.62 -0.77 -0.16 -0.26 0.00 0.00 0.00 173.10 172.54 1l7x s ILE 486 N -4.00 1.51 -0.07 0.90 -4.36 0.53 -4.49 121.20 111.22 1l7x s ILE 486 Ca 0.26 -1.80 -0.27 0.00 -0.26 0.00 0.00 60.65 58.57 1l7x s ILE 486 Cb 0.01 -1.66 -0.03 0.00 1.25 0.00 0.00 42.46 42.03 1l7x s ILE 486 CO 0.10 -0.39 0.87 0.28 0.24 0.00 0.00 174.94 176.04 1l7x s THR 487 N -2.13 4.91 -0.92 8.37 -1.32 -1.26 0.57 115.64 123.86 1l7x s THR 487 Ca 0.12 1.78 0.16 0.00 -1.21 0.00 0.00 61.69 62.54 1l7x s THR 487 Cb -0.05 -4.20 0.14 0.00 -1.51 0.00 0.00 72.50 66.89 1l7x s THR 487 CO 0.04 0.14 1.52 -0.81 -2.21 0.00 0.00 174.62 173.30 1l7x n PRO 488 N 4.30 0.03 0.03 7.08 -0.04 -1.26 -2.12 135.00 143.01 1l7x n PRO 488 Ca 0.04 0.27 -0.03 0.00 -0.04 0.00 0.00 63.50 63.74 1l7x n PRO 488 Cb 0.50 -1.56 -0.01 0.00 -0.04 0.00 0.00 33.50 32.39 1l7x n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1l7x h ARG 489 N 0.00 -0.18 -0.20 0.54 -0.00 -1.91 -2.43 114.38 110.20 1l7x h ARG 489 Ca 0.00 0.01 -0.14 0.00 -0.50 0.00 0.00 59.98 59.35 1l7x h ARG 489 Cb 0.28 0.04 -0.01 0.00 0.00 0.00 0.00 29.97 30.28 1l7x h ARG 489 CO 0.00 -0.12 -0.48 -0.09 0.00 0.00 0.00 179.97 179.28 1l7x h ARG 490 N -1.05 0.52 -0.31 0.04 2.43 -1.97 -0.45 114.38 113.59 1l7x h ARG 490 Ca -0.02 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 1l7x h ARG 490 Cb 0.14 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1l7x h ARG 490 CO 0.03 0.88 0.00 0.91 -1.51 0.00 0.00 179.97 180.29 1l7x n TRP 491 N -3.99 0.41 0.04 2.20 7.02 -0.90 -2.73 117.44 119.48 1l7x n TRP 491 Ca -0.02 -0.21 0.00 0.00 -1.02 0.00 0.00 57.50 56.25 1l7x n TRP 491 Cb 0.56 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.45 1l7x n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1l7x n LEU 492 N 0.63 -0.19 -0.19 -0.99 7.94 -1.03 -4.78 117.00 118.39 1l7x n LEU 492 Ca 0.15 0.13 -0.02 0.00 -1.11 0.00 0.00 56.01 55.16 1l7x n LEU 492 Cb 0.36 0.28 0.09 0.00 0.53 0.00 0.00 43.42 44.68 1l7x n LEU 492 CO 0.11 -0.53 1.00 -0.07 -1.11 0.00 0.00 177.39 176.80 1l7x h LEU 493 N 0.00 0.28 0.02 -1.96 4.07 -1.11 -1.22 115.31 115.39 1l7x h LEU 493 Ca 0.00 0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.02 1l7x h LEU 493 Cb 0.00 0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.76 1l7x h LEU 493 CO 0.00 0.18 -0.01 0.25 -1.08 0.00 0.00 178.44 177.78 1l7x h LEU 494 N 0.44 -0.03 -1.39 1.67 6.46 -1.25 -3.32 115.31 117.90 1l7x h LEU 494 Ca 0.27 -0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 57.97 1l7x h LEU 494 Cb 0.28 0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1l7x h LEU 494 CO -0.25 0.49 -0.07 0.00 -0.62 0.00 0.00 178.44 177.99 1l7x n ASN 496 N -3.20 1.40 -0.15 0.00 2.85 -0.46 -4.81 115.26 110.88 1l7x n ASN 496 Ca 0.00 -3.10 0.27 0.00 -0.11 0.00 0.00 54.58 51.64 1l7x n ASN 496 Cb 0.34 -0.61 0.71 0.00 1.24 0.00 0.00 39.78 41.45 1l7x n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1l7x h PRO 497 N 3.10 0.03 -0.13 1.20 0.13 -1.67 -1.34 132.00 133.32 1l7x h PRO 497 Ca 0.10 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1l7x h PRO 497 Cb 0.88 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 1l7x h PRO 497 CO 0.55 0.02 0.06 0.78 -0.23 0.00 0.00 178.00 179.18 1l7x h GLY 498 N 0.03 0.21 1.56 1.56 0.00 -1.91 -2.14 103.07 102.37 1l7x h GLY 498 Ca 0.40 -0.11 -0.16 0.00 0.00 0.00 0.00 47.33 47.46 1l7x h GLY 498 CO -0.02 0.11 -0.59 -2.00 0.00 0.00 0.00 176.54 174.04 1l7x h LEU 499 N 0.06 0.52 -0.64 3.11 5.85 -1.63 -1.65 115.31 120.94 1l7x h LEU 499 Ca 0.04 -0.29 -0.06 0.00 0.84 0.00 0.00 57.88 58.42 1l7x h LEU 499 Cb 0.16 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1l7x h LEU 499 CO -0.00 0.99 0.16 0.00 -0.34 0.00 0.00 178.44 179.25 1l7x h ALA 500 N 1.02 0.84 -0.24 1.25 0.00 -1.35 -1.36 119.26 119.42 1l7x h ALA 500 Ca -0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 1l7x h ALA 500 Cb 1.13 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1l7x h ALA 500 CO 0.10 0.55 -0.35 1.49 0.00 0.00 0.00 179.25 181.04 1l7x h GLU 501 N 0.94 0.66 -0.15 0.00 4.81 -1.37 -1.18 114.58 118.28 1l7x h GLU 501 Ca 0.20 -0.39 0.04 0.00 -0.13 0.00 0.00 59.36 59.09 1l7x h GLU 501 Cb 0.35 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.72 1l7x h GLU 501 CO 0.00 1.00 -0.16 1.25 -0.73 0.00 0.00 179.01 180.38 1l7x h LEU 502 N 0.37 -0.49 -0.98 1.64 5.85 -1.09 -0.52 115.31 120.08 1l7x h LEU 502 Ca 0.02 0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1l7x h LEU 502 Cb 0.94 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 1l7x h LEU 502 CO 0.08 -0.20 0.13 0.40 -0.34 0.00 0.00 178.44 178.51 1l7x h ILE 503 N -0.19 1.23 -0.28 4.05 2.04 -1.26 -2.80 117.51 120.30 1l7x h ILE 503 Ca 0.10 -0.85 -0.08 0.00 1.00 0.00 0.00 64.86 65.03 1l7x h ILE 503 Cb 0.34 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1l7x h ILE 503 CO -0.26 0.32 -0.18 0.00 0.00 0.00 0.00 178.15 178.03 1l7x h ALA 504 N 1.31 1.17 0.00 1.87 0.00 -0.42 -1.08 119.26 122.10 1l7x h ALA 504 Ca 0.18 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1l7x h ALA 504 Cb 0.32 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1l7x h ALA 504 CO 0.00 0.53 0.00 1.49 0.00 0.00 0.00 179.25 181.27 1l7x h GLU 505 N 0.45 0.00 0.00 0.00 4.81 -0.86 -1.51 114.58 117.48 1l7x h GLU 505 Ca 0.08 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.93 1l7x h GLU 505 Cb 0.57 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.88 1l7x h GLU 505 CO 0.04 0.00 -2.41 1.63 -0.73 0.00 0.00 179.01 177.54 1l7x n LYS 506 N -2.53 0.69 -0.01 1.92 4.76 -0.84 -4.77 118.16 117.39 1l7x n LYS 506 Ca 0.03 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.50 1l7x n LYS 506 Cb 0.32 -1.52 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 1l7x n LYS 506 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1l7x n ILE 507 N -2.89 0.21 0.00 -0.18 -5.35 -0.47 -5.06 119.36 105.62 1l7x n ILE 507 Ca -0.36 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 61.91 1l7x n ILE 507 Cb 1.11 0.89 0.00 0.00 -1.74 0.00 0.00 39.64 39.90 1l7x n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1l7x n GLY 508 N -0.11 -0.19 0.06 3.28 0.00 -0.57 -4.67 105.19 102.99 1l7x n GLY 508 Ca 0.00 -1.87 0.12 0.00 0.00 0.00 0.00 46.02 44.27 1l7x n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1l7x n GLU 509 N -0.26 0.32 -0.37 1.61 1.02 -1.26 -4.29 120.64 117.42 1l7x n GLU 509 Ca 0.00 0.05 0.31 0.00 -0.02 0.00 0.00 57.16 57.50 1l7x n GLU 509 Cb 0.00 -1.66 0.58 0.00 -0.02 0.00 0.00 31.44 30.34 1l7x n GLU 509 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1l7x h ASP 510 N 0.00 0.35 0.00 1.62 3.45 -1.96 -0.81 116.42 119.07 1l7x h ASP 510 Ca 0.00 0.20 0.00 0.00 0.43 0.00 0.00 57.03 57.66 1l7x h ASP 510 Cb 0.76 0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.72 1l7x h ASP 510 CO 0.00 -0.26 0.18 0.10 -1.57 0.00 0.00 179.24 177.68 1l7x h TYR 511 N 0.12 0.00 0.00 4.55 -0.00 -1.77 -2.16 116.97 117.71 1l7x h TYR 511 Ca 0.81 0.00 -0.07 0.00 -0.00 0.00 0.00 58.73 59.47 1l7x h TYR 511 Cb 2.19 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 38.91 1l7x h TYR 511 CO -0.01 0.00 -0.33 0.28 -0.00 0.00 0.00 178.16 178.11 1l7x h VAL 512 N 0.00 0.99 -0.01 -0.90 2.07 -1.49 -2.75 116.25 114.16 1l7x h VAL 512 Ca 0.00 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.29 1l7x h VAL 512 Cb 0.35 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1l7x h VAL 512 CO 0.00 0.32 -0.44 0.29 0.02 0.00 0.00 177.57 177.76 1l7x n LYS 513 N -3.79 1.75 -3.32 1.57 5.02 -0.83 -4.78 118.16 113.78 1l7x n LYS 513 Ca -0.01 -0.59 -0.12 0.00 -2.02 0.00 0.00 58.31 55.56 1l7x n LYS 513 Cb 0.41 -1.26 -0.06 0.00 -0.02 0.00 0.00 35.03 34.10 1l7x n LYS 513 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1l7x s ASP 514 N -2.05 0.52 0.50 4.39 3.68 -1.10 -5.04 116.67 117.59 1l7x s ASP 514 Ca 0.11 -1.14 0.17 0.00 2.13 0.00 0.00 52.55 53.82 1l7x s ASP 514 Cb 0.13 0.93 1.24 0.00 -1.45 0.00 0.00 42.92 43.77 1l7x s ASP 514 CO 0.47 -0.27 2.10 0.25 0.13 0.00 0.00 175.17 177.85 1l7x h LEU 515 N 7.34 0.00 -2.27 -1.34 5.85 -1.77 -2.35 115.31 120.78 1l7x h LEU 515 Ca 0.01 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1l7x h LEU 515 Cb 1.09 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 1l7x h LEU 515 CO 0.20 0.07 0.23 0.77 -0.34 0.00 0.00 178.44 179.37 1l7x h SER 516 N 0.00 0.00 0.00 1.25 4.64 -1.87 0.11 113.55 117.68 1l7x h SER 516 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1l7x h SER 516 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1l7x h SER 516 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 1l7x n GLN 517 N -3.38 0.02 0.28 4.77 1.13 -0.88 -1.73 117.38 117.58 1l7x n GLN 517 Ca 0.00 0.52 0.16 0.00 -1.94 0.00 0.00 57.00 55.74 1l7x n GLN 517 Cb 0.33 -1.57 0.77 0.00 0.11 0.00 0.00 30.24 29.88 1l7x n GLN 517 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1l7x h LEU 518 N 0.00 0.00 -2.56 1.08 3.38 -1.00 -2.61 115.31 113.60 1l7x h LEU 518 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1l7x h LEU 518 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1l7x h LEU 518 CO 0.00 0.06 -0.02 0.71 0.09 0.00 0.00 178.44 179.29 1l7x h THR 519 N 0.00 0.17 0.00 0.22 1.35 -1.00 -1.31 112.91 112.34 1l7x h THR 519 Ca -0.00 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1l7x h THR 519 Cb 0.40 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 67.93 1l7x h THR 519 CO 0.01 0.02 0.00 0.11 -0.25 0.00 0.00 175.52 175.40 1l7x h LYS 520 N 0.00 0.00 0.00 4.72 1.57 -1.71 -1.86 116.57 119.29 1l7x h LYS 520 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1l7x h LYS 520 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1l7x h LYS 520 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 179.45 178.81 1l7x h LEU 521 N 0.00 0.00 -1.64 2.94 3.38 -1.46 -2.96 115.31 115.57 1l7x h LEU 521 Ca 0.00 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.14 1l7x h LEU 521 Cb 0.15 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1l7x h LEU 521 CO 0.00 0.00 0.52 0.45 0.09 0.00 0.00 178.44 179.50 1l7x h HIS 522 N 0.00 0.40 -0.08 1.13 3.86 -1.55 -0.44 115.15 118.48 1l7x h HIS 522 Ca 0.00 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.24 1l7x h HIS 522 Cb 0.34 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.68 1l7x h HIS 522 CO 0.00 0.14 0.41 0.77 0.86 0.00 0.00 177.93 180.11 1l7x h SER 523 N 0.33 0.00 -0.63 2.45 0.02 -1.76 0.12 113.55 114.08 1l7x h SER 523 Ca 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 1l7x h SER 523 Cb 1.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.54 1l7x h SER 523 CO -0.11 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.07 1l7x n PHE 524 N -2.99 1.71 0.16 3.45 3.01 -0.18 -4.55 117.46 118.08 1l7x n PHE 524 Ca -0.00 -0.65 0.17 0.00 1.01 0.00 0.00 57.45 57.98 1l7x n PHE 524 Cb 0.48 -0.34 0.78 0.00 -0.01 0.00 0.00 39.48 40.38 1l7x n PHE 524 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1l7x h LEU 525 N 4.11 0.00 0.00 4.37 3.38 -0.91 -2.72 115.31 123.54 1l7x h LEU 525 Ca 0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 1l7x h LEU 525 Cb 1.65 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.36 1l7x h LEU 525 CO 0.33 0.00 -2.09 0.61 0.09 0.00 0.00 178.44 177.37 1l7x n GLY 526 N -1.47 -0.92 3.56 0.83 0.00 -1.26 -4.92 105.19 101.00 1l7x n GLY 526 Ca 0.03 -0.40 -0.37 0.00 0.00 0.00 0.00 46.02 45.28 1l7x n GLY 526 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1l7x s ASP 527 N -4.78 4.58 0.27 1.61 3.68 -1.03 -4.83 116.67 116.18 1l7x s ASP 527 Ca -0.08 1.11 -0.02 0.00 2.13 0.00 0.00 52.55 55.68 1l7x s ASP 527 Cb 0.09 -2.50 0.37 0.00 -1.45 0.00 0.00 42.92 39.43 1l7x s ASP 527 CO 0.81 -2.77 1.85 0.44 0.13 0.00 0.00 175.17 175.63 1l7x h ASP 528 N 18.89 0.87 -0.34 -0.34 5.19 -1.91 -2.05 116.42 136.73 1l7x h ASP 528 Ca -0.26 -0.12 0.07 0.00 -0.62 0.00 0.00 57.03 56.10 1l7x h ASP 528 Cb 1.26 -0.22 -0.06 0.00 0.18 0.00 0.00 39.33 40.48 1l7x h ASP 528 CO 1.14 0.78 -0.07 0.58 -3.12 0.00 0.00 179.24 178.55 1l7x h VAL 529 N 0.93 0.67 -0.68 -1.35 2.07 -1.97 0.15 116.25 116.05 1l7x h VAL 529 Ca 0.22 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.73 1l7x h VAL 529 Cb 0.19 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1l7x h VAL 529 CO -0.02 0.00 0.40 0.15 0.02 0.00 0.00 177.57 178.12 1l7x h PHE 530 N 0.01 0.92 -0.32 1.57 3.57 -1.81 -1.28 116.94 119.60 1l7x h PHE 530 Ca 0.16 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 1l7x h PHE 530 Cb 0.25 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 1l7x h PHE 530 CO -0.31 0.63 -0.00 -0.07 -2.23 0.00 0.00 178.31 176.33 1l7x h LEU 531 N 0.93 0.46 -0.38 0.59 3.38 -0.63 0.14 115.31 119.80 1l7x h LEU 531 Ca 0.24 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1l7x h LEU 531 Cb -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1l7x h LEU 531 CO -0.04 0.54 -0.05 0.03 0.09 0.00 0.00 178.44 179.00 1l7x h ARG 532 N 0.48 0.71 -0.56 1.13 3.08 -0.15 -1.77 114.38 117.29 1l7x h ARG 532 Ca 0.10 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 1l7x h ARG 532 Cb 0.32 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 1l7x h ARG 532 CO 0.01 0.84 0.31 0.93 -1.07 0.00 0.00 179.97 180.98 1l7x h GLU 533 N 0.52 0.79 -0.88 0.04 5.08 -0.48 -0.23 114.58 119.42 1l7x h GLU 533 Ca 0.10 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1l7x h GLU 533 Cb 0.55 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.61 1l7x h GLU 533 CO 0.03 0.61 0.52 1.25 -1.00 0.00 0.00 179.01 180.42 1l7x h LEU 534 N 0.76 1.06 -0.73 1.33 5.85 -0.63 -1.48 115.31 121.47 1l7x h LEU 534 Ca 0.20 -0.07 -0.14 0.00 0.84 0.00 0.00 57.88 58.71 1l7x h LEU 534 Cb 0.05 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 1l7x h LEU 534 CO -0.03 0.82 -0.57 0.00 -0.34 0.00 0.00 178.44 178.32 1l7x h ALA 535 N 1.36 0.92 0.09 1.25 0.00 -0.89 -2.74 119.26 119.24 1l7x h ALA 535 Ca 0.31 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1l7x h ALA 535 Cb -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1l7x h ALA 535 CO -0.06 0.71 -0.04 -0.22 0.00 0.00 0.00 179.25 179.64 1l7x h LYS 536 N 0.14 -0.11 -0.51 0.00 3.64 -0.32 0.10 116.57 119.51 1l7x h LYS 536 Ca -0.00 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.47 1l7x h LYS 536 Cb 1.05 0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.83 1l7x h LYS 536 CO 0.09 0.21 0.11 0.28 -2.27 0.00 0.00 179.45 177.86 1l7x h VAL 537 N -0.44 0.73 -0.67 2.00 2.07 -1.31 0.36 116.25 119.00 1l7x h VAL 537 Ca -0.01 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 1l7x h VAL 537 Cb 0.37 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1l7x h VAL 537 CO 0.02 0.05 0.40 0.50 0.02 0.00 0.00 177.57 178.56 1l7x h LYS 538 N 0.25 0.90 -0.17 1.57 1.63 -1.36 -2.04 116.57 117.35 1l7x h LYS 538 Ca 0.25 -0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 59.95 1l7x h LYS 538 Cb 0.34 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.77 1l7x h LYS 538 CO -0.32 0.63 -0.01 0.37 -3.45 0.00 0.00 179.45 176.67 1l7x h GLN 539 N 0.91 0.31 -0.76 1.90 5.75 0.21 -2.36 115.11 121.07 1l7x h GLN 539 Ca 0.24 -0.10 0.06 0.00 -0.15 0.00 0.00 58.65 58.70 1l7x h GLN 539 Cb -0.04 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.44 1l7x h GLN 539 CO -0.05 0.53 0.50 0.93 -2.65 0.00 0.00 178.83 178.09 1l7x h GLU 540 N 0.05 0.80 -0.46 1.69 5.08 -0.07 -0.97 114.58 120.71 1l7x h GLU 540 Ca 0.05 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 1l7x h GLU 540 Cb 0.40 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1l7x h GLU 540 CO 0.01 0.53 -0.21 -0.91 -1.00 0.00 0.00 179.01 177.43 1l7x h ASN 541 N 0.83 0.95 -0.39 1.42 2.35 -1.21 -1.33 115.58 118.20 1l7x h ASN 541 Ca 0.32 -0.35 -0.15 0.00 -0.55 0.00 0.00 56.30 55.57 1l7x h ASN 541 Cb 0.21 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1l7x h ASN 541 CO -0.11 1.12 -0.35 0.11 -1.65 0.00 0.00 177.43 176.55 1l7x h LYS 542 N 0.81 0.94 -0.56 0.81 1.57 -0.87 -1.21 116.57 118.06 1l7x h LYS 542 Ca 0.11 -0.48 -0.06 0.00 -1.87 0.00 0.00 60.65 58.35 1l7x h LYS 542 Cb 0.77 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 1l7x h LYS 542 CO 0.06 1.14 0.10 1.25 -0.57 0.00 0.00 179.45 181.43 1l7x h LEU 543 N 0.78 0.88 -0.51 2.94 5.85 -1.09 0.29 115.31 124.44 1l7x h LEU 543 Ca 0.07 -0.25 -0.13 0.00 0.84 0.00 0.00 57.88 58.41 1l7x h LEU 543 Cb 0.94 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1l7x h LEU 543 CO 0.09 0.91 -0.23 0.50 -0.34 0.00 0.00 178.44 179.37 1l7x h LYS 544 N 0.82 0.97 0.00 1.25 3.64 -1.18 -2.95 116.57 119.11 1l7x h LYS 544 Ca 0.17 -0.42 -0.10 0.00 -1.27 0.00 0.00 60.65 59.03 1l7x h LYS 544 Cb 0.39 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1l7x h LYS 544 CO 0.01 1.09 -0.50 0.35 -2.27 0.00 0.00 179.45 178.13 1l7x h PHE 545 N 0.83 0.00 -0.36 1.91 3.57 -1.02 -3.05 116.94 118.82 1l7x h PHE 545 Ca 0.11 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.53 1l7x h PHE 545 Cb 0.80 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.53 1l7x h PHE 545 CO 0.05 0.50 -0.10 0.77 -2.23 0.00 0.00 178.31 177.29 1l7x h SER 546 N 0.00 0.61 -0.81 0.41 0.02 -0.27 -1.66 113.55 111.84 1l7x h SER 546 Ca -0.00 -0.16 0.01 0.00 -0.84 0.00 0.00 61.79 60.79 1l7x h SER 546 Cb 1.08 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.42 1l7x h SER 546 CO 0.06 0.75 0.53 1.56 -1.14 0.00 0.00 176.83 178.59 1l7x h GLN 547 N 0.57 1.07 0.78 3.45 4.20 -1.41 -1.52 115.11 122.25 1l7x h GLN 547 Ca 0.10 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 1l7x h GLN 547 Cb 0.52 -0.24 0.01 0.00 0.30 0.00 0.00 27.48 28.07 1l7x h GLN 547 CO 0.03 0.72 -0.37 0.35 -0.67 0.00 0.00 178.83 178.88 1l7x h PHE 548 N 1.10 -0.97 0.06 2.96 3.57 -1.40 -2.50 116.94 119.76 1l7x h PHE 548 Ca 0.29 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.79 1l7x h PHE 548 Cb -0.11 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 38.90 1l7x h PHE 548 CO -0.01 -0.59 -0.51 -0.07 -2.23 0.00 0.00 178.31 174.89 1l7x h LEU 549 N -1.08 -1.54 -2.29 0.59 3.38 -1.08 -0.53 115.31 112.74 1l7x h LEU 549 Ca -0.11 0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 1l7x h LEU 549 Cb 0.81 0.58 -0.00 0.00 0.09 0.00 0.00 40.66 42.14 1l7x h LEU 549 CO 0.18 -0.53 -0.01 -0.33 0.09 0.00 0.00 178.44 177.83 1l7x h GLU 550 N -0.70 0.00 0.01 1.13 5.08 -1.36 0.74 114.58 119.49 1l7x h GLU 550 Ca 0.01 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.16 1l7x h GLU 550 Cb 0.73 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 1l7x h GLU 550 CO -0.32 0.01 -0.92 1.15 -1.00 0.00 0.00 179.01 177.94 1l7x h THR 551 N 0.00 1.45 0.00 1.13 2.02 -0.92 -3.30 112.91 113.30 1l7x h THR 551 Ca -0.00 -2.56 -0.19 0.00 0.77 0.00 0.00 66.41 64.43 1l7x h THR 551 Cb 0.03 2.46 -0.03 0.00 -1.74 0.00 0.00 68.15 68.87 1l7x h THR 551 CO 0.00 0.75 -1.36 -0.33 0.37 0.00 0.00 175.52 174.96 1l7x h GLU 552 N 0.16 0.00 -5.97 6.66 4.39 0.26 -3.47 114.58 116.61 1l7x h GLU 552 Ca -0.06 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.10 1l7x h GLU 552 Cb 1.56 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 29.98 1l7x h GLU 552 CO 0.15 0.41 -0.82 0.71 -1.16 0.00 0.00 179.01 178.30 1l7x s TYR 553 N -2.83 1.68 0.39 4.33 1.51 0.25 -5.04 117.35 117.63 1l7x s TYR 553 Ca -0.02 -0.41 0.06 0.00 -1.01 0.00 0.00 57.07 55.69 1l7x s TYR 553 Cb 0.08 -0.95 0.78 0.00 -0.11 0.00 0.00 41.96 41.77 1l7x s TYR 553 CO 0.81 0.14 2.02 -0.22 -1.11 0.00 0.00 175.55 177.19 1l7x h LYS 554 N 4.39 0.58 -6.27 -0.62 1.63 -1.85 -3.38 116.57 111.04 1l7x h LYS 554 Ca -0.44 -0.05 -0.61 0.00 -0.85 0.00 0.00 60.65 58.71 1l7x h LYS 554 Cb 1.18 -0.12 0.15 0.00 -0.60 0.00 0.00 32.23 32.83 1l7x h LYS 554 CO 0.41 0.42 -0.51 0.28 -3.45 0.00 0.00 179.45 176.60 1l7x n VAL 555 N -4.44 1.58 -3.91 2.00 0.31 -1.26 -4.98 118.33 107.63 1l7x n VAL 555 Ca 0.03 -0.50 -0.36 0.00 -0.01 0.00 0.00 64.34 63.51 1l7x n VAL 555 Cb 0.08 -0.44 -0.12 0.00 -0.91 0.00 0.00 33.84 32.46 1l7x n VAL 555 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1l7x s LYS 556 N -1.49 3.77 0.12 5.55 2.36 -1.26 -4.53 119.74 124.26 1l7x s LYS 556 Ca 0.63 -0.43 -0.16 0.00 -2.55 0.00 0.00 55.97 53.46 1l7x s LYS 556 Cb -0.60 -3.25 -0.07 0.00 -1.05 0.00 0.00 37.83 32.86 1l7x s LYS 556 CO 0.59 0.01 0.55 0.42 1.55 0.00 0.00 175.35 178.47 1l7x s ILE 557 N 1.07 4.83 -0.82 5.43 -1.09 -1.26 -5.00 121.20 124.36 1l7x s ILE 557 Ca 0.04 0.96 -0.12 0.00 -2.23 0.00 0.00 60.65 59.30 1l7x s ILE 557 Cb -0.14 -3.79 0.21 0.00 -1.58 0.00 0.00 42.46 37.17 1l7x s ILE 557 CO 0.03 0.36 0.74 0.21 -1.23 0.00 0.00 174.94 175.05 1l7x s ASN 558 N -1.49 6.57 0.12 3.58 2.47 -1.26 -4.93 114.94 120.00 1l7x s ASN 558 Ca 0.34 -2.78 0.04 0.00 0.42 0.00 0.00 52.86 50.89 1l7x s ASN 558 Cb -0.17 -2.16 0.24 0.00 -1.45 0.00 0.00 41.25 37.72 1l7x s ASN 558 CO 0.19 -0.52 0.95 -0.81 -3.72 0.00 0.00 177.10 173.18 1l7x n PRO 559 N 3.81 0.03 0.01 0.43 -0.04 -1.26 0.46 135.00 138.44 1l7x n PRO 559 Ca 0.14 0.38 0.11 0.00 -0.04 0.00 0.00 63.50 64.09 1l7x n PRO 559 Cb 0.45 -1.87 0.02 0.00 -0.04 0.00 0.00 33.50 32.06 1l7x n PRO 559 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1l7x n SER 560 N -1.55 0.71 -4.71 3.54 3.41 -1.26 -4.95 113.62 108.82 1l7x n SER 560 Ca -0.00 -0.54 -0.29 0.00 -0.26 0.00 0.00 58.87 57.78 1l7x n SER 560 Cb 0.28 0.77 0.15 0.00 -0.26 0.00 0.00 64.21 65.15 1l7x n SER 560 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1l7x s SER 561 N -3.30 3.17 -0.13 4.04 1.04 0.17 -4.97 113.70 113.73 1l7x s SER 561 Ca 0.07 1.33 -0.25 0.00 0.48 0.00 0.00 55.95 57.59 1l7x s SER 561 Cb 0.16 -2.01 -0.02 0.00 0.10 0.00 0.00 66.02 64.25 1l7x s SER 561 CO 0.80 -2.81 0.78 -0.32 0.98 0.00 0.00 173.24 172.67 1l7x s MET 562 N -4.97 4.35 -0.72 4.02 1.75 -0.11 -4.81 119.30 118.81 1l7x s MET 562 Ca 0.64 0.96 -0.25 0.00 -1.25 0.00 0.00 55.69 55.79 1l7x s MET 562 Cb -0.18 -3.53 0.05 0.00 2.84 0.00 0.00 34.83 34.01 1l7x s MET 562 CO 0.57 -0.18 1.13 -0.06 -0.65 0.00 0.00 175.02 175.83 1l7x s PHE 563 N 1.64 2.50 -0.39 4.11 0.40 -1.26 -1.12 117.98 123.86 1l7x s PHE 563 Ca 0.38 -0.35 -0.20 0.00 -0.60 0.00 0.00 56.93 56.17 1l7x s PHE 563 Cb -0.17 -4.46 0.01 0.00 0.51 0.00 0.00 43.02 38.90 1l7x s PHE 563 CO 0.15 -1.86 0.59 0.34 0.70 0.00 0.00 175.22 175.14 1l7x s ASP 564 N 3.75 6.34 -0.03 1.36 -1.08 -0.91 -1.43 116.67 124.69 1l7x s ASP 564 Ca 0.29 -0.12 0.05 0.00 -0.52 0.00 0.00 52.55 52.25 1l7x s ASP 564 Cb -0.12 -2.30 -0.01 0.00 -1.46 0.00 0.00 42.92 39.03 1l7x s ASP 564 CO 0.11 -0.62 -0.18 -0.69 0.52 0.00 0.00 175.17 174.31 1l7x s VAL 565 N 2.62 1.43 -0.36 1.11 1.01 -0.48 -0.02 120.40 125.70 1l7x s VAL 565 Ca 0.21 -0.75 -0.00 0.00 0.00 0.00 0.00 61.98 61.44 1l7x s VAL 565 Cb -0.15 -1.21 0.13 0.00 0.00 0.00 0.00 36.38 35.15 1l7x s VAL 565 CO 0.16 0.41 0.19 -1.58 0.00 0.00 0.00 175.10 174.28 1l7x s GLN 566 N -0.24 0.72 -0.24 2.72 0.74 -0.11 -0.83 119.66 122.42 1l7x s GLN 566 Ca 0.03 -1.37 0.01 0.00 0.05 0.00 0.00 55.36 54.09 1l7x s GLN 566 Cb -0.09 -1.65 0.04 0.00 1.10 0.00 0.00 33.01 32.42 1l7x s GLN 566 CO 0.00 -1.14 -0.12 0.14 -0.55 0.00 0.00 175.29 173.62 1l7x s VAL 567 N 1.09 2.30 0.11 1.34 -7.23 -1.26 -1.95 120.40 114.80 1l7x s VAL 567 Ca 0.16 -1.35 -0.25 0.00 -1.81 0.00 0.00 61.98 58.73 1l7x s VAL 567 Cb -0.22 -2.22 0.08 0.00 0.56 0.00 0.00 36.38 34.58 1l7x s VAL 567 CO -0.08 0.15 1.10 -1.59 -0.31 0.00 0.00 175.10 174.37 1l7x s LYS 568 N 1.19 0.98 0.29 4.82 -2.85 -1.04 -4.99 119.74 118.14 1l7x s LYS 568 Ca -0.04 -0.59 -0.29 0.00 -1.00 0.00 0.00 55.97 54.05 1l7x s LYS 568 Cb -0.18 0.30 -0.10 0.00 -2.06 0.00 0.00 37.83 35.79 1l7x s LYS 568 CO -0.07 -0.45 1.44 1.03 0.10 0.00 0.00 175.35 177.40 1l7x s ARG 569 N -2.56 4.24 -0.12 1.78 1.81 -1.26 -3.92 118.95 118.92 1l7x s ARG 569 Ca 0.18 2.37 -0.29 0.00 -1.72 0.00 0.00 55.73 56.26 1l7x s ARG 569 Cb -0.00 -3.07 -0.05 0.00 -0.45 0.00 0.00 34.95 31.38 1l7x s ARG 569 CO 0.02 -0.42 1.82 0.42 -0.68 0.00 0.00 175.30 176.46 1l7x s ILE 570 N -0.44 3.39 0.04 1.52 -1.09 -0.26 -4.93 121.20 119.43 1l7x s ILE 570 Ca 0.56 0.45 -0.04 0.00 -2.23 0.00 0.00 60.65 59.39 1l7x s ILE 570 Cb -0.43 -3.36 -0.02 0.00 -1.58 0.00 0.00 42.46 37.07 1l7x s ILE 570 CO 0.49 -0.12 0.07 -1.00 -1.23 0.00 0.00 174.94 173.15 1l7x s HIS 571 N 5.33 0.25 0.05 3.97 3.76 -1.26 -4.72 115.29 122.67 1l7x s HIS 571 Ca 0.81 -0.59 -0.15 0.00 -0.15 0.00 0.00 55.06 54.98 1l7x s HIS 571 Cb -0.32 -0.18 -0.26 0.00 1.11 0.00 0.00 32.58 32.93 1l7x s HIS 571 CO 0.33 -0.36 1.13 0.93 -0.85 0.00 0.00 174.74 175.93 1l7x h GLU 572 N 3.64 0.63 0.00 1.40 5.08 -1.97 -3.12 114.58 120.25 1l7x h GLU 572 Ca -0.33 -0.74 -0.04 0.00 -1.00 0.00 0.00 59.36 57.25 1l7x h GLU 572 Cb 1.18 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 1l7x h GLU 572 CO 0.52 1.32 -0.18 0.10 -1.00 0.00 0.00 179.01 179.76 1l7x h TYR 573 N 0.26 0.00 -0.00 4.33 -0.00 -1.96 0.45 116.97 120.05 1l7x h TYR 573 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.58 1l7x h TYR 573 Cb 1.73 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.46 1l7x h TYR 573 CO 0.12 0.18 -0.01 1.63 -0.00 0.00 0.00 178.16 180.08 1l7x n LYS 574 N -4.03 0.06 -3.68 0.10 5.02 -1.22 -2.57 118.16 111.84 1l7x n LYS 574 Ca -0.02 -0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 55.98 1l7x n LYS 574 Cb 0.26 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.81 1l7x n LYS 574 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1l7x n ARG 575 N -1.47 -1.82 0.22 1.97 1.74 0.15 -4.01 116.66 113.44 1l7x n ARG 575 Ca 0.08 0.49 0.15 0.00 -0.77 0.00 0.00 57.85 57.80 1l7x n ARG 575 Cb 0.33 -4.37 0.58 0.00 -1.02 0.00 0.00 32.46 27.97 1l7x n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1l7x h GLN 576 N -1.83 0.00 0.32 5.56 7.50 -1.82 -2.90 115.11 121.94 1l7x h GLN 576 Ca -0.65 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 58.48 1l7x h GLN 576 Cb 1.36 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.89 1l7x h GLN 576 CO 0.50 0.00 -0.15 -0.07 -1.50 0.00 0.00 178.83 177.61 1l7x h LEU 577 N 0.00 -0.36 -0.60 1.46 3.38 -1.90 -1.29 115.31 116.00 1l7x h LEU 577 Ca 0.00 -0.12 0.10 0.00 0.09 0.00 0.00 57.88 57.95 1l7x h LEU 577 Cb 0.52 0.09 -0.11 0.00 0.09 0.00 0.00 40.66 41.25 1l7x h LEU 577 CO 0.00 -0.08 -0.36 0.25 0.09 0.00 0.00 178.44 178.34 1l7x h LEU 578 N -0.65 -1.26 -0.90 1.67 5.85 -1.88 0.82 115.31 118.94 1l7x h LEU 578 Ca -0.04 0.24 0.15 0.00 0.84 0.00 0.00 57.88 59.06 1l7x h LEU 578 Cb 0.46 0.61 -0.09 0.00 0.37 0.00 0.00 40.66 42.01 1l7x h LEU 578 CO 0.07 -0.31 0.51 -1.13 -0.34 0.00 0.00 178.44 177.24 1l7x h ASN 579 N -0.17 0.66 -0.30 1.25 -0.73 -1.53 0.17 115.58 114.93 1l7x h ASN 579 Ca 0.22 0.08 -0.08 0.00 1.87 0.00 0.00 56.30 58.39 1l7x h ASN 579 Cb 0.56 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 39.09 1l7x h ASN 579 CO -0.69 0.30 -0.08 0.00 -0.37 0.00 0.00 177.43 176.58 1l7x h LEU 581 N 0.64 0.00 0.08 0.00 3.38 0.31 -2.61 115.31 117.11 1l7x h LEU 581 Ca 0.12 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.89 1l7x h LEU 581 Cb 0.51 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.28 1l7x h LEU 581 CO 0.03 0.26 -0.83 -0.74 0.09 0.00 0.00 178.44 177.25 1l7x h HIS 582 N 0.00 0.69 -0.69 1.13 2.76 -0.52 -2.22 115.15 116.31 1l7x h HIS 582 Ca -0.00 -0.43 0.05 0.00 -2.20 0.00 0.00 60.37 57.79 1l7x h HIS 582 Cb 0.57 -0.06 -0.05 0.00 1.55 0.00 0.00 27.41 29.42 1l7x h HIS 582 CO 0.00 1.28 0.40 0.28 -1.30 0.00 0.00 177.93 178.59 1l7x h VAL 583 N -0.09 1.00 -0.32 5.26 2.07 -1.17 0.02 116.25 123.02 1l7x h VAL 583 Ca -0.13 -0.25 -0.12 0.00 0.82 0.00 0.00 66.70 67.02 1l7x h VAL 583 Cb 1.57 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1l7x h VAL 583 CO 0.16 0.14 -0.27 0.40 0.02 0.00 0.00 177.57 178.02 1l7x h ILE 584 N 0.74 1.29 -0.95 4.57 2.04 -1.55 -0.86 117.51 122.80 1l7x h ILE 584 Ca 0.30 -1.42 0.12 0.00 1.00 0.00 0.00 64.86 64.86 1l7x h ILE 584 Cb 0.15 1.50 -0.08 0.00 -0.74 0.00 0.00 36.82 37.66 1l7x h ILE 584 CO -0.16 0.46 0.61 0.74 0.00 0.00 0.00 178.15 179.79 1l7x h THR 585 N 0.50 0.91 -0.07 -0.27 2.02 -0.77 0.10 112.91 115.33 1l7x h THR 585 Ca 0.06 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 1l7x h THR 585 Cb 0.83 -0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1l7x h THR 585 CO 0.07 0.16 -0.05 0.24 0.37 0.00 0.00 175.52 176.32 1l7x h MET 586 N 0.90 0.15 -0.63 6.66 2.86 -0.72 -2.93 114.93 121.23 1l7x h MET 586 Ca 0.47 -0.07 0.13 0.00 -2.06 0.00 0.00 59.70 58.16 1l7x h MET 586 Cb 0.53 -0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.09 1l7x h MET 586 CO -0.23 0.55 0.05 -0.92 1.06 0.00 0.00 176.91 177.42 1l7x h TYR 587 N -0.25 0.05 0.00 -0.22 3.20 0.28 0.39 116.97 120.41 1l7x h TYR 587 Ca 0.01 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1l7x h TYR 587 Cb 0.52 0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.86 1l7x h TYR 587 CO 0.08 -0.13 0.00 0.09 -1.64 0.00 0.00 178.16 176.56 1l7x n ASN 588 N -5.23 0.59 0.08 -2.11 3.02 0.22 -2.56 115.26 109.25 1l7x n ASN 588 Ca 0.10 0.69 -0.23 0.00 -0.03 0.00 0.00 54.58 55.10 1l7x n ASN 588 Cb 0.36 -0.80 -0.15 0.00 -0.61 0.00 0.00 39.78 38.59 1l7x n ASN 588 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1l7x h ARG 589 N 0.00 0.40 -0.57 3.52 3.08 -0.06 -3.15 114.38 117.60 1l7x h ARG 589 Ca 0.00 -0.69 -0.10 0.00 0.07 0.00 0.00 59.98 59.26 1l7x h ARG 589 Cb 0.23 0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 1l7x h ARG 589 CO 0.00 1.33 -0.04 0.82 -1.07 0.00 0.00 179.97 181.01 1l7x h ILE 590 N 0.09 1.27 0.00 2.04 2.04 -1.13 -1.77 117.51 120.04 1l7x h ILE 590 Ca -0.34 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.34 1l7x h ILE 590 Cb 2.09 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 39.05 1l7x h ILE 590 CO 0.18 0.42 0.00 0.29 0.00 0.00 0.00 178.15 179.04 1l7x n LYS 591 N -4.20 0.15 0.04 2.37 4.76 -1.06 -1.80 118.16 118.43 1l7x n LYS 591 Ca 0.02 0.41 -0.13 0.00 -2.87 0.00 0.00 58.31 55.73 1l7x n LYS 591 Cb 0.36 -1.80 -0.14 0.00 -1.84 0.00 0.00 35.03 31.61 1l7x n LYS 591 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1l7x h LYS 592 N 0.00 0.15 -1.50 1.97 3.64 -1.29 -3.43 116.57 116.11 1l7x h LYS 592 Ca 0.00 -0.25 -0.30 0.00 -1.27 0.00 0.00 60.65 58.82 1l7x h LYS 592 Cb 0.32 0.09 -0.24 0.00 -0.41 0.00 0.00 32.23 31.99 1l7x h LYS 592 CO 0.00 0.94 -0.66 0.34 -2.27 0.00 0.00 179.45 177.80 1l7x s ASP 593 N -6.71 -0.37 0.00 4.20 -1.08 -0.97 -5.01 116.67 106.73 1l7x s ASP 593 Ca -0.07 -2.13 0.00 0.00 -0.52 0.00 0.00 52.55 49.82 1l7x s ASP 593 Cb 0.08 1.06 0.00 0.00 -1.46 0.00 0.00 42.92 42.59 1l7x s ASP 593 CO 0.83 -0.11 0.59 -2.65 0.52 0.00 0.00 175.17 174.35 1l7x n PRO 594 N 3.04 0.00 -0.00 4.34 -0.02 -0.74 -0.54 135.00 141.08 1l7x n PRO 594 Ca 0.21 0.16 0.02 0.00 -2.02 0.00 0.00 63.50 61.87 1l7x n PRO 594 Cb 0.53 -1.56 0.01 0.00 -0.02 0.00 0.00 33.50 32.46 1l7x n PRO 594 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1l7x n LYS 595 N -1.09 -0.48 -2.59 -0.52 5.02 -1.26 -5.00 118.16 112.24 1l7x n LYS 595 Ca 0.00 -0.71 -0.42 0.00 -2.02 0.00 0.00 58.31 55.16 1l7x n LYS 595 Cb 0.06 -1.06 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 1l7x n LYS 595 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1l7x s LYS 596 N -0.28 4.45 -0.20 1.97 2.20 0.30 -4.94 119.74 123.23 1l7x s LYS 596 Ca 0.04 1.53 -0.39 0.00 -0.36 0.00 0.00 55.97 56.79 1l7x s LYS 596 Cb 0.03 -3.49 -0.16 0.00 -1.51 0.00 0.00 37.83 32.70 1l7x s LYS 596 CO 0.04 -0.26 1.69 1.28 -0.36 0.00 0.00 175.35 177.74 1l7x n LEU 597 N 4.56 2.34 -4.00 5.43 7.99 -1.26 -4.96 117.00 127.10 1l7x n LEU 597 Ca 0.09 1.08 -0.27 0.00 -0.01 0.00 0.00 56.01 56.89 1l7x n LEU 597 Cb 0.48 -1.17 -0.17 0.00 -0.11 0.00 0.00 43.42 42.46 1l7x n LEU 597 CO 0.53 -0.51 -0.47 0.12 -1.51 0.00 0.00 177.39 175.56 1l7x s PHE 598 N 3.06 1.74 -0.52 -1.77 5.36 -1.26 -5.08 117.98 119.51 1l7x s PHE 598 Ca 0.96 -0.82 -0.27 0.00 -0.96 0.00 0.00 56.93 55.83 1l7x s PHE 598 Cb -1.03 -1.31 -0.01 0.00 -0.34 0.00 0.00 43.02 40.34 1l7x s PHE 598 CO 0.62 -0.46 1.71 0.08 -1.46 0.00 0.00 175.22 175.70 1l7x s VAL 599 N 1.17 3.52 0.27 3.12 1.01 -1.26 -4.93 120.40 123.29 1l7x s VAL 599 Ca -0.04 0.42 -0.28 0.00 0.00 0.00 0.00 61.98 62.08 1l7x s VAL 599 Cb -0.14 -4.01 -0.15 0.00 0.00 0.00 0.00 36.38 32.08 1l7x s VAL 599 CO -0.03 -0.85 0.96 -0.81 0.00 0.00 0.00 175.10 174.36 1l7x n PRO 600 N 8.82 1.15 -3.94 2.72 -0.04 -1.26 -4.88 135.00 137.58 1l7x n PRO 600 Ca 0.19 0.40 -0.10 0.00 -0.04 0.00 0.00 63.50 63.95 1l7x n PRO 600 Cb 0.50 -1.73 -0.11 0.00 -0.04 0.00 0.00 33.50 32.11 1l7x n PRO 600 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1l7x s ARG 601 N -1.37 0.29 -0.31 0.54 0.52 -0.51 -0.94 118.95 117.17 1l7x s ARG 601 Ca 0.61 -0.44 0.03 0.00 -0.52 0.00 0.00 55.73 55.41 1l7x s ARG 601 Cb -0.75 0.11 0.09 0.00 0.52 0.00 0.00 34.95 34.92 1l7x s ARG 601 CO 0.59 -0.05 0.02 0.99 0.02 0.00 0.00 175.30 176.86 1l7x s THR 602 N -1.14 2.07 -0.25 0.02 2.01 -0.28 -2.43 115.64 115.65 1l7x s THR 602 Ca -0.12 -2.04 -0.20 0.00 0.31 0.00 0.00 61.69 59.63 1l7x s THR 602 Cb -0.08 -2.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.97 1l7x s THR 602 CO -0.00 -0.46 0.62 -0.69 -0.69 0.00 0.00 174.62 173.40 1l7x s VAL 603 N 1.04 4.99 -0.23 3.82 1.01 0.68 -2.13 120.40 129.58 1l7x s VAL 603 Ca 0.06 1.12 -0.02 0.00 0.00 0.00 0.00 61.98 63.14 1l7x s VAL 603 Cb -0.19 -3.93 0.01 0.00 0.00 0.00 0.00 36.38 32.28 1l7x s VAL 603 CO -0.09 0.04 -0.08 -0.63 0.00 0.00 0.00 175.10 174.34 1l7x s ILE 604 N 2.46 2.92 -0.19 2.22 1.01 0.97 -0.13 121.20 130.45 1l7x s ILE 604 Ca 0.26 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 60.08 1l7x s ILE 604 Cb -0.16 -2.40 0.04 0.00 0.01 0.00 0.00 42.46 39.96 1l7x s ILE 604 CO 0.09 0.32 -0.10 -0.63 0.00 0.00 0.00 174.94 174.62 1l7x s ILE 605 N 1.37 1.57 0.24 2.92 1.01 -0.40 -0.93 121.20 126.99 1l7x s ILE 605 Ca 0.03 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.75 1l7x s ILE 605 Cb -0.15 -1.65 -0.05 0.00 0.01 0.00 0.00 42.46 40.62 1l7x s ILE 605 CO -0.05 0.18 0.09 -0.83 0.00 0.00 0.00 174.94 174.33 1l7x s GLY 606 N 1.43 1.66 0.00 6.18 0.00 -0.82 -2.03 107.32 113.73 1l7x s GLY 606 Ca -0.01 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 42.89 1l7x s GLY 606 CO -0.08 -1.57 0.00 0.61 0.00 0.00 0.00 173.10 172.06 1l7x n GLY 607 N -0.42 4.35 3.93 0.20 0.00 -1.25 -2.51 105.19 109.49 1l7x n GLY 607 Ca -0.00 -1.30 -0.26 0.00 0.00 0.00 0.00 46.02 44.46 1l7x n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l7x s LYS 608 N -3.18 3.53 -0.08 1.61 1.02 -1.26 -4.66 119.74 116.73 1l7x s LYS 608 Ca 0.00 -0.24 0.04 0.00 0.02 0.00 0.00 55.97 55.79 1l7x s LYS 608 Cb 0.00 -2.68 -0.02 0.00 -0.52 0.00 0.00 37.83 34.62 1l7x s LYS 608 CO 0.00 0.19 -0.19 0.00 -0.92 0.00 0.00 175.35 174.43 1l7x s ALA 609 N -2.20 2.42 0.21 5.17 0.00 -1.26 -1.10 121.76 124.99 1l7x s ALA 609 Ca 0.41 -0.98 -0.32 0.00 0.00 0.00 0.00 51.96 51.07 1l7x s ALA 609 Cb -0.10 -0.91 -0.12 0.00 0.00 0.00 0.00 23.12 21.99 1l7x s ALA 609 CO 0.34 0.40 1.68 0.00 0.00 0.00 0.00 175.76 178.17 1l7x n ALA 610 N 2.98 2.54 -0.34 0.00 0.00 -1.26 -4.86 120.51 119.57 1l7x n ALA 610 Ca -0.18 0.40 0.20 0.00 0.00 0.00 0.00 53.44 53.86 1l7x n ALA 610 Cb 0.52 -2.48 0.38 0.00 0.00 0.00 0.00 19.45 17.86 1l7x n ALA 610 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1l7x h PRO 611 N 6.30 0.01 -0.06 0.00 0.11 -1.99 0.23 132.00 136.60 1l7x h PRO 611 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1l7x h PRO 611 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1l7x h PRO 611 CO 0.92 0.01 0.00 0.41 -0.21 0.00 0.00 178.00 179.13 1l7x n GLY 612 N -1.43 -0.02 3.52 -0.55 0.00 -1.26 -4.75 105.19 100.70 1l7x n GLY 612 Ca 0.27 -0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 1l7x n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1l7x s TYR 613 N -1.94 2.89 0.15 1.61 6.14 0.81 -4.88 117.35 122.13 1l7x s TYR 613 Ca 0.37 -1.33 -0.21 0.00 0.64 0.00 0.00 57.07 56.54 1l7x s TYR 613 Cb 0.20 -4.53 0.03 0.00 0.42 0.00 0.00 41.96 38.07 1l7x s TYR 613 CO 0.31 -1.71 1.65 1.25 0.64 0.00 0.00 175.55 177.70 1l7x h HIS 614 N 8.74 -0.45 -0.70 4.97 -0.00 -1.85 -1.57 115.15 124.28 1l7x h HIS 614 Ca 0.25 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.62 1l7x h HIS 614 Cb 0.97 0.24 -0.03 0.00 -0.00 0.00 0.00 27.41 28.58 1l7x h HIS 614 CO 1.25 -0.25 0.32 1.98 -0.00 0.00 0.00 177.93 181.22 1l7x h MET 615 N -0.17 1.00 -0.68 5.26 1.85 -1.98 -0.82 114.93 119.40 1l7x h MET 615 Ca 0.14 -0.14 -0.03 0.00 -0.61 0.00 0.00 59.70 59.05 1l7x h MET 615 Cb 0.38 -0.18 -0.03 0.00 0.43 0.00 0.00 31.60 32.20 1l7x h MET 615 CO -0.35 0.78 0.30 0.00 -0.40 0.00 0.00 176.91 177.24 1l7x h ALA 616 N 1.36 0.87 -0.13 0.39 0.00 -1.77 -0.85 119.26 119.13 1l7x h ALA 616 Ca 0.24 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1l7x h ALA 616 Cb 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1l7x h ALA 616 CO -0.03 0.47 -0.31 0.87 0.00 0.00 0.00 179.25 180.24 1l7x h LYS 617 N 0.95 0.24 -0.43 0.00 1.57 -0.77 -1.99 116.57 116.15 1l7x h LYS 617 Ca 0.23 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 1l7x h LYS 617 Cb 0.16 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1l7x h LYS 617 CO -0.02 0.54 -0.02 0.52 -0.57 0.00 0.00 179.45 179.89 1l7x h MET 618 N 0.21 0.78 -0.32 3.15 2.86 -0.45 -2.22 114.93 118.95 1l7x h MET 618 Ca 0.03 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.40 1l7x h MET 618 Cb 0.67 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.25 1l7x h MET 618 CO 0.05 0.86 0.15 0.82 1.06 0.00 0.00 176.91 179.85 1l7x h ILE 619 N 0.61 1.11 -0.11 -1.22 2.04 -0.86 -0.04 117.51 119.05 1l7x h ILE 619 Ca 0.12 -0.32 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1l7x h ILE 619 Cb 0.52 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1l7x h ILE 619 CO 0.03 0.13 -0.06 0.40 0.00 0.00 0.00 178.15 178.65 1l7x h ILE 620 N 0.44 1.32 -0.23 -0.67 2.04 -1.08 -1.41 117.51 117.92 1l7x h ILE 620 Ca 0.11 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.86 1l7x h ILE 620 Cb 0.05 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1l7x h ILE 620 CO -0.02 0.31 0.03 0.50 0.00 0.00 0.00 178.15 178.98 1l7x h LYS 621 N -0.12 0.32 -0.17 2.37 1.63 -0.79 -0.40 116.57 119.42 1l7x h LYS 621 Ca 0.02 -0.05 -0.20 0.00 -0.85 0.00 0.00 60.65 59.58 1l7x h LYS 621 Cb 0.51 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 1l7x h LYS 621 CO 0.02 0.33 -0.69 1.25 -3.45 0.00 0.00 179.45 176.90 1l7x h LEU 622 N 0.32 0.80 -0.44 5.20 5.85 -0.92 -2.06 115.31 124.07 1l7x h LEU 622 Ca 0.08 -0.49 -0.15 0.00 0.84 0.00 0.00 57.88 58.15 1l7x h LEU 622 Cb 0.17 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1l7x h LEU 622 CO 0.00 1.27 -0.33 0.40 -0.34 0.00 0.00 178.44 179.44 1l7x h ILE 623 N 0.49 1.27 -0.08 4.05 2.04 -0.61 -1.64 117.51 123.04 1l7x h ILE 623 Ca -0.03 -1.50 -0.14 0.00 1.00 0.00 0.00 64.86 64.20 1l7x h ILE 623 Cb 1.29 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 1l7x h ILE 623 CO 0.14 0.51 -0.57 0.71 0.00 0.00 0.00 178.15 178.93 1l7x h THR 624 N 0.79 1.37 -0.10 -0.27 1.35 -1.11 -1.15 112.91 113.80 1l7x h THR 624 Ca 0.08 -1.90 -0.03 0.00 -0.55 0.00 0.00 66.41 64.01 1l7x h THR 624 Cb 0.91 1.95 -0.00 0.00 -1.73 0.00 0.00 68.15 69.28 1l7x h THR 624 CO 0.09 0.56 -0.04 0.28 -0.25 0.00 0.00 175.52 176.16 1l7x h SER 625 N 0.18 0.21 0.02 5.36 0.02 -1.32 -1.40 113.55 116.61 1l7x h SER 625 Ca -0.00 -0.41 0.02 0.00 -0.84 0.00 0.00 61.79 60.56 1l7x h SER 625 Cb 1.06 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.52 1l7x h SER 625 CO 0.09 0.57 -0.11 0.58 -1.14 0.00 0.00 176.83 176.82 1l7x h VAL 626 N -0.15 0.73 -0.44 2.27 2.07 -1.27 -2.29 116.25 117.17 1l7x h VAL 626 Ca 0.02 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.63 1l7x h VAL 626 Cb 0.49 0.73 -0.09 0.00 -1.52 0.00 0.00 31.29 30.89 1l7x h VAL 626 CO 0.01 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 177.38 1l7x h ALA 627 N 0.76 0.09 -0.49 1.67 0.00 -1.12 0.49 119.26 120.66 1l7x h ALA 627 Ca 0.04 0.15 0.11 0.00 0.00 0.00 0.00 54.91 55.21 1l7x h ALA 627 Cb 0.24 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1l7x h ALA 627 CO -0.10 -0.58 0.34 -0.44 0.00 0.00 0.00 179.25 178.47 1l7x h ASP 628 N -0.13 0.16 0.57 0.00 5.19 -0.88 0.17 116.42 121.49 1l7x h ASP 628 Ca 0.21 0.00 -0.28 0.00 -0.62 0.00 0.00 57.03 56.34 1l7x h ASP 628 Cb 0.46 -0.03 0.01 0.00 0.18 0.00 0.00 39.33 39.95 1l7x h ASP 628 CO -0.52 0.09 -1.26 0.58 -3.12 0.00 0.00 179.24 175.01 1l7x h VAL 629 N 0.17 1.47 0.15 -1.35 2.07 -0.42 -3.17 116.25 115.17 1l7x h VAL 629 Ca 0.23 -2.99 -0.25 0.00 0.82 0.00 0.00 66.70 64.51 1l7x h VAL 629 Cb 0.68 2.94 0.03 0.00 -1.52 0.00 0.00 31.29 33.42 1l7x h VAL 629 CO -0.04 0.88 -1.07 0.58 0.02 0.00 0.00 177.57 177.94 1l7x h VAL 630 N 0.09 1.39 0.00 2.57 2.07 -0.33 -2.94 116.25 119.10 1l7x h VAL 630 Ca -0.15 -2.51 -0.05 0.00 0.82 0.00 0.00 66.70 64.81 1l7x h VAL 630 Cb 1.98 2.98 -0.01 0.00 -1.52 0.00 0.00 31.29 34.72 1l7x h VAL 630 CO 0.21 0.74 -0.24 0.78 0.02 0.00 0.00 177.57 179.08 1l7x h ASN 631 N -0.06 0.00 -0.02 0.57 4.21 -0.85 -3.10 115.58 116.34 1l7x h ASN 631 Ca -0.18 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.33 1l7x h ASN 631 Cb 1.81 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 39.01 1l7x h ASN 631 CO 0.20 0.24 -0.29 0.59 -1.29 0.00 0.00 177.43 176.88 1l7x n ASN 632 N -3.69 1.94 -4.64 5.81 3.02 -1.20 -4.91 115.26 111.59 1l7x n ASN 632 Ca -0.01 -1.47 -0.43 0.00 -0.03 0.00 0.00 54.58 52.64 1l7x n ASN 632 Cb 0.35 0.36 -0.02 0.00 -0.61 0.00 0.00 39.78 39.86 1l7x n ASN 632 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1l7x s ASP 633 N -1.95 6.63 0.33 6.41 3.68 -1.11 -4.90 116.67 125.77 1l7x s ASP 633 Ca 0.17 1.49 0.04 0.00 2.13 0.00 0.00 52.55 56.37 1l7x s ASP 633 Cb 0.15 -2.54 0.65 0.00 -1.45 0.00 0.00 42.92 39.73 1l7x s ASP 633 CO 0.40 -1.06 1.93 -0.65 0.13 0.00 0.00 175.17 175.92 1l7x h PRO 634 N 9.54 0.85 0.00 4.34 0.11 -1.91 -2.67 132.00 142.26 1l7x h PRO 634 Ca -0.29 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.74 1l7x h PRO 634 Cb 1.12 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1l7x h PRO 634 CO 1.01 0.56 -0.14 1.98 -0.21 0.00 0.00 178.00 181.21 1l7x h MET 635 N 0.88 0.00 0.10 1.05 4.05 -1.97 -3.09 114.93 115.96 1l7x h MET 635 Ca 0.36 0.00 -0.30 0.00 -0.28 0.00 0.00 59.70 59.48 1l7x h MET 635 Cb 0.28 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.06 1l7x h MET 635 CO -0.13 0.14 -1.53 -0.24 0.23 0.00 0.00 176.91 175.37 1l7x h VAL 636 N 0.00 1.14 0.00 -5.77 3.04 -1.81 -3.48 116.25 109.37 1l7x h VAL 636 Ca -0.00 -2.81 0.00 0.00 -1.01 0.00 0.00 66.70 62.88 1l7x h VAL 636 Cb 0.55 2.73 0.00 0.00 -2.01 0.00 0.00 31.29 32.56 1l7x h VAL 636 CO 0.02 0.80 0.00 0.61 -1.01 0.00 0.00 177.57 177.99 1l7x n GLY 637 N 1.65 2.09 0.47 3.17 0.00 -1.17 -1.82 105.19 109.58 1l7x n GLY 637 Ca -0.16 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1l7x n GLY 637 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1l7x n SER 638 N -0.12 0.84 0.02 1.61 3.41 -1.26 -3.56 113.62 114.56 1l7x n SER 638 Ca 0.00 -1.79 -0.05 0.00 -0.26 0.00 0.00 58.87 56.78 1l7x n SER 638 Cb 0.00 -0.42 -0.11 0.00 -0.26 0.00 0.00 64.21 63.42 1l7x n SER 638 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1l7x h LYS 639 N 0.10 0.00 -2.31 4.33 1.57 -1.71 -3.44 116.57 115.11 1l7x h LYS 639 Ca 0.00 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.71 1l7x h LYS 639 Cb 0.42 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 32.52 1l7x h LYS 639 CO 0.00 0.49 -0.01 -1.17 -0.57 0.00 0.00 179.45 178.19 1l7x s LEU 640 N -6.09 -0.26 -0.10 2.94 2.96 -1.23 -1.42 118.68 115.47 1l7x s LEU 640 Ca -0.03 1.08 -0.06 0.00 -0.22 0.00 0.00 54.13 54.90 1l7x s LEU 640 Cb 0.08 2.06 0.04 0.00 0.50 0.00 0.00 46.19 48.87 1l7x s LEU 640 CO 0.81 -0.27 0.25 -0.54 -1.32 0.00 0.00 176.35 175.28 1l7x s LYS 641 N 0.03 0.23 -0.14 1.98 -0.14 -1.02 -4.67 119.74 116.02 1l7x s LYS 641 Ca -0.02 0.49 -0.04 0.00 -1.36 0.00 0.00 55.97 55.04 1l7x s LYS 641 Cb -0.04 -0.05 -0.03 0.00 -1.68 0.00 0.00 37.83 36.03 1l7x s LYS 641 CO 0.02 -0.13 -0.02 0.08 -0.76 0.00 0.00 175.35 174.55 1l7x s VAL 642 N 0.96 4.10 -0.11 3.17 1.01 -1.26 -0.23 120.40 128.04 1l7x s VAL 642 Ca -0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 1l7x s VAL 642 Cb -0.08 -2.78 0.03 0.00 0.00 0.00 0.00 36.38 33.55 1l7x s VAL 642 CO -0.06 0.52 -0.05 -0.63 0.00 0.00 0.00 175.10 174.88 1l7x s ILE 643 N 0.02 0.83 -0.47 2.22 -1.09 0.82 -4.87 121.20 118.66 1l7x s ILE 643 Ca 0.02 -0.22 -0.21 0.00 -2.23 0.00 0.00 60.65 58.00 1l7x s ILE 643 Cb -0.13 -0.93 0.03 0.00 -1.58 0.00 0.00 42.46 39.85 1l7x s ILE 643 CO 0.02 0.29 0.70 0.12 -1.23 0.00 0.00 174.94 174.84 1l7x s PHE 644 N 1.78 3.01 -0.47 3.97 5.36 -1.26 -1.27 117.98 129.11 1l7x s PHE 644 Ca 0.04 -0.11 -0.28 0.00 -0.96 0.00 0.00 56.93 55.62 1l7x s PHE 644 Cb -0.13 -3.53 -0.01 0.00 -0.34 0.00 0.00 43.02 39.02 1l7x s PHE 644 CO -0.07 -0.98 1.64 -1.17 -1.46 0.00 0.00 175.22 173.18 1l7x s LEU 645 N 3.00 3.44 0.57 6.12 2.96 -0.86 -4.94 118.68 128.98 1l7x s LEU 645 Ca 0.23 0.72 -0.19 0.00 -0.22 0.00 0.00 54.13 54.67 1l7x s LEU 645 Cb -0.15 -3.17 -0.04 0.00 0.50 0.00 0.00 46.19 43.33 1l7x s LEU 645 CO 0.18 -1.82 1.20 -1.61 -1.32 0.00 0.00 176.35 172.99 1l7x s GLU 646 N 5.81 3.10 -1.37 1.98 2.02 -1.26 -3.84 118.70 125.14 1l7x s GLU 646 Ca 0.66 1.82 -0.00 0.00 0.02 0.00 0.00 54.97 57.47 1l7x s GLU 646 Cb -0.15 -2.00 0.00 0.00 0.10 0.00 0.00 34.13 32.08 1l7x s GLU 646 CO 0.28 -1.10 0.52 -1.71 0.02 0.00 0.00 175.26 173.27 1l7x n ASN 647 N -1.42 -0.64 -4.71 -0.19 5.15 -1.21 -4.89 115.26 107.34 1l7x n ASN 647 Ca 0.13 -0.94 -0.42 0.00 -0.60 0.00 0.00 54.58 52.74 1l7x n ASN 647 Cb 0.49 -3.41 -0.03 0.00 -0.53 0.00 0.00 39.78 36.30 1l7x n ASN 647 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1l7x n TYR 648 N -4.36 2.72 -3.64 1.20 9.36 -1.26 -4.87 117.16 116.32 1l7x n TYR 648 Ca -0.30 0.04 -0.09 0.00 3.32 0.00 0.00 57.90 60.86 1l7x n TYR 648 Cb 0.68 -2.67 -0.02 0.00 -0.63 0.00 0.00 39.34 36.70 1l7x n TYR 648 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 1l7x s ARG 649 N 1.24 1.53 0.28 2.98 1.70 -1.26 -4.72 118.95 120.69 1l7x s ARG 649 Ca 0.76 -0.73 -0.04 0.00 -0.47 0.00 0.00 55.73 55.25 1l7x s ARG 649 Cb -0.51 0.60 0.57 0.00 -0.57 0.00 0.00 34.95 35.03 1l7x s ARG 649 CO 0.33 -0.69 1.59 0.28 -1.08 0.00 0.00 175.30 175.73 1l7x h VAL 650 N 2.00 0.14 -0.31 4.99 2.07 -1.96 0.17 116.25 123.34 1l7x h VAL 650 Ca -0.27 -0.01 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 1l7x h VAL 650 Cb 1.28 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1l7x h VAL 650 CO 0.31 0.01 -0.07 0.77 0.02 0.00 0.00 177.57 178.60 1l7x h SER 651 N 0.04 0.48 0.32 0.57 4.64 -1.97 -2.11 113.55 115.53 1l7x h SER 651 Ca 0.50 -0.11 -0.23 0.00 -0.47 0.00 0.00 61.79 61.49 1l7x h SER 651 Cb 0.93 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1l7x h SER 651 CO -0.85 0.60 -0.94 0.25 -0.87 0.00 0.00 176.83 175.02 1l7x h LEU 652 N 0.47 0.54 -1.09 5.97 6.46 -1.18 -3.16 115.31 123.32 1l7x h LEU 652 Ca 0.09 -0.43 0.01 0.00 -0.12 0.00 0.00 57.88 57.44 1l7x h LEU 652 Cb 0.42 -0.17 -0.05 0.00 -0.73 0.00 0.00 40.66 40.14 1l7x h LEU 652 CO 0.02 1.23 0.61 0.00 -0.62 0.00 0.00 178.44 179.68 1l7x h ALA 653 N 0.74 1.35 0.00 1.25 0.00 -0.45 0.18 119.26 122.32 1l7x h ALA 653 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1l7x h ALA 653 Cb 1.57 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1l7x h ALA 653 CO 0.16 0.60 0.00 0.93 0.00 0.00 0.00 179.25 180.94 1l7x h GLU 654 N 1.24 0.00 0.00 0.00 5.08 -1.36 -1.55 114.58 118.00 1l7x h GLU 654 Ca 0.34 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.63 1l7x h GLU 654 Cb -0.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1l7x h GLU 654 CO -0.08 0.00 -0.76 1.63 -1.00 0.00 0.00 179.01 178.80 1l7x n LYS 655 N -2.61 0.49 0.08 2.33 5.02 0.52 -4.48 118.16 119.51 1l7x n LYS 655 Ca -0.00 0.54 -0.07 0.00 -2.02 0.00 0.00 58.31 56.76 1l7x n LYS 655 Cb 0.16 -1.71 0.05 0.00 -0.02 0.00 0.00 35.03 33.51 1l7x n LYS 655 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 1l7x h VAL 656 N -1.00 1.45 0.19 -0.18 3.04 -1.28 -3.34 116.25 115.13 1l7x h VAL 656 Ca -0.11 -2.33 0.01 0.00 -1.01 0.00 0.00 66.70 63.26 1l7x h VAL 656 Cb 0.76 2.26 -0.03 0.00 -2.01 0.00 0.00 31.29 32.27 1l7x h VAL 656 CO -0.07 0.68 -0.32 0.40 -1.01 0.00 0.00 177.57 177.26 1l7x h ILE 657 N 0.14 0.33 0.00 3.17 2.04 -1.52 -1.70 117.51 119.97 1l7x h ILE 657 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1l7x h ILE 657 Cb 1.33 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1l7x h ILE 657 CO 0.12 0.00 0.04 -0.65 0.00 0.00 0.00 178.15 177.66 1l7x h PRO 658 N -0.59 0.00 -0.16 2.37 0.11 -1.79 -0.83 132.00 131.12 1l7x h PRO 658 Ca 0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.12 1l7x h PRO 658 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 1l7x h PRO 658 CO -0.14 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.65 1l7x n ALA 659 N -2.04 2.48 -1.92 -0.75 0.00 -0.69 -4.76 120.51 112.85 1l7x n ALA 659 Ca -0.03 -0.69 -0.39 0.00 0.00 0.00 0.00 53.44 52.33 1l7x n ALA 659 Cb 0.10 -0.96 -0.06 0.00 0.00 0.00 0.00 19.45 18.53 1l7x n ALA 659 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1l7x s THR 660 N -1.81 4.29 -0.22 0.00 2.01 -0.32 -4.60 115.64 114.99 1l7x s THR 660 Ca 0.34 1.80 -0.07 0.00 0.31 0.00 0.00 61.69 64.08 1l7x s THR 660 Cb 0.20 -4.18 -0.11 0.00 0.01 0.00 0.00 72.50 68.42 1l7x s THR 660 CO 0.30 0.50 -0.25 0.47 -0.69 0.00 0.00 174.62 174.95 1l7x n ASP 661 N 1.53 1.88 -4.19 3.53 8.00 -0.80 -4.25 116.55 122.26 1l7x n ASP 661 Ca -0.04 0.13 -0.30 0.00 0.71 0.00 0.00 54.79 55.29 1l7x n ASP 661 Cb 0.48 -0.55 -0.17 0.00 -0.02 0.00 0.00 41.12 40.87 1l7x n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1l7x s LEU 662 N -6.87 1.98 -0.19 0.64 2.96 -0.51 -0.45 118.68 116.25 1l7x s LEU 662 Ca -0.31 -0.47 -0.05 0.00 -0.22 0.00 0.00 54.13 53.08 1l7x s LEU 662 Cb 0.10 -1.23 -0.03 0.00 0.50 0.00 0.00 46.19 45.53 1l7x s LEU 662 CO 0.43 0.16 0.01 -0.55 -1.32 0.00 0.00 176.35 175.08 1l7x s SER 663 N 0.22 5.02 -0.39 3.68 0.15 0.27 -1.39 113.70 121.26 1l7x s SER 663 Ca -0.12 -0.12 -0.19 0.00 0.70 0.00 0.00 55.95 56.22 1l7x s SER 663 Cb -0.16 -1.85 0.01 0.00 -1.71 0.00 0.00 66.02 62.31 1l7x s SER 663 CO 0.06 0.11 0.54 -1.61 1.20 0.00 0.00 173.24 173.54 1l7x s GLU 664 N 0.72 3.43 -0.52 5.44 0.41 -0.01 -1.04 118.70 127.12 1l7x s GLU 664 Ca 0.00 -0.32 0.05 0.00 -0.41 0.00 0.00 54.97 54.29 1l7x s GLU 664 Cb -0.14 -3.88 0.18 0.00 -1.78 0.00 0.00 34.13 28.51 1l7x s GLU 664 CO 0.02 -0.79 0.44 1.04 -0.49 0.00 0.00 175.26 175.47 1l7x n GLN 665 N 5.89 0.93 -1.54 1.61 1.13 -0.78 -4.72 117.38 119.89 1l7x n GLN 665 Ca -0.04 -3.71 -0.22 0.00 -1.94 0.00 0.00 57.00 51.10 1l7x n GLN 665 Cb 0.48 -1.87 0.08 0.00 0.11 0.00 0.00 30.24 29.05 1l7x n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 1l7x n ILE 666 N 2.28 2.80 -2.31 5.09 -5.35 -1.26 -2.75 119.36 117.86 1l7x n ILE 666 Ca 0.26 -3.55 -0.35 0.00 -0.27 0.00 0.00 62.75 58.84 1l7x n ILE 666 Cb 0.44 -0.94 -0.01 0.00 -1.74 0.00 0.00 39.64 37.40 1l7x n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1l7x s SER 667 N -2.92 5.88 0.44 7.28 1.04 -1.26 -4.58 113.70 119.58 1l7x s SER 667 Ca 0.53 2.08 -0.25 0.00 0.48 0.00 0.00 55.95 58.79 1l7x s SER 667 Cb 0.43 -2.57 -0.09 0.00 0.10 0.00 0.00 66.02 63.89 1l7x s SER 667 CO 0.01 -1.11 1.19 0.41 0.98 0.00 0.00 173.24 174.73 1l7x n THR 668 N -1.28 2.68 -1.69 2.02 -1.04 -1.06 -4.65 114.28 109.25 1l7x n THR 668 Ca 0.11 -0.50 -0.44 0.00 -2.04 0.00 0.00 64.05 61.18 1l7x n THR 668 Cb 0.52 -1.45 -0.04 0.00 -1.82 0.00 0.00 70.33 67.54 1l7x n THR 668 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1l7x n ALA 669 N -0.42 2.01 -0.50 2.41 0.00 -1.26 -1.98 120.51 120.78 1l7x n ALA 669 Ca 0.08 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1l7x n ALA 669 Cb 0.40 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.43 1l7x n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l7x n GLY 670 N 3.52 0.75 0.13 0.00 0.00 -1.26 -4.70 105.19 103.63 1l7x n GLY 670 Ca 0.16 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 1l7x n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1l7x n THR 671 N -2.05 1.51 -2.71 2.61 -2.24 -0.84 -4.83 114.28 105.74 1l7x n THR 671 Ca 0.00 -0.56 -0.43 0.00 -2.27 0.00 0.00 64.05 60.79 1l7x n THR 671 Cb 0.00 -1.48 -0.03 0.00 -2.10 0.00 0.00 70.33 66.72 1l7x n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1l7x s GLU 672 N -2.52 3.45 0.31 -0.78 2.56 -1.26 -4.81 118.70 115.65 1l7x s GLU 672 Ca -0.34 0.05 0.04 0.00 0.00 0.00 0.00 54.97 54.72 1l7x s GLU 672 Cb 0.09 -4.02 0.64 0.00 2.00 0.00 0.00 34.13 32.85 1l7x s GLU 672 CO 0.60 -1.54 1.84 0.00 -0.56 0.00 0.00 175.26 175.60 1l7x h ALA 673 N 9.39 1.62 0.00 6.30 0.00 -1.88 -2.41 119.26 132.28 1l7x h ALA 673 Ca -0.25 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1l7x h ALA 673 Cb 1.07 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1l7x h ALA 673 CO 1.13 0.12 0.00 0.45 0.00 0.00 0.00 179.25 180.95 1l7x n SER 674 N -4.61 -2.96 0.00 0.00 2.88 -1.26 -4.13 113.62 103.54 1l7x n SER 674 Ca 0.19 0.79 0.00 0.00 -1.33 0.00 0.00 58.87 58.52 1l7x n SER 674 Cb 0.40 2.82 0.00 0.00 -0.75 0.00 0.00 64.21 66.68 1l7x n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1l7x n GLY 675 N -0.48 -2.29 0.00 0.46 0.00 -1.26 -1.08 105.19 100.53 1l7x n GLY 675 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1l7x n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1l7x n THR 676 N -1.24 0.00 -0.20 2.61 -2.24 -1.26 -4.72 114.28 107.23 1l7x n THR 676 Ca 0.00 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.74 1l7x n THR 676 Cb 0.00 0.02 0.06 0.00 -2.10 0.00 0.00 70.33 68.30 1l7x n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1l7x h GLY 677 N 0.00 0.83 -0.15 3.38 0.00 -1.94 -0.51 103.07 104.69 1l7x h GLY 677 Ca 0.00 -0.25 0.16 0.00 0.00 0.00 0.00 47.33 47.24 1l7x h GLY 677 CO 0.00 0.20 0.11 3.45 0.00 0.00 0.00 176.54 180.30 1l7x h ASN 678 N 0.67 -0.12 -0.44 0.19 -1.07 -1.94 0.51 115.58 113.39 1l7x h ASN 678 Ca 0.24 0.16 0.01 0.00 0.07 0.00 0.00 56.30 56.78 1l7x h ASN 678 Cb 0.05 0.24 -0.03 0.00 -2.07 0.00 0.00 38.32 36.52 1l7x h ASN 678 CO -0.11 -0.09 0.27 0.24 0.07 0.00 0.00 177.43 177.81 1l7x h MET 679 N 0.20 0.54 -0.14 4.14 2.86 -1.42 -1.38 114.93 119.72 1l7x h MET 679 Ca 0.40 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 58.03 1l7x h MET 679 Cb 0.70 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 1l7x h MET 679 CO -0.55 0.36 -0.00 0.87 1.06 0.00 0.00 176.91 178.64 1l7x h LYS 680 N 0.55 0.04 -0.21 1.72 1.57 -0.29 -0.61 116.57 119.35 1l7x h LYS 680 Ca 0.17 -0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.97 1l7x h LYS 680 Cb -0.02 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1l7x h LYS 680 CO -0.06 0.03 0.08 0.74 -0.57 0.00 0.00 179.45 179.66 1l7x h PHE 681 N 0.04 0.14 -0.50 -1.35 0.04 -1.11 -0.74 116.94 113.47 1l7x h PHE 681 Ca 0.07 0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.91 1l7x h PHE 681 Cb 0.08 -0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.15 1l7x h PHE 681 CO -0.15 0.07 0.20 1.98 -0.60 0.00 0.00 178.31 179.81 1l7x h MET 682 N 0.18 0.39 0.00 1.51 4.05 -0.84 -1.11 114.93 119.11 1l7x h MET 682 Ca 0.09 -0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.43 1l7x h MET 682 Cb 0.05 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.75 1l7x h MET 682 CO -0.09 0.26 -0.28 1.25 0.23 0.00 0.00 176.91 178.28 1l7x h LEU 683 N 0.40 0.00 -2.91 3.39 5.85 -0.87 -3.15 115.31 118.02 1l7x h LEU 683 Ca 0.24 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.96 1l7x h LEU 683 Cb 0.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.25 1l7x h LEU 683 CO -0.22 0.28 0.00 0.59 -0.34 0.00 0.00 178.44 178.75 1l7x n ASN 684 N -4.03 4.54 -0.10 1.25 3.02 -0.31 -4.90 115.26 114.74 1l7x n ASN 684 Ca -0.02 -2.65 0.00 0.00 -0.03 0.00 0.00 54.58 51.88 1l7x n ASN 684 Cb 0.34 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.90 1l7x n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l7x n GLY 685 N 0.60 0.76 3.42 7.41 0.00 -1.10 -4.78 105.19 111.50 1l7x n GLY 685 Ca 0.22 -0.68 -0.25 0.00 0.00 0.00 0.00 46.02 45.31 1l7x n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l7x s ALA 686 N -2.21 2.49 0.15 4.61 0.00 -1.04 -4.80 121.76 120.97 1l7x s ALA 686 Ca 0.00 -1.67 -0.05 0.00 0.00 0.00 0.00 51.96 50.23 1l7x s ALA 686 Cb 0.00 -0.29 -0.06 0.00 0.00 0.00 0.00 23.12 22.77 1l7x s ALA 686 CO 0.00 0.36 0.40 -0.51 0.00 0.00 0.00 175.76 176.01 1l7x s LEU 687 N -2.86 4.25 -0.14 0.00 1.43 0.40 -4.44 118.68 117.32 1l7x s LEU 687 Ca 0.22 0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 53.93 1l7x s LEU 687 Cb -0.07 -3.35 -0.02 0.00 0.03 0.00 0.00 46.19 42.78 1l7x s LEU 687 CO 0.10 0.04 -0.08 -0.89 0.23 0.00 0.00 176.35 175.75 1l7x s THR 688 N -1.67 3.49 -0.20 5.49 2.01 -1.26 0.95 115.64 124.44 1l7x s THR 688 Ca 0.42 -0.50 -0.04 0.00 0.31 0.00 0.00 61.69 61.87 1l7x s THR 688 Cb -0.12 -2.50 -0.02 0.00 0.01 0.00 0.00 72.50 69.87 1l7x s THR 688 CO 0.24 0.51 -0.03 -0.51 -0.69 0.00 0.00 174.62 174.13 1l7x s ILE 689 N 0.36 3.60 0.02 1.82 2.07 -0.21 -0.96 121.20 127.91 1l7x s ILE 689 Ca -0.07 -0.43 -0.27 0.00 -1.41 0.00 0.00 60.65 58.46 1l7x s ILE 689 Cb -0.15 -2.62 0.09 0.00 0.13 0.00 0.00 42.46 39.92 1l7x s ILE 689 CO 0.04 0.44 1.24 -0.83 -1.91 0.00 0.00 174.94 173.92 1l7x s GLY 690 N 1.10 -0.11 0.56 1.50 0.00 -0.41 -1.87 107.32 108.10 1l7x s GLY 690 Ca 0.02 0.02 -0.05 0.00 0.00 0.00 0.00 44.72 44.71 1l7x s GLY 690 CO 0.00 4.57 0.86 -0.51 0.00 0.00 0.00 173.10 178.02 1l7x s THR 691 N -2.09 3.78 -1.51 0.90 -4.23 -1.11 -1.93 115.64 109.46 1l7x s THR 691 Ca 0.27 -0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 60.60 1l7x s THR 691 Cb -0.00 -3.48 0.00 0.00 1.34 0.00 0.00 72.50 70.36 1l7x s THR 691 CO 0.00 -0.47 2.46 0.23 -0.54 0.00 0.00 174.62 176.30 1l7x n MET 692 N -2.49 3.19 -4.48 3.99 2.81 -1.26 -4.70 117.12 114.18 1l7x n MET 692 Ca 0.04 -2.52 -0.24 0.00 -1.81 0.00 0.00 57.70 53.17 1l7x n MET 692 Cb 0.57 -3.10 -0.10 0.00 -0.71 0.00 0.00 33.22 29.88 1l7x n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1l7x s ASP 693 N 2.72 3.55 0.00 7.83 3.68 -1.26 -4.68 116.67 128.51 1l7x s ASP 693 Ca 0.54 -1.07 0.00 0.00 2.13 0.00 0.00 52.55 54.15 1l7x s ASP 693 Cb 0.15 -0.30 0.00 0.00 -1.45 0.00 0.00 42.92 41.32 1l7x s ASP 693 CO -0.08 -0.04 0.00 0.61 0.13 0.00 0.00 175.17 175.80 1l7x n GLY 694 N -0.65 1.99 0.00 2.66 0.00 -0.91 -0.72 105.19 107.57 1l7x n GLY 694 Ca -0.05 -0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.00 1l7x n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l7x n ALA 695 N 6.09 2.51 -0.14 4.61 0.00 -0.24 -3.26 120.51 130.08 1l7x n ALA 695 Ca 0.00 -0.16 -0.09 0.00 0.00 0.00 0.00 53.44 53.19 1l7x n ALA 695 Cb 0.00 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.02 1l7x n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1l7x h ASN 696 N 0.00 0.55 -0.60 0.00 2.35 -1.14 -0.74 115.58 116.00 1l7x h ASN 696 Ca 0.00 -0.16 0.12 0.00 -0.55 0.00 0.00 56.30 55.71 1l7x h ASN 696 Cb 0.00 -0.14 -0.10 0.00 0.05 0.00 0.00 38.32 38.13 1l7x h ASN 696 CO 0.00 0.56 0.01 0.58 -1.65 0.00 0.00 177.43 176.94 1l7x h VAL 697 N 0.51 0.52 0.00 2.81 2.07 -1.57 0.34 116.25 120.93 1l7x h VAL 697 Ca 0.14 -0.04 -0.12 0.00 0.82 0.00 0.00 66.70 67.49 1l7x h VAL 697 Cb 0.18 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1l7x h VAL 697 CO -0.01 0.02 -0.59 -0.33 0.02 0.00 0.00 177.57 176.68 1l7x h GLU 698 N 0.13 0.00 -0.44 1.57 5.08 -1.67 -1.29 114.58 117.96 1l7x h GLU 698 Ca 0.31 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.60 1l7x h GLU 698 Cb 0.50 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1l7x h GLU 698 CO -0.50 0.59 0.00 0.52 -1.00 0.00 0.00 179.01 178.63 1l7x h MET 699 N 0.00 0.78 -0.16 2.33 2.86 0.18 -1.82 114.93 119.09 1l7x h MET 699 Ca -0.01 -0.25 -0.00 0.00 -2.06 0.00 0.00 59.70 57.39 1l7x h MET 699 Cb 1.09 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 1l7x h MET 699 CO 0.08 0.84 0.10 0.00 1.06 0.00 0.00 176.91 178.98 1l7x h ALA 700 N 0.91 0.20 -0.96 6.32 0.00 -0.71 -0.13 119.26 124.89 1l7x h ALA 700 Ca 0.13 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.10 1l7x h ALA 700 Cb 0.49 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.14 1l7x h ALA 700 CO 0.02 -0.30 0.60 0.93 0.00 0.00 0.00 179.25 180.51 1l7x h GLU 701 N 0.19 0.99 -0.07 0.00 5.08 -1.07 0.59 114.58 120.29 1l7x h GLU 701 Ca 0.06 -0.06 -0.19 0.00 -1.00 0.00 0.00 59.36 58.17 1l7x h GLU 701 Cb 0.01 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.05 1l7x h GLU 701 CO -0.01 0.65 -0.71 0.93 -1.00 0.00 0.00 179.01 178.88 1l7x h GLU 702 N 1.02 0.60 0.00 2.33 4.39 -0.95 -3.35 114.58 118.61 1l7x h GLU 702 Ca 0.45 -0.55 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1l7x h GLU 702 Cb 0.33 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1l7x h GLU 702 CO -0.22 1.17 -1.08 0.00 -1.16 0.00 0.00 179.01 177.72 1l7x n ALA 703 N -2.59 3.94 0.00 3.43 0.00 -0.09 -4.84 120.51 120.35 1l7x n ALA 703 Ca -0.09 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.85 1l7x n ALA 703 Cb 0.71 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 19.29 1l7x n ALA 703 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l7x n GLY 704 N 1.43 1.36 0.44 0.00 0.00 0.20 -4.58 105.19 104.03 1l7x n GLY 704 Ca 0.02 -1.15 0.23 0.00 0.00 0.00 0.00 46.02 45.13 1l7x n GLY 704 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1l7x h GLU 705 N 0.00 0.00 -0.01 1.61 4.81 -1.81 0.62 114.58 119.80 1l7x h GLU 705 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1l7x h GLU 705 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1l7x h GLU 705 CO 0.00 0.00 0.00 -0.85 -0.73 0.00 0.00 179.01 177.43 1l7x n GLU 706 N -3.54 1.52 -0.60 1.92 0.00 -1.26 -3.42 120.64 115.25 1l7x n GLU 706 Ca 0.13 -0.75 0.09 0.00 0.00 0.00 0.00 57.16 56.63 1l7x n GLU 706 Cb 0.94 -1.48 0.35 0.00 0.00 0.00 0.00 31.44 31.25 1l7x n GLU 706 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1l7x n ASN 707 N -0.09 4.70 -3.94 -1.84 3.02 0.22 -4.87 115.26 112.46 1l7x n ASN 707 Ca 0.20 -2.47 -0.09 0.00 -0.03 0.00 0.00 54.58 52.19 1l7x n ASN 707 Cb 0.30 -0.57 -0.10 0.00 -0.61 0.00 0.00 39.78 38.81 1l7x n ASN 707 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1l7x s LEU 708 N -1.89 1.90 -1.04 3.41 1.02 -1.22 -4.79 118.68 116.07 1l7x s LEU 708 Ca 0.50 -0.54 -0.12 0.00 0.02 0.00 0.00 54.13 53.99 1l7x s LEU 708 Cb 0.33 0.50 0.24 0.00 0.02 0.00 0.00 46.19 47.28 1l7x s LEU 708 CO 0.23 -0.47 1.08 -0.36 0.02 0.00 0.00 176.35 176.85 1l7x s PHE 709 N -2.44 3.95 0.42 0.29 0.40 -0.14 -4.96 117.98 115.50 1l7x s PHE 709 Ca -0.06 -2.34 -0.16 0.00 -0.60 0.00 0.00 56.93 53.76 1l7x s PHE 709 Cb -0.02 -3.94 -0.09 0.00 0.51 0.00 0.00 43.02 39.48 1l7x s PHE 709 CO -0.04 -1.07 0.88 0.42 0.70 0.00 0.00 175.22 176.11 1l7x s ILE 710 N -0.18 4.57 0.08 0.64 -1.09 -1.26 -1.29 121.20 122.68 1l7x s ILE 710 Ca 0.30 1.12 -0.27 0.00 -2.23 0.00 0.00 60.65 59.57 1l7x s ILE 710 Cb -0.08 -3.66 0.08 0.00 -1.58 0.00 0.00 42.46 37.22 1l7x s ILE 710 CO -0.07 -0.43 1.02 0.72 -1.23 0.00 0.00 174.94 174.95 1l7x s PHE 711 N -2.29 -0.15 0.02 3.97 -0.12 -0.81 -4.90 117.98 113.68 1l7x s PHE 711 Ca 0.57 -0.08 0.00 0.00 -0.05 0.00 0.00 56.93 57.37 1l7x s PHE 711 Cb -0.10 0.60 0.00 0.00 -0.63 0.00 0.00 43.02 42.89 1l7x s PHE 711 CO 0.23 -0.65 0.00 0.41 -0.05 0.00 0.00 175.22 175.15 1l7x n GLY 712 N -0.42 -2.24 3.71 1.99 0.00 -1.26 -4.18 105.19 102.78 1l7x n GLY 712 Ca -0.07 -1.51 -0.34 0.00 0.00 0.00 0.00 46.02 44.10 1l7x n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1l7x s MET 713 N -1.02 1.83 0.37 1.61 -1.94 -1.26 -4.90 119.30 113.98 1l7x s MET 713 Ca 0.00 1.78 0.08 0.00 -1.71 0.00 0.00 55.69 55.84 1l7x s MET 713 Cb 0.00 -1.79 -0.05 0.00 2.01 0.00 0.00 34.83 35.00 1l7x s MET 713 CO 0.00 -2.08 0.12 1.03 -0.01 0.00 0.00 175.02 174.08 1l7x s ARG 714 N -4.03 2.22 0.32 2.03 0.52 -1.26 -4.57 118.95 114.19 1l7x s ARG 714 Ca 0.74 -1.74 0.06 0.00 -0.52 0.00 0.00 55.73 54.27 1l7x s ARG 714 Cb -0.30 -2.01 0.89 0.00 0.52 0.00 0.00 34.95 34.05 1l7x s ARG 714 CO 0.48 0.02 1.57 0.97 0.02 0.00 0.00 175.30 178.36 1l7x h ILE 715 N 1.57 0.00 -0.37 1.52 6.09 -1.84 0.46 117.51 124.93 1l7x h ILE 715 Ca -0.43 -0.00 -0.14 0.00 -1.37 0.00 0.00 64.86 62.92 1l7x h ILE 715 Cb 1.25 0.00 -0.01 0.00 0.47 0.00 0.00 36.82 38.53 1l7x h ILE 715 CO 0.67 0.00 -0.31 0.44 -3.07 0.00 0.00 178.15 175.88 1l7x h ASP 716 N 0.00 0.86 -0.52 2.19 5.19 -1.96 -2.13 116.42 120.05 1l7x h ASP 716 Ca 0.66 -0.35 -0.04 0.00 -0.62 0.00 0.00 57.03 56.67 1l7x h ASP 716 Cb 1.47 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 40.72 1l7x h ASP 716 CO -0.90 1.10 0.18 0.44 -3.12 0.00 0.00 179.24 176.95 1l7x h ASP 717 N 0.69 0.78 -0.34 6.45 3.32 -0.54 -1.05 116.42 125.74 1l7x h ASP 717 Ca 0.08 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 56.94 1l7x h ASP 717 Cb 0.86 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1l7x h ASP 717 CO 0.08 0.74 -0.06 0.58 -1.72 0.00 0.00 179.24 178.86 1l7x h VAL 718 N 0.83 1.27 -0.36 -1.35 2.07 -0.90 -1.74 116.25 116.07 1l7x h VAL 718 Ca 0.19 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.61 1l7x h VAL 718 Cb 0.23 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 1l7x h VAL 718 CO -0.01 0.36 0.17 0.00 0.02 0.00 0.00 177.57 178.11 1l7x h ALA 719 N 0.82 0.46 -0.96 1.67 0.00 -1.07 -0.98 119.26 119.21 1l7x h ALA 719 Ca 0.09 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1l7x h ALA 719 Cb 0.54 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1l7x h ALA 719 CO 0.03 0.03 0.62 0.00 0.00 0.00 0.00 179.25 179.93 1l7x h ALA 720 N 1.02 1.28 -0.11 0.00 0.00 -1.12 0.22 119.26 120.56 1l7x h ALA 720 Ca 0.12 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1l7x h ALA 720 Cb 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1l7x h ALA 720 CO -0.02 0.48 -0.44 1.25 0.00 0.00 0.00 179.25 180.52 1l7x h LEU 721 N 1.19 0.26 0.20 0.00 5.85 -0.96 -2.22 115.31 119.64 1l7x h LEU 721 Ca 0.39 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 1l7x h LEU 721 Cb 0.04 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1l7x h LEU 721 CO -0.13 0.67 -0.10 0.44 -0.34 0.00 0.00 178.44 178.98 1l7x h ASP 722 N 0.20 -0.23 -0.69 1.25 3.32 -0.19 0.23 116.42 120.31 1l7x h ASP 722 Ca 0.02 -0.29 0.15 0.00 0.02 0.00 0.00 57.03 56.93 1l7x h ASP 722 Cb 0.87 0.06 -0.11 0.00 0.22 0.00 0.00 39.33 40.36 1l7x h ASP 722 CO 0.07 0.23 0.06 0.50 -1.72 0.00 0.00 179.24 178.37 1l7x h LYS 723 N -0.75 0.15 0.39 3.56 3.64 -0.97 -1.77 116.57 120.81 1l7x h LYS 723 Ca -0.03 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1l7x h LYS 723 Cb 0.51 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1l7x h LYS 723 CO 0.05 0.10 -0.19 -0.22 -2.27 0.00 0.00 179.45 176.92 1l7x h LYS 724 N 0.16 -0.50 0.00 1.90 3.64 -1.40 -3.50 116.57 116.87 1l7x h LYS 724 Ca 0.38 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.79 1l7x h LYS 724 Cb 0.64 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1l7x h LYS 724 CO -0.56 -0.19 0.00 0.41 -2.27 0.00 0.00 179.45 176.84 1l7x n GLY 725 N -0.35 3.97 3.66 5.01 0.00 0.80 -5.09 105.19 113.20 1l7x n GLY 725 Ca -0.10 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 1l7x n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1l7x s TYR 726 N 0.00 3.38 -0.63 1.61 5.04 -1.23 -4.87 117.35 120.65 1l7x s TYR 726 Ca 0.00 1.12 0.05 0.00 -2.44 0.00 0.00 57.07 55.80 1l7x s TYR 726 Cb 0.00 -2.94 0.19 0.00 0.35 0.00 0.00 41.96 39.56 1l7x s TYR 726 CO 0.00 -0.25 0.53 0.39 -1.34 0.00 0.00 175.55 174.89 1l7x n GLU 727 N 5.31 1.67 -0.52 4.97 -0.58 -1.26 -4.96 120.64 125.26 1l7x n GLU 727 Ca 0.03 -4.25 0.44 0.00 -0.42 0.00 0.00 57.16 52.95 1l7x n GLU 727 Cb 0.49 -2.12 0.76 0.00 -0.57 0.00 0.00 31.44 30.00 1l7x n GLU 727 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1l7x h ALA 728 N 5.06 3.38 0.00 0.62 0.00 -1.84 0.45 119.26 126.92 1l7x h ALA 728 Ca 0.18 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1l7x h ALA 728 Cb 0.76 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1l7x h ALA 728 CO 0.67 -1.87 -0.09 1.57 0.00 0.00 0.00 179.25 179.53 1l7x h LYS 729 N 0.03 0.00 0.22 0.00 2.10 -1.88 -3.02 116.57 114.03 1l7x h LYS 729 Ca 0.79 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 59.42 1l7x h LYS 729 Cb 3.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 34.33 1l7x h LYS 729 CO -0.09 0.09 -0.11 0.93 -2.00 0.00 0.00 179.45 178.27 1l7x h GLU 730 N 0.00 -0.29 -0.19 0.07 5.08 -1.32 0.13 114.58 118.06 1l7x h GLU 730 Ca -0.00 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1l7x h GLU 730 Cb 0.20 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1l7x h GLU 730 CO 0.01 -0.07 0.06 1.88 -1.00 0.00 0.00 179.01 179.88 1l7x h TYR 731 N -0.46 0.25 -0.33 4.33 -1.99 -1.70 0.71 116.97 117.77 1l7x h TYR 731 Ca -0.03 -0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.62 1l7x h TYR 731 Cb 0.35 -0.08 -0.01 0.00 2.00 0.00 0.00 36.73 38.99 1l7x h TYR 731 CO -0.02 0.22 -0.08 -0.92 -0.00 0.00 0.00 178.16 177.36 1l7x h TYR 732 N 0.26 0.71 -0.24 4.88 3.20 -1.38 -0.89 116.97 123.51 1l7x h TYR 732 Ca 0.07 -0.15 -0.11 0.00 3.14 0.00 0.00 58.73 61.67 1l7x h TYR 732 Cb 0.08 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 1l7x h TYR 732 CO 0.00 0.80 -0.32 1.49 -1.64 0.00 0.00 178.16 178.50 1l7x h GLU 733 N 0.41 0.50 -0.66 1.82 4.57 0.89 -3.18 114.58 118.93 1l7x h GLU 733 Ca 0.08 -0.22 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 1l7x h GLU 733 Cb 0.58 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 1l7x h GLU 733 CO 0.03 0.76 0.00 0.00 -1.18 0.00 0.00 179.01 178.62 1l7x n ALA 734 N -2.49 3.07 -3.51 2.92 0.00 0.23 -4.80 120.51 115.92 1l7x n ALA 734 Ca -0.01 -1.52 -0.29 0.00 0.00 0.00 0.00 53.44 51.62 1l7x n ALA 734 Cb 0.45 -1.03 -0.13 0.00 0.00 0.00 0.00 19.45 18.75 1l7x n ALA 734 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1l7x s LEU 735 N -1.77 1.14 0.11 0.00 1.43 -0.35 -4.99 118.68 114.26 1l7x s LEU 735 Ca 0.50 -2.05 -0.26 0.00 -1.03 0.00 0.00 54.13 51.28 1l7x s LEU 735 Cb 0.32 -0.48 -0.08 0.00 0.03 0.00 0.00 46.19 45.99 1l7x s LEU 735 CO 0.24 -0.33 1.44 1.55 0.23 0.00 0.00 176.35 179.48 1l7x h PRO 736 N 7.27 -0.19 -1.02 1.29 0.13 -1.87 0.16 132.00 137.79 1l7x h PRO 736 Ca -0.00 0.01 0.26 0.00 -0.87 0.00 0.00 66.00 65.40 1l7x h PRO 736 Cb 0.97 0.04 -0.08 0.00 0.13 0.00 0.00 31.00 32.06 1l7x h PRO 736 CO 0.33 -0.12 0.67 0.93 -0.23 0.00 0.00 178.00 179.57 1l7x h GLU 737 N -0.19 0.36 0.06 0.86 5.08 -1.96 -1.72 114.58 117.07 1l7x h GLU 737 Ca 0.09 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1l7x h GLU 737 Cb 0.42 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1l7x h GLU 737 CO -0.59 0.24 -0.03 1.25 -1.00 0.00 0.00 179.01 178.88 1l7x h LEU 738 N 0.37 -0.07 -0.95 1.33 5.85 -1.28 -3.14 115.31 117.42 1l7x h LEU 738 Ca 0.57 -0.55 0.26 0.00 0.84 0.00 0.00 57.88 59.00 1l7x h LEU 738 Cb 1.48 0.02 -0.14 0.00 0.37 0.00 0.00 40.66 42.39 1l7x h LEU 738 CO -0.25 0.57 0.46 0.50 -0.34 0.00 0.00 178.44 179.38 1l7x h LYS 739 N -0.78 0.36 0.81 1.25 3.64 0.11 -1.47 116.57 120.50 1l7x h LYS 739 Ca -0.01 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1l7x h LYS 739 Cb 0.62 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.36 1l7x h LYS 739 CO 0.01 0.24 -0.39 1.25 -2.27 0.00 0.00 179.45 178.29 1l7x h LEU 740 N 0.37 -0.93 -0.92 5.20 5.85 -1.53 -0.63 115.31 122.73 1l7x h LEU 740 Ca 0.63 0.03 0.20 0.00 0.84 0.00 0.00 57.88 59.59 1l7x h LEU 740 Cb 1.31 0.24 -0.17 0.00 0.37 0.00 0.00 40.66 42.41 1l7x h LEU 740 CO -0.57 -0.58 -0.17 0.58 -0.34 0.00 0.00 178.44 177.36 1l7x h VAL 741 N -1.25 0.08 0.56 1.05 2.07 -1.25 0.13 116.25 117.64 1l7x h VAL 741 Ca -0.11 -0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 1l7x h VAL 741 Cb 0.84 0.07 0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1l7x h VAL 741 CO 0.18 0.00 -0.27 0.40 0.02 0.00 0.00 177.57 177.91 1l7x h ILE 742 N 0.01 0.41 -0.79 4.57 1.08 -1.27 -2.07 117.51 119.46 1l7x h ILE 742 Ca 0.47 -0.19 0.19 0.00 -0.39 0.00 0.00 64.86 64.95 1l7x h ILE 742 Cb 0.78 0.49 -0.05 0.00 -3.07 0.00 0.00 36.82 34.97 1l7x h ILE 742 CO -0.93 0.03 0.54 0.44 -0.69 0.00 0.00 178.15 177.54 1l7x h ASP 743 N -0.87 0.22 -0.34 1.72 3.32 0.50 0.26 116.42 121.22 1l7x h ASP 743 Ca -0.08 0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.84 1l7x h ASP 743 Cb 0.62 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1l7x h ASP 743 CO 0.13 0.10 -0.35 1.56 -1.72 0.00 0.00 179.24 178.95 1l7x h GLN 744 N 0.23 0.88 -0.23 3.56 4.20 -0.55 -0.67 115.11 122.52 1l7x h GLN 744 Ca 0.39 -0.44 -0.17 0.00 0.06 0.00 0.00 58.65 58.48 1l7x h GLN 744 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.98 1l7x h GLN 744 CO -0.09 1.09 -0.54 0.82 -0.67 0.00 0.00 178.83 179.45 1l7x h ILE 745 N 0.73 1.29 0.00 2.54 2.04 0.09 -0.80 117.51 123.40 1l7x h ILE 745 Ca 0.07 -1.74 0.00 0.00 1.00 0.00 0.00 64.86 64.19 1l7x h ILE 745 Cb 0.93 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1l7x h ILE 745 CO 0.09 0.56 -0.04 -0.78 0.00 0.00 0.00 178.15 177.98 1l7x h ASP 746 N 0.52 0.00 -0.02 1.72 3.58 -0.78 -3.33 116.42 118.12 1l7x h ASP 746 Ca -0.00 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1l7x h ASP 746 Cb 1.15 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.20 1l7x h ASP 746 CO 0.12 0.00 -0.12 0.59 -2.88 0.00 0.00 179.24 176.95 1l7x n ASN 747 N -2.58 2.24 0.00 2.28 3.02 -0.26 -4.71 115.26 115.24 1l7x n ASN 747 Ca 0.05 -1.62 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 1l7x n ASN 747 Cb 0.47 0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.80 1l7x n ASN 747 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1l7x n GLY 748 N 1.08 0.95 0.31 7.41 0.00 -1.15 -4.87 105.19 108.92 1l7x n GLY 748 Ca 0.09 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.17 1l7x n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1l7x h PHE 749 N 0.00 0.36 -0.02 1.61 3.57 -1.44 -2.15 116.94 118.87 1l7x h PHE 749 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1l7x h PHE 749 Cb 0.00 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.62 1l7x h PHE 749 CO 0.00 0.21 -0.02 1.19 -2.23 0.00 0.00 178.31 177.46 1l7x n PHE 750 N -4.48 0.00 -2.98 0.41 3.72 -1.26 -4.66 117.46 108.21 1l7x n PHE 750 Ca 0.03 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.27 1l7x n PHE 750 Cb 0.16 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.68 1l7x n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1l7x n SER 751 N 1.02 -1.31 0.06 4.37 3.41 -0.85 -4.70 113.62 115.62 1l7x n SER 751 Ca 0.11 -2.98 -0.11 0.00 -0.26 0.00 0.00 58.87 55.63 1l7x n SER 751 Cb 0.48 0.55 -0.05 0.00 -0.26 0.00 0.00 64.21 64.93 1l7x n SER 751 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1l7x h PRO 752 N 4.01 -0.26 -0.11 4.33 0.13 -1.71 -1.73 132.00 136.66 1l7x h PRO 752 Ca -0.03 0.02 0.03 0.00 -0.87 0.00 0.00 66.00 65.15 1l7x h PRO 752 Cb 0.95 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.14 1l7x h PRO 752 CO 0.40 -0.18 0.13 0.87 -0.23 0.00 0.00 178.00 178.99 1l7x h LYS 753 N -0.27 0.00 -2.62 0.86 1.79 -1.96 -3.23 116.57 111.14 1l7x h LYS 753 Ca 0.05 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.92 1l7x h LYS 753 Cb 0.34 0.00 -0.39 0.00 -1.58 0.00 0.00 32.23 30.59 1l7x h LYS 753 CO -0.15 0.00 -0.84 -0.65 -1.08 0.00 0.00 179.45 176.73 1l7x s GLN 754 N -4.63 1.45 0.28 3.15 -0.21 -0.69 -5.01 119.66 114.00 1l7x s GLN 754 Ca -0.05 -2.55 0.01 0.00 0.02 0.00 0.00 55.36 52.80 1l7x s GLN 754 Cb 0.15 -2.12 0.58 0.00 1.00 0.00 0.00 33.01 32.62 1l7x s GLN 754 CO 0.54 -1.35 1.79 -1.35 -2.12 0.00 0.00 175.29 172.80 1l7x h PRO 755 N 5.55 0.75 -0.61 2.91 0.11 -1.48 -2.27 132.00 136.97 1l7x h PRO 755 Ca 0.23 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1l7x h PRO 755 Cb 0.85 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1l7x h PRO 755 CO 0.49 0.50 0.00 -0.40 -0.21 0.00 0.00 178.00 178.38 1l7x n ASP 756 N -4.76 5.43 -0.30 -2.05 5.75 -1.26 -3.30 116.55 116.05 1l7x n ASP 756 Ca 0.19 -2.78 0.11 0.00 -0.01 0.00 0.00 54.79 52.30 1l7x n ASP 756 Cb 0.44 -0.66 0.27 0.00 -1.03 0.00 0.00 41.12 40.14 1l7x n ASP 756 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1l7x h LEU 757 N 4.01 0.42 -2.92 -2.12 5.85 -1.73 -1.86 115.31 116.96 1l7x h LEU 757 Ca 0.00 0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1l7x h LEU 757 Cb 1.82 0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.91 1l7x h LEU 757 CO 0.41 0.09 0.03 0.49 -0.34 0.00 0.00 178.44 179.13 1l7x n PHE 758 N -4.97 1.58 -0.09 1.25 3.72 -1.26 -4.57 117.46 113.13 1l7x n PHE 758 Ca 0.20 -0.60 -0.08 0.00 -0.05 0.00 0.00 57.45 56.93 1l7x n PHE 758 Cb 0.57 -0.43 -0.01 0.00 -0.94 0.00 0.00 39.48 38.66 1l7x n PHE 758 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1l7x h LYS 759 N 2.78 -0.23 -0.77 -1.08 3.64 -1.67 -0.97 116.57 118.26 1l7x h LYS 759 Ca 0.03 0.02 0.17 0.00 -1.27 0.00 0.00 60.65 59.60 1l7x h LYS 759 Cb 1.65 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 33.47 1l7x h LYS 759 CO 0.39 -0.15 0.52 -0.44 -2.27 0.00 0.00 179.45 177.50 1l7x h ASP 760 N -0.24 0.32 -0.02 4.20 3.45 -1.84 0.21 116.42 122.49 1l7x h ASP 760 Ca 0.16 0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.60 1l7x h ASP 760 Cb 0.50 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1l7x h ASP 760 CO -0.47 0.15 -0.15 0.40 -1.57 0.00 0.00 179.24 177.60 1l7x h ILE 761 N 0.33 1.52 -0.64 0.35 2.04 -1.56 -2.18 117.51 117.37 1l7x h ILE 761 Ca 0.38 -1.73 0.01 0.00 1.00 0.00 0.00 64.86 64.52 1l7x h ILE 761 Cb 1.02 2.60 -0.03 0.00 -0.74 0.00 0.00 36.82 39.66 1l7x h ILE 761 CO -0.11 0.47 0.42 0.40 0.00 0.00 0.00 178.15 179.33 1l7x h ILE 762 N -0.50 1.15 0.00 -0.67 1.08 -0.49 0.59 117.51 118.67 1l7x h ILE 762 Ca -0.01 -0.29 -0.05 0.00 -0.39 0.00 0.00 64.86 64.11 1l7x h ILE 762 Cb 0.85 0.23 -0.01 0.00 -3.07 0.00 0.00 36.82 34.82 1l7x h ILE 762 CO 0.03 0.16 -0.25 -1.13 -0.69 0.00 0.00 178.15 176.26 1l7x h ASN 763 N 0.85 0.00 0.17 1.72 -1.24 -0.67 -1.71 115.58 114.70 1l7x h ASN 763 Ca 0.24 0.00 -0.23 0.00 0.71 0.00 0.00 56.30 57.02 1l7x h ASN 763 Cb -0.09 0.00 0.03 0.00 0.73 0.00 0.00 38.32 38.99 1l7x h ASN 763 CO -0.06 0.25 -0.99 -0.03 -1.29 0.00 0.00 177.43 175.31 1l7x h MET 764 N 0.00 0.36 0.00 6.67 4.05 -0.70 -2.06 114.93 123.25 1l7x h MET 764 Ca -0.00 -0.61 -0.01 0.00 -0.28 0.00 0.00 59.70 58.80 1l7x h MET 764 Cb 0.52 0.23 -0.00 0.00 -0.80 0.00 0.00 31.60 31.54 1l7x h MET 764 CO 0.03 1.29 -0.05 -0.07 0.23 0.00 0.00 176.91 178.35 1l7x h LEU 765 N -0.25 0.00 0.01 3.39 3.38 -0.69 -1.06 115.31 120.09 1l7x h LEU 765 Ca -0.18 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.42 1l7x h LEU 765 Cb 1.78 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.46 1l7x h LEU 765 CO 0.18 0.05 -2.33 0.49 0.09 0.00 0.00 178.44 176.92 1l7x n PHE 766 N -3.87 0.20 -0.36 1.13 3.01 -0.66 -4.63 117.46 112.28 1l7x n PHE 766 Ca -0.03 0.06 0.00 0.00 1.01 0.00 0.00 57.45 58.49 1l7x n PHE 766 Cb 0.14 -1.03 0.00 0.00 -0.01 0.00 0.00 39.48 38.58 1l7x n PHE 766 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1l7x n TYR 767 N -3.06 0.00 -2.67 1.38 4.02 -0.78 -4.42 117.16 111.63 1l7x n TYR 767 Ca -0.37 -0.19 -0.02 0.00 -0.01 0.00 0.00 57.90 57.31 1l7x n TYR 767 Cb 1.07 -0.02 0.09 0.00 -0.02 0.00 0.00 39.34 40.46 1l7x n TYR 767 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1l7x n HIS 768 N -0.19 -0.86 -3.16 -0.72 8.25 -0.52 -5.01 115.22 113.00 1l7x n HIS 768 Ca 0.00 -1.73 -0.45 0.00 -0.26 0.00 0.00 57.72 55.28 1l7x n HIS 768 Cb 0.24 0.89 -0.04 0.00 1.12 0.00 0.00 29.99 32.21 1l7x n HIS 768 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1l7x s ASP 769 N -1.97 6.35 0.02 0.41 2.15 -0.52 -4.81 116.67 118.30 1l7x s ASP 769 Ca 0.15 -1.82 0.22 0.00 0.43 0.00 0.00 52.55 51.53 1l7x s ASP 769 Cb 0.38 -2.28 0.92 0.00 -0.30 0.00 0.00 42.92 41.64 1l7x s ASP 769 CO -0.10 -0.96 1.70 0.54 -0.17 0.00 0.00 175.17 176.18 1l7x n ARG 770 N 5.73 0.02 -0.42 4.34 1.74 -1.26 -3.08 116.66 123.72 1l7x n ARG 770 Ca -0.01 0.14 0.08 0.00 -0.77 0.00 0.00 57.85 57.29 1l7x n ARG 770 Cb 0.44 -1.53 0.25 0.00 -1.02 0.00 0.00 32.46 30.60 1l7x n ARG 770 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1l7x n PHE 771 N -1.56 0.91 -3.80 -1.55 3.72 -1.26 -5.02 117.46 108.90 1l7x n PHE 771 Ca 0.05 -0.83 -0.27 0.00 -0.05 0.00 0.00 57.45 56.35 1l7x n PHE 771 Cb 0.26 -0.29 0.01 0.00 -0.94 0.00 0.00 39.48 38.52 1l7x n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1l7x n LYS 772 N -0.37 -0.63 0.25 -1.08 5.02 -1.18 -4.77 118.16 115.40 1l7x n LYS 772 Ca 0.20 0.02 -0.16 0.00 -2.02 0.00 0.00 58.31 56.36 1l7x n LYS 772 Cb 0.85 -1.32 -0.08 0.00 -0.02 0.00 0.00 35.03 34.46 1l7x n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1l7x h VAL 773 N -0.46 0.38 -0.93 -0.18 2.07 -1.92 -3.05 116.25 112.15 1l7x h VAL 773 Ca -0.46 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.07 1l7x h VAL 773 Cb 0.92 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1l7x h VAL 773 CO 0.31 0.00 0.60 -0.26 0.02 0.00 0.00 177.57 178.25 1l7x h PHE 774 N -0.70 1.19 -0.30 1.57 0.05 -1.91 -2.51 116.94 114.33 1l7x h PHE 774 Ca -0.04 0.02 0.09 0.00 3.82 0.00 0.00 57.97 61.86 1l7x h PHE 774 Cb 0.60 -0.40 -0.01 0.00 2.00 0.00 0.00 35.95 38.13 1l7x h PHE 774 CO -0.13 0.76 0.50 0.00 -0.18 0.00 0.00 178.31 179.26 1l7x h ALA 775 N 1.33 1.92 -0.07 2.45 0.00 -1.91 0.31 119.26 123.28 1l7x h ALA 775 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1l7x h ALA 775 Cb -0.12 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1l7x h ALA 775 CO -0.07 -0.66 0.00 -0.25 0.00 0.00 0.00 179.25 178.27 1l7x n ASP 776 N -3.34 1.89 -0.12 0.00 8.00 -0.97 -4.71 116.55 117.30 1l7x n ASP 776 Ca 0.05 -1.51 -0.09 0.00 0.71 0.00 0.00 54.79 53.96 1l7x n ASP 776 Cb 0.63 -0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.68 1l7x n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1l7x h TYR 777 N 1.36 0.50 -0.15 1.24 3.20 -0.07 -1.17 116.97 121.87 1l7x h TYR 777 Ca 0.00 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 1l7x h TYR 777 Cb 0.40 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1l7x h TYR 777 CO 0.04 0.38 0.06 1.49 -1.64 0.00 0.00 178.16 178.49 1l7x h GLU 778 N 0.47 0.23 -0.50 1.82 4.81 -1.84 -1.50 114.58 118.06 1l7x h GLU 778 Ca 0.13 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1l7x h GLU 778 Cb 0.04 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 1l7x h GLU 778 CO -0.02 0.33 0.25 0.00 -0.73 0.00 0.00 179.01 178.84 1l7x h ALA 779 N 0.89 0.64 -0.56 2.92 0.00 -1.87 -2.42 119.26 118.87 1l7x h ALA 779 Ca 0.05 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1l7x h ALA 779 Cb 0.19 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1l7x h ALA 779 CO -0.00 0.19 0.35 -0.92 0.00 0.00 0.00 179.25 178.87 1l7x h TYR 780 N 0.66 0.66 -0.41 0.00 3.20 -1.09 -0.46 116.97 119.53 1l7x h TYR 780 Ca 0.17 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 1l7x h TYR 780 Cb 0.09 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 1l7x h TYR 780 CO -0.01 0.39 0.00 0.28 -1.64 0.00 0.00 178.16 177.18 1l7x h VAL 781 N 0.70 1.26 -0.69 1.81 2.07 -1.13 -1.03 116.25 119.24 1l7x h VAL 781 Ca 0.21 -1.02 -0.05 0.00 0.82 0.00 0.00 66.70 66.67 1l7x h VAL 781 Cb -0.03 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1l7x h VAL 781 CO -0.07 0.35 0.22 0.11 0.02 0.00 0.00 177.57 178.20 1l7x h LYS 782 N 0.56 1.05 -0.58 1.57 1.57 -1.28 -2.62 116.57 116.83 1l7x h LYS 782 Ca 0.12 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1l7x h LYS 782 Cb 0.48 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.60 1l7x h LYS 782 CO 0.02 0.89 0.36 0.00 -0.57 0.00 0.00 179.45 180.15 1l7x h GLN 784 N 0.79 1.08 -0.74 0.00 1.08 -0.87 -2.50 115.11 113.94 1l7x h GLN 784 Ca 0.21 -0.10 0.01 0.00 -1.45 0.00 0.00 58.65 57.32 1l7x h GLN 784 Cb -0.03 -0.22 -0.04 0.00 -0.05 0.00 0.00 27.48 27.14 1l7x h GLN 784 CO -0.04 0.77 0.49 -0.44 -0.95 0.00 0.00 178.83 178.66 1l7x h ASP 785 N 1.09 0.83 -0.13 1.46 3.32 -1.17 -0.58 116.42 121.25 1l7x h ASP 785 Ca 0.28 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.20 1l7x h ASP 785 Cb -0.01 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1l7x h ASP 785 CO -0.05 0.60 -0.27 0.11 -1.72 0.00 0.00 179.24 177.91 1l7x h LYS 786 N 0.98 0.59 -0.24 3.56 1.57 -1.36 -0.40 116.57 121.27 1l7x h LYS 786 Ca 0.27 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1l7x h LYS 786 Cb -0.09 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1l7x h LYS 786 CO -0.06 0.80 0.14 0.28 -0.57 0.00 0.00 179.45 180.04 1l7x h VAL 787 N 0.51 1.09 -0.50 0.50 2.07 -0.86 -0.11 116.25 118.96 1l7x h VAL 787 Ca 0.07 -0.23 0.05 0.00 0.82 0.00 0.00 66.70 67.41 1l7x h VAL 787 Cb 0.73 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 1l7x h VAL 787 CO 0.06 0.09 0.22 0.28 0.02 0.00 0.00 177.57 178.24 1l7x h SER 788 N 0.29 0.29 0.13 0.57 0.02 -0.84 -0.92 113.55 113.09 1l7x h SER 788 Ca 0.09 0.04 0.02 0.00 -0.84 0.00 0.00 61.79 61.09 1l7x h SER 788 Cb 0.02 -0.01 -0.04 0.00 0.14 0.00 0.00 62.40 62.52 1l7x h SER 788 CO -0.02 0.20 -0.29 1.56 -1.14 0.00 0.00 176.83 177.15 1l7x h GLN 789 N 0.43 -0.49 -0.15 3.45 4.20 -0.34 -2.21 115.11 120.01 1l7x h GLN 789 Ca 0.23 0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.99 1l7x h GLN 789 Cb 0.18 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1l7x h GLN 789 CO -0.19 -0.33 0.10 1.25 -0.67 0.00 0.00 178.83 178.99 1l7x h LEU 790 N -0.51 0.09 -1.08 1.46 5.85 -0.68 -2.45 115.31 117.98 1l7x h LEU 790 Ca 0.03 -0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.65 1l7x h LEU 790 Cb 0.54 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1l7x h LEU 790 CO -0.16 0.06 -0.45 0.22 -0.34 0.00 0.00 178.44 177.77 1l7x h TYR 791 N 0.11 0.01 0.00 1.25 3.20 -0.54 -1.95 116.97 119.04 1l7x h TYR 791 Ca 0.06 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1l7x h TYR 791 Cb 0.12 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.38 1l7x h TYR 791 CO -0.00 0.46 0.00 -1.33 -1.64 0.00 0.00 178.16 175.65 1l7x n MET 792 N -4.00 0.06 -3.80 1.82 2.81 -0.92 -4.04 117.12 109.04 1l7x n MET 792 Ca -0.02 0.23 -0.34 0.00 -1.81 0.00 0.00 57.70 55.76 1l7x n MET 792 Cb 0.48 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.38 1l7x n MET 792 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1l7x s ASN 793 N -2.88 4.96 0.19 7.83 2.47 -0.73 -4.98 114.94 121.79 1l7x s ASN 793 Ca 0.09 -3.03 -0.19 0.00 0.42 0.00 0.00 52.86 50.14 1l7x s ASN 793 Cb 0.09 -1.78 0.13 0.00 -1.45 0.00 0.00 41.25 38.25 1l7x s ASN 793 CO 0.25 -0.29 1.60 -0.65 -3.72 0.00 0.00 177.10 174.28 1l7x h PRO 794 N 6.68 -0.14 -0.57 0.43 0.11 -1.78 -0.39 132.00 136.34 1l7x h PRO 794 Ca -0.01 0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.20 1l7x h PRO 794 Cb 0.91 0.03 -0.07 0.00 0.11 0.00 0.00 31.00 31.98 1l7x h PRO 794 CO 0.71 -0.09 0.19 -0.22 -0.21 0.00 0.00 178.00 178.38 1l7x h LYS 795 N -0.15 0.35 0.01 1.05 1.63 -1.93 -0.49 116.57 117.03 1l7x h LYS 795 Ca 0.23 -0.02 -0.21 0.00 -0.85 0.00 0.00 60.65 59.80 1l7x h LYS 795 Cb 0.52 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.07 1l7x h LYS 795 CO -0.62 0.23 -0.93 0.00 -3.45 0.00 0.00 179.45 174.68 1l7x h ALA 796 N 1.41 0.42 0.17 5.00 0.00 -1.76 -2.20 119.26 122.30 1l7x h ALA 796 Ca 0.29 -0.73 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1l7x h ALA 796 Cb 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1l7x h ALA 796 CO -0.31 0.88 -0.08 2.35 0.00 0.00 0.00 179.25 182.08 1l7x h TRP 797 N 0.16 -0.21 0.00 0.00 2.91 -0.70 -1.75 115.95 116.36 1l7x h TRP 797 Ca -0.06 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 59.91 1l7x h TRP 797 Cb 1.57 0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 30.28 1l7x h TRP 797 CO 0.04 0.07 -0.21 -0.91 -1.03 0.00 0.00 178.44 176.41 1l7x h ASN 798 N -0.49 0.00 -0.22 2.65 2.35 -1.19 -0.85 115.58 117.82 1l7x h ASN 798 Ca -0.02 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.66 1l7x h ASN 798 Cb 0.38 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1l7x h ASN 798 CO 0.04 0.21 -0.11 0.74 -1.65 0.00 0.00 177.43 176.65 1l7x h THR 799 N 0.00 1.30 -0.72 2.81 2.02 -1.22 -0.38 112.91 116.72 1l7x h THR 799 Ca -0.00 -1.19 -0.05 0.00 0.77 0.00 0.00 66.41 65.95 1l7x h THR 799 Cb 0.49 1.61 -0.03 0.00 -1.74 0.00 0.00 68.15 68.48 1l7x h THR 799 CO 0.03 0.36 0.27 -0.03 0.37 0.00 0.00 175.52 176.52 1l7x h MET 800 N 0.18 1.08 -0.08 6.66 1.85 -0.83 -2.55 114.93 121.25 1l7x h MET 800 Ca 0.05 -0.21 0.02 0.00 -0.61 0.00 0.00 59.70 58.95 1l7x h MET 800 Cb 0.61 -0.17 -0.02 0.00 0.43 0.00 0.00 31.60 32.45 1l7x h MET 800 CO 0.03 0.90 -0.06 0.28 -0.40 0.00 0.00 176.91 177.67 1l7x h VAL 801 N 1.04 0.82 -0.99 -5.77 2.07 -0.99 -1.86 116.25 110.57 1l7x h VAL 801 Ca 0.24 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.93 1l7x h VAL 801 Cb 0.24 0.82 -0.09 0.00 -1.52 0.00 0.00 31.29 30.73 1l7x h VAL 801 CO -0.02 0.00 0.62 0.25 0.02 0.00 0.00 177.57 178.44 1l7x h LEU 802 N -0.07 0.78 -1.58 2.57 5.85 -0.80 0.19 115.31 122.24 1l7x h LEU 802 Ca 0.05 0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 1l7x h LEU 802 Cb 0.15 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1l7x h LEU 802 CO -0.12 0.32 -0.21 0.11 -0.34 0.00 0.00 178.44 178.20 1l7x h LYS 803 N 0.78 0.00 0.20 1.25 1.57 -0.95 -1.82 116.57 117.61 1l7x h LYS 803 Ca 0.54 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 59.02 1l7x h LYS 803 Cb 0.82 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.15 1l7x h LYS 803 CO -0.32 0.21 -1.36 -0.91 -0.57 0.00 0.00 179.45 176.50 1l7x h ASN 804 N 0.00 0.67 -0.33 0.86 2.35 -0.18 -3.17 115.58 115.77 1l7x h ASN 804 Ca -0.00 -0.93 -0.07 0.00 -0.55 0.00 0.00 56.30 54.76 1l7x h ASN 804 Cb 0.50 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 1l7x h ASN 804 CO 0.03 1.64 -0.01 0.40 -1.65 0.00 0.00 177.43 177.84 1l7x h ILE 805 N -0.04 1.23 0.00 2.81 2.04 -1.08 -2.29 117.51 120.18 1l7x h ILE 805 Ca -0.25 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 64.66 1l7x h ILE 805 Cb 1.99 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.98 1l7x h ILE 805 CO 0.21 0.33 0.00 0.00 0.00 0.00 0.00 178.15 178.69 1l7x h ALA 806 N 1.33 1.00 -0.11 1.87 0.00 -1.45 -3.18 119.26 118.73 1l7x h ALA 806 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1l7x h ALA 806 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1l7x h ALA 806 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.27 1l7x n ALA 807 N -1.81 2.43 0.88 0.00 0.00 -0.96 -2.46 120.51 118.59 1l7x n ALA 807 Ca 0.04 -0.73 0.13 0.00 0.00 0.00 0.00 53.44 52.87 1l7x n ALA 807 Cb 0.35 -0.52 0.55 0.00 0.00 0.00 0.00 19.45 19.83 1l7x n ALA 807 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1l7x n SER 808 N 0.84 0.08 -0.31 0.00 3.41 -0.90 -4.08 113.62 112.65 1l7x n SER 808 Ca 0.10 0.51 0.27 0.00 -0.26 0.00 0.00 58.87 59.49 1l7x n SER 808 Cb 0.39 -0.53 0.61 0.00 -0.26 0.00 0.00 64.21 64.42 1l7x n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1l7x h GLY 809 N 4.53 0.73 2.00 5.00 0.00 -1.80 0.30 103.07 113.83 1l7x h GLY 809 Ca 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 1l7x h GLY 809 CO 0.00 -0.09 -0.07 1.70 0.00 0.00 0.00 176.54 178.08 1l7x h LYS 810 N 0.23 0.00 -0.50 4.80 3.64 -1.90 -2.91 116.57 119.93 1l7x h LYS 810 Ca 0.57 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.95 1l7x h LYS 810 Cb 1.77 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.59 1l7x h LYS 810 CO -0.18 0.07 0.00 1.19 -2.27 0.00 0.00 179.45 178.26 1l7x n PHE 811 N -3.42 0.70 -2.58 1.91 3.72 0.10 -4.77 117.46 113.11 1l7x n PHE 811 Ca -0.02 -0.30 -0.42 0.00 -0.05 0.00 0.00 57.45 56.67 1l7x n PHE 811 Cb 0.22 -0.09 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 1l7x n PHE 811 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1l7x s SER 812 N -0.84 7.27 0.34 4.37 0.15 -1.10 -0.34 113.70 123.55 1l7x s SER 812 Ca 0.28 1.88 0.23 0.00 0.70 0.00 0.00 55.95 59.03 1l7x s SER 812 Cb 0.16 -2.58 1.25 0.00 -1.71 0.00 0.00 66.02 63.14 1l7x s SER 812 CO 0.16 -0.30 1.71 0.77 1.20 0.00 0.00 173.24 176.78 1l7x h SER 813 N 6.33 0.00 0.33 5.45 4.64 -0.10 -0.65 113.55 129.56 1l7x h SER 813 Ca -0.42 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.81 1l7x h SER 813 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1l7x h SER 813 CO 0.76 0.00 -0.40 0.44 -0.87 0.00 0.00 176.83 176.76 1l7x h ASP 814 N 0.00 0.10 -0.10 4.97 3.45 -1.91 -1.09 116.42 121.85 1l7x h ASP 814 Ca 0.00 -0.04 -0.09 0.00 0.43 0.00 0.00 57.03 57.33 1l7x h ASP 814 Cb 0.02 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 38.76 1l7x h ASP 814 CO 0.00 0.50 -0.28 -0.09 -1.57 0.00 0.00 179.24 177.80 1l7x h ARG 815 N 0.08 0.36 0.01 3.56 1.12 -1.43 -2.44 114.38 115.64 1l7x h ARG 815 Ca 0.01 -0.26 0.02 0.00 -1.11 0.00 0.00 59.98 58.64 1l7x h ARG 815 Cb 0.76 0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 30.73 1l7x h ARG 815 CO 0.06 0.87 -0.16 1.15 -3.11 0.00 0.00 179.97 178.78 1l7x h THR 816 N -0.09 0.61 -0.83 0.20 2.02 -1.50 -2.06 112.91 111.25 1l7x h THR 816 Ca -0.01 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.19 1l7x h THR 816 Cb 0.89 0.61 -0.05 0.00 -1.74 0.00 0.00 68.15 67.87 1l7x h THR 816 CO 0.06 0.00 0.54 0.40 0.37 0.00 0.00 175.52 176.89 1l7x h ILE 817 N -0.28 1.17 -0.97 3.11 1.08 -1.26 -1.53 117.51 118.84 1l7x h ILE 817 Ca 0.05 -0.37 0.04 0.00 -0.39 0.00 0.00 64.86 64.19 1l7x h ILE 817 Cb 0.34 -0.01 -0.06 0.00 -3.07 0.00 0.00 36.82 34.02 1l7x h ILE 817 CO -0.15 0.20 0.63 0.50 -0.69 0.00 0.00 178.15 178.65 1l7x h LYS 818 N 1.08 1.18 -0.30 2.37 3.64 -1.08 0.25 116.57 123.71 1l7x h LYS 818 Ca 0.32 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.49 1l7x h LYS 818 Cb -0.06 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.49 1l7x h LYS 818 CO -0.09 0.78 -0.38 0.93 -2.27 0.00 0.00 179.45 178.42 1l7x h GLU 819 N 1.21 0.71 -0.43 1.90 5.08 -0.64 -2.14 114.58 120.27 1l7x h GLU 819 Ca 0.39 -0.36 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 1l7x h GLU 819 Cb 0.02 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1l7x h GLU 819 CO -0.12 0.97 0.00 1.88 -1.00 0.00 0.00 179.01 180.74 1l7x h TYR 820 N 0.58 0.83 -0.24 4.33 0.05 -0.72 -2.04 116.97 119.76 1l7x h TYR 820 Ca 0.05 -0.14 0.01 0.00 0.05 0.00 0.00 58.73 58.70 1l7x h TYR 820 Cb 0.91 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 38.42 1l7x h TYR 820 CO 0.04 0.82 0.14 0.00 -1.05 0.00 0.00 178.16 178.12 1l7x h ALA 821 N 0.90 0.30 -0.18 3.88 0.00 -0.82 0.83 119.26 124.17 1l7x h ALA 821 Ca 0.12 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1l7x h ALA 821 Cb 0.48 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1l7x h ALA 821 CO 0.02 -0.25 -0.35 1.96 0.00 0.00 0.00 179.25 180.63 1l7x h GLN 822 N 0.30 0.56 -0.00 0.00 4.20 -1.36 0.33 115.11 119.14 1l7x h GLN 822 Ca 0.09 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1l7x h GLN 822 Cb -0.01 0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1l7x h GLN 822 CO -0.04 0.97 -0.94 0.09 -0.67 0.00 0.00 178.83 178.24 1l7x n ASN 823 N -4.30 1.00 0.05 1.46 3.02 -0.77 -4.39 115.26 111.32 1l7x n ASN 823 Ca -0.06 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 1l7x n ASN 823 Cb 0.51 0.98 0.00 0.00 -0.61 0.00 0.00 39.78 40.66 1l7x n ASN 823 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1l7x n ILE 824 N -1.43 0.89 0.16 2.41 5.41 0.19 -4.86 119.36 122.13 1l7x n ILE 824 Ca 0.04 0.29 0.07 0.00 1.00 0.00 0.00 62.75 64.16 1l7x n ILE 824 Cb 0.32 -1.46 0.07 0.00 -0.71 0.00 0.00 39.64 37.86 1l7x n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1l7x h TRP 825 N 0.00 0.00 -5.72 1.39 6.55 -1.40 -3.49 115.95 113.28 1l7x h TRP 825 Ca 0.00 0.00 -0.32 0.00 0.95 0.00 0.00 58.89 59.52 1l7x h TRP 825 Cb 0.18 0.00 0.16 0.00 -0.86 0.00 0.00 29.16 28.63 1l7x h TRP 825 CO 0.00 0.25 -0.87 -1.71 -1.05 0.00 0.00 178.44 175.06 1l7x n ASN 826 N -3.08 -5.31 -4.20 -3.49 5.15 0.11 -4.93 115.26 99.52 1l7x n ASN 826 Ca 0.01 -0.79 -0.12 0.00 -0.60 0.00 0.00 54.58 53.09 1l7x n ASN 826 Cb 0.64 -4.64 -0.10 0.00 -0.53 0.00 0.00 39.78 35.15 1l7x n ASN 826 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1l7x s VAL 827 N -3.43 0.70 0.20 3.44 -7.23 -0.90 -4.97 120.40 108.20 1l7x s VAL 827 Ca 0.37 -1.96 0.10 0.00 -1.81 0.00 0.00 61.98 58.68 1l7x s VAL 827 Cb -0.07 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.94 1l7x s VAL 827 CO 0.78 -0.70 -0.21 -1.61 -0.31 0.00 0.00 175.10 173.05 1l7x s GLU 828 N -3.87 1.46 -0.81 4.82 2.02 -1.26 -4.45 118.70 116.61 1l7x s GLU 828 Ca 0.17 -1.54 -0.23 0.00 0.02 0.00 0.00 54.97 53.40 1l7x s GLU 828 Cb 0.05 -1.62 -0.18 0.00 0.10 0.00 0.00 34.13 32.49 1l7x s GLU 828 CO -0.01 0.33 2.37 -2.30 0.02 0.00 0.00 175.26 175.68 1l7x n PRO 829 N 0.06 0.48 0.00 0.39 -0.02 -1.26 -4.79 135.00 129.85 1l7x n PRO 829 Ca -0.11 -0.56 0.00 0.00 -2.02 0.00 0.00 63.50 60.81 1l7x n PRO 829 Cb 0.57 -3.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.01 1l7x n PRO 829 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91