#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l7x s ASN 23 N 0.00 5.37 0.10 1.62 4.22 -1.26 -4.95 114.94 120.04 1l7x s ASN 23 Ca 0.00 0.06 -0.26 0.00 -2.14 0.00 0.00 52.86 50.52 1l7x s ASN 23 Cb 0.00 -1.01 -0.11 0.00 1.28 0.00 0.00 41.25 41.41 1l7x s ASN 23 CO 0.00 -1.07 1.68 0.58 -2.04 0.00 0.00 177.10 176.25 1l7x h VAL 24 N 0.12 0.63 -0.73 3.54 2.07 -2.00 -2.16 116.25 117.71 1l7x h VAL 24 Ca -0.43 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.17 1l7x h VAL 24 Cb 1.29 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 31.62 1l7x h VAL 24 CO 0.53 0.00 0.40 0.00 0.02 0.00 0.00 177.57 178.52 1l7x h ALA 25 N 0.48 1.01 0.00 1.67 0.00 -1.96 -1.30 119.26 119.16 1l7x h ALA 25 Ca 0.01 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1l7x h ALA 25 Cb 0.34 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1l7x h ALA 25 CO -0.06 0.04 -0.31 0.93 0.00 0.00 0.00 179.25 179.85 1l7x h GLU 26 N 0.70 0.00 -0.00 0.00 4.39 -1.94 -2.54 114.58 115.19 1l7x h GLU 26 Ca 0.35 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.88 1l7x h GLU 26 Cb 0.30 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 1l7x h GLU 26 CO -0.23 0.31 -0.80 -0.07 -1.16 0.00 0.00 179.01 177.06 1l7x h LEU 27 N 0.00 0.07 -0.32 1.33 3.38 -0.65 -1.99 115.31 117.12 1l7x h LEU 27 Ca -0.00 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 57.77 1l7x h LEU 27 Cb 0.84 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1l7x h LEU 27 CO 0.04 0.84 -0.37 0.11 0.09 0.00 0.00 178.44 179.15 1l7x h LYS 28 N 0.03 0.82 -0.44 1.13 1.57 -0.93 -1.64 116.57 117.12 1l7x h LYS 28 Ca -0.02 -0.45 -0.04 0.00 -1.87 0.00 0.00 60.65 58.27 1l7x h LYS 28 Cb 1.41 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.72 1l7x h LYS 28 CO 0.11 1.09 0.10 0.87 -0.57 0.00 0.00 179.45 181.05 1l7x h LYS 29 N 0.60 0.71 -0.61 3.15 1.57 -1.43 -1.38 116.57 119.17 1l7x h LYS 29 Ca 0.05 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 1l7x h LYS 29 Cb 0.96 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.15 1l7x h LYS 29 CO 0.09 0.71 0.26 1.03 -0.57 0.00 0.00 179.45 180.97 1l7x h SER 30 N 0.58 0.83 -0.00 0.86 0.87 -1.32 0.56 113.55 115.92 1l7x h SER 30 Ca 0.14 -0.16 0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1l7x h SER 30 Cb 0.32 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 1l7x h SER 30 CO 0.00 0.76 -0.07 0.15 -0.53 0.00 0.00 176.83 177.15 1l7x h PHE 31 N 0.84 -0.16 -0.03 2.24 3.04 -1.10 -0.46 116.94 121.32 1l7x h PHE 31 Ca 0.21 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.12 1l7x h PHE 31 Cb 0.18 0.07 -0.01 0.00 2.56 0.00 0.00 35.95 38.75 1l7x h PHE 31 CO 0.01 -0.10 -0.19 -0.91 -2.02 0.00 0.00 178.31 175.10 1l7x h ASN 32 N -0.11 0.04 -0.30 0.41 2.35 -1.03 -0.18 115.58 116.75 1l7x h ASN 32 Ca 0.03 -0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.62 1l7x h ASN 32 Cb 0.15 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1l7x h ASN 32 CO -0.07 0.23 -0.39 -0.09 -1.65 0.00 0.00 177.43 175.46 1l7x h ARG 33 N 0.04 0.84 -0.05 0.81 2.43 -0.07 -2.31 114.38 116.06 1l7x h ARG 33 Ca 0.01 -0.44 -0.24 0.00 -0.81 0.00 0.00 59.98 58.50 1l7x h ARG 33 Cb 0.35 0.01 0.02 0.00 -0.42 0.00 0.00 29.97 29.93 1l7x h ARG 33 CO 0.03 1.08 -0.89 0.45 -1.51 0.00 0.00 179.97 179.12 1l7x h HIS 34 N 0.69 1.00 -0.87 2.20 3.86 -0.66 -0.64 115.15 120.74 1l7x h HIS 34 Ca 0.06 -0.51 0.09 0.00 -1.16 0.00 0.00 60.37 58.85 1l7x h HIS 34 Cb 0.96 -0.13 -0.07 0.00 1.06 0.00 0.00 27.41 29.23 1l7x h HIS 34 CO 0.06 1.34 0.52 1.25 0.86 0.00 0.00 177.93 181.95 1l7x h LEU 35 N 0.38 0.76 0.08 2.43 5.85 -1.00 0.21 115.31 124.03 1l7x h LEU 35 Ca -0.10 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 1l7x h LEU 35 Cb 1.55 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.47 1l7x h LEU 35 CO 0.18 0.44 -0.04 -0.74 -0.34 0.00 0.00 178.44 177.94 1l7x h HIS 36 N 0.87 -0.10 0.00 1.25 2.76 -1.39 -1.45 115.15 117.09 1l7x h HIS 36 Ca 0.41 -0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.43 1l7x h HIS 36 Cb 0.34 0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.31 1l7x h HIS 36 CO -0.04 -0.06 -0.69 0.74 -1.30 0.00 0.00 177.93 176.58 1l7x h PHE 37 N -0.23 0.00 0.00 5.26 0.04 -1.15 -0.80 116.94 120.05 1l7x h PHE 37 Ca -0.01 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.43 1l7x h PHE 37 Cb 0.08 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.17 1l7x h PHE 37 CO 0.07 0.69 -2.19 2.41 -0.60 0.00 0.00 178.31 178.69 1l7x n THR 38 N -3.67 1.37 0.54 -1.55 -1.04 0.61 -4.45 114.28 106.09 1l7x n THR 38 Ca -0.01 -0.82 0.06 0.00 -2.04 0.00 0.00 64.05 61.24 1l7x n THR 38 Cb 0.69 -0.58 -0.02 0.00 -1.82 0.00 0.00 70.33 68.60 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 -2.80 1.11 -3.83 -4.42 7.99 -0.39 -5.00 117.00 109.65 1l7x n LEU 39 Ca -0.27 -0.68 -0.25 0.00 -0.01 0.00 0.00 56.01 54.80 1l7x n LEU 39 Cb 1.10 0.00 0.01 0.00 -0.11 0.00 0.00 43.42 44.42 1l7x n LEU 39 CO 0.44 0.23 -0.08 0.52 -1.51 0.00 0.00 177.39 176.98 1l7x n VAL 40 N -0.54 -3.53 -4.27 4.08 0.31 -0.31 -4.95 118.33 109.12 1l7x n VAL 40 Ca 0.04 -0.39 -0.15 0.00 -0.01 0.00 0.00 64.34 63.83 1l7x n VAL 40 Cb 0.23 -3.22 -0.10 0.00 -0.91 0.00 0.00 33.84 29.84 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 -6.29 1.26 0.37 5.55 -0.14 -0.59 -5.00 119.74 114.90 1l7x s LYS 41 Ca 0.15 -1.65 0.04 0.00 -1.36 0.00 0.00 55.97 53.14 1l7x s LYS 41 Cb -0.07 -0.20 -0.04 0.00 -1.68 0.00 0.00 37.83 35.84 1l7x s LYS 41 CO 0.84 -0.24 0.11 0.16 -0.76 0.00 0.00 175.35 175.47 1l7x s ASP 42 N -3.24 2.51 0.53 2.83 3.84 -1.26 -3.75 116.67 118.14 1l7x s ASP 42 Ca 0.32 -1.58 0.28 0.00 -0.00 0.00 0.00 52.55 51.57 1l7x s ASP 42 Cb 0.07 0.34 1.48 0.00 -1.38 0.00 0.00 42.92 43.44 1l7x s ASP 42 CO 0.09 -0.84 2.08 0.03 -0.00 0.00 0.00 175.17 176.53 1l7x h ARG 43 N 1.93 0.00 0.00 2.11 2.47 -1.99 -0.89 114.38 118.01 1l7x h ARG 43 Ca -0.37 0.00 -0.13 0.00 -1.26 0.00 0.00 59.98 58.23 1l7x h ARG 43 Cb 1.26 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.57 1l7x h ARG 43 CO 0.60 0.11 -0.60 -0.91 0.56 0.00 0.00 179.97 179.72 1l7x h ASN 44 N 0.00 0.00 -0.00 7.04 4.21 -2.04 -3.34 115.58 121.44 1l7x h ASN 44 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1l7x h ASN 44 Cb 0.33 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.53 1l7x h ASN 44 CO 0.01 0.60 -0.11 0.52 -1.29 0.00 0.00 177.43 177.16 1l7x n VAL 45 N -3.35 0.00 -2.08 2.81 0.31 -1.12 -5.03 118.33 109.86 1l7x n VAL 45 Ca 0.01 -0.44 -0.42 0.00 -0.01 0.00 0.00 64.34 63.48 1l7x n VAL 45 Cb 0.73 1.06 -0.03 0.00 -0.91 0.00 0.00 33.84 34.69 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 -0.95 3.66 0.78 3.52 0.00 -0.35 -4.89 121.76 123.52 1l7x s ALA 46 Ca 0.04 1.21 -0.08 0.00 0.00 0.00 0.00 51.96 53.14 1l7x s ALA 46 Cb 0.04 -3.57 0.11 0.00 0.00 0.00 0.00 23.12 19.71 1l7x s ALA 46 CO 0.14 -0.67 1.09 0.95 0.00 0.00 0.00 175.76 177.27 1l7x s THR 47 N 1.09 2.16 0.23 0.00 -4.23 -1.26 -4.92 115.64 108.71 1l7x s THR 47 Ca 0.66 -0.28 -0.02 0.00 -1.18 0.00 0.00 61.69 60.88 1l7x s THR 47 Cb -0.39 -2.89 0.02 0.00 1.34 0.00 0.00 72.50 70.57 1l7x s THR 47 CO 0.31 0.00 1.62 0.74 -0.54 0.00 0.00 174.62 176.75 1l7x h THR 48 N -0.87 1.29 -0.70 3.99 2.02 -2.00 -1.83 112.91 114.82 1l7x h THR 48 Ca -0.42 -1.47 -0.06 0.00 0.77 0.00 0.00 66.41 65.22 1l7x h THR 48 Cb 1.28 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 69.11 1l7x h THR 48 CO 0.49 0.47 0.21 -0.09 0.37 0.00 0.00 175.52 176.97 1l7x h ARG 49 N 0.51 1.10 -0.10 6.66 2.43 -1.96 -1.30 114.38 121.72 1l7x h ARG 49 Ca 0.05 -0.24 0.01 0.00 -0.81 0.00 0.00 59.98 58.99 1l7x h ARG 49 Cb 0.83 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1l7x h ARG 49 CO 0.07 0.95 0.01 -0.44 -1.51 0.00 0.00 179.97 179.06 1l7x h ASP 50 N 1.04 -0.01 -0.56 -3.80 3.32 -1.79 0.13 116.42 114.76 1l7x h ASP 50 Ca 0.22 0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.31 1l7x h ASP 50 Cb 0.32 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 1l7x h ASP 50 CO -0.00 0.01 0.34 1.88 -1.72 0.00 0.00 179.24 179.75 1l7x h TYR 51 N 0.06 0.64 -0.67 4.55 0.05 -1.08 -0.33 116.97 120.18 1l7x h TYR 51 Ca 0.05 0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.88 1l7x h TYR 51 Cb 0.04 -0.21 -0.04 0.00 1.01 0.00 0.00 36.73 37.53 1l7x h TYR 51 CO -0.12 0.37 0.41 -0.92 -1.05 0.00 0.00 178.16 176.85 1l7x h TYR 52 N 0.68 0.77 -0.44 4.88 3.20 -0.80 0.15 116.97 125.42 1l7x h TYR 52 Ca 0.22 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.02 1l7x h TYR 52 Cb 0.01 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 1l7x h TYR 52 CO -0.06 0.44 -0.10 0.74 -1.64 0.00 0.00 178.16 177.54 1l7x h PHE 53 N 0.81 0.85 -0.43 -3.82 0.04 -0.48 0.77 116.94 114.67 1l7x h PHE 53 Ca 0.27 -0.15 -0.10 0.00 2.80 0.00 0.00 57.97 60.79 1l7x h PHE 53 Cb 0.03 -0.22 -0.02 0.00 2.20 0.00 0.00 35.95 37.95 1l7x h PHE 53 CO -0.05 0.83 -0.14 0.00 -0.60 0.00 0.00 178.31 178.35 1l7x h ALA 54 N 1.19 0.94 -0.19 2.45 0.00 -0.44 -0.32 119.26 122.90 1l7x h ALA 54 Ca 0.12 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 1l7x h ALA 54 Cb 0.57 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1l7x h ALA 54 CO 0.04 0.61 -0.27 1.25 0.00 0.00 0.00 179.25 180.89 1l7x h LEU 55 N 0.71 0.55 -0.54 0.00 5.85 -0.73 -1.84 115.31 119.31 1l7x h LEU 55 Ca 0.11 -0.52 0.07 0.00 0.84 0.00 0.00 57.88 58.39 1l7x h LEU 55 Cb 0.64 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.45 1l7x h LEU 55 CO 0.04 0.96 0.21 0.00 -0.34 0.00 0.00 178.44 179.32 1l7x h ALA 56 N 0.61 0.69 -0.41 1.25 0.00 -0.65 -0.37 119.26 120.37 1l7x h ALA 56 Ca 0.02 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1l7x h ALA 56 Cb 0.84 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1l7x h ALA 56 CO 0.06 -0.18 -0.16 0.45 0.00 0.00 0.00 179.25 179.43 1l7x h HIS 57 N 0.41 0.85 -0.70 0.00 3.86 -1.03 0.81 115.15 119.36 1l7x h HIS 57 Ca 0.26 -0.17 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1l7x h HIS 57 Cb 0.27 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.50 1l7x h HIS 57 CO -0.15 0.87 0.37 1.15 0.86 0.00 0.00 177.93 181.03 1l7x h THR 58 N 0.69 1.22 -0.05 2.45 2.02 -0.42 -1.97 112.91 116.84 1l7x h THR 58 Ca 0.11 -0.57 -0.24 0.00 0.77 0.00 0.00 66.41 66.48 1l7x h THR 58 Cb 0.65 0.32 0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1l7x h THR 58 CO 0.05 0.25 -0.89 0.58 0.37 0.00 0.00 175.52 175.87 1l7x h VAL 59 N 0.96 1.30 -0.70 3.16 2.07 -0.91 -3.24 116.25 118.89 1l7x h VAL 59 Ca 0.24 -2.12 0.12 0.00 0.82 0.00 0.00 66.70 65.76 1l7x h VAL 59 Cb 0.06 2.28 -0.05 0.00 -1.52 0.00 0.00 31.29 32.06 1l7x h VAL 59 CO -0.04 0.66 0.46 -0.09 0.02 0.00 0.00 177.57 178.58 1l7x h ARG 60 N 0.37 0.45 0.00 1.57 2.43 -0.62 -1.16 114.38 117.42 1l7x h ARG 60 Ca -0.10 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 1l7x h ARG 60 Cb 1.54 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.99 1l7x h ARG 60 CO 0.18 0.30 -0.05 -0.44 -1.51 0.00 0.00 179.97 178.44 1l7x h ASP 61 N 0.46 0.00 0.67 -3.80 3.32 -1.38 -2.50 116.42 113.20 1l7x h ASP 61 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1l7x h ASP 61 Cb 0.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.21 1l7x h ASP 61 CO -0.10 0.05 0.00 1.41 -1.72 0.00 0.00 179.24 178.88 1l7x n HIS 62 N -4.28 0.31 -0.05 4.55 8.25 -0.44 -3.25 115.22 120.31 1l7x n HIS 62 Ca -0.03 0.12 -0.13 0.00 -0.26 0.00 0.00 57.72 57.42 1l7x n HIS 62 Cb 0.14 -0.69 -0.14 0.00 1.12 0.00 0.00 29.99 30.42 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 -1.78 1.25 -0.21 2.41 4.77 -0.94 -4.59 117.00 117.92 1l7x n LEU 63 Ca 0.03 0.20 -0.02 0.00 -0.03 0.00 0.00 56.01 56.20 1l7x n LEU 63 Cb 0.22 -0.13 0.05 0.00 -2.33 0.00 0.00 43.42 41.23 1l7x n LEU 63 CO 0.18 0.57 0.70 0.58 -1.33 0.00 0.00 177.39 178.09 1l7x h VAL 64 N 0.01 0.30 -0.24 4.08 2.07 -1.61 0.70 116.25 121.56 1l7x h VAL 64 Ca -0.41 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.16 1l7x h VAL 64 Cb 2.07 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 32.09 1l7x h VAL 64 CO 0.05 0.00 -0.07 1.23 0.02 0.00 0.00 177.57 178.80 1l7x h GLY 65 N -0.06 0.16 2.00 2.17 0.00 -1.81 -1.78 103.07 103.75 1l7x h GLY 65 Ca 0.28 0.10 -0.06 0.00 0.00 0.00 0.00 47.33 47.65 1l7x h GLY 65 CO -0.66 -0.10 -0.31 3.21 0.00 0.00 0.00 176.54 178.68 1l7x h ARG 66 N -0.02 0.00 -0.14 4.80 3.08 -1.71 -1.95 114.38 118.44 1l7x h ARG 66 Ca 0.12 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.03 1l7x h ARG 66 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1l7x h ARG 66 CO -0.26 0.31 -0.45 2.35 -1.07 0.00 0.00 179.97 180.85 1l7x h TRP 67 N 0.00 0.73 -0.28 3.04 7.01 -0.36 0.18 115.95 126.25 1l7x h TRP 67 Ca -0.00 -0.29 -0.12 0.00 2.11 0.00 0.00 58.89 60.58 1l7x h TRP 67 Cb 0.93 -0.12 -0.00 0.00 -2.10 0.00 0.00 29.16 27.87 1l7x h TRP 67 CO 0.00 1.06 -0.29 0.82 -2.79 0.00 0.00 178.44 177.24 1l7x h ILE 68 N 0.19 1.30 -0.42 2.65 2.04 -1.36 -2.29 117.51 119.61 1l7x h ILE 68 Ca -0.02 -1.46 -0.01 0.00 1.00 0.00 0.00 64.86 64.37 1l7x h ILE 68 Cb 1.07 1.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.73 1l7x h ILE 68 CO 0.10 0.47 0.21 -0.09 0.00 0.00 0.00 178.15 178.83 1l7x h ARG 69 N 0.44 0.61 -0.00 2.37 2.43 -1.36 -0.51 114.38 118.36 1l7x h ARG 69 Ca 0.04 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1l7x h ARG 69 Cb 0.86 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1l7x h ARG 69 CO 0.07 0.52 0.00 1.15 -1.51 0.00 0.00 179.97 180.21 1l7x h THR 70 N 0.55 1.08 0.00 0.20 2.02 -0.61 -0.36 112.91 115.78 1l7x h THR 70 Ca 0.15 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 67.02 1l7x h THR 70 Cb 0.11 1.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1l7x h THR 70 CO -0.02 0.06 -0.30 1.56 0.37 0.00 0.00 175.52 177.19 1l7x h GLN 71 N -0.10 0.00 -0.12 6.66 1.08 -1.34 -1.86 115.11 119.42 1l7x h GLN 71 Ca 0.00 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.01 1l7x h GLN 71 Cb 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1l7x h GLN 71 CO -0.00 0.30 -0.72 0.37 -0.95 0.00 0.00 178.83 177.84 1l7x h GLN 72 N 0.00 0.56 -0.63 1.46 5.75 -0.86 -2.92 115.11 118.47 1l7x h GLN 72 Ca -0.00 -0.44 -0.04 0.00 -0.15 0.00 0.00 58.65 58.02 1l7x h GLN 72 Cb 0.54 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.15 1l7x h GLN 72 CO 0.04 1.07 0.25 1.25 -2.65 0.00 0.00 178.83 178.79 1l7x h HIS 73 N 0.39 0.96 -0.19 3.99 2.76 -0.49 -1.78 115.15 120.80 1l7x h HIS 73 Ca -0.03 -0.07 -0.03 0.00 -2.20 0.00 0.00 60.37 58.04 1l7x h HIS 73 Cb 1.31 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 29.97 1l7x h HIS 73 CO 0.06 0.76 0.01 1.88 -1.30 0.00 0.00 177.93 179.34 1l7x h TYR 74 N 0.89 0.28 -0.12 5.26 0.05 -1.29 -1.77 116.97 120.27 1l7x h TYR 74 Ca 0.21 -0.01 -0.18 0.00 0.05 0.00 0.00 58.73 58.80 1l7x h TYR 74 Cb 0.21 -0.09 0.01 0.00 1.01 0.00 0.00 36.73 37.87 1l7x h TYR 74 CO 0.01 0.29 -0.64 -0.92 -1.05 0.00 0.00 178.16 175.85 1l7x h TYR 75 N 0.28 0.88 -0.10 4.88 3.20 -1.26 -0.82 116.97 124.02 1l7x h TYR 75 Ca 0.07 -0.39 -0.17 0.00 3.14 0.00 0.00 58.73 61.38 1l7x h TYR 75 Cb 0.18 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1l7x h TYR 75 CO 0.00 1.20 -0.64 -0.44 -1.64 0.00 0.00 178.16 176.64 1l7x h ASP 76 N 0.31 0.45 0.00 -2.11 3.32 -1.01 -3.31 116.42 114.07 1l7x h ASP 76 Ca -0.04 -0.27 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1l7x h ASP 76 Cb 1.28 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.69 1l7x h ASP 76 CO 0.13 0.97 -1.44 0.29 -1.72 0.00 0.00 179.24 177.47 1l7x n LYS 77 N -3.88 0.64 -3.82 3.56 4.76 -0.69 -5.04 118.16 113.69 1l7x n LYS 77 Ca -0.03 -0.10 -0.34 0.00 -2.87 0.00 0.00 58.31 54.97 1l7x n LYS 77 Cb 0.65 -1.44 0.02 0.00 -1.84 0.00 0.00 35.03 32.43 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 -6.15 3.31 0.30 0.00 0.04 -1.26 -4.95 135.00 126.30 1l7x s PRO 79 Ca 0.36 0.76 -0.30 0.00 0.04 0.00 0.00 61.00 61.86 1l7x s PRO 79 Cb -0.16 -2.05 -0.11 0.00 0.04 0.00 0.00 34.50 32.21 1l7x s PRO 79 CO 0.91 -0.78 1.60 0.21 0.04 0.00 0.00 177.00 178.98 1l7x s LYS 80 N -5.17 4.10 -0.05 4.56 2.20 -1.26 -4.97 119.74 119.15 1l7x s LYS 80 Ca 0.56 2.61 -0.07 0.00 -0.36 0.00 0.00 55.97 58.71 1l7x s LYS 80 Cb -0.12 -3.01 -0.04 0.00 -1.51 0.00 0.00 37.83 33.15 1l7x s LYS 80 CO 0.54 -0.65 0.21 1.03 -0.36 0.00 0.00 175.35 176.11 1l7x s ARG 81 N -0.61 3.52 -0.14 4.03 0.52 -0.06 -4.59 118.95 121.62 1l7x s ARG 81 Ca 0.63 -0.11 -0.01 0.00 -0.52 0.00 0.00 55.73 55.72 1l7x s ARG 81 Cb -0.48 -3.14 -0.02 0.00 0.52 0.00 0.00 34.95 31.82 1l7x s ARG 81 CO 0.49 0.71 -0.10 0.08 0.02 0.00 0.00 175.30 176.51 1l7x s VAL 82 N -1.17 3.35 -0.21 3.52 1.01 -0.86 -1.40 120.40 124.65 1l7x s VAL 82 Ca 0.22 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.66 1l7x s VAL 82 Cb -0.13 -2.43 0.04 0.00 0.00 0.00 0.00 36.38 33.86 1l7x s VAL 82 CO 0.11 0.52 -0.16 -0.31 0.00 0.00 0.00 175.10 175.26 1l7x s TYR 83 N 0.31 2.90 -0.53 5.22 2.02 0.98 -0.59 117.35 127.66 1l7x s TYR 83 Ca -0.08 -1.87 -0.19 0.00 -0.37 0.00 0.00 57.07 54.56 1l7x s TYR 83 Cb -0.15 -1.88 0.07 0.00 -0.40 0.00 0.00 41.96 39.59 1l7x s TYR 83 CO 0.05 -0.82 0.65 -0.47 -1.57 0.00 0.00 175.55 173.38 1l7x s TYR 84 N 1.24 3.03 -0.32 2.71 5.04 0.26 -0.47 117.35 128.85 1l7x s TYR 84 Ca -0.01 -0.64 -0.16 0.00 -2.44 0.00 0.00 57.07 53.82 1l7x s TYR 84 Cb -0.16 -3.66 -0.02 0.00 0.35 0.00 0.00 41.96 38.48 1l7x s TYR 84 CO -0.10 -1.10 0.42 -1.17 -1.34 0.00 0.00 175.55 172.27 1l7x s LEU 85 N 2.65 4.27 -0.06 6.97 2.96 -0.76 -0.74 118.68 133.96 1l7x s LEU 85 Ca 0.14 0.03 -0.14 0.00 -0.22 0.00 0.00 54.13 53.94 1l7x s LEU 85 Cb -0.20 -2.46 0.03 0.00 0.50 0.00 0.00 46.19 44.05 1l7x s LEU 85 CO 0.10 -0.34 0.34 -0.55 -1.32 0.00 0.00 176.35 174.58 1l7x s SER 86 N 1.70 -0.27 0.01 3.68 0.15 -0.63 -1.93 113.70 116.41 1l7x s SER 86 Ca 0.15 0.36 0.27 0.00 0.70 0.00 0.00 55.95 57.43 1l7x s SER 86 Cb -0.16 0.49 1.15 0.00 -1.71 0.00 0.00 66.02 65.78 1l7x s SER 86 CO 0.12 -0.32 1.87 0.18 1.20 0.00 0.00 173.24 176.28 1l7x n LEU 87 N 1.92 0.04 -4.04 3.45 7.99 -1.26 -3.95 117.00 121.15 1l7x n LEU 87 Ca -0.18 0.50 -0.20 0.00 -0.01 0.00 0.00 56.01 56.13 1l7x n LEU 87 Cb 0.57 -0.49 -0.15 0.00 -0.11 0.00 0.00 43.42 43.24 1l7x n LEU 87 CO 0.19 -0.04 -0.44 -1.61 -1.51 0.00 0.00 177.39 173.98 1l7x s GLU 88 N -3.01 0.86 -0.28 3.23 2.02 -1.26 -4.57 118.70 115.69 1l7x s GLU 88 Ca 0.13 -0.36 -0.02 0.00 0.02 0.00 0.00 54.97 54.73 1l7x s GLU 88 Cb 0.18 -0.83 0.12 0.00 0.10 0.00 0.00 34.13 33.69 1l7x s GLU 88 CO 0.50 0.21 0.22 -0.06 0.02 0.00 0.00 175.26 176.15 1l7x s PHE 89 N -0.19 -0.11 -1.24 1.61 0.40 -0.39 -4.60 117.98 113.46 1l7x s PHE 89 Ca 0.03 -0.45 -0.12 0.00 -0.60 0.00 0.00 56.93 55.79 1l7x s PHE 89 Cb -0.05 -0.64 0.17 0.00 0.51 0.00 0.00 43.02 43.01 1l7x s PHE 89 CO -0.00 -0.86 1.59 0.98 0.70 0.00 0.00 175.22 177.63 1l7x n TYR 90 N 5.29 4.27 0.18 0.36 4.19 0.34 -3.10 117.16 128.68 1l7x n TYR 90 Ca -0.04 -3.16 0.06 0.00 3.31 0.00 0.00 57.90 58.07 1l7x n TYR 90 Cb 0.45 -2.10 0.20 0.00 0.49 0.00 0.00 39.34 38.37 1l7x n TYR 90 CO 0.00 0.00 0.00 0.52 0.91 0.00 0.00 176.86 178.29 1l7x h MET 91 N 6.65 0.00 0.00 2.98 2.86 -1.76 -3.41 114.93 122.25 1l7x h MET 91 Ca 0.34 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.98 1l7x h MET 91 Cb 0.79 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.45 1l7x h MET 91 CO 1.38 0.35 0.00 0.41 1.06 0.00 0.00 176.91 180.11 1l7x n GLY 92 N 0.82 1.26 3.87 8.32 0.00 -1.13 -4.76 105.19 113.58 1l7x n GLY 92 Ca 0.02 -0.67 -0.32 0.00 0.00 0.00 0.00 46.02 45.04 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 3.81 -0.17 1.61 0.52 -1.26 -1.19 118.95 122.27 1l7x s ARG 93 Ca 0.00 0.28 0.12 0.00 -0.52 0.00 0.00 55.73 55.61 1l7x s ARG 93 Cb 0.00 -2.65 -0.19 0.00 0.52 0.00 0.00 34.95 32.64 1l7x s ARG 93 CO 0.00 0.32 0.01 2.41 0.02 0.00 0.00 175.30 178.06 1l7x n THR 94 N -0.13 1.12 0.14 0.02 -1.04 -1.26 -4.58 114.28 108.55 1l7x n THR 94 Ca 0.00 -0.65 -0.14 0.00 -2.04 0.00 0.00 64.05 61.23 1l7x n THR 94 Cb 0.52 -0.69 -0.08 0.00 -1.82 0.00 0.00 70.33 68.27 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 -1.22 -0.32 -4.42 5.85 -1.97 -0.42 115.31 112.81 1l7x h LEU 95 Ca -0.44 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.39 1l7x h LEU 95 Cb 1.95 0.44 -0.02 0.00 0.37 0.00 0.00 40.66 43.40 1l7x h LEU 95 CO 0.01 -0.48 0.19 -0.61 -0.34 0.00 0.00 178.44 177.21 1l7x h GLN 96 N -0.68 0.43 -0.61 1.25 4.15 -1.97 -1.54 115.11 116.15 1l7x h GLN 96 Ca -0.02 -0.04 0.11 0.00 0.77 0.00 0.00 58.65 59.47 1l7x h GLN 96 Cb 0.64 -0.09 -0.08 0.00 0.21 0.00 0.00 27.48 28.16 1l7x h GLN 96 CO -0.17 0.34 0.18 -0.97 -1.93 0.00 0.00 178.83 176.27 1l7x h ASN 97 N 0.41 0.11 -0.58 -0.69 -0.00 -1.78 -0.93 115.58 112.12 1l7x h ASN 97 Ca 0.11 0.10 -0.07 0.00 -0.00 0.00 0.00 56.30 56.44 1l7x h ASN 97 Cb 0.02 0.11 -0.03 0.00 -0.00 0.00 0.00 38.32 38.42 1l7x h ASN 97 CO -0.02 0.06 0.10 0.74 -0.00 0.00 0.00 177.43 178.31 1l7x h THR 98 N 0.33 1.25 -0.39 -3.57 2.02 -0.75 -1.81 112.91 109.98 1l7x h THR 98 Ca 0.32 -0.99 -0.08 0.00 0.77 0.00 0.00 66.41 66.43 1l7x h THR 98 Cb 0.45 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.52 1l7x h THR 98 CO -0.37 0.37 -0.10 0.24 0.37 0.00 0.00 175.52 176.03 1l7x h MET 99 N 0.93 0.69 -0.03 6.66 2.86 -0.19 -2.14 114.93 123.71 1l7x h MET 99 Ca 0.19 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1l7x h MET 99 Cb 0.41 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 1l7x h MET 99 CO 0.01 0.77 -0.04 0.82 1.06 0.00 0.00 176.91 179.53 1l7x h ILE 100 N 0.63 1.41 0.00 -1.22 2.04 -0.95 0.62 117.51 120.04 1l7x h ILE 100 Ca 0.11 -1.29 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1l7x h ILE 100 Cb 0.54 2.22 -0.00 0.00 -0.74 0.00 0.00 36.82 38.84 1l7x h ILE 100 CO 0.03 0.34 -0.03 0.78 0.00 0.00 0.00 178.15 179.27 1l7x h ASN 101 N -0.43 0.00 -0.02 1.72 4.21 -1.32 -1.95 115.58 117.79 1l7x h ASN 101 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1l7x h ASN 101 Cb 0.58 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.78 1l7x h ASN 101 CO 0.01 0.03 -0.17 0.18 -1.29 0.00 0.00 177.43 176.19 1l7x n LEU 102 N -3.24 2.52 -1.95 1.61 4.77 -0.81 -0.70 117.00 119.20 1l7x n LEU 102 Ca -0.01 -0.91 -0.13 0.00 -0.03 0.00 0.00 56.01 54.93 1l7x n LEU 102 Cb 0.20 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.32 1l7x n LEU 102 CO 0.25 0.44 0.06 0.61 -1.33 0.00 0.00 177.39 177.42 1l7x n GLY 103 N 1.30 0.07 0.00 -0.72 0.00 -0.63 -4.96 105.19 100.26 1l7x n GLY 103 Ca 0.11 -0.23 0.04 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.60 0.05 -0.25 0.99 4.77 0.21 -4.81 117.00 115.35 1l7x n LEU 104 Ca -0.03 -0.06 -0.07 0.00 -0.03 0.00 0.00 56.01 55.82 1l7x n LEU 104 Cb 0.55 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.58 1l7x n LEU 104 CO 0.30 0.01 0.47 1.67 -1.33 0.00 0.00 177.39 178.52 1l7x n GLN 105 N -1.70 -0.27 -0.36 3.23 7.27 -1.03 -0.49 117.38 124.04 1l7x n GLN 105 Ca -0.01 1.28 0.08 0.00 0.07 0.00 0.00 57.00 58.42 1l7x n GLN 105 Cb 0.20 -1.89 0.25 0.00 2.41 0.00 0.00 30.24 31.21 1l7x n GLN 105 CO 0.00 0.00 0.00 -0.91 0.07 0.00 0.00 177.06 176.22 1l7x h ASN 106 N 0.00 0.88 -0.20 1.69 2.35 -1.91 0.35 115.58 118.75 1l7x h ASN 106 Ca 0.10 0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.85 1l7x h ASN 106 Cb 0.25 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1l7x h ASN 106 CO -0.57 0.44 -0.11 0.00 -1.65 0.00 0.00 177.43 175.54 1l7x h ALA 107 N 1.56 0.28 -0.66 -0.83 0.00 -1.52 -2.35 119.26 115.75 1l7x h ALA 107 Ca 0.51 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1l7x h ALA 107 Cb 0.57 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1l7x h ALA 107 CO -0.29 0.13 0.15 0.00 0.00 0.00 0.00 179.25 179.23 1l7x h ASP 109 N 0.98 0.62 -0.17 0.00 3.32 -0.28 0.15 116.42 121.04 1l7x h ASP 109 Ca 0.20 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.23 1l7x h ASP 109 Cb 0.38 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 1l7x h ASP 109 CO 0.00 0.41 -0.09 -0.08 -1.72 0.00 0.00 179.24 177.76 1l7x h GLU 110 N 0.75 0.37 0.03 3.56 4.57 -1.03 -1.92 114.58 120.91 1l7x h GLU 110 Ca 0.30 -0.16 0.01 0.00 -1.18 0.00 0.00 59.36 58.33 1l7x h GLU 110 Cb 0.15 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 1l7x h GLU 110 CO -0.16 0.68 -0.11 0.00 -1.18 0.00 0.00 179.01 178.24 1l7x h ALA 111 N 0.68 -0.15 -0.44 2.92 0.00 -0.79 -0.02 119.26 121.47 1l7x h ALA 111 Ca 0.04 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1l7x h ALA 111 Cb 0.57 0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 1l7x h ALA 111 CO 0.03 -0.61 0.22 0.82 0.00 0.00 0.00 179.25 179.71 1l7x h ILE 112 N -0.20 0.98 -0.90 0.00 1.08 -1.00 -1.54 117.51 115.92 1l7x h ILE 112 Ca 0.03 -0.15 0.03 0.00 -0.39 0.00 0.00 64.86 64.38 1l7x h ILE 112 Cb 0.23 0.49 -0.05 0.00 -3.07 0.00 0.00 36.82 34.42 1l7x h ILE 112 CO -0.08 0.08 0.59 0.22 -0.69 0.00 0.00 178.15 178.27 1l7x h TYR 113 N 0.44 1.10 0.00 1.37 3.20 -1.10 -1.16 116.97 120.83 1l7x h TYR 113 Ca 0.19 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.08 1l7x h TYR 113 Cb 0.09 -0.37 0.00 0.00 1.54 0.00 0.00 36.73 37.99 1l7x h TYR 113 CO -0.10 0.64 0.00 1.96 -1.64 0.00 0.00 178.16 179.02 1l7x h GLN 114 N 1.15 0.00 -0.10 1.82 4.20 -0.17 -1.65 115.11 120.36 1l7x h GLN 114 Ca 0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.07 1l7x h GLN 114 Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1l7x h GLN 114 CO -0.11 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.33 1l7x n LEU 115 N -3.03 1.58 0.00 1.46 4.77 -0.54 -4.90 117.00 116.33 1l7x n LEU 115 Ca -0.00 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 1l7x n LEU 115 Cb 0.26 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1l7x n LEU 115 CO 0.25 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1l7x n GLY 116 N 1.15 0.63 3.67 -0.72 0.00 -0.62 -5.07 105.19 104.23 1l7x n GLY 116 Ca 0.17 -0.43 -0.25 0.00 0.00 0.00 0.00 46.02 45.52 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 0.00 3.04 -0.35 0.99 1.43 -0.63 -5.02 118.68 118.15 1l7x s LEU 117 Ca 0.00 -1.02 -0.04 0.00 -1.03 0.00 0.00 54.13 52.04 1l7x s LEU 117 Cb 0.00 -1.38 0.06 0.00 0.03 0.00 0.00 46.19 44.91 1l7x s LEU 117 CO 0.00 -0.34 0.10 -0.62 0.23 0.00 0.00 176.35 175.72 1l7x s ASP 118 N -3.78 5.15 0.45 2.29 3.68 -1.26 -3.50 116.67 119.71 1l7x s ASP 118 Ca 0.37 -1.43 0.16 0.00 2.13 0.00 0.00 52.55 53.78 1l7x s ASP 118 Cb 0.02 -1.80 1.10 0.00 -1.45 0.00 0.00 42.92 40.78 1l7x s ASP 118 CO 0.20 -0.37 1.97 -0.29 0.13 0.00 0.00 175.17 176.82 1l7x h ILE 119 N 6.33 0.84 -0.54 4.11 2.10 -1.90 -1.40 117.51 127.06 1l7x h ILE 119 Ca -0.20 -0.11 -0.04 0.00 1.08 0.00 0.00 64.86 65.59 1l7x h ILE 119 Cb 1.07 0.48 -0.03 0.00 -1.09 0.00 0.00 36.82 37.25 1l7x h ILE 119 CO 0.61 0.06 0.18 -0.08 -1.08 0.00 0.00 178.15 177.83 1l7x h GLU 120 N 0.33 0.80 -0.19 2.19 4.22 -1.99 -0.91 114.58 119.03 1l7x h GLU 120 Ca 0.29 -0.14 -0.17 0.00 0.08 0.00 0.00 59.36 59.42 1l7x h GLU 120 Cb 0.69 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 1l7x h GLU 120 CO -0.07 0.69 -0.58 1.49 -2.18 0.00 0.00 179.01 178.36 1l7x h GLU 121 N 0.78 0.62 -0.48 1.92 4.81 -1.69 -2.94 114.58 117.61 1l7x h GLU 121 Ca 0.18 -0.41 -0.10 0.00 -0.13 0.00 0.00 59.36 58.90 1l7x h GLU 121 Cb 0.22 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1l7x h GLU 121 CO -0.01 1.03 -0.10 -0.07 -0.73 0.00 0.00 179.01 179.13 1l7x h LEU 122 N 0.47 0.87 -1.37 1.64 3.38 -1.18 -2.92 115.31 116.19 1l7x h LEU 122 Ca 0.00 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 1l7x h LEU 122 Cb 1.15 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1l7x h LEU 122 CO 0.11 0.99 0.08 -0.33 0.09 0.00 0.00 178.44 179.39 1l7x h GLU 123 N 0.79 0.51 0.00 1.13 5.08 -1.07 -2.22 114.58 118.80 1l7x h GLU 123 Ca 0.13 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1l7x h GLU 123 Cb 0.61 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1l7x h GLU 123 CO 0.04 0.47 0.00 0.39 -1.00 0.00 0.00 179.01 178.91 1l7x n GLU 124 N -4.35 0.17 -0.07 2.33 -0.58 -1.10 -2.55 120.64 114.48 1l7x n GLU 124 Ca 0.02 0.43 -0.13 0.00 -0.42 0.00 0.00 57.16 57.06 1l7x n GLU 124 Cb 0.18 -1.85 -0.00 0.00 -0.57 0.00 0.00 31.44 29.20 1l7x n GLU 124 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1l7x h ILE 125 N 0.00 1.28 -2.38 -3.67 1.08 -1.46 -3.44 117.51 108.92 1l7x h ILE 125 Ca 0.00 -1.67 -0.56 0.00 -0.39 0.00 0.00 64.86 62.24 1l7x h ILE 125 Cb 0.31 1.56 0.05 0.00 -3.07 0.00 0.00 36.82 35.67 1l7x h ILE 125 CO 0.00 0.54 0.94 1.21 -0.69 0.00 0.00 178.15 180.15 1l7x n GLU 126 N -4.02 2.43 -2.68 2.37 2.13 -1.06 -4.96 120.64 114.85 1l7x n GLU 126 Ca -0.03 0.88 -0.36 0.00 0.66 0.00 0.00 57.16 58.31 1l7x n GLU 126 Cb 0.59 -2.70 -0.05 0.00 0.27 0.00 0.00 31.44 29.55 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 1.63 4.28 0.38 5.31 0.41 -1.26 -4.98 118.70 124.47 1l7x s GLU 127 Ca 0.80 1.35 -0.25 0.00 -0.41 0.00 0.00 54.97 56.46 1l7x s GLU 127 Cb -0.60 -2.50 -0.09 0.00 -1.78 0.00 0.00 34.13 29.16 1l7x s GLU 127 CO 0.38 -0.01 1.11 -0.51 -0.49 0.00 0.00 175.26 175.74 1l7x s ASP 128 N -1.76 6.74 -1.13 -0.19 -0.00 -1.26 -4.69 116.67 114.39 1l7x s ASP 128 Ca 0.57 2.21 -0.13 0.00 -0.00 0.00 0.00 52.55 55.20 1l7x s ASP 128 Cb -0.17 -2.60 0.21 0.00 -0.00 0.00 0.00 42.92 40.35 1l7x s ASP 128 CO 0.22 -0.51 1.25 0.00 -0.00 0.00 0.00 175.17 176.14 1l7x s ALA 129 N -1.47 4.21 -1.28 5.23 0.00 -0.33 -4.90 121.76 123.22 1l7x s ALA 129 Ca 0.55 -3.47 -0.06 0.00 0.00 0.00 0.00 51.96 48.98 1l7x s ALA 129 Cb -0.27 -3.89 0.16 0.00 0.00 0.00 0.00 23.12 19.12 1l7x s ALA 129 CO 0.34 -2.56 2.18 0.41 0.00 0.00 0.00 175.76 176.13 1l7x n GLY 130 N 3.74 5.21 1.93 0.00 0.00 -1.26 -2.45 105.19 112.36 1l7x n GLY 130 Ca 0.30 -2.14 -0.17 0.00 0.00 0.00 0.00 46.02 44.00 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 2.00 6.51 -4.00 0.99 4.77 -1.18 -0.46 117.00 125.63 1l7x n LEU 131 Ca 0.54 -3.35 -0.10 0.00 -0.03 0.00 0.00 56.01 53.07 1l7x n LEU 131 Cb 0.28 -1.06 -0.05 0.00 -2.33 0.00 0.00 43.42 40.26 1l7x n LEU 131 CO 0.70 1.25 0.19 -0.83 -1.33 0.00 0.00 177.39 177.38 1l7x s GLY 132 N 0.13 0.67 -0.17 -0.72 0.00 -1.26 -1.26 107.32 104.71 1l7x s GLY 132 Ca 0.33 -0.97 0.08 0.00 0.00 0.00 0.00 44.72 44.16 1l7x s GLY 132 CO -0.01 -0.67 -0.05 0.70 0.00 0.00 0.00 173.10 173.07 1l7x n ASN 133 N -0.59 1.76 0.00 1.64 3.02 -1.26 -4.36 115.26 115.46 1l7x n ASN 133 Ca -0.02 -0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 1l7x n ASN 133 Cb 0.62 0.34 0.00 0.00 -0.61 0.00 0.00 39.78 40.13 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 2.28 0.88 0.35 7.41 0.00 -1.26 -4.91 105.19 109.94 1l7x n GLY 134 Ca -0.30 0.23 -0.07 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.27 0.10 -0.02 0.00 -1.99 -0.43 103.07 100.45 1l7x h GLY 135 Ca 0.00 0.45 0.18 0.00 0.00 0.00 0.00 47.33 47.95 1l7x h GLY 135 CO 0.00 -0.20 0.48 -2.00 0.00 0.00 0.00 176.54 174.82 1l7x h LEU 136 N -0.24 0.56 -0.02 3.11 6.46 -1.98 0.74 115.31 123.94 1l7x h LEU 136 Ca 0.18 0.11 -0.22 0.00 -0.12 0.00 0.00 57.88 57.83 1l7x h LEU 136 Cb 0.55 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 1l7x h LEU 136 CO -0.59 0.18 -1.04 1.23 -0.62 0.00 0.00 178.44 177.61 1l7x h GLY 137 N 0.61 0.09 1.93 3.75 0.00 -1.62 -3.15 103.07 104.68 1l7x h GLY 137 Ca 0.52 -0.22 -0.20 0.00 0.00 0.00 0.00 47.33 47.43 1l7x h GLY 137 CO -0.41 0.19 -0.94 -0.09 0.00 0.00 0.00 176.54 175.30 1l7x h ARG 138 N 0.03 0.06 -0.06 4.80 9.65 0.06 0.10 114.38 129.02 1l7x h ARG 138 Ca -0.04 -0.08 -0.00 0.00 -1.10 0.00 0.00 59.98 58.76 1l7x h ARG 138 Cb 1.78 0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 30.38 1l7x h ARG 138 CO 0.15 0.95 0.04 1.25 2.80 0.00 0.00 179.97 185.15 1l7x h LEU 139 N 0.02 0.08 -0.96 3.80 5.85 0.39 -0.59 115.31 123.90 1l7x h LEU 139 Ca -0.03 -0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.76 1l7x h LEU 139 Cb 1.63 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.56 1l7x h LEU 139 CO 0.13 0.10 0.59 0.00 -0.34 0.00 0.00 178.44 178.91 1l7x h ALA 140 N 0.98 1.42 -0.52 1.25 0.00 -1.55 0.35 119.26 121.20 1l7x h ALA 140 Ca 0.02 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 1l7x h ALA 140 Cb 0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1l7x h ALA 140 CO -0.00 0.20 -0.17 0.00 0.00 0.00 0.00 179.25 179.28 1l7x h ALA 141 N 1.51 0.72 -0.14 0.00 0.00 -1.28 -2.49 119.26 117.58 1l7x h ALA 141 Ca 0.47 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1l7x h ALA 141 Cb 0.44 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1l7x h ALA 141 CO -0.26 0.67 -0.33 0.00 0.00 0.00 0.00 179.25 179.33 1l7x h PHE 143 N 0.24 1.18 -0.25 0.00 -1.00 -0.72 -1.17 116.94 115.21 1l7x h PHE 143 Ca 0.03 -0.16 -0.02 0.00 2.81 0.00 0.00 57.97 60.63 1l7x h PHE 143 Cb 0.71 -0.32 -0.01 0.00 3.61 0.00 0.00 35.95 39.94 1l7x h PHE 143 CO 0.01 0.98 0.09 -0.07 -1.61 0.00 0.00 178.31 177.72 1l7x h LEU 144 N 1.03 0.35 -0.33 1.54 3.38 -1.32 0.41 115.31 120.36 1l7x h LEU 144 Ca 0.20 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.04 1l7x h LEU 144 Cb 0.44 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 1l7x h LEU 144 CO 0.01 0.43 0.07 -0.78 0.09 0.00 0.00 178.44 178.27 1l7x h ASP 145 N 0.25 0.03 -0.22 -0.43 3.58 -1.32 0.45 116.42 118.76 1l7x h ASP 145 Ca 0.08 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.58 1l7x h ASP 145 Cb 0.19 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 1l7x h ASP 145 CO -0.01 0.05 0.11 0.28 -2.88 0.00 0.00 179.24 176.80 1l7x h SER 146 N 0.19 0.29 -0.35 2.28 0.02 -0.89 0.06 113.55 115.16 1l7x h SER 146 Ca 0.15 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1l7x h SER 146 Cb 0.16 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1l7x h SER 146 CO -0.19 0.32 0.23 0.24 -1.14 0.00 0.00 176.83 176.28 1l7x h MET 147 N 0.23 0.47 0.04 3.45 2.86 0.22 0.51 114.93 122.71 1l7x h MET 147 Ca 0.08 -0.03 -0.25 0.00 -2.06 0.00 0.00 59.70 57.44 1l7x h MET 147 Cb 0.11 -0.10 0.01 0.00 0.06 0.00 0.00 31.60 31.67 1l7x h MET 147 CO -0.01 0.32 -1.04 0.00 1.06 0.00 0.00 176.91 177.24 1l7x h ALA 148 N 1.77 0.26 -0.26 6.32 0.00 -0.60 -0.23 119.26 126.51 1l7x h ALA 148 Ca 0.13 -0.75 -0.09 0.00 0.00 0.00 0.00 54.91 54.20 1l7x h ALA 148 Cb -0.04 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1l7x h ALA 148 CO -0.03 0.82 -0.22 1.15 0.00 0.00 0.00 179.25 180.97 1l7x h THR 149 N 0.21 1.26 -0.00 0.00 2.02 -0.04 -2.30 112.91 114.06 1l7x h THR 149 Ca -0.11 -1.21 0.00 0.00 0.77 0.00 0.00 66.41 65.86 1l7x h THR 149 Cb 1.70 1.30 0.00 0.00 -1.74 0.00 0.00 68.15 69.41 1l7x h THR 149 CO 0.18 0.39 -0.03 0.18 0.37 0.00 0.00 175.52 176.61 1l7x n LEU 150 N -4.14 0.35 -0.73 2.58 4.77 0.08 -4.75 117.00 115.17 1l7x n LEU 150 Ca -0.00 -0.03 -0.07 0.00 -0.03 0.00 0.00 56.01 55.88 1l7x n LEU 150 Cb 0.39 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.38 1l7x n LEU 150 CO 0.42 0.06 -0.08 0.61 -1.33 0.00 0.00 177.39 177.06 1l7x n GLY 151 N 1.14 0.18 3.86 -0.72 0.00 -0.86 -4.41 105.19 104.39 1l7x n GLY 151 Ca 0.19 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.86 3.88 -1.31 0.99 1.43 -0.12 -4.72 118.68 116.97 1l7x s LEU 152 Ca 0.00 1.23 -0.10 0.00 -1.03 0.00 0.00 54.13 54.23 1l7x s LEU 152 Cb 0.00 -4.09 0.14 0.00 0.03 0.00 0.00 46.19 42.27 1l7x s LEU 152 CO 0.00 -0.36 1.96 0.00 0.23 0.00 0.00 176.35 178.18 1l7x n ALA 153 N -1.03 5.47 -2.80 4.21 0.00 -1.26 -4.71 120.51 120.39 1l7x n ALA 153 Ca 0.03 -4.23 -0.31 0.00 0.00 0.00 0.00 53.44 48.93 1l7x n ALA 153 Cb 0.54 -3.07 -0.06 0.00 0.00 0.00 0.00 19.45 16.86 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 0.81 3.65 -0.02 0.00 0.00 -1.26 -2.02 121.76 122.92 1l7x s ALA 154 Ca 0.41 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 51.41 1l7x s ALA 154 Cb 0.11 -1.52 0.01 0.00 0.00 0.00 0.00 23.12 21.73 1l7x s ALA 154 CO -0.01 0.77 -0.03 0.71 0.00 0.00 0.00 175.76 177.19 1l7x s TYR 155 N -1.41 0.48 -0.12 0.00 2.02 0.24 -4.10 117.35 114.46 1l7x s TYR 155 Ca 0.30 -0.09 -0.06 0.00 -0.37 0.00 0.00 57.07 56.85 1l7x s TYR 155 Cb -0.12 -0.43 -0.04 0.00 -0.40 0.00 0.00 41.96 40.96 1l7x s TYR 155 CO 0.23 -0.10 0.11 0.20 -1.57 0.00 0.00 175.55 174.41 1l7x s GLY 156 N 0.58 2.07 -0.14 0.71 0.00 -1.01 -0.57 107.32 108.96 1l7x s GLY 156 Ca -0.07 -0.68 -0.00 0.00 0.00 0.00 0.00 44.72 43.97 1l7x s GLY 156 CO -0.01 -0.36 -0.08 -0.19 0.00 0.00 0.00 173.10 172.46 1l7x s TYR 157 N -0.83 1.74 0.00 1.90 1.51 0.08 -0.36 117.35 121.40 1l7x s TYR 157 Ca 0.13 -1.01 0.00 0.00 -1.01 0.00 0.00 57.07 55.19 1l7x s TYR 157 Cb -0.12 -1.35 0.00 0.00 -0.11 0.00 0.00 41.96 40.38 1l7x s TYR 157 CO 0.03 -0.59 0.00 0.41 -1.11 0.00 0.00 175.55 174.29 1l7x n GLY 158 N 4.87 4.97 3.45 0.71 0.00 -0.86 -1.60 105.19 116.74 1l7x n GLY 158 Ca -0.13 -1.27 -0.33 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.79 3.06 -1.10 -0.61 1.01 -1.26 -1.24 121.20 120.26 1l7x s ILE 159 Ca 0.00 -0.71 -0.16 0.00 0.00 0.00 0.00 60.65 59.79 1l7x s ILE 159 Cb 0.00 -2.22 0.16 0.00 0.01 0.00 0.00 42.46 40.41 1l7x s ILE 159 CO 0.00 0.57 1.31 -0.60 0.00 0.00 0.00 174.94 176.23 1l7x s ARG 160 N -0.45 3.91 0.22 2.79 3.52 0.32 -4.71 118.95 124.54 1l7x s ARG 160 Ca 0.06 -2.29 -0.30 0.00 -0.13 0.00 0.00 55.73 53.07 1l7x s ARG 160 Cb -0.12 -5.00 -0.10 0.00 -1.56 0.00 0.00 34.95 28.17 1l7x s ARG 160 CO 0.02 -1.76 1.47 0.71 -0.81 0.00 0.00 175.30 174.93 1l7x s TYR 161 N 1.96 3.04 0.29 5.12 2.02 -1.26 -4.74 117.35 123.78 1l7x s TYR 161 Ca 0.39 0.92 0.02 0.00 -0.37 0.00 0.00 57.07 58.02 1l7x s TYR 161 Cb -0.04 -3.84 0.46 0.00 -0.40 0.00 0.00 41.96 38.14 1l7x s TYR 161 CO -0.04 -2.84 1.79 1.49 -1.57 0.00 0.00 175.55 174.38 1l7x h GLU 162 N 5.59 0.60 -4.85 -0.62 4.81 -0.66 -3.41 114.58 116.04 1l7x h GLU 162 Ca -0.45 -0.17 -0.58 0.00 -0.13 0.00 0.00 59.36 58.03 1l7x h GLU 162 Cb 1.21 -0.07 -0.33 0.00 0.63 0.00 0.00 28.75 30.19 1l7x h GLU 162 CO 0.82 0.68 -0.84 0.71 -0.73 0.00 0.00 179.01 179.64 1l7x s TYR 163 N -4.84 1.92 0.00 0.92 1.51 0.40 -4.21 117.35 113.06 1l7x s TYR 163 Ca -0.08 -0.78 0.00 0.00 -1.01 0.00 0.00 57.07 55.20 1l7x s TYR 163 Cb 0.15 -1.35 0.00 0.00 -0.11 0.00 0.00 41.96 40.65 1l7x s TYR 163 CO 0.79 -0.36 0.00 0.41 -1.11 0.00 0.00 175.55 175.28 1l7x n GLY 164 N 3.78 1.34 3.73 0.71 0.00 -1.24 -1.94 105.19 111.57 1l7x n GLY 164 Ca -0.21 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 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 1.65 2.12 0.84 -0.61 1.10 0.39 -4.47 121.20 122.23 1l7x s ILE 165 Ca 0.00 0.09 -0.14 0.00 -0.51 0.00 0.00 60.65 60.09 1l7x s ILE 165 Cb 0.00 -3.06 0.03 0.00 0.15 0.00 0.00 42.46 39.58 1l7x s ILE 165 CO 0.00 0.01 0.67 2.22 -2.11 0.00 0.00 174.94 175.73 1l7x n PHE 166 N 3.49 -0.46 -3.18 3.50 -1.74 -1.26 -4.64 117.46 113.16 1l7x n PHE 166 Ca 0.13 0.32 -0.39 0.00 -0.56 0.00 0.00 57.45 56.96 1l7x n PHE 166 Cb 0.36 -1.92 -0.05 0.00 1.52 0.00 0.00 39.48 39.39 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 -1.88 6.86 -0.12 5.98 0.01 0.00 -4.91 114.94 120.88 1l7x s ASN 167 Ca 0.64 1.02 -0.11 0.00 -0.71 0.00 0.00 52.86 53.71 1l7x s ASN 167 Cb -0.28 -2.35 -0.05 0.00 0.41 0.00 0.00 41.25 38.98 1l7x s ASN 167 CO 0.60 -0.03 0.23 -1.58 -1.51 0.00 0.00 177.10 174.80 1l7x s GLN 168 N 0.58 3.88 0.10 -0.60 0.74 -1.26 -1.29 119.66 121.81 1l7x s GLN 168 Ca 0.32 0.02 0.03 0.00 0.05 0.00 0.00 55.36 55.77 1l7x s GLN 168 Cb -0.17 -3.30 -0.04 0.00 1.10 0.00 0.00 33.01 30.61 1l7x s GLN 168 CO 0.15 0.54 -0.09 0.15 -0.55 0.00 0.00 175.29 175.48 1l7x s LYS 169 N -0.40 0.85 -0.21 1.67 1.02 -0.34 -3.76 119.74 118.57 1l7x s LYS 169 Ca 0.16 -1.23 -0.01 0.00 0.02 0.00 0.00 55.97 54.91 1l7x s LYS 169 Cb -0.13 -0.42 0.01 0.00 -0.52 0.00 0.00 37.83 36.77 1l7x s LYS 169 CO 0.05 0.05 -0.11 0.42 -0.92 0.00 0.00 175.35 174.83 1l7x s ILE 170 N -2.86 2.70 -0.18 2.17 -1.09 -1.26 0.11 121.20 120.80 1l7x s ILE 170 Ca 0.08 -0.82 0.01 0.00 -2.23 0.00 0.00 60.65 57.68 1l7x s ILE 170 Cb -0.00 -2.24 0.03 0.00 -1.58 0.00 0.00 42.46 38.67 1l7x s ILE 170 CO -0.01 0.41 -0.15 -0.13 -1.23 0.00 0.00 174.94 173.83 1l7x s ARG 171 N 1.36 2.41 -1.24 2.79 1.81 0.16 -4.68 118.95 121.57 1l7x s ARG 171 Ca 0.04 -0.75 -0.07 0.00 -1.72 0.00 0.00 55.73 53.23 1l7x s ARG 171 Cb -0.14 -2.36 0.01 0.00 -0.45 0.00 0.00 34.95 32.01 1l7x s ARG 171 CO -0.07 -0.30 0.88 -3.47 -0.68 0.00 0.00 175.30 171.66 1l7x n ASP 172 N 4.69 -5.75 0.00 0.23 2.03 -1.26 -2.22 116.55 114.27 1l7x n ASP 172 Ca -0.17 -0.40 0.00 0.00 0.52 0.00 0.00 54.79 54.74 1l7x n ASP 172 Cb 0.49 -4.43 0.00 0.00 -0.72 0.00 0.00 41.12 36.46 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 -1.70 2.78 3.80 0.27 0.00 -1.26 -5.02 105.19 104.06 1l7x n GLY 173 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.58 3.27 0.18 1.61 0.52 -0.94 -4.01 118.94 116.99 1l7x s TRP 174 Ca 0.00 0.13 -0.30 0.00 0.02 0.00 0.00 56.10 55.94 1l7x s TRP 174 Cb 0.00 -1.66 -0.08 0.00 -1.15 0.00 0.00 33.47 30.57 1l7x s TRP 174 CO 0.00 0.54 1.32 -1.14 0.02 0.00 0.00 176.95 177.69 1l7x s GLN 175 N -2.33 4.38 -0.03 4.98 0.74 -1.26 -0.67 119.66 125.47 1l7x s GLN 175 Ca 0.30 2.04 0.05 0.00 0.05 0.00 0.00 55.36 57.80 1l7x s GLN 175 Cb -0.12 -3.21 -0.01 0.00 1.10 0.00 0.00 33.01 30.77 1l7x s GLN 175 CO 0.22 -0.28 -0.17 0.08 -0.55 0.00 0.00 175.29 174.58 1l7x s VAL 176 N 0.32 1.41 -0.13 1.34 1.01 0.31 -4.89 120.40 119.77 1l7x s VAL 176 Ca 0.58 -0.74 -0.06 0.00 0.00 0.00 0.00 61.98 61.77 1l7x s VAL 176 Cb -0.36 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 1l7x s VAL 176 CO 0.36 0.40 0.08 -1.61 0.00 0.00 0.00 175.10 174.34 1l7x s GLU 177 N -0.22 3.45 -0.02 2.72 8.01 -1.26 -1.19 118.70 130.18 1l7x s GLU 177 Ca 0.02 -0.26 0.05 0.00 0.01 0.00 0.00 54.97 54.78 1l7x s GLU 177 Cb -0.09 -3.08 -0.01 0.00 -4.31 0.00 0.00 34.13 26.64 1l7x s GLU 177 CO 0.00 0.63 -0.15 -1.21 0.01 0.00 0.00 175.26 174.54 1l7x s GLU 178 N -0.63 1.33 0.38 1.61 2.02 -0.41 -4.99 118.70 118.01 1l7x s GLU 178 Ca 0.12 -0.55 -0.27 0.00 0.02 0.00 0.00 54.97 54.29 1l7x s GLU 178 Cb -0.12 -1.26 -0.11 0.00 0.10 0.00 0.00 34.13 32.74 1l7x s GLU 178 CO 0.02 0.31 1.30 0.00 0.02 0.00 0.00 175.26 176.91 1l7x n ALA 179 N 2.81 1.41 -3.25 5.21 0.00 -1.26 -0.82 120.51 124.61 1l7x n ALA 179 Ca -0.15 0.32 -0.43 0.00 0.00 0.00 0.00 53.44 53.17 1l7x n ALA 179 Cb 0.54 -2.28 -0.00 0.00 0.00 0.00 0.00 19.45 17.71 1l7x n ALA 179 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1l7x n ASP 180 N 0.51 5.71 -3.32 0.00 2.03 -1.26 -4.60 116.55 115.60 1l7x n ASP 180 Ca 0.05 -3.18 -0.29 0.00 0.52 0.00 0.00 54.79 51.88 1l7x n ASP 180 Cb 0.38 -1.31 -0.03 0.00 -0.72 0.00 0.00 41.12 39.44 1l7x n ASP 180 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1l7x n ASP 181 N 2.15 4.51 0.26 1.67 2.03 -1.26 -3.59 116.55 122.32 1l7x n ASP 181 Ca 0.25 -2.45 0.18 0.00 0.52 0.00 0.00 54.79 53.28 1l7x n ASP 181 Cb 0.37 -1.16 0.84 0.00 -0.72 0.00 0.00 41.12 40.45 1l7x n ASP 181 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1l7x h TRP 182 N 6.62 0.00 -0.01 -0.67 5.08 -1.92 -2.95 115.95 122.11 1l7x h TRP 182 Ca 0.50 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.47 1l7x h TRP 182 Cb 0.32 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.48 1l7x h TRP 182 CO 1.75 0.00 -0.66 1.28 -1.28 0.00 0.00 178.44 179.53 1l7x n LEU 183 N -2.85 1.29 -0.35 0.11 4.77 -1.26 -4.60 117.00 114.11 1l7x n LEU 183 Ca -0.01 -0.49 0.05 0.00 -0.03 0.00 0.00 56.01 55.53 1l7x n LEU 183 Cb 0.17 -0.05 0.13 0.00 -2.33 0.00 0.00 43.42 41.34 1l7x n LEU 183 CO 0.21 0.27 0.66 -0.09 -1.33 0.00 0.00 177.39 177.11 1l7x h ARG 184 N 0.99 -0.00 -0.17 3.23 2.43 -1.88 0.25 114.38 119.23 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 0.59 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1l7x h ARG 184 CO 0.00 -0.00 0.00 0.66 -1.51 0.00 0.00 179.97 179.12 1l7x n TYR 185 N -5.60 0.21 0.00 2.20 0.53 -1.26 -5.04 117.16 108.20 1l7x n TYR 185 Ca 0.15 -0.11 0.00 0.00 -1.02 0.00 0.00 57.90 56.92 1l7x n TYR 185 Cb 0.48 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.79 1l7x n TYR 185 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1l7x n GLY 186 N 1.14 1.27 2.85 2.72 0.00 0.89 -5.01 105.19 109.05 1l7x n GLY 186 Ca 0.16 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.65 3.79 0.52 1.61 2.47 -1.26 -4.90 114.94 116.52 1l7x s ASN 187 Ca 0.00 -1.33 0.30 0.00 0.42 0.00 0.00 52.86 52.26 1l7x s ASN 187 Cb 0.00 -1.01 1.30 0.00 -1.45 0.00 0.00 41.25 40.08 1l7x s ASN 187 CO 0.00 -0.31 1.97 1.55 -3.72 0.00 0.00 177.10 176.58 1l7x h PRO 188 N 8.02 0.00 -0.02 0.43 0.13 -1.99 -3.11 132.00 135.45 1l7x h PRO 188 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 1l7x h PRO 188 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1l7x h PRO 188 CO 0.42 0.09 0.00 0.91 -0.23 0.00 0.00 178.00 179.19 1l7x n TRP 189 N -3.25 0.03 -4.51 1.56 7.02 -1.26 -4.84 117.44 112.19 1l7x n TRP 189 Ca -0.00 -0.01 -0.31 0.00 -1.02 0.00 0.00 57.50 56.15 1l7x n TRP 189 Cb 0.32 0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.10 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 -1.97 2.32 -0.23 -0.99 -1.05 -1.18 -4.17 118.70 111.43 1l7x s GLU 190 Ca 0.40 -0.86 -0.00 0.00 -0.15 0.00 0.00 54.97 54.36 1l7x s GLU 190 Cb 0.20 -2.36 0.06 0.00 -0.44 0.00 0.00 34.13 31.59 1l7x s GLU 190 CO 0.32 0.57 -0.02 0.21 0.95 0.00 0.00 175.26 177.28 1l7x s LYS 191 N -1.53 1.33 0.31 -4.83 2.47 0.21 -4.92 119.74 112.77 1l7x s LYS 191 Ca 0.17 -0.86 -0.29 0.00 -1.56 0.00 0.00 55.97 53.43 1l7x s LYS 191 Cb -0.11 -2.45 -0.12 0.00 -1.46 0.00 0.00 37.83 33.69 1l7x s LYS 191 CO 0.08 -0.63 1.41 0.45 0.16 0.00 0.00 175.35 176.82 1l7x n SER 192 N 4.77 3.12 -3.43 1.43 2.88 -1.26 -0.71 113.62 120.42 1l7x n SER 192 Ca -0.11 1.18 -0.26 0.00 -1.33 0.00 0.00 58.87 58.35 1l7x n SER 192 Cb 0.45 -1.51 -0.08 0.00 -0.75 0.00 0.00 64.21 62.31 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 1.29 1.91 -0.12 -1.46 5.12 -0.50 -4.88 116.66 118.02 1l7x n ARG 193 Ca 0.07 -4.25 0.11 0.00 -1.93 0.00 0.00 57.85 51.85 1l7x n ARG 193 Cb 0.35 -2.00 0.46 0.00 -1.16 0.00 0.00 32.46 30.11 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 4.37 0.49 0.00 5.56 0.13 -1.93 -1.87 132.00 138.76 1l7x h PRO 194 Ca 0.17 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1l7x h PRO 194 Cb 0.73 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.75 1l7x h PRO 194 CO 0.71 0.33 0.00 -0.85 -0.23 0.00 0.00 178.00 177.96 1l7x n GLU 195 N -4.48 0.15 -0.44 0.86 0.00 -1.26 -1.83 120.64 113.64 1l7x n GLU 195 Ca 0.11 0.55 0.08 0.00 0.00 0.00 0.00 57.16 57.90 1l7x n GLU 195 Cb 0.35 -1.90 0.28 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 -2.21 1.05 -1.49 -1.84 3.72 -0.70 -5.01 117.46 110.99 1l7x n PHE 196 Ca 0.00 -0.62 -0.37 0.00 -0.05 0.00 0.00 57.45 56.41 1l7x n PHE 196 Cb 0.11 -0.18 0.07 0.00 -0.94 0.00 0.00 39.48 38.54 1l7x n PHE 196 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 1l7x n MET 197 N 0.68 0.69 -3.83 -1.08 1.56 -0.76 -4.73 117.12 109.65 1l7x n MET 197 Ca 0.21 0.28 -0.12 0.00 -0.27 0.00 0.00 57.70 57.80 1l7x n MET 197 Cb 0.74 -2.21 -0.09 0.00 2.15 0.00 0.00 33.22 33.81 1l7x n MET 197 CO 0.00 0.00 0.00 -0.51 -0.73 0.00 0.00 175.97 174.73 1l7x s LEU 198 N -2.71 1.27 0.02 -0.89 1.43 -0.47 -4.98 118.68 112.36 1l7x s LEU 198 Ca 0.75 -0.08 -0.16 0.00 -1.03 0.00 0.00 54.13 53.61 1l7x s LEU 198 Cb -0.37 0.91 -0.06 0.00 0.03 0.00 0.00 46.19 46.70 1l7x s LEU 198 CO 0.48 -0.40 0.45 -2.16 0.23 0.00 0.00 176.35 174.95 1l7x s PRO 199 N -1.35 3.98 -0.06 1.29 0.04 -1.26 0.65 135.00 138.30 1l7x s PRO 199 Ca -0.14 0.49 0.05 0.00 0.04 0.00 0.00 61.00 61.43 1l7x s PRO 199 Cb -0.07 -3.21 -0.00 0.00 0.04 0.00 0.00 34.50 31.26 1l7x s PRO 199 CO 0.03 0.67 -0.21 0.08 0.04 0.00 0.00 177.00 177.61 1l7x s VAL 200 N -1.11 1.73 0.14 -0.36 1.01 0.15 -4.91 120.40 117.06 1l7x s VAL 200 Ca 0.26 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.39 1l7x s VAL 200 Cb -0.17 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1l7x s VAL 200 CO 0.15 0.49 0.24 -1.00 0.00 0.00 0.00 175.10 174.98 1l7x s HIS 201 N 0.07 3.40 0.05 5.22 3.76 -1.26 -0.94 115.29 125.59 1l7x s HIS 201 Ca -0.07 0.10 -0.09 0.00 -0.15 0.00 0.00 55.06 54.85 1l7x s HIS 201 Cb -0.14 -1.64 0.00 0.00 1.11 0.00 0.00 32.58 31.92 1l7x s HIS 201 CO 0.04 0.52 0.18 -0.06 -0.85 0.00 0.00 174.74 174.57 1l7x s PHE 202 N -1.72 0.09 0.00 1.40 0.08 -0.19 -4.94 117.98 112.70 1l7x s PHE 202 Ca 0.34 -0.36 0.00 0.00 0.12 0.00 0.00 56.93 57.02 1l7x s PHE 202 Cb -0.11 -0.05 0.00 0.00 -0.57 0.00 0.00 43.02 42.29 1l7x s PHE 202 CO 0.27 -0.44 0.00 0.66 -0.10 0.00 0.00 175.22 175.61 1l7x n TYR 203 N 0.55 0.00 -4.55 0.36 4.02 0.56 -0.27 117.16 117.83 1l7x n TYR 203 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 1l7x n TYR 203 Cb 0.60 0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.93 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 -0.55 3.32 2.72 0.00 -1.19 -4.56 105.19 104.94 1l7x n GLY 204 Ca 0.00 -1.09 -0.10 0.00 0.00 0.00 0.00 46.02 44.83 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 1.25 -0.08 1.61 -2.85 0.08 -4.84 119.74 114.91 1l7x s LYS 205 Ca 0.00 -1.41 -0.05 0.00 -1.00 0.00 0.00 55.97 53.51 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 -0.45 0.12 0.08 0.10 0.00 0.00 175.35 175.21 1l7x s VAL 206 N -4.07 5.23 -0.19 1.79 1.01 -1.26 -1.15 120.40 121.76 1l7x s VAL 206 Ca 0.28 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 1l7x s VAL 206 Cb 0.04 -3.32 0.05 0.00 0.00 0.00 0.00 36.38 33.16 1l7x s VAL 206 CO 0.07 0.52 -0.02 -0.70 0.00 0.00 0.00 175.10 174.97 1l7x s GLU 207 N -1.29 1.20 -0.96 2.72 2.12 0.13 -4.97 118.70 117.64 1l7x s GLU 207 Ca 0.18 -0.60 -0.15 0.00 0.36 0.00 0.00 54.97 54.76 1l7x s GLU 207 Cb -0.12 -2.17 0.19 0.00 0.26 0.00 0.00 34.13 32.28 1l7x s GLU 207 CO 0.08 -0.55 1.05 -1.01 -0.54 0.00 0.00 175.26 174.30 1l7x s HIS 208 N 1.65 3.54 0.67 5.30 3.76 -1.26 0.16 115.29 129.12 1l7x s HIS 208 Ca -0.02 -1.87 0.04 0.00 -0.15 0.00 0.00 55.06 53.06 1l7x s HIS 208 Cb -0.17 -4.08 0.12 0.00 1.11 0.00 0.00 32.58 29.57 1l7x s HIS 208 CO -0.07 -1.24 0.93 0.95 -0.85 0.00 0.00 174.74 174.46 1l7x s THR 209 N 1.17 2.06 -2.08 1.30 -4.23 -1.02 -4.97 115.64 107.87 1l7x s THR 209 Ca 0.29 -0.78 0.31 0.00 -1.18 0.00 0.00 61.69 60.33 1l7x s THR 209 Cb -0.07 -2.28 0.85 0.00 1.34 0.00 0.00 72.50 72.34 1l7x s THR 209 CO -0.08 0.00 2.15 -0.46 -0.54 0.00 0.00 174.62 175.69 1l7x n ASN 210 N -2.62 0.24 -0.36 3.99 0.23 -1.26 -2.88 115.26 112.60 1l7x n ASN 210 Ca 0.16 -1.08 0.03 0.00 -0.53 0.00 0.00 54.58 53.16 1l7x n ASN 210 Cb 0.61 -0.00 0.09 0.00 -2.08 0.00 0.00 39.78 38.40 1l7x n ASN 210 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1l7x n THR 211 N -0.81 0.99 0.00 5.53 -2.24 -1.26 -5.08 114.28 111.41 1l7x n THR 211 Ca 0.23 -1.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 1l7x n THR 211 Cb 0.15 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 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 0.07 2.67 3.75 3.38 0.00 -1.14 -5.05 105.19 108.88 1l7x n GLY 212 Ca 0.07 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.59 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 -2.05 4.04 -0.14 2.61 2.01 -1.26 -2.44 115.64 118.40 1l7x s THR 213 Ca 0.00 1.94 0.01 0.00 0.31 0.00 0.00 61.69 63.95 1l7x s THR 213 Cb 0.00 -4.24 0.02 0.00 0.01 0.00 0.00 72.50 68.29 1l7x s THR 213 CO 0.00 0.42 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.65 1l7x s LYS 214 N -0.91 2.44 -0.51 4.92 1.02 0.43 -4.88 119.74 122.24 1l7x s LYS 214 Ca 0.44 -0.63 -0.19 0.00 0.02 0.00 0.00 55.97 55.61 1l7x s LYS 214 Cb -0.27 -2.12 0.06 0.00 -0.52 0.00 0.00 37.83 34.98 1l7x s LYS 214 CO 0.33 -0.14 0.62 -0.46 -0.92 0.00 0.00 175.35 174.78 1l7x s TRP 215 N 1.20 3.05 0.47 3.18 -0.00 -1.26 0.18 118.94 125.76 1l7x s TRP 215 Ca -0.01 -0.57 0.02 0.00 -0.00 0.00 0.00 56.10 55.55 1l7x s TRP 215 Cb -0.14 -3.55 -0.02 0.00 -0.00 0.00 0.00 33.47 29.76 1l7x s TRP 215 CO -0.06 -1.04 0.04 0.96 -0.00 0.00 0.00 176.95 176.85 1l7x s ILE 216 N 2.60 1.07 -1.47 5.86 -4.36 -0.30 -4.79 121.20 119.81 1l7x s ILE 216 Ca 0.15 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.46 1l7x s ILE 216 Cb -0.20 -2.29 0.06 0.00 1.25 0.00 0.00 42.46 41.28 1l7x s ILE 216 CO 0.11 0.00 0.78 0.47 0.24 0.00 0.00 174.94 176.54 1l7x n ASP 217 N -1.24 -2.77 -4.96 4.36 8.00 -1.26 -0.74 116.55 117.94 1l7x n ASP 217 Ca -0.14 -0.86 -0.22 0.00 0.71 0.00 0.00 54.79 54.27 1l7x n ASP 217 Cb 0.66 -3.64 0.01 0.00 -0.02 0.00 0.00 41.12 38.13 1l7x n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1l7x s THR 218 N -3.52 4.01 -0.17 -3.53 -4.23 -1.26 -3.15 115.64 103.78 1l7x s THR 218 Ca 0.37 -0.56 -0.13 0.00 -1.18 0.00 0.00 61.69 60.19 1l7x s THR 218 Cb -0.19 -3.47 -0.05 0.00 1.34 0.00 0.00 72.50 70.13 1l7x s THR 218 CO 0.85 -0.31 0.27 -1.10 -0.54 0.00 0.00 174.62 173.78 1l7x s GLN 219 N -4.51 4.23 -0.05 3.99 -0.21 0.62 -4.88 119.66 118.85 1l7x s GLN 219 Ca 0.48 0.04 -0.03 0.00 0.02 0.00 0.00 55.36 55.87 1l7x s GLN 219 Cb -0.10 -3.44 -0.04 0.00 1.00 0.00 0.00 33.01 30.43 1l7x s GLN 219 CO 0.37 0.21 0.09 0.08 -2.12 0.00 0.00 175.29 173.92 1l7x s VAL 220 N 0.56 4.90 -0.02 1.09 1.01 -1.26 -1.02 120.40 125.65 1l7x s VAL 220 Ca 0.15 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 61.96 1l7x s VAL 220 Cb -0.13 -3.17 0.01 0.00 0.00 0.00 0.00 36.38 33.09 1l7x s VAL 220 CO 0.03 0.48 -0.05 -0.69 0.00 0.00 0.00 175.10 174.87 1l7x s VAL 221 N -1.09 0.48 0.19 2.92 1.01 -0.11 -4.48 120.40 119.32 1l7x s VAL 221 Ca 0.19 -0.19 -0.09 0.00 0.00 0.00 0.00 61.98 61.88 1l7x s VAL 221 Cb -0.12 -0.45 -0.07 0.00 0.00 0.00 0.00 36.38 35.74 1l7x s VAL 221 CO 0.09 0.17 0.50 -0.76 0.00 0.00 0.00 175.10 175.10 1l7x s LEU 222 N 0.29 4.23 -0.19 3.92 1.43 0.14 0.34 118.68 128.84 1l7x s LEU 222 Ca -0.03 0.87 0.01 0.00 -1.03 0.00 0.00 54.13 53.95 1l7x s LEU 222 Cb -0.07 -3.49 0.02 0.00 0.03 0.00 0.00 46.19 42.68 1l7x s LEU 222 CO -0.00 -0.00 -0.18 0.00 0.23 0.00 0.00 176.35 176.39 1l7x s ALA 223 N -1.70 2.38 -0.26 4.21 0.00 0.21 0.24 121.76 126.84 1l7x s ALA 223 Ca 0.44 -1.30 -0.08 0.00 0.00 0.00 0.00 51.96 51.02 1l7x s ALA 223 Cb -0.12 -1.26 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 1l7x s ALA 223 CO 0.21 -0.47 0.10 -1.17 0.00 0.00 0.00 175.76 174.43 1l7x s LEU 224 N 1.27 3.59 0.26 0.00 2.96 0.12 -1.36 118.68 125.51 1l7x s LEU 224 Ca 0.03 -0.15 -0.24 0.00 -0.22 0.00 0.00 54.13 53.55 1l7x s LEU 224 Cb -0.14 -1.97 -0.09 0.00 0.50 0.00 0.00 46.19 44.49 1l7x s LEU 224 CO -0.11 -0.03 0.83 -2.16 -1.32 0.00 0.00 176.35 173.55 1l7x s PRO 225 N 1.63 4.46 -0.11 0.98 0.04 -1.26 -0.11 135.00 140.63 1l7x s PRO 225 Ca 0.06 1.13 0.02 0.00 0.04 0.00 0.00 61.00 62.25 1l7x s PRO 225 Cb -0.15 -2.91 0.01 0.00 0.04 0.00 0.00 34.50 31.49 1l7x s PRO 225 CO 0.05 0.38 -0.16 0.71 0.04 0.00 0.00 177.00 178.02 1l7x s TYR 226 N -1.50 2.00 -0.14 0.56 2.02 0.84 -1.41 117.35 119.73 1l7x s TYR 226 Ca 0.45 -0.93 -0.08 0.00 -0.37 0.00 0.00 57.07 56.14 1l7x s TYR 226 Cb -0.19 -1.43 -0.04 0.00 -0.40 0.00 0.00 41.96 39.90 1l7x s TYR 226 CO 0.23 -0.47 0.14 -0.51 -1.57 0.00 0.00 175.55 173.37 1l7x s ASP 227 N 0.92 6.34 -0.10 2.29 -0.00 0.11 -0.81 116.67 125.42 1l7x s ASP 227 Ca -0.08 0.40 0.02 0.00 -0.00 0.00 0.00 52.55 52.90 1l7x s ASP 227 Cb -0.15 -2.08 0.01 0.00 -0.00 0.00 0.00 42.92 40.70 1l7x s ASP 227 CO -0.01 0.34 -0.16 -0.89 -0.00 0.00 0.00 175.17 174.45 1l7x s THR 228 N -0.61 1.53 0.31 -1.27 2.01 0.03 0.64 115.64 118.28 1l7x s THR 228 Ca 0.13 -0.68 -0.29 0.00 0.31 0.00 0.00 61.69 61.16 1l7x s THR 228 Cb -0.12 -1.38 -0.10 0.00 0.01 0.00 0.00 72.50 70.91 1l7x s THR 228 CO 0.02 0.45 1.20 -2.16 -0.69 0.00 0.00 174.62 173.44 1l7x s PRO 229 N 0.81 4.46 -0.39 4.92 0.04 -1.26 -0.49 135.00 143.09 1l7x s PRO 229 Ca -0.10 2.00 0.02 0.00 0.04 0.00 0.00 61.00 62.96 1l7x s PRO 229 Cb -0.16 -3.09 0.11 0.00 0.04 0.00 0.00 34.50 31.40 1l7x s PRO 229 CO 0.01 -0.02 0.13 0.08 0.04 0.00 0.00 177.00 177.25 1l7x s VAL 230 N -1.17 2.63 0.01 -0.36 1.01 0.22 -4.87 120.40 117.86 1l7x s VAL 230 Ca 0.48 -2.44 -0.25 0.00 0.00 0.00 0.00 61.98 59.76 1l7x s VAL 230 Cb -0.35 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 1l7x s VAL 230 CO 0.46 -0.66 0.77 -2.16 0.00 0.00 0.00 175.10 173.52 1l7x s PRO 231 N 0.75 4.49 0.76 2.72 0.04 -1.26 -0.43 135.00 142.08 1l7x s PRO 231 Ca 0.11 1.06 -0.11 0.00 0.04 0.00 0.00 61.00 62.10 1l7x s PRO 231 Cb -0.21 -3.40 0.05 0.00 0.04 0.00 0.00 34.50 30.98 1l7x s PRO 231 CO -0.06 0.19 1.10 0.20 0.04 0.00 0.00 177.00 178.46 1l7x s GLY 232 N 0.30 1.63 -0.35 0.56 0.00 -0.18 -4.80 107.32 104.47 1l7x s GLY 232 Ca 0.40 -0.23 -0.29 0.00 0.00 0.00 0.00 44.72 44.59 1l7x s GLY 232 CO 0.22 0.17 1.25 -0.47 0.00 0.00 0.00 173.10 174.27 1l7x s TYR 233 N -3.21 2.74 -1.53 1.90 5.04 -1.26 -4.20 117.35 116.82 1l7x s TYR 233 Ca 0.60 0.86 -0.07 0.00 -2.44 0.00 0.00 57.07 56.03 1l7x s TYR 233 Cb -0.13 -4.04 0.06 0.00 0.35 0.00 0.00 41.96 38.20 1l7x s TYR 233 CO 0.53 -1.52 0.49 -1.33 -1.34 0.00 0.00 175.55 172.39 1l7x n MET 234 N 7.47 -2.91 0.00 4.97 2.81 0.12 -4.86 117.12 124.71 1l7x n MET 234 Ca 0.14 0.35 0.00 0.00 -1.81 0.00 0.00 57.70 56.38 1l7x n MET 234 Cb 0.47 -4.60 0.00 0.00 -0.71 0.00 0.00 33.22 28.39 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 -2.86 0.30 0.00 7.83 0.23 -1.26 -5.01 115.26 114.49 1l7x n ASN 235 Ca -0.18 -1.08 0.00 0.00 -0.53 0.00 0.00 54.58 52.79 1l7x n ASN 235 Cb 0.62 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.32 1l7x n ASN 235 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1l7x n ASN 236 N -0.04 -2.73 -4.81 0.53 3.02 -1.26 -4.99 115.26 104.97 1l7x n ASN 236 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 1l7x n ASN 236 Cb 0.30 -1.51 -0.07 0.00 -0.61 0.00 0.00 39.78 37.89 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 -2.00 5.39 -0.17 3.41 2.01 -1.26 -4.81 115.64 118.20 1l7x s THR 237 Ca 0.00 0.34 -0.04 0.00 0.31 0.00 0.00 61.69 62.30 1l7x s THR 237 Cb 0.00 -3.50 0.06 0.00 0.01 0.00 0.00 72.50 69.07 1l7x s THR 237 CO 0.00 0.53 0.06 -0.69 -0.69 0.00 0.00 174.62 173.83 1l7x s VAL 238 N -0.44 0.24 0.00 3.82 1.01 -1.26 -1.01 120.40 122.76 1l7x s VAL 238 Ca 0.15 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1l7x s VAL 238 Cb -0.13 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1l7x s VAL 238 CO 0.04 -0.21 0.00 0.59 0.00 0.00 0.00 175.10 175.52 1l7x n ASN 239 N 5.16 0.00 -4.10 3.32 3.02 0.43 -4.64 115.26 118.46 1l7x n ASN 239 Ca -0.08 -0.99 -0.21 0.00 -0.03 0.00 0.00 54.58 53.28 1l7x n ASN 239 Cb 0.48 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.51 1l7x n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1l7x s THR 240 N 0.19 1.01 -0.31 3.41 2.01 -1.26 -0.61 115.64 120.07 1l7x s THR 240 Ca 0.00 -0.68 -0.03 0.00 0.31 0.00 0.00 61.69 61.29 1l7x s THR 240 Cb 0.00 -0.87 0.05 0.00 0.01 0.00 0.00 72.50 71.69 1l7x s THR 240 CO 0.00 0.18 0.04 -0.32 -0.69 0.00 0.00 174.62 173.83 1l7x s MET 241 N -0.57 2.50 -0.37 4.92 1.75 0.36 -2.40 119.30 125.49 1l7x s MET 241 Ca 0.04 -1.24 -0.13 0.00 -1.25 0.00 0.00 55.69 53.11 1l7x s MET 241 Cb -0.06 -3.28 0.00 0.00 2.84 0.00 0.00 34.83 34.34 1l7x s MET 241 CO 0.00 -0.64 0.24 0.50 -0.65 0.00 0.00 175.02 174.48 1l7x s ARG 242 N 1.31 3.18 -0.15 4.11 3.52 0.51 -0.79 118.95 130.64 1l7x s ARG 242 Ca -0.04 -0.86 -0.04 0.00 -0.13 0.00 0.00 55.73 54.66 1l7x s ARG 242 Cb -0.20 -3.82 -0.03 0.00 -1.56 0.00 0.00 34.95 29.34 1l7x s ARG 242 CO 0.00 -0.59 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.38 1l7x s LEU 243 N 1.66 3.40 0.00 -0.88 1.43 0.01 -2.02 118.68 122.28 1l7x s LEU 243 Ca 0.05 -0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 52.99 1l7x s LEU 243 Cb -0.18 -1.82 -0.05 0.00 0.03 0.00 0.00 46.19 44.17 1l7x s LEU 243 CO 0.09 0.21 0.35 0.26 0.23 0.00 0.00 176.35 177.49 1l7x s TRP 244 N 0.12 3.65 -0.04 0.29 0.52 -0.37 -0.11 118.94 123.01 1l7x s TRP 244 Ca 0.00 0.82 0.07 0.00 0.02 0.00 0.00 56.10 57.01 1l7x s TRP 244 Cb -0.13 -2.17 -0.02 0.00 -1.15 0.00 0.00 33.47 30.00 1l7x s TRP 244 CO 0.02 0.62 -0.24 0.45 0.02 0.00 0.00 176.95 177.83 1l7x s SER 245 N -1.33 3.22 -0.02 2.95 0.15 0.85 -0.52 113.70 118.99 1l7x s SER 245 Ca 0.25 -0.44 -0.25 0.00 0.70 0.00 0.00 55.95 56.21 1l7x s SER 245 Cb -0.15 -0.61 -0.04 0.00 -1.71 0.00 0.00 66.02 63.52 1l7x s SER 245 CO 0.14 0.30 0.78 0.00 1.20 0.00 0.00 173.24 175.65 1l7x s ALA 246 N -0.46 3.31 0.02 5.45 0.00 -1.26 0.10 121.76 128.92 1l7x s ALA 246 Ca 0.05 0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.30 1l7x s ALA 246 Cb -0.11 -3.05 -0.01 0.00 0.00 0.00 0.00 23.12 19.94 1l7x s ALA 246 CO 0.01 -0.08 -0.06 1.03 0.00 0.00 0.00 175.76 176.66 1l7x s ARG 247 N 0.59 0.43 0.32 0.00 1.81 0.14 -4.57 118.95 117.68 1l7x s ARG 247 Ca 0.41 -0.43 -0.28 0.00 -1.72 0.00 0.00 55.73 53.71 1l7x s ARG 247 Cb -0.19 -0.31 -0.09 0.00 -0.45 0.00 0.00 34.95 33.91 1l7x s ARG 247 CO 0.22 0.07 1.09 0.00 -0.68 0.00 0.00 175.30 176.00 1l7x s ALA 248 N -0.70 3.31 1.03 2.13 0.00 -1.26 0.27 121.76 126.53 1l7x s ALA 248 Ca -0.04 0.85 -0.13 0.00 0.00 0.00 0.00 51.96 52.63 1l7x s ALA 248 Cb -0.06 -3.31 0.20 0.00 0.00 0.00 0.00 23.12 19.95 1l7x s ALA 248 CO 0.00 -0.19 1.10 -1.25 0.00 0.00 0.00 175.76 175.42 1l7x s PRO 249 N -1.76 0.20 -0.24 0.00 0.04 -1.26 -4.80 135.00 127.18 1l7x s PRO 249 Ca 0.49 0.40 -0.02 0.00 0.04 0.00 0.00 61.00 61.91 1l7x s PRO 249 Cb -0.29 -1.72 0.08 0.00 0.04 0.00 0.00 34.50 32.60 1l7x s PRO 249 CO 0.37 -2.86 0.06 -0.80 0.04 0.00 0.00 177.00 173.81 1l7x s ASN 250 N -3.55 3.38 0.00 6.66 0.01 -1.26 -5.10 114.94 115.09 1l7x s ASN 250 Ca 0.66 -1.15 0.00 0.00 -0.71 0.00 0.00 52.86 51.66 1l7x s ASN 250 Cb -0.17 -0.69 0.00 0.00 0.41 0.00 0.00 41.25 40.80 1l7x s ASN 250 CO 0.57 -0.35 0.00 -0.90 -1.51 0.00 0.00 177.10 174.91 1l7x n ASP 251 N 4.99 0.00 -0.63 -1.22 5.68 -1.26 -5.28 116.55 118.82 1l7x n ASP 251 Ca -0.07 0.00 0.08 0.00 -0.50 0.00 0.00 54.79 54.31 1l7x n ASP 251 Cb 0.45 0.16 -0.03 0.00 -1.14 0.00 0.00 41.12 40.56 1l7x n ASP 251 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1l7x n GLY 260 N -0.93 -2.14 3.73 6.12 0.00 -1.26 -5.36 105.19 105.36 1l7x n GLY 260 Ca 0.00 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.27 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 -5.70 6.72 0.10 1.61 2.15 -1.26 -4.94 116.67 115.34 1l7x s ASP 261 Ca 0.00 2.53 -0.18 0.00 0.43 0.00 0.00 52.55 55.33 1l7x s ASP 261 Cb 0.00 -2.61 -0.07 0.00 -0.30 0.00 0.00 42.92 39.95 1l7x s ASP 261 CO 0.00 -0.68 1.57 0.22 -0.17 0.00 0.00 175.17 176.11 1l7x h TYR 262 N 5.82 0.48 0.07 -5.34 3.20 -2.06 -2.50 116.97 116.65 1l7x h TYR 262 Ca -0.44 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.36 1l7x h TYR 262 Cb 1.21 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 1l7x h TYR 262 CO 0.63 0.56 -0.07 0.82 -1.64 0.00 0.00 178.16 178.45 1l7x h ILE 263 N 0.27 0.83 -0.43 1.81 1.08 -2.00 -1.59 117.51 117.49 1l7x h ILE 263 Ca 0.08 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.60 1l7x h ILE 263 Cb 0.33 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 34.87 1l7x h ILE 263 CO 0.01 0.00 0.18 -0.61 -0.69 0.00 0.00 178.15 177.04 1l7x h GLN 264 N -0.16 0.37 -0.46 2.37 5.75 -1.97 -0.87 115.11 120.13 1l7x h GLN 264 Ca 0.00 -0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.57 1l7x h GLN 264 Cb 0.16 -0.08 -0.08 0.00 1.07 0.00 0.00 27.48 28.55 1l7x h GLN 264 CO -0.02 0.24 -0.02 0.00 -2.65 0.00 0.00 178.83 176.38 1l7x h ALA 265 N 1.25 0.41 -0.64 3.38 0.00 -1.13 0.85 119.26 123.37 1l7x h ALA 265 Ca 0.19 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.21 1l7x h ALA 265 Cb 0.14 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1l7x h ALA 265 CO -0.17 -0.40 0.26 0.28 0.00 0.00 0.00 179.25 179.22 1l7x h VAL 266 N 0.09 1.24 -0.65 0.00 2.07 -0.69 -2.71 116.25 115.59 1l7x h VAL 266 Ca 0.23 -0.74 -0.07 0.00 0.82 0.00 0.00 66.70 66.94 1l7x h VAL 266 Cb 0.34 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1l7x h VAL 266 CO -0.39 0.29 0.13 -0.07 0.02 0.00 0.00 177.57 177.54 1l7x h LEU 267 N 0.91 1.02 -0.58 2.57 3.38 -0.10 -2.33 115.31 120.17 1l7x h LEU 267 Ca 0.21 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1l7x h LEU 267 Cb 0.20 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1l7x h LEU 267 CO -0.02 1.01 0.03 0.47 0.09 0.00 0.00 178.44 180.02 1l7x n ASP 268 N -4.26 0.23 0.24 -0.43 8.00 0.28 -0.95 116.55 119.66 1l7x n ASP 268 Ca 0.04 0.59 0.17 0.00 0.71 0.00 0.00 54.79 56.29 1l7x n ASP 268 Cb 0.27 -0.61 0.84 0.00 -0.02 0.00 0.00 41.12 41.61 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 -0.33 -1.24 3.08 -1.34 -1.41 114.38 113.13 1l7x h ARG 269 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 1l7x h ARG 269 Cb 0.06 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 1l7x h ARG 269 CO 0.00 0.00 0.02 -0.91 -1.07 0.00 0.00 179.97 178.01 1l7x h ASN 270 N 0.00 0.47 -0.03 7.04 2.35 -1.26 -3.04 115.58 121.11 1l7x h ASN 270 Ca 0.00 -0.08 0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1l7x h ASN 270 Cb 0.09 -0.12 -0.05 0.00 0.05 0.00 0.00 38.32 38.29 1l7x h ASN 270 CO 0.00 0.52 -0.32 -0.07 -1.65 0.00 0.00 177.43 175.91 1l7x h LEU 271 N 0.49 -0.96 -0.09 1.61 3.38 -1.48 0.15 115.31 118.42 1l7x h LEU 271 Ca 0.11 0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.22 1l7x h LEU 271 Cb 0.28 0.39 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1l7x h LEU 271 CO 0.01 -0.38 0.03 0.00 0.09 0.00 0.00 178.44 178.19 1l7x h ALA 272 N 0.30 0.09 0.00 1.53 0.00 -1.72 -1.87 119.26 117.59 1l7x h ALA 272 Ca 0.07 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1l7x h ALA 272 Cb 0.55 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1l7x h ALA 272 CO -0.28 -0.44 0.00 0.39 0.00 0.00 0.00 179.25 178.92 1l7x n GLU 273 N -5.07 0.03 0.00 0.00 1.02 -0.98 -1.60 120.64 114.04 1l7x n GLU 273 Ca -0.05 0.39 0.10 0.00 -0.02 0.00 0.00 57.16 57.58 1l7x n GLU 273 Cb 0.05 -1.56 0.45 0.00 -0.02 0.00 0.00 31.44 30.35 1l7x n GLU 273 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1l7x n ASN 274 N -1.61 0.02 -0.15 1.62 3.02 0.50 -3.50 115.26 115.15 1l7x n ASN 274 Ca 0.02 0.50 -0.09 0.00 -0.03 0.00 0.00 54.58 54.98 1l7x n ASN 274 Cb 0.10 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 1l7x n ASN 274 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1l7x h ILE 275 N 0.00 1.20 -0.80 2.41 2.04 -1.43 -2.72 117.51 118.21 1l7x h ILE 275 Ca 0.00 -0.61 -0.46 0.00 1.00 0.00 0.00 64.86 64.79 1l7x h ILE 275 Cb 0.37 0.76 -0.26 0.00 -0.74 0.00 0.00 36.82 36.95 1l7x h ILE 275 CO 0.00 0.23 0.38 -1.54 0.00 0.00 0.00 178.15 177.22 1l7x n SER 276 N -4.61 4.38 -0.03 1.72 3.41 -1.23 -4.67 113.62 112.59 1l7x n SER 276 Ca 0.01 -3.72 -0.09 0.00 -0.26 0.00 0.00 58.87 54.81 1l7x n SER 276 Cb 0.14 -0.78 -0.08 0.00 -0.26 0.00 0.00 64.21 63.24 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 1.32 -0.06 -3.72 4.33 9.65 -1.57 -2.25 114.38 122.08 1l7x h ARG 277 Ca 0.50 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 59.19 1l7x h ARG 277 Cb 1.97 0.01 -0.24 0.00 -1.39 0.00 0.00 29.97 30.32 1l7x h ARG 277 CO 0.99 0.50 -0.65 0.54 2.80 0.00 0.00 179.97 184.16 1l7x s VAL 278 N -2.46 0.05 0.12 0.20 0.11 -1.26 -0.46 120.40 116.71 1l7x s VAL 278 Ca -0.12 -0.42 -0.30 0.00 -2.93 0.00 0.00 61.98 58.20 1l7x s VAL 278 Cb -0.01 -0.20 -0.07 0.00 -1.53 0.00 0.00 36.38 34.57 1l7x s VAL 278 CO 0.45 -0.23 1.16 -0.22 -3.33 0.00 0.00 175.10 172.93 1l7x s LEU 279 N -0.71 4.43 -0.07 2.54 2.96 -0.82 -4.98 118.68 122.03 1l7x s LEU 279 Ca -0.08 2.08 -0.30 0.00 -0.22 0.00 0.00 54.13 55.61 1l7x s LEU 279 Cb -0.05 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.01 1l7x s LEU 279 CO -0.00 -0.36 1.42 -0.31 -1.32 0.00 0.00 176.35 175.78 1l7x s TYR 280 N 0.39 2.61 0.00 5.38 2.02 -1.26 -4.81 117.35 121.68 1l7x s TYR 280 Ca 0.54 0.71 0.00 0.00 -0.37 0.00 0.00 57.07 57.95 1l7x s TYR 280 Cb -0.30 -3.67 0.00 0.00 -0.40 0.00 0.00 41.96 37.59 1l7x s TYR 280 CO 0.33 -2.57 0.91 -0.35 -1.57 0.00 0.00 175.55 172.30 1l7x n PRO 281 N 6.29 0.84 -4.11 -1.71 -0.04 -1.26 -4.88 135.00 130.14 1l7x n PRO 281 Ca 0.14 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.26 1l7x n PRO 281 Cb 0.44 -1.08 -0.11 0.00 -0.04 0.00 0.00 33.50 32.71 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 1.09 5.27 -0.23 3.54 0.01 -1.26 -4.39 114.94 118.98 1l7x s ASN 282 Ca 0.00 -0.03 -0.06 0.00 -0.71 0.00 0.00 52.86 52.06 1l7x s ASN 282 Cb 0.00 -1.89 -0.02 0.00 0.41 0.00 0.00 41.25 39.74 1l7x s ASN 282 CO 0.00 0.14 0.03 -0.62 -1.51 0.00 0.00 177.10 175.15 1l7x s ASP 283 N 0.54 4.94 -1.38 -1.22 -1.08 -1.26 -4.60 116.67 112.60 1l7x s ASP 283 Ca 0.01 -0.22 -0.09 0.00 -0.52 0.00 0.00 52.55 51.73 1l7x s ASP 283 Cb -0.13 -1.87 0.03 0.00 -1.46 0.00 0.00 42.92 39.49 1l7x s ASP 283 CO 0.02 0.01 1.09 0.59 0.52 0.00 0.00 175.17 177.39 1l7x n ASN 284 N 4.64 -5.20 -3.68 -0.34 3.02 -1.26 -5.00 115.26 107.44 1l7x n ASN 284 Ca -0.17 -0.63 -0.10 0.00 -0.03 0.00 0.00 54.58 53.66 1l7x n ASN 284 Cb 0.51 -4.70 -0.10 0.00 -0.61 0.00 0.00 39.78 34.89 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 -3.34 -0.70 -0.21 3.10 5.36 -1.26 -3.94 117.98 116.99 1l7x s PHE 285 Ca 0.51 1.48 -0.17 0.00 -0.96 0.00 0.00 56.93 57.78 1l7x s PHE 285 Cb -0.23 0.35 -0.03 0.00 -0.34 0.00 0.00 43.02 42.76 1l7x s PHE 285 CO 0.76 -0.38 0.47 0.12 -1.46 0.00 0.00 175.22 174.73 1l7x s PHE 286 N 1.41 3.36 -0.27 10.12 5.36 0.67 -4.89 117.98 133.73 1l7x s PHE 286 Ca -0.09 0.69 0.01 0.00 -0.96 0.00 0.00 56.93 56.58 1l7x s PHE 286 Cb -0.07 -2.63 0.05 0.00 -0.34 0.00 0.00 43.02 40.03 1l7x s PHE 286 CO -0.14 -0.10 -0.08 -1.21 -1.46 0.00 0.00 175.22 172.23 1l7x s GLU 287 N 1.63 2.39 -1.45 10.12 2.02 -1.26 -4.98 118.70 127.17 1l7x s GLU 287 Ca 0.22 -1.26 -0.12 0.00 0.02 0.00 0.00 54.97 53.82 1l7x s GLU 287 Cb -0.15 -2.96 0.05 0.00 0.10 0.00 0.00 34.13 31.17 1l7x s GLU 287 CO 0.09 -0.55 2.27 0.41 0.02 0.00 0.00 175.26 177.51 1l7x n GLY 288 N 4.51 4.48 3.79 -1.39 0.00 -1.26 -4.93 105.19 110.40 1l7x n GLY 288 Ca -0.14 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 43.84 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 2.48 3.89 0.35 1.61 -0.14 -1.26 -4.99 119.74 121.68 1l7x s LYS 289 Ca 0.49 -0.12 0.09 0.00 -1.36 0.00 0.00 55.97 55.07 1l7x s LYS 289 Cb 0.14 -3.32 0.82 0.00 -1.68 0.00 0.00 37.83 33.79 1l7x s LYS 289 CO -0.07 0.50 1.84 1.49 -0.76 0.00 0.00 175.35 178.35 1l7x h GLU 290 N 5.92 0.67 -0.90 1.68 4.81 -1.99 -0.41 114.58 124.35 1l7x h GLU 290 Ca -0.47 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.71 1l7x h GLU 290 Cb 1.19 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 30.37 1l7x h GLU 290 CO 0.68 0.44 0.50 1.25 -0.73 0.00 0.00 179.01 181.16 1l7x h LEU 291 N 0.69 1.11 -0.50 1.64 5.85 -1.98 -1.04 115.31 121.08 1l7x h LEU 291 Ca 0.49 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 59.09 1l7x h LEU 291 Cb 0.82 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1l7x h LEU 291 CO -0.25 0.88 0.20 -0.09 -0.34 0.00 0.00 178.44 178.84 1l7x h ARG 292 N 1.25 0.74 -0.49 1.25 9.65 -1.45 -0.70 114.38 124.62 1l7x h ARG 292 Ca 0.32 -0.13 0.03 0.00 -1.10 0.00 0.00 59.98 59.10 1l7x h ARG 292 Cb 0.01 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 28.44 1l7x h ARG 292 CO -0.05 0.66 0.33 1.25 2.80 0.00 0.00 179.97 184.95 1l7x h LEU 293 N 0.66 0.47 -0.41 3.80 5.85 -0.89 0.27 115.31 125.06 1l7x h LEU 293 Ca 0.17 -0.01 -0.17 0.00 0.84 0.00 0.00 57.88 58.71 1l7x h LEU 293 Cb 0.19 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1l7x h LEU 293 CO -0.01 0.32 -0.50 0.11 -0.34 0.00 0.00 178.44 178.01 1l7x h LYS 294 N 0.54 0.78 -0.58 1.25 1.57 -0.25 -2.17 116.57 117.71 1l7x h LYS 294 Ca 0.20 -0.47 -0.09 0.00 -1.87 0.00 0.00 60.65 58.42 1l7x h LYS 294 Cb 0.12 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1l7x h LYS 294 CO -0.05 1.10 0.00 1.96 -0.57 0.00 0.00 179.45 181.89 1l7x h GLN 295 N 0.61 1.01 0.02 3.15 4.20 0.20 0.31 115.11 124.60 1l7x h GLN 295 Ca 0.02 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.43 1l7x h GLN 295 Cb 1.08 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.77 1l7x h GLN 295 CO 0.11 0.98 -0.01 0.93 -0.67 0.00 0.00 178.83 180.17 1l7x h GLU 296 N 0.92 -0.02 -0.26 1.46 5.08 -0.90 -2.20 114.58 118.66 1l7x h GLU 296 Ca 0.17 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.44 1l7x h GLU 296 Cb 0.53 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1l7x h GLU 296 CO 0.03 0.10 -0.20 -0.92 -1.00 0.00 0.00 179.01 177.02 1l7x h TYR 297 N -0.14 0.70 -0.38 4.33 3.20 -1.32 -2.61 116.97 120.76 1l7x h TYR 297 Ca -0.00 -0.20 0.05 0.00 3.14 0.00 0.00 58.73 61.72 1l7x h TYR 297 Cb 0.13 -0.15 -0.08 0.00 1.54 0.00 0.00 36.73 38.17 1l7x h TYR 297 CO -0.04 0.88 -0.55 0.35 -1.64 0.00 0.00 178.16 177.16 1l7x h PHE 298 N 0.31 -1.69 -0.33 -3.82 3.57 -0.28 0.53 116.94 115.25 1l7x h PHE 298 Ca 0.05 0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 1l7x h PHE 298 Cb 0.74 0.79 -0.02 0.00 2.79 0.00 0.00 35.95 40.25 1l7x h PHE 298 CO 0.07 -0.49 0.12 -0.24 -2.23 0.00 0.00 178.31 175.53 1l7x h VAL 299 N -0.41 1.14 -0.02 1.41 3.04 -1.46 -2.42 116.25 117.53 1l7x h VAL 299 Ca 0.07 -0.44 -0.02 0.00 -1.01 0.00 0.00 66.70 65.30 1l7x h VAL 299 Cb 0.60 0.76 0.00 0.00 -2.01 0.00 0.00 31.29 30.64 1l7x h VAL 299 CO -0.58 0.16 -0.05 0.58 -1.01 0.00 0.00 177.57 176.68 1l7x h VAL 300 N 0.46 1.48 -0.43 1.51 2.07 -0.85 -2.16 116.25 118.33 1l7x h VAL 300 Ca 0.11 -1.50 -0.00 0.00 0.82 0.00 0.00 66.70 66.13 1l7x h VAL 300 Cb 0.12 2.45 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 1l7x h VAL 300 CO -0.01 0.40 0.26 0.00 0.02 0.00 0.00 177.57 178.24 1l7x h ALA 301 N 0.39 0.55 0.21 1.67 0.00 0.12 -1.90 119.26 120.30 1l7x h ALA 301 Ca -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1l7x h ALA 301 Cb 0.67 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1l7x h ALA 301 CO 0.01 0.03 -0.10 0.00 0.00 0.00 0.00 179.25 179.19 1l7x h ALA 302 N 1.12 -0.28 0.00 0.00 0.00 -1.53 -2.47 119.26 116.12 1l7x h ALA 302 Ca 0.15 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1l7x h ALA 302 Cb -0.01 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1l7x h ALA 302 CO -0.03 -0.61 -0.23 1.15 0.00 0.00 0.00 179.25 179.53 1l7x h THR 303 N -0.37 0.46 0.00 0.00 2.02 -1.30 -0.59 112.91 113.14 1l7x h THR 303 Ca -0.03 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 1l7x h THR 303 Cb 0.28 0.46 -0.00 0.00 -1.74 0.00 0.00 68.15 67.15 1l7x h THR 303 CO 0.05 0.00 -0.11 -0.07 0.37 0.00 0.00 175.52 175.76 1l7x h LEU 304 N -0.37 0.00 -0.04 2.58 3.38 -1.37 0.47 115.31 119.97 1l7x h LEU 304 Ca 0.06 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.79 1l7x h LEU 304 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1l7x h LEU 304 CO -0.21 0.11 -1.08 1.56 0.09 0.00 0.00 178.44 178.91 1l7x h GLN 305 N 0.00 0.26 -0.21 1.13 4.20 -1.02 -2.33 115.11 117.13 1l7x h GLN 305 Ca -0.00 -0.36 -0.14 0.00 0.06 0.00 0.00 58.65 58.21 1l7x h GLN 305 Cb 0.20 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1l7x h GLN 305 CO 0.01 1.12 -0.44 0.22 -0.67 0.00 0.00 178.83 179.08 1l7x h ASP 306 N 0.11 0.55 -0.03 1.46 3.58 -0.13 -1.07 116.42 120.89 1l7x h ASP 306 Ca -0.09 -0.25 -0.22 0.00 0.42 0.00 0.00 57.03 56.88 1l7x h ASP 306 Cb 1.77 -0.16 0.01 0.00 1.72 0.00 0.00 39.33 42.67 1l7x h ASP 306 CO 0.17 0.92 -0.81 0.40 -2.88 0.00 0.00 179.24 177.04 1l7x h ILE 307 N 0.42 1.30 -0.20 2.25 2.04 -0.97 -2.09 117.51 120.27 1l7x h ILE 307 Ca 0.03 -2.06 -0.02 0.00 1.00 0.00 0.00 64.86 63.81 1l7x h ILE 307 Cb 0.93 2.07 -0.01 0.00 -0.74 0.00 0.00 36.82 39.08 1l7x h ILE 307 CO 0.08 0.64 0.05 0.40 0.00 0.00 0.00 178.15 179.32 1l7x h ILE 308 N 0.46 1.21 -0.11 -0.67 2.04 -1.35 0.96 117.51 120.06 1l7x h ILE 308 Ca -0.06 -0.68 0.02 0.00 1.00 0.00 0.00 64.86 65.15 1l7x h ILE 308 Cb 1.43 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 38.76 1l7x h ILE 308 CO 0.16 0.21 -0.05 -0.09 0.00 0.00 0.00 178.15 178.38 1l7x h ARG 309 N 0.14 -0.03 -0.39 2.37 2.43 -1.22 0.84 114.38 118.51 1l7x h ARG 309 Ca 0.06 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.28 1l7x h ARG 309 Cb 0.28 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.79 1l7x h ARG 309 CO 0.00 -0.02 0.15 -0.09 -1.51 0.00 0.00 179.97 178.50 1l7x h ARG 310 N -0.03 0.31 -0.12 0.20 2.43 -1.22 0.69 114.38 116.63 1l7x h ARG 310 Ca 0.06 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1l7x h ARG 310 Cb 0.12 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 1l7x h ARG 310 CO -0.13 0.21 -0.14 0.35 -1.51 0.00 0.00 179.97 178.74 1l7x h PHE 311 N 0.32 -0.36 0.00 2.20 3.57 -0.22 -1.03 116.94 121.42 1l7x h PHE 311 Ca 0.18 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.70 1l7x h PHE 311 Cb 0.15 0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.07 1l7x h PHE 311 CO -0.14 -0.21 0.00 0.87 -2.23 0.00 0.00 178.31 176.60 1l7x h LYS 312 N -0.18 0.00 0.00 1.11 1.57 -0.47 -2.46 116.57 116.15 1l7x h LYS 312 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1l7x h LYS 312 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1l7x h LYS 312 CO -0.23 0.00 -0.45 0.00 -0.57 0.00 0.00 179.45 178.20 1l7x n ALA 313 N -2.06 3.19 -1.56 3.86 0.00 0.20 -4.76 120.51 119.38 1l7x n ALA 313 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1l7x n ALA 313 Cb 0.26 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1l7x n ALA 313 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1l7x n SER 314 N -1.67 0.00 -2.27 0.00 3.41 -0.62 -4.91 113.62 107.55 1l7x n SER 314 Ca 0.05 -0.19 -0.20 0.00 -0.26 0.00 0.00 58.87 58.27 1l7x n SER 314 Cb 0.36 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.21 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 -0.19 2.21 -0.24 4.33 3.00 -1.26 -5.05 118.16 120.96 1l7x n LYS 315 Ca 0.00 -1.75 0.03 0.00 -0.00 0.00 0.00 58.31 56.60 1l7x n LYS 315 Cb 0.00 -2.07 -0.01 0.00 0.00 0.00 0.00 35.03 32.96 1l7x n LYS 315 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1l7x n PHE 316 N 1.56 -1.92 0.00 5.64 0.99 -1.26 -5.16 117.46 117.31 1l7x n PHE 316 Ca 0.46 0.30 0.00 0.00 -0.00 0.00 0.00 57.45 58.21 1l7x n PHE 316 Cb 0.71 -0.49 0.00 0.00 -1.00 0.00 0.00 39.48 38.70 1l7x n PHE 316 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 1l7x n THR 324 N -1.30 0.00 0.19 4.37 -1.04 -1.26 -4.99 114.28 110.25 1l7x n THR 324 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 1l7x n THR 324 Cb 0.11 0.00 0.45 0.00 -1.82 0.00 0.00 70.33 69.07 1l7x n THR 324 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1l7x h VAL 325 N 0.00 1.16 0.00 12.58 2.07 -2.04 -2.20 116.25 127.82 1l7x h VAL 325 Ca 0.00 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1l7x h VAL 325 Cb 0.00 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1l7x h VAL 325 CO 0.00 0.22 0.00 0.49 0.02 0.00 0.00 177.57 178.30 1l7x n PHE 326 N -4.28 0.00 -0.03 1.57 3.01 -1.26 -3.64 117.46 112.83 1l7x n PHE 326 Ca -0.02 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.54 1l7x n PHE 326 Cb 0.27 -0.42 0.51 0.00 -0.01 0.00 0.00 39.48 39.84 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 0.00 0.34 -0.09 4.37 5.19 -1.86 0.12 116.42 124.49 1l7x h ASP 327 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1l7x h ASP 327 Cb 0.35 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.79 1l7x h ASP 327 CO 0.00 0.22 0.00 0.00 -3.12 0.00 0.00 179.24 176.34 1l7x n ALA 328 N -2.52 2.56 0.18 3.45 0.00 -1.24 -4.37 120.51 118.58 1l7x n ALA 328 Ca 0.07 -0.35 -0.14 0.00 0.00 0.00 0.00 53.44 53.01 1l7x n ALA 328 Cb 0.29 -1.19 -0.07 0.00 0.00 0.00 0.00 19.45 18.49 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 1.32 -0.79 0.00 0.00 3.57 -0.99 -2.25 116.94 117.80 1l7x h PHE 329 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1l7x h PHE 329 Cb 0.29 0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1l7x h PHE 329 CO 0.05 -0.42 0.00 -2.30 -2.23 0.00 0.00 178.31 173.41 1l7x n PRO 330 N -5.41 0.12 0.02 6.41 -0.02 -1.26 0.51 135.00 135.37 1l7x n PRO 330 Ca -0.09 0.54 0.11 0.00 -2.02 0.00 0.00 63.50 62.04 1l7x n PRO 330 Cb 0.32 -1.82 0.06 0.00 -0.02 0.00 0.00 33.50 32.03 1l7x n PRO 330 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1l7x n ASP 331 N -2.06 0.63 -0.00 2.55 8.00 -0.91 -4.13 116.55 120.63 1l7x n ASP 331 Ca -0.00 -0.24 0.03 0.00 0.71 0.00 0.00 54.79 55.28 1l7x n ASP 331 Cb 0.08 0.67 -0.04 0.00 -0.02 0.00 0.00 41.12 41.82 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 -1.88 2.49 -3.95 -1.24 1.13 -0.05 -4.53 117.38 109.36 1l7x n GLN 332 Ca 0.03 -0.03 -0.16 0.00 -1.94 0.00 0.00 57.00 54.89 1l7x n GLN 332 Cb 0.41 -0.96 -0.16 0.00 0.11 0.00 0.00 30.24 29.65 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 -1.98 0.18 -0.07 5.09 1.01 0.18 -0.89 120.40 123.93 1l7x s VAL 333 Ca -0.00 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.04 1l7x s VAL 333 Cb 0.04 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 36.18 1l7x s VAL 333 CO 0.23 0.13 -0.07 0.00 0.00 0.00 0.00 175.10 175.39 1l7x s ALA 334 N 0.84 0.98 -0.16 5.51 0.00 -0.49 -4.42 121.76 124.01 1l7x s ALA 334 Ca -0.08 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.63 1l7x s ALA 334 Cb -0.12 -0.58 0.01 0.00 0.00 0.00 0.00 23.12 22.43 1l7x s ALA 334 CO -0.01 -0.09 -0.20 0.42 0.00 0.00 0.00 175.76 175.88 1l7x s ILE 335 N 1.07 2.16 -0.17 0.00 1.01 -0.08 -0.01 121.20 125.17 1l7x s ILE 335 Ca -0.08 -0.93 -0.11 0.00 0.00 0.00 0.00 60.65 59.53 1l7x s ILE 335 Cb -0.14 -1.89 -0.05 0.00 0.01 0.00 0.00 42.46 40.39 1l7x s ILE 335 CO -0.01 0.54 0.19 -1.58 0.00 0.00 0.00 174.94 174.08 1l7x s GLN 336 N 1.04 4.12 -0.38 2.79 2.00 0.38 -2.02 119.66 127.59 1l7x s GLN 336 Ca -0.01 -0.10 -0.18 0.00 -2.00 0.00 0.00 55.36 53.06 1l7x s GLN 336 Cb -0.14 -3.39 0.01 0.00 0.80 0.00 0.00 33.01 30.28 1l7x s GLN 336 CO -0.06 0.34 0.52 -0.51 -0.50 0.00 0.00 175.29 175.08 1l7x s LEU 337 N 0.20 4.47 -0.77 3.68 1.43 0.21 -1.83 118.68 126.07 1l7x s LEU 337 Ca 0.12 -0.21 -0.26 0.00 -1.03 0.00 0.00 54.13 52.75 1l7x s LEU 337 Cb -0.12 -2.58 0.04 0.00 0.03 0.00 0.00 46.19 43.56 1l7x s LEU 337 CO 0.01 -0.56 1.27 0.21 0.23 0.00 0.00 176.35 177.51 1l7x s ASN 338 N 1.82 6.21 0.67 2.29 2.47 -0.82 -2.43 114.94 125.15 1l7x s ASN 338 Ca 0.18 -0.64 0.00 0.00 0.42 0.00 0.00 52.86 52.82 1l7x s ASN 338 Cb -0.15 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.10 1l7x s ASN 338 CO 0.15 -1.75 0.00 -0.67 -3.72 0.00 0.00 177.10 171.10 1l7x n ASP 339 N 9.12 -4.43 -0.13 -4.21 -0.08 -0.92 -3.96 116.55 111.93 1l7x n ASP 339 Ca 0.06 0.09 0.14 0.00 -1.51 0.00 0.00 54.79 53.58 1l7x n ASP 339 Cb 0.49 -0.26 0.67 0.00 2.34 0.00 0.00 41.12 44.35 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 -1.59 0.00 -0.30 5.18 -2.24 -1.26 -4.25 114.28 109.82 1l7x n THR 340 Ca 0.00 -0.07 0.12 0.00 -2.27 0.00 0.00 64.05 61.83 1l7x n THR 340 Cb 0.04 -0.13 0.29 0.00 -2.10 0.00 0.00 70.33 68.43 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 0.63 0.67 -0.98 4.78 3.86 -1.96 0.56 115.15 122.71 1l7x h HIS 341 Ca 0.00 0.04 -0.53 0.00 -1.16 0.00 0.00 60.37 58.72 1l7x h HIS 341 Cb 0.31 -0.16 -0.30 0.00 1.06 0.00 0.00 27.41 28.32 1l7x h HIS 341 CO 0.00 0.00 0.67 -0.35 0.86 0.00 0.00 177.93 179.11 1l7x n PRO 342 N -5.01 2.27 -0.08 2.45 -0.04 -1.26 -4.62 135.00 128.71 1l7x n PRO 342 Ca 0.21 -2.97 0.09 0.00 -0.04 0.00 0.00 63.50 60.79 1l7x n PRO 342 Cb 0.60 -2.16 0.46 0.00 -0.04 0.00 0.00 33.50 32.35 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 1.14 1.88 0.00 0.55 0.00 -1.15 -1.74 119.26 119.94 1l7x h ALA 343 Ca 0.62 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.51 1l7x h ALA 343 Cb 2.58 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 20.25 1l7x h ALA 343 CO 1.14 0.01 0.05 1.28 0.00 0.00 0.00 179.25 181.74 1l7x n LEU 344 N -4.47 0.36 -0.01 0.00 4.77 -1.26 -1.94 117.00 114.43 1l7x n LEU 344 Ca 0.08 0.64 0.02 0.00 -0.03 0.00 0.00 56.01 56.73 1l7x n LEU 344 Cb 0.27 -0.68 0.36 0.00 -2.33 0.00 0.00 43.42 41.04 1l7x n LEU 344 CO 0.34 -0.77 1.07 0.00 -1.33 0.00 0.00 177.39 176.70 1l7x h ALA 345 N 1.85 1.54 0.56 -1.18 0.00 -1.68 -1.01 119.26 119.35 1l7x h ALA 345 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1l7x h ALA 345 Cb 0.10 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1l7x h ALA 345 CO 0.00 0.36 -0.33 0.82 0.00 0.00 0.00 179.25 180.10 1l7x h ILE 346 N 0.56 0.32 -0.01 0.00 2.04 -1.62 0.09 117.51 118.89 1l7x h ILE 346 Ca 0.14 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.89 1l7x h ILE 346 Cb 0.11 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 1l7x h ILE 346 CO -0.01 0.00 -0.52 1.55 0.00 0.00 0.00 178.15 179.17 1l7x h PRO 347 N -0.84 0.01 -0.71 2.37 0.13 -1.72 -2.65 132.00 128.59 1l7x h PRO 347 Ca -0.07 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1l7x h PRO 347 Cb 0.68 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.77 1l7x h PRO 347 CO 0.08 0.53 0.43 1.49 -0.23 0.00 0.00 178.00 180.30 1l7x h GLU 348 N 0.01 0.97 -0.60 0.86 4.57 -0.91 0.60 114.58 120.07 1l7x h GLU 348 Ca -0.00 -0.09 -0.07 0.00 -1.18 0.00 0.00 59.36 58.02 1l7x h GLU 348 Cb 0.92 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 1l7x h GLU 348 CO 0.07 0.68 0.10 1.25 -1.18 0.00 0.00 179.01 179.93 1l7x h LEU 349 N 0.97 0.95 -0.41 1.64 5.85 -0.87 -0.77 115.31 122.68 1l7x h LEU 349 Ca 0.26 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1l7x h LEU 349 Cb -0.04 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 1l7x h LEU 349 CO -0.05 0.96 0.21 0.24 -0.34 0.00 0.00 178.44 179.47 1l7x h MET 350 N 0.89 0.57 -0.42 1.25 2.86 -1.02 -0.46 114.93 118.60 1l7x h MET 350 Ca 0.18 -0.07 0.06 0.00 -2.06 0.00 0.00 59.70 57.81 1l7x h MET 350 Cb 0.41 -0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.91 1l7x h MET 350 CO 0.01 0.47 0.12 -0.09 1.06 0.00 0.00 176.91 178.48 1l7x h ARG 351 N 0.52 0.26 0.10 1.72 2.43 0.60 -0.95 114.38 119.06 1l7x h ARG 351 Ca 0.14 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1l7x h ARG 351 Cb 0.07 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1l7x h ARG 351 CO -0.02 0.17 -0.05 0.82 -1.51 0.00 0.00 179.97 179.38 1l7x h ILE 352 N 0.27 0.98 -1.00 1.20 2.04 -0.75 -0.21 117.51 120.03 1l7x h ILE 352 Ca 0.20 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.81 1l7x h ILE 352 Cb 0.21 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.39 1l7x h ILE 352 CO -0.23 0.07 0.66 -0.26 0.00 0.00 0.00 178.15 178.39 1l7x h PHE 353 N -0.25 1.26 0.00 1.37 0.05 -0.86 0.35 116.94 118.85 1l7x h PHE 353 Ca -0.01 0.03 -0.09 0.00 3.82 0.00 0.00 57.97 61.71 1l7x h PHE 353 Cb 0.21 -0.43 -0.01 0.00 2.00 0.00 0.00 35.95 37.72 1l7x h PHE 353 CO -0.03 0.79 -0.57 0.28 -0.18 0.00 0.00 178.31 178.60 1l7x h VAL 354 N 1.35 0.98 0.00 -0.55 2.07 -1.14 0.48 116.25 119.44 1l7x h VAL 354 Ca 0.37 -1.93 -0.20 0.00 0.82 0.00 0.00 66.70 65.76 1l7x h VAL 354 Cb -0.15 2.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 1l7x h VAL 354 CO -0.08 0.33 -0.97 0.44 0.02 0.00 0.00 177.57 177.31 1l7x h ASP 355 N -1.00 0.00 0.00 0.57 3.32 -1.15 -3.05 116.42 115.11 1l7x h ASP 355 Ca -0.14 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.69 1l7x h ASP 355 Cb 0.93 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 1l7x h ASP 355 CO -0.08 0.91 -1.72 -0.38 -1.72 0.00 0.00 179.24 176.25 1l7x n ILE 356 N -3.30 1.51 1.80 0.35 2.08 -0.62 -4.53 119.36 116.65 1l7x n ILE 356 Ca -0.01 -0.11 0.15 0.00 0.56 0.00 0.00 62.75 63.35 1l7x n ILE 356 Cb 0.91 -2.13 0.79 0.00 -0.75 0.00 0.00 39.64 38.46 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 -4.37 1.22 -2.89 0.38 -0.58 0.02 -4.94 120.64 109.49 1l7x n GLU 357 Ca -0.33 -0.35 -0.21 0.00 -0.42 0.00 0.00 57.16 55.85 1l7x n GLU 357 Cb 0.69 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 30.08 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 -0.58 -3.68 -3.15 3.49 4.76 -0.89 -4.92 118.16 113.19 1l7x n LYS 358 Ca 0.22 0.82 -0.33 0.00 -2.87 0.00 0.00 58.31 56.15 1l7x n LYS 358 Cb 0.20 -5.59 -0.06 0.00 -1.84 0.00 0.00 35.03 27.74 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 -6.40 4.08 0.58 -0.35 1.43 0.16 -4.96 118.68 113.23 1l7x s LEU 359 Ca 0.22 1.27 -0.18 0.00 -1.03 0.00 0.00 54.13 54.42 1l7x s LEU 359 Cb -0.10 -4.03 -0.04 0.00 0.03 0.00 0.00 46.19 42.05 1l7x s LEU 359 CO 0.28 -0.18 1.11 -2.16 0.23 0.00 0.00 176.35 175.62 1l7x s PRO 360 N -2.91 3.21 0.16 1.29 0.04 -1.26 -4.25 135.00 131.27 1l7x s PRO 360 Ca 0.53 1.46 -0.25 0.00 0.04 0.00 0.00 61.00 62.79 1l7x s PRO 360 Cb -0.11 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 32.47 1l7x s PRO 360 CO 0.18 -0.94 1.59 2.35 0.04 0.00 0.00 177.00 180.22 1l7x h TRP 361 N 0.75 -1.06 -0.87 0.56 2.91 -1.97 -1.14 115.95 115.13 1l7x h TRP 361 Ca -0.48 0.06 0.20 0.00 1.13 0.00 0.00 58.89 59.80 1l7x h TRP 361 Cb 1.25 0.53 -0.12 0.00 -0.51 0.00 0.00 29.16 30.31 1l7x h TRP 361 CO 0.54 -0.41 0.37 0.66 -1.03 0.00 0.00 178.44 178.57 1l7x h SER 362 N -0.28 0.32 -0.03 2.65 4.64 -1.99 0.13 113.55 118.98 1l7x h SER 362 Ca 0.16 0.14 -0.05 0.00 -0.47 0.00 0.00 61.79 61.58 1l7x h SER 362 Cb 0.56 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 1l7x h SER 362 CO -0.56 0.03 -0.16 0.50 -0.87 0.00 0.00 176.83 175.76 1l7x h LYS 363 N 0.42 0.15 -0.37 4.77 1.63 -1.81 -2.86 116.57 118.51 1l7x h LYS 363 Ca 0.53 -0.13 0.08 0.00 -0.85 0.00 0.00 60.65 60.27 1l7x h LYS 363 Cb 0.95 0.03 -0.08 0.00 -0.60 0.00 0.00 32.23 32.53 1l7x h LYS 363 CO -0.50 0.81 -0.15 0.00 -3.45 0.00 0.00 179.45 176.15 1l7x h ALA 364 N 0.35 0.15 -1.00 5.00 0.00 -0.34 -1.36 119.26 122.06 1l7x h ALA 364 Ca -0.01 0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1l7x h ALA 364 Cb 0.84 0.38 -0.06 0.00 0.00 0.00 0.00 17.79 18.96 1l7x h ALA 364 CO 0.03 -0.52 0.65 2.35 0.00 0.00 0.00 179.25 181.76 1l7x h TRP 365 N -0.08 1.21 -0.13 0.00 -0.00 -0.85 -1.65 115.95 114.46 1l7x h TRP 365 Ca 0.18 0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 59.10 1l7x h TRP 365 Cb 0.36 -0.40 -0.01 0.00 -0.00 0.00 0.00 29.16 29.11 1l7x h TRP 365 CO -0.38 0.67 0.06 1.49 -0.00 0.00 0.00 178.44 180.28 1l7x h GLU 366 N 1.22 0.19 -0.61 2.65 4.81 -1.04 -2.37 114.58 119.43 1l7x h GLU 366 Ca 0.41 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.58 1l7x h GLU 366 Cb 0.07 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 1l7x h GLU 366 CO -0.14 0.24 0.24 -0.07 -0.73 0.00 0.00 179.01 178.55 1l7x h LEU 367 N 0.09 0.82 -0.20 1.64 3.38 -1.01 -2.43 115.31 117.58 1l7x h LEU 367 Ca 0.04 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1l7x h LEU 367 Cb 0.12 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1l7x h LEU 367 CO -0.01 0.74 0.11 0.74 0.09 0.00 0.00 178.44 180.11 1l7x h THR 368 N 0.88 1.12 0.00 0.22 2.02 -1.12 -0.86 112.91 115.16 1l7x h THR 368 Ca 0.21 -0.32 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 1l7x h THR 368 Cb 0.18 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 1l7x h THR 368 CO -0.02 0.11 -0.26 1.56 0.37 0.00 0.00 175.52 177.28 1l7x h GLN 369 N 0.21 0.00 0.00 6.66 4.20 -1.25 -1.30 115.11 123.63 1l7x h GLN 369 Ca 0.07 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.72 1l7x h GLN 369 Cb 0.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1l7x h GLN 369 CO -0.01 0.26 -0.31 0.87 -0.67 0.00 0.00 178.83 178.97 1l7x h LYS 370 N 0.00 0.00 0.12 1.46 1.57 -1.04 -2.89 116.57 115.79 1l7x h LYS 370 Ca -0.00 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.56 1l7x h LYS 370 Cb 0.46 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.78 1l7x h LYS 370 CO 0.03 0.31 -1.04 1.15 -0.57 0.00 0.00 179.45 179.34 1l7x h THR 371 N 0.00 1.30 -3.32 -0.16 2.02 -0.29 -3.47 112.91 109.00 1l7x h THR 371 Ca -0.00 -2.46 -0.56 0.00 0.77 0.00 0.00 66.41 64.16 1l7x h THR 371 Cb 1.15 2.97 -0.04 0.00 -1.74 0.00 0.00 68.15 70.49 1l7x h THR 371 CO 0.04 0.69 -0.12 -0.36 0.37 0.00 0.00 175.52 176.13 1l7x s PHE 372 N -2.43 3.55 -0.01 3.16 0.40 -0.57 -0.90 117.98 121.17 1l7x s PHE 372 Ca -0.17 0.95 0.01 0.00 -0.60 0.00 0.00 56.93 57.12 1l7x s PHE 372 Cb 0.02 -2.30 0.00 0.00 0.51 0.00 0.00 43.02 41.26 1l7x s PHE 372 CO 0.79 0.40 -0.02 0.00 0.70 0.00 0.00 175.22 177.08 1l7x s ALA 373 N -1.56 0.26 -0.11 5.36 0.00 -0.86 -1.97 121.76 122.90 1l7x s ALA 373 Ca 0.40 -0.07 0.02 0.00 0.00 0.00 0.00 51.96 52.31 1l7x s ALA 373 Cb -0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.86 1l7x s ALA 373 CO 0.20 0.04 -0.18 -0.47 0.00 0.00 0.00 175.76 175.34 1l7x s TYR 374 N 0.14 2.68 -0.29 0.00 5.04 0.97 -0.62 117.35 125.28 1l7x s TYR 374 Ca -0.01 -0.74 -0.07 0.00 -2.44 0.00 0.00 57.07 53.81 1l7x s TYR 374 Cb -0.04 -1.76 0.00 0.00 0.35 0.00 0.00 41.96 40.52 1l7x s TYR 374 CO -0.00 -0.24 0.07 0.99 -1.34 0.00 0.00 175.55 175.03 1l7x s THR 375 N 0.20 3.99 -0.15 4.34 2.01 -1.02 -1.13 115.64 123.88 1l7x s THR 375 Ca -0.11 -0.61 -0.22 0.00 0.31 0.00 0.00 61.69 61.06 1l7x s THR 375 Cb -0.16 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 1l7x s THR 375 CO 0.06 0.13 0.65 0.21 -0.69 0.00 0.00 174.62 174.98 1l7x s ASN 376 N 1.52 6.80 0.00 3.53 3.84 0.19 -2.16 114.94 128.64 1l7x s ASN 376 Ca 0.03 0.97 0.14 0.00 0.21 0.00 0.00 52.86 54.21 1l7x s ASN 376 Cb -0.17 -2.37 0.24 0.00 -0.55 0.00 0.00 41.25 38.41 1l7x s ASN 376 CO 0.02 -0.21 1.13 1.41 -2.79 0.00 0.00 177.10 176.66 1l7x n HIS 377 N 4.54 0.28 -3.47 0.43 8.25 -1.26 -4.02 115.22 119.97 1l7x n HIS 377 Ca -0.01 -0.24 -0.10 0.00 -0.26 0.00 0.00 57.72 57.10 1l7x n HIS 377 Cb 0.50 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.58 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 -1.09 0.00 0.00 1.59 -1.32 -1.26 -4.67 115.64 108.89 1l7x s THR 378 Ca 0.23 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.71 1l7x s THR 378 Cb 0.13 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.12 1l7x s THR 378 CO 0.19 0.00 0.41 1.33 -2.21 0.00 0.00 174.62 174.34 1l7x n VAL 379 N -0.27 0.11 -2.29 5.08 0.24 -1.26 -5.03 118.33 114.91 1l7x n VAL 379 Ca -0.13 -0.39 -0.43 0.00 -2.04 0.00 0.00 64.34 61.36 1l7x n VAL 379 Cb 0.63 1.22 -0.02 0.00 -1.47 0.00 0.00 33.84 34.20 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 -0.11 4.04 0.31 1.34 1.43 -1.26 -4.92 118.68 119.52 1l7x s LEU 380 Ca 0.00 1.61 0.04 0.00 -1.03 0.00 0.00 54.13 54.75 1l7x s LEU 380 Cb 0.00 -3.54 0.80 0.00 0.03 0.00 0.00 46.19 43.48 1l7x s LEU 380 CO 0.00 -1.00 1.60 -0.65 0.23 0.00 0.00 176.35 176.53 1l7x h PRO 381 N 9.34 0.07 0.00 1.29 0.11 -1.96 0.23 132.00 141.09 1l7x h PRO 381 Ca -0.30 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1l7x h PRO 381 Cb 1.12 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1l7x h PRO 381 CO 0.99 0.05 0.00 1.05 -0.21 0.00 0.00 178.00 179.88 1l7x h GLU 382 N 0.08 0.00 -0.00 1.05 9.09 -1.91 -2.60 114.58 120.29 1l7x h GLU 382 Ca 0.61 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.02 1l7x h GLU 382 Cb 1.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.40 1l7x h GLU 382 CO -0.80 0.00 -0.58 0.00 0.05 0.00 0.00 179.01 177.68 1l7x n ALA 383 N -1.84 3.76 -2.26 1.06 0.00 0.82 -0.24 120.51 121.81 1l7x n ALA 383 Ca 0.01 -0.41 -0.42 0.00 0.00 0.00 0.00 53.44 52.62 1l7x n ALA 383 Cb 0.19 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.56 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 -2.96 4.38 -0.35 0.00 1.43 -0.98 -4.31 118.68 115.89 1l7x s LEU 384 Ca 0.11 2.20 -0.26 0.00 -1.03 0.00 0.00 54.13 55.15 1l7x s LEU 384 Cb 0.17 -3.59 0.01 0.00 0.03 0.00 0.00 46.19 42.82 1l7x s LEU 384 CO 0.72 -0.56 0.96 -1.61 0.23 0.00 0.00 176.35 176.09 1l7x s GLU 385 N 0.96 3.91 -0.36 1.70 2.02 -1.26 -4.72 118.70 120.95 1l7x s GLU 385 Ca 0.61 0.70 -0.00 0.00 0.02 0.00 0.00 54.97 56.30 1l7x s GLU 385 Cb -0.34 -3.78 0.12 0.00 0.10 0.00 0.00 34.13 30.23 1l7x s GLU 385 CO 0.30 -0.93 0.17 1.03 0.02 0.00 0.00 175.26 175.86 1l7x s ARG 386 N 3.51 0.77 -0.05 1.61 0.52 -1.26 -2.95 118.95 121.09 1l7x s ARG 386 Ca 0.40 -1.34 -0.25 0.00 -0.52 0.00 0.00 55.73 54.01 1l7x s ARG 386 Cb -0.12 -1.80 -0.03 0.00 0.52 0.00 0.00 34.95 33.52 1l7x s ARG 386 CO 0.18 -1.10 0.79 -1.58 0.02 0.00 0.00 175.30 173.61 1l7x s TRP 387 N 1.17 3.59 0.11 -0.53 0.52 -1.10 -4.67 118.94 118.03 1l7x s TRP 387 Ca 0.14 1.38 -0.31 0.00 0.02 0.00 0.00 56.10 57.33 1l7x s TRP 387 Cb -0.21 -2.91 -0.10 0.00 -1.15 0.00 0.00 33.47 29.10 1l7x s TRP 387 CO -0.12 0.03 1.87 -2.30 0.02 0.00 0.00 176.95 176.45 1l7x n PRO 388 N 3.92 2.85 0.08 4.98 -0.02 -1.26 -0.25 135.00 145.31 1l7x n PRO 388 Ca 0.01 1.04 0.19 0.00 -2.02 0.00 0.00 63.50 62.72 1l7x n PRO 388 Cb 0.51 -2.95 0.74 0.00 -0.02 0.00 0.00 33.50 31.78 1l7x n PRO 388 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1l7x h VAL 389 N 4.84 0.59 -0.36 -1.45 -1.51 -1.68 -0.73 116.25 115.95 1l7x h VAL 389 Ca -0.47 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.00 1l7x h VAL 389 Cb 1.22 0.75 -0.02 0.00 -2.13 0.00 0.00 31.29 31.11 1l7x h VAL 389 CO 0.95 0.00 0.22 0.44 -1.23 0.00 0.00 177.57 177.94 1l7x h ASP 390 N 0.00 0.44 -0.28 4.19 3.45 -1.89 0.30 116.42 122.63 1l7x h ASP 390 Ca 0.19 -0.06 -0.01 0.00 0.43 0.00 0.00 57.03 57.58 1l7x h ASP 390 Cb 0.86 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.51 1l7x h ASP 390 CO -0.00 0.37 0.13 0.25 -1.57 0.00 0.00 179.24 178.42 1l7x h LEU 391 N 0.47 0.38 -1.21 1.55 5.85 -1.52 -2.69 115.31 118.14 1l7x h LEU 391 Ca 0.13 -0.14 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 1l7x h LEU 391 Cb 0.02 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1l7x h LEU 391 CO -0.02 0.42 -0.18 0.58 -0.34 0.00 0.00 178.44 178.89 1l7x h VAL 392 N 0.32 1.22 -0.32 1.05 2.07 -1.19 -2.40 116.25 117.00 1l7x h VAL 392 Ca 0.10 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 1l7x h VAL 392 Cb 0.15 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1l7x h VAL 392 CO -0.01 0.31 0.11 -0.08 0.02 0.00 0.00 177.57 177.92 1l7x h GLU 393 N 0.30 0.49 -0.15 1.57 4.81 -0.12 0.15 114.58 121.64 1l7x h GLU 393 Ca 0.05 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1l7x h GLU 393 Cb 0.50 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 1l7x h GLU 393 CO 0.03 0.52 -0.03 -0.22 -0.73 0.00 0.00 179.01 178.58 1l7x h LYS 394 N 0.37 0.29 0.21 1.92 3.64 -1.38 -2.88 116.57 118.73 1l7x h LYS 394 Ca 0.11 -0.11 -0.29 0.00 -1.27 0.00 0.00 60.65 59.09 1l7x h LYS 394 Cb 0.23 -0.02 0.03 0.00 -0.41 0.00 0.00 32.23 32.06 1l7x h LYS 394 CO -0.01 0.56 -1.25 1.25 -2.27 0.00 0.00 179.45 177.74 1l7x h LEU 395 N -0.01 0.73 -5.89 5.20 5.85 -1.45 -3.37 115.31 116.37 1l7x h LEU 395 Ca 0.04 -0.92 -0.56 0.00 0.84 0.00 0.00 57.88 57.28 1l7x h LEU 395 Cb 0.46 -0.24 -0.41 0.00 0.37 0.00 0.00 40.66 40.84 1l7x h LEU 395 CO 0.01 1.61 -0.91 0.18 -0.34 0.00 0.00 178.44 178.99 1l7x n LEU 396 N -3.86 2.16 -0.16 2.25 4.77 0.54 -0.32 117.00 122.38 1l7x n LEU 396 Ca -0.16 -5.18 -0.03 0.00 -0.03 0.00 0.00 56.01 50.61 1l7x n LEU 396 Cb 1.01 0.08 0.03 0.00 -2.33 0.00 0.00 43.42 42.22 1l7x n LEU 396 CO 0.57 2.19 0.76 1.55 -1.33 0.00 0.00 177.39 181.13 1l7x h PRO 397 N 3.55 -0.00 0.00 3.23 0.13 -1.57 -0.91 132.00 136.43 1l7x h PRO 397 Ca 0.12 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.21 1l7x h PRO 397 Cb 0.77 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 1l7x h PRO 397 CO 0.64 -0.00 -0.19 -0.09 -0.23 0.00 0.00 178.00 178.13 1l7x h ARG 398 N -0.00 0.00 0.00 0.86 9.65 -1.91 -2.46 114.38 120.52 1l7x h ARG 398 Ca 0.24 0.00 -0.13 0.00 -1.10 0.00 0.00 59.98 58.99 1l7x h ARG 398 Cb 0.36 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.93 1l7x h ARG 398 CO -0.51 0.19 -0.61 0.45 2.80 0.00 0.00 179.97 182.29 1l7x h HIS 399 N 0.00 0.00 -0.18 2.20 3.86 -1.57 -2.79 115.15 116.67 1l7x h HIS 399 Ca -0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1l7x h HIS 399 Cb 0.35 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 1l7x h HIS 399 CO 0.00 0.61 -0.06 1.25 0.86 0.00 0.00 177.93 180.59 1l7x h LEU 400 N 0.00 0.37 -0.79 2.43 5.85 -0.82 -1.67 115.31 120.68 1l7x h LEU 400 Ca -0.01 -0.39 0.07 0.00 0.84 0.00 0.00 57.88 58.40 1l7x h LEU 400 Cb 1.40 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.26 1l7x h LEU 400 CO 0.08 0.67 0.47 -0.33 -0.34 0.00 0.00 178.44 178.99 1l7x h GLU 401 N 0.07 0.81 -0.26 1.25 5.08 -1.50 -0.01 114.58 120.01 1l7x h GLU 401 Ca 0.04 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.23 1l7x h GLU 401 Cb 0.52 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1l7x h GLU 401 CO 0.02 0.53 -0.35 0.82 -1.00 0.00 0.00 179.01 179.04 1l7x h ILE 402 N 0.83 1.29 -0.20 3.13 2.04 -1.38 -1.32 117.51 121.91 1l7x h ILE 402 Ca 0.36 -1.47 -0.14 0.00 1.00 0.00 0.00 64.86 64.61 1l7x h ILE 402 Cb 0.23 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1l7x h ILE 402 CO -0.20 0.47 -0.45 0.40 0.00 0.00 0.00 178.15 178.37 1l7x h ILE 403 N 0.47 1.31 -0.34 -0.67 2.04 -0.65 -0.79 117.51 118.89 1l7x h ILE 403 Ca 0.05 -1.64 -0.08 0.00 1.00 0.00 0.00 64.86 64.19 1l7x h ILE 403 Cb 0.83 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 1l7x h ILE 403 CO 0.07 0.51 -0.09 1.88 0.00 0.00 0.00 178.15 180.52 1l7x h TYR 404 N 0.40 0.74 -0.52 1.37 0.05 -0.80 -1.33 116.97 116.88 1l7x h TYR 404 Ca 0.03 -0.16 -0.07 0.00 0.05 0.00 0.00 58.73 58.58 1l7x h TYR 404 Cb 0.95 -0.18 -0.02 0.00 1.01 0.00 0.00 36.73 38.49 1l7x h TYR 404 CO 0.03 0.83 0.06 1.49 -1.05 0.00 0.00 178.16 179.52 1l7x h GLU 405 N 0.44 0.88 -0.95 4.88 4.57 -1.11 -0.20 114.58 123.09 1l7x h GLU 405 Ca 0.08 -0.25 0.06 0.00 -1.18 0.00 0.00 59.36 58.08 1l7x h GLU 405 Cb 0.60 -0.10 -0.06 0.00 -0.16 0.00 0.00 28.75 29.02 1l7x h GLU 405 CO 0.04 0.88 0.61 0.82 -1.18 0.00 0.00 179.01 180.17 1l7x h ILE 406 N 0.76 1.08 -0.28 2.32 2.04 -1.00 -1.09 117.51 121.34 1l7x h ILE 406 Ca 0.16 -0.38 -0.13 0.00 1.00 0.00 0.00 64.86 65.50 1l7x h ILE 406 Cb 0.44 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 1l7x h ILE 406 CO 0.01 0.20 -0.37 -1.13 0.00 0.00 0.00 178.15 176.87 1l7x h ASN 407 N 1.11 0.67 0.53 1.72 -1.24 -0.72 -1.66 115.58 115.98 1l7x h ASN 407 Ca 0.41 -0.28 -0.03 0.00 0.71 0.00 0.00 56.30 57.11 1l7x h ASN 407 Cb 0.15 -0.19 0.01 0.00 0.73 0.00 0.00 38.32 39.02 1l7x h ASN 407 CO -0.17 0.97 -0.25 -0.61 -1.29 0.00 0.00 177.43 176.08 1l7x h GLN 408 N 0.53 -0.68 -0.51 6.67 5.75 0.12 0.30 115.11 127.30 1l7x h GLN 408 Ca 0.05 0.05 0.08 0.00 -0.15 0.00 0.00 58.65 58.68 1l7x h GLN 408 Cb 0.87 0.15 -0.03 0.00 1.07 0.00 0.00 27.48 29.55 1l7x h GLN 408 CO 0.08 -0.42 0.34 0.87 -2.65 0.00 0.00 178.83 177.05 1l7x h LYS 409 N -0.79 0.36 -0.12 1.69 1.79 -1.26 0.44 116.57 118.68 1l7x h LYS 409 Ca -0.07 -0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.33 1l7x h LYS 409 Cb 0.58 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.15 1l7x h LYS 409 CO 0.12 0.24 -0.11 1.25 -1.08 0.00 0.00 179.45 179.87 1l7x h HIS 410 N 0.37 0.35 0.00 -1.35 2.76 -0.79 -3.15 115.15 113.34 1l7x h HIS 410 Ca 0.23 -0.10 -0.12 0.00 -2.20 0.00 0.00 60.37 58.18 1l7x h HIS 410 Cb 0.43 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.30 1l7x h HIS 410 CO -0.00 0.69 -0.57 -0.07 -1.30 0.00 0.00 177.93 176.68 1l7x h LEU 411 N -0.10 0.00 -1.18 0.26 3.38 0.24 -3.07 115.31 114.84 1l7x h LEU 411 Ca 0.02 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1l7x h LEU 411 Cb 0.63 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1l7x h LEU 411 CO 0.03 0.57 0.20 0.44 0.09 0.00 0.00 178.44 179.77 1l7x h ASP 412 N 0.00 0.71 0.30 -0.43 3.32 -0.99 -0.73 116.42 118.60 1l7x h ASP 412 Ca -0.01 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.94 1l7x h ASP 412 Cb 1.30 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1l7x h ASP 412 CO 0.07 0.65 -0.15 -0.09 -1.72 0.00 0.00 179.24 178.01 1l7x h ARG 413 N 0.76 -0.39 -0.54 3.56 9.65 -1.49 -2.26 114.38 123.67 1l7x h ARG 413 Ca 0.18 0.03 0.08 0.00 -1.10 0.00 0.00 59.98 59.17 1l7x h ARG 413 Cb 0.18 0.09 -0.07 0.00 -1.39 0.00 0.00 29.97 28.78 1l7x h ARG 413 CO -0.01 -0.13 0.18 0.82 2.80 0.00 0.00 179.97 183.62 1l7x h ILE 414 N -0.61 0.78 -0.82 1.20 1.08 -1.40 -0.40 117.51 117.33 1l7x h ILE 414 Ca -0.04 -0.12 0.07 0.00 -0.39 0.00 0.00 64.86 64.38 1l7x h ILE 414 Cb 0.44 0.40 -0.05 0.00 -3.07 0.00 0.00 36.82 34.54 1l7x h ILE 414 CO 0.07 0.06 0.53 0.58 -0.69 0.00 0.00 178.15 178.70 1l7x h VAL 415 N 0.34 1.04 0.37 1.67 2.07 -1.10 0.35 116.25 120.99 1l7x h VAL 415 Ca 0.27 -0.30 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1l7x h VAL 415 Cb 0.32 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1l7x h VAL 415 CO -0.29 0.16 -0.18 0.00 0.02 0.00 0.00 177.57 177.28 1l7x h ALA 416 N 1.56 -0.50 0.00 1.67 0.00 -0.51 -1.59 119.26 119.90 1l7x h ALA 416 Ca 0.35 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1l7x h ALA 416 Cb 0.24 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1l7x h ALA 416 CO -0.13 -0.62 0.00 -0.07 0.00 0.00 0.00 179.25 178.43 1l7x h LEU 417 N -0.81 0.00 -5.70 0.00 3.38 -0.84 -3.34 115.31 108.01 1l7x h LEU 417 Ca -0.05 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.48 1l7x h LEU 417 Cb 0.53 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.96 1l7x h LEU 417 CO 0.08 0.00 -0.94 0.49 0.09 0.00 0.00 178.44 178.16 1l7x n PHE 418 N -2.46 -1.08 -0.36 1.13 3.01 0.12 -5.00 117.46 112.82 1l7x n PHE 418 Ca 0.02 -3.12 0.29 0.00 1.01 0.00 0.00 57.45 55.65 1l7x n PHE 418 Cb 0.25 0.22 0.59 0.00 -0.01 0.00 0.00 39.48 40.54 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 3.64 0.23 0.00 -1.08 0.11 -1.41 -3.16 132.00 130.33 1l7x h PRO 419 Ca 0.02 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1l7x h PRO 419 Cb 0.96 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1l7x h PRO 419 CO 0.41 0.15 0.00 1.63 -0.21 0.00 0.00 178.00 179.98 1l7x n LYS 420 N -4.56 0.00 -1.47 1.05 4.01 -1.26 -4.78 118.16 111.15 1l7x n LYS 420 Ca 0.29 0.36 -0.21 0.00 -0.51 0.00 0.00 58.31 58.24 1l7x n LYS 420 Cb 1.11 -0.85 -0.22 0.00 -0.51 0.00 0.00 35.03 34.56 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 -1.68 -1.49 0.10 4.39 4.64 -1.20 -4.71 116.55 116.60 1l7x n ASP 421 Ca 0.00 -0.61 0.11 0.00 -1.38 0.00 0.00 54.79 52.91 1l7x n ASP 421 Cb 0.00 -0.54 -0.01 0.00 -1.04 0.00 0.00 41.12 39.53 1l7x n ASP 421 CO 0.00 0.00 0.00 1.33 -0.82 0.00 0.00 177.20 177.71 1l7x n VAL 422 N 5.47 0.64 0.23 5.18 0.24 -1.26 -3.61 118.33 125.23 1l7x n VAL 422 Ca 0.64 -0.56 0.12 0.00 -2.04 0.00 0.00 64.34 62.50 1l7x n VAL 422 Cb 0.16 -0.35 0.47 0.00 -1.47 0.00 0.00 33.84 32.65 1l7x n VAL 422 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 1l7x h ASP 423 N 0.00 0.00 0.42 -1.34 -0.00 -1.98 -2.48 116.42 111.04 1l7x h ASP 423 Ca -0.01 0.00 -0.14 0.00 -0.00 0.00 0.00 57.03 56.89 1l7x h ASP 423 Cb 1.03 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.34 1l7x h ASP 423 CO 0.00 0.15 -0.59 -0.09 -0.00 0.00 0.00 179.24 178.72 1l7x h ARG 424 N 0.00 0.17 -0.59 0.28 2.43 -1.95 -2.27 114.38 112.45 1l7x h ARG 424 Ca -0.00 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 58.99 1l7x h ARG 424 Cb 0.74 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.28 1l7x h ARG 424 CO 0.02 0.71 0.10 -0.07 -1.51 0.00 0.00 179.97 179.21 1l7x h LEU 425 N 0.13 0.94 -0.78 3.80 3.38 -1.58 -1.77 115.31 119.41 1l7x h LEU 425 Ca -0.00 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.61 1l7x h LEU 425 Cb 1.07 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1l7x h LEU 425 CO 0.09 0.96 -0.11 -0.09 0.09 0.00 0.00 178.44 179.37 1l7x h ARG 426 N 0.88 0.80 0.00 1.13 2.43 -1.43 -1.79 114.38 116.40 1l7x h ARG 426 Ca 0.18 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1l7x h ARG 426 Cb 0.42 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1l7x h ARG 426 CO 0.01 0.88 0.00 0.00 -1.51 0.00 0.00 179.97 179.35 1l7x h ARG 427 N 0.72 0.00 -0.08 0.20 3.08 -1.18 -3.26 114.38 113.87 1l7x h ARG 427 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1l7x h ARG 427 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1l7x h ARG 427 CO 0.04 0.00 0.00 -1.33 -1.07 0.00 0.00 179.97 177.61 1l7x n MET 428 N -2.79 1.07 -2.23 0.04 2.81 -0.69 -5.02 117.12 110.31 1l7x n MET 428 Ca 0.04 -1.38 -0.35 0.00 -1.81 0.00 0.00 57.70 54.20 1l7x n MET 428 Cb 0.44 -1.24 0.00 0.00 -0.71 0.00 0.00 33.22 31.71 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 -1.01 5.72 0.08 7.83 0.15 -0.69 -4.92 113.70 120.87 1l7x s SER 429 Ca 0.16 2.22 0.28 0.00 0.70 0.00 0.00 55.95 59.31 1l7x s SER 429 Cb 0.11 -2.59 1.03 0.00 -1.71 0.00 0.00 66.02 62.86 1l7x s SER 429 CO 0.15 -1.22 1.84 0.18 1.20 0.00 0.00 173.24 175.39 1l7x n LEU 430 N -1.23 0.35 -4.41 3.45 4.32 -1.26 -4.74 117.00 113.47 1l7x n LEU 430 Ca 0.11 0.51 -0.33 0.00 -0.02 0.00 0.00 56.01 56.29 1l7x n LEU 430 Cb 0.50 -0.42 -0.14 0.00 -1.62 0.00 0.00 43.42 41.75 1l7x n LEU 430 CO 0.43 -0.07 -0.45 -0.63 -1.22 0.00 0.00 177.39 175.45 1l7x s ILE 431 N -3.04 3.02 -0.19 -0.08 -1.09 -1.26 -0.72 121.20 117.84 1l7x s ILE 431 Ca 0.12 -0.70 -0.08 0.00 -2.23 0.00 0.00 60.65 57.77 1l7x s ILE 431 Cb 0.16 -2.23 -0.04 0.00 -1.58 0.00 0.00 42.46 38.77 1l7x s ILE 431 CO 0.56 0.56 0.07 -1.61 -1.23 0.00 0.00 174.94 173.29 1l7x s GLU 432 N -0.14 3.98 -0.12 2.79 2.02 0.57 -4.95 118.70 122.86 1l7x s GLU 432 Ca -0.01 -0.34 0.16 0.00 0.02 0.00 0.00 54.97 54.80 1l7x s GLU 432 Cb -0.14 -3.24 -0.24 0.00 0.10 0.00 0.00 34.13 30.62 1l7x s GLU 432 CO 0.03 0.26 0.34 0.39 0.02 0.00 0.00 175.26 176.31 1l7x n GLU 433 N 3.59 0.66 -1.47 1.61 -0.58 -1.26 -1.56 120.64 121.63 1l7x n GLU 433 Ca -0.16 0.10 -0.44 0.00 -0.42 0.00 0.00 57.16 56.24 1l7x n GLU 433 Cb 0.52 -1.63 -0.12 0.00 -0.57 0.00 0.00 31.44 29.64 1l7x n GLU 433 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1l7x n GLU 434 N -2.84 0.30 0.00 3.49 4.71 -1.26 -4.36 120.64 120.68 1l7x n GLU 434 Ca -0.25 0.03 0.00 0.00 -0.01 0.00 0.00 57.16 56.93 1l7x n GLU 434 Cb 1.08 -1.95 0.00 0.00 -1.01 0.00 0.00 31.44 29.56 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 6.57 1.77 3.67 0.62 0.00 -1.26 -4.69 105.19 111.87 1l7x n GLY 435 Ca 0.57 -0.48 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 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 7.13 0.27 1.61 1.04 -1.26 -4.98 113.70 113.51 1l7x s SER 436 Ca 0.00 1.42 -0.30 0.00 0.48 0.00 0.00 55.95 57.55 1l7x s SER 436 Cb 0.00 -2.54 -0.13 0.00 0.10 0.00 0.00 66.02 63.45 1l7x s SER 436 CO 0.00 -0.62 1.39 0.29 0.98 0.00 0.00 173.24 175.28 1l7x n LYS 437 N 6.03 2.10 -4.21 4.02 5.02 -1.26 -4.87 118.16 125.00 1l7x n LYS 437 Ca 0.11 0.75 -0.12 0.00 -2.02 0.00 0.00 58.31 57.03 1l7x n LYS 437 Cb 0.47 -2.39 -0.10 0.00 -0.02 0.00 0.00 35.03 32.98 1l7x n LYS 437 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1l7x s ARG 438 N -0.78 0.99 -0.18 1.97 0.52 -0.60 -1.88 118.95 118.98 1l7x s ARG 438 Ca 0.65 -1.45 -0.05 0.00 -0.52 0.00 0.00 55.73 54.36 1l7x s ARG 438 Cb -0.62 -0.21 -0.03 0.00 0.52 0.00 0.00 34.95 34.62 1l7x s ARG 438 CO 0.53 -0.10 -0.01 0.42 0.02 0.00 0.00 175.30 176.16 1l7x s ILE 439 N -3.67 3.99 -0.84 1.52 1.01 0.66 -0.32 121.20 123.56 1l7x s ILE 439 Ca 0.19 -0.31 -0.21 0.00 0.00 0.00 0.00 60.65 60.33 1l7x s ILE 439 Cb 0.06 -2.79 0.10 0.00 0.01 0.00 0.00 42.46 39.84 1l7x s ILE 439 CO 0.00 0.45 1.11 0.21 0.00 0.00 0.00 174.94 176.71 1l7x s ASN 440 N 0.75 6.44 0.43 3.58 3.84 0.10 -2.70 114.94 127.38 1l7x s ASN 440 Ca -0.00 -1.57 0.12 0.00 0.21 0.00 0.00 52.86 51.63 1l7x s ASN 440 Cb -0.14 -2.43 0.99 0.00 -0.55 0.00 0.00 41.25 39.12 1l7x s ASN 440 CO 0.02 -1.27 1.99 0.24 -2.79 0.00 0.00 177.10 175.29 1l7x h MET 441 N 9.23 0.44 -0.46 0.43 2.86 -1.83 -1.62 114.93 123.98 1l7x h MET 441 Ca -0.01 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1l7x h MET 441 Cb 1.04 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.58 1l7x h MET 441 CO 1.17 0.29 0.20 0.00 1.06 0.00 0.00 176.91 179.63 1l7x h ALA 442 N 1.70 0.60 -0.74 6.32 0.00 -1.90 -0.24 119.26 124.99 1l7x h ALA 442 Ca 0.27 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1l7x h ALA 442 Cb 0.45 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1l7x h ALA 442 CO -0.07 0.19 0.48 0.45 0.00 0.00 0.00 179.25 180.29 1l7x h HIS 443 N 0.60 0.90 -0.76 0.00 3.86 -1.68 -1.22 115.15 116.85 1l7x h HIS 443 Ca 0.16 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.41 1l7x h HIS 443 Cb 0.16 -0.30 -0.04 0.00 1.06 0.00 0.00 27.41 28.29 1l7x h HIS 443 CO -0.00 0.54 0.50 1.25 0.86 0.00 0.00 177.93 181.08 1l7x h LEU 444 N 0.95 0.85 -0.40 2.43 5.85 -0.83 -2.40 115.31 121.76 1l7x h LEU 444 Ca 0.29 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.82 1l7x h LEU 444 Cb -0.03 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.78 1l7x h LEU 444 CO -0.09 0.61 -0.50 0.00 -0.34 0.00 0.00 178.44 178.12 1l7x h ILE 446 N 0.62 0.88 -0.11 0.00 2.04 -0.77 -1.95 117.51 118.24 1l7x h ILE 446 Ca 0.03 -0.04 -0.11 0.00 1.00 0.00 0.00 64.86 65.74 1l7x h ILE 446 Cb 1.08 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 1l7x h ILE 446 CO 0.11 0.01 -0.41 -0.37 0.00 0.00 0.00 178.15 177.49 1l7x h VAL 447 N -0.19 1.31 -0.04 1.67 -1.51 -1.53 -2.93 116.25 113.02 1l7x h VAL 447 Ca -0.02 -1.51 0.00 0.00 -1.23 0.00 0.00 66.70 63.95 1l7x h VAL 447 Cb 0.15 1.68 0.00 0.00 -2.13 0.00 0.00 31.29 30.98 1l7x h VAL 447 CO 0.03 0.45 0.00 0.61 -1.23 0.00 0.00 177.57 177.43 1l7x n GLY 448 N -0.20 -0.11 3.59 5.19 0.00 -1.03 -4.89 105.19 107.74 1l7x n GLY 448 Ca -0.01 -0.39 -0.24 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.89 4.25 0.00 1.61 0.01 -0.74 -3.75 113.70 113.20 1l7x s SER 449 Ca 0.38 -0.72 0.16 0.00 1.31 0.00 0.00 55.95 57.07 1l7x s SER 449 Cb 0.20 -0.69 -0.14 0.00 0.21 0.00 0.00 66.02 65.60 1l7x s SER 449 CO 0.32 0.03 0.71 0.00 0.41 0.00 0.00 173.24 174.71 1l7x n HIS 450 N -0.63 0.00 -3.80 2.43 1.44 -0.83 -4.92 115.22 108.91 1l7x n HIS 450 Ca -0.07 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.51 1l7x n HIS 450 Cb 0.58 0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.58 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 -2.38 -0.54 -0.02 1.59 0.00 -1.26 -4.67 121.76 114.48 1l7x s ALA 451 Ca 0.07 0.56 0.01 0.00 0.00 0.00 0.00 51.96 52.60 1l7x s ALA 451 Cb 0.12 -0.32 0.02 0.00 0.00 0.00 0.00 23.12 22.95 1l7x s ALA 451 CO 0.60 -0.12 -0.01 0.08 0.00 0.00 0.00 175.76 176.31 1l7x s VAL 452 N -0.04 0.21 0.02 0.00 1.01 -0.69 -0.02 120.40 120.90 1l7x s VAL 452 Ca -0.02 0.03 -0.00 0.00 0.00 0.00 0.00 61.98 61.99 1l7x s VAL 452 Cb -0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 36.06 1l7x s VAL 452 CO 0.01 0.13 -0.03 0.54 0.00 0.00 0.00 175.10 175.75 1l7x s ASN 453 N 0.78 0.24 0.75 3.32 4.22 -0.29 -0.54 114.94 123.42 1l7x s ASN 453 Ca -0.08 -0.50 -0.01 0.00 -2.14 0.00 0.00 52.86 50.13 1l7x s ASN 453 Cb -0.11 0.10 0.14 0.00 1.28 0.00 0.00 41.25 42.66 1l7x s ASN 453 CO -0.01 -0.30 1.03 -0.83 -2.04 0.00 0.00 177.10 174.94 1l7x s GLY 454 N -1.47 1.76 -0.08 0.45 0.00 -1.04 -0.64 107.32 106.30 1l7x s GLY 454 Ca -0.16 -1.77 0.14 0.00 0.00 0.00 0.00 44.72 42.93 1l7x s GLY 454 CO -0.01 -1.16 1.38 3.33 0.00 0.00 0.00 173.10 176.64 1l7x n VAL 455 N -2.92 1.57 -3.62 1.40 0.24 -1.26 -2.71 118.33 111.03 1l7x n VAL 455 Ca 0.16 -1.32 -0.06 0.00 -2.04 0.00 0.00 64.34 61.07 1l7x n VAL 455 Cb 0.61 0.19 -0.06 0.00 -1.47 0.00 0.00 33.84 33.11 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 -1.75 -2.06 0.19 2.33 0.00 -1.26 -1.53 121.76 117.68 1l7x s ALA 456 Ca 0.35 1.75 -0.24 0.00 0.00 0.00 0.00 51.96 53.82 1l7x s ALA 456 Cb 0.23 -1.33 0.10 0.00 0.00 0.00 0.00 23.12 22.11 1l7x s ALA 456 CO 0.15 -0.23 1.55 0.87 0.00 0.00 0.00 175.76 178.11 1l7x h LYS 457 N 2.81 -0.04 -0.06 0.00 1.57 -1.90 0.42 116.57 119.36 1l7x h LYS 457 Ca -0.19 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.54 1l7x h LYS 457 Cb 1.18 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1l7x h LYS 457 CO 0.22 -0.03 -0.20 0.97 -0.57 0.00 0.00 179.45 179.84 1l7x h ILE 458 N -0.04 1.18 0.00 1.86 2.10 -1.91 -1.04 117.51 119.65 1l7x h ILE 458 Ca 0.25 -0.83 -0.02 0.00 1.08 0.00 0.00 64.86 65.34 1l7x h ILE 458 Cb 0.53 1.36 0.00 0.00 -1.09 0.00 0.00 36.82 37.62 1l7x h ILE 458 CO -0.92 0.25 -0.06 -0.74 -1.08 0.00 0.00 178.15 175.60 1l7x h HIS 459 N 0.09 0.06 -0.88 2.19 2.76 -1.08 -2.69 115.15 115.60 1l7x h HIS 459 Ca 0.02 -0.04 0.03 0.00 -2.20 0.00 0.00 60.37 58.18 1l7x h HIS 459 Cb 0.42 -0.01 -0.05 0.00 1.55 0.00 0.00 27.41 29.32 1l7x h HIS 459 CO 0.00 0.85 0.58 0.77 -1.30 0.00 0.00 177.93 178.83 1l7x h SER 460 N -0.74 0.96 -0.21 3.26 0.02 -0.22 0.50 113.55 117.12 1l7x h SER 460 Ca -0.01 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1l7x h SER 460 Cb 0.87 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.17 1l7x h SER 460 CO 0.01 0.67 0.10 -0.78 -1.14 0.00 0.00 176.83 175.70 1l7x h ASP 461 N 1.12 0.27 -0.11 3.07 3.58 -1.25 0.89 116.42 123.99 1l7x h ASP 461 Ca 0.34 -0.12 -0.05 0.00 0.42 0.00 0.00 57.03 57.63 1l7x h ASP 461 Cb -0.02 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 40.95 1l7x h ASP 461 CO -0.10 0.31 -0.06 0.40 -2.88 0.00 0.00 179.24 176.92 1l7x h ILE 462 N 0.22 1.19 -0.21 2.25 2.04 -1.05 -0.38 117.51 121.57 1l7x h ILE 462 Ca 0.07 -0.77 -0.19 0.00 1.00 0.00 0.00 64.86 64.97 1l7x h ILE 462 Cb 0.11 1.06 0.01 0.00 -0.74 0.00 0.00 36.82 37.26 1l7x h ILE 462 CO -0.01 0.25 -0.62 0.58 0.00 0.00 0.00 178.15 178.35 1l7x h VAL 463 N 0.37 1.29 0.03 1.67 2.07 -0.44 -1.24 116.25 120.00 1l7x h VAL 463 Ca 0.08 -1.82 -0.13 0.00 0.82 0.00 0.00 66.70 65.65 1l7x h VAL 463 Cb 0.35 1.85 0.01 0.00 -1.52 0.00 0.00 31.29 31.98 1l7x h VAL 463 CO 0.02 0.58 -0.51 0.50 0.02 0.00 0.00 177.57 178.17 1l7x h LYS 464 N 0.52 0.30 0.00 1.57 3.64 -0.53 -1.51 116.57 120.56 1l7x h LYS 464 Ca -0.02 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1l7x h LYS 464 Cb 1.24 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.17 1l7x h LYS 464 CO 0.13 1.07 -1.20 0.25 -2.27 0.00 0.00 179.45 177.44 1l7x n THR 465 N -4.30 0.16 0.01 1.00 -2.24 -0.18 -3.48 114.28 105.25 1l7x n THR 465 Ca -0.11 -0.29 -0.01 0.00 -2.27 0.00 0.00 64.05 61.37 1l7x n THR 465 Cb 0.64 0.20 -0.00 0.00 -2.10 0.00 0.00 70.33 69.07 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 -2.03 0.03 -0.22 -0.78 5.02 -0.90 -4.39 118.16 114.88 1l7x n LYS 466 Ca 0.01 0.01 -0.05 0.00 -2.02 0.00 0.00 58.31 56.26 1l7x n LYS 466 Cb 0.46 -0.27 0.12 0.00 -0.02 0.00 0.00 35.03 35.32 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 -0.06 1.25 -0.03 -0.18 2.07 -1.35 -3.22 116.25 114.73 1l7x h VAL 467 Ca 0.00 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 1l7x h VAL 467 Cb 0.06 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1l7x h VAL 467 CO 0.00 0.33 -0.36 0.49 0.02 0.00 0.00 177.57 178.05 1l7x n PHE 468 N -4.27 0.08 -0.38 1.57 0.99 -0.57 -4.85 117.46 110.04 1l7x n PHE 468 Ca 0.05 -1.39 -0.09 0.00 -0.00 0.00 0.00 57.45 56.02 1l7x n PHE 468 Cb 0.22 -0.25 -0.07 0.00 -1.00 0.00 0.00 39.48 38.38 1l7x n PHE 468 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.76 177.93 1l7x n LYS 469 N -1.18 -0.38 0.07 -1.08 4.81 -1.22 0.02 118.16 119.20 1l7x n LYS 469 Ca 0.19 1.39 0.21 0.00 -0.87 0.00 0.00 58.31 59.23 1l7x n LYS 469 Cb 0.70 -2.05 0.72 0.00 0.02 0.00 0.00 35.03 34.43 1l7x n LYS 469 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1l7x h ASP 470 N 0.00 0.00 0.14 3.14 3.32 -1.88 -1.39 116.42 119.74 1l7x h ASP 470 Ca 0.17 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.86 1l7x h ASP 470 Cb 0.40 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 1l7x h ASP 470 CO -0.87 0.00 -2.02 0.49 -1.72 0.00 0.00 179.24 175.12 1l7x n PHE 471 N -3.65 1.16 0.23 4.55 3.01 0.10 -4.21 117.46 118.66 1l7x n PHE 471 Ca 0.08 0.25 0.12 0.00 1.01 0.00 0.00 57.45 58.91 1l7x n PHE 471 Cb 0.68 -1.15 0.47 0.00 -0.01 0.00 0.00 39.48 39.47 1l7x n PHE 471 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1l7x h SER 472 N 0.06 0.00 -0.11 4.37 4.64 -0.54 -1.56 113.55 120.42 1l7x h SER 472 Ca -0.43 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.77 1l7x h SER 472 Cb 2.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 64.10 1l7x h SER 472 CO 0.08 0.16 -0.31 -0.33 -0.87 0.00 0.00 176.83 175.56 1l7x h GLU 473 N 0.00 0.59 0.16 4.77 5.08 -1.46 -1.25 114.58 122.48 1l7x h GLU 473 Ca -0.00 -0.26 -0.24 0.00 -1.00 0.00 0.00 59.36 57.86 1l7x h GLU 473 Cb 0.74 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 29.99 1l7x h GLU 473 CO 0.02 0.83 -1.11 -0.07 -1.00 0.00 0.00 179.01 177.69 1l7x h LEU 474 N 0.51 0.54 -7.00 1.33 4.07 -1.68 -3.40 115.31 109.67 1l7x h LEU 474 Ca 0.06 -0.93 -0.62 0.00 0.08 0.00 0.00 57.88 56.48 1l7x h LEU 474 Cb 0.79 -0.18 -0.41 0.00 1.08 0.00 0.00 40.66 41.94 1l7x h LEU 474 CO 0.06 1.52 -0.64 -1.61 -1.08 0.00 0.00 178.44 176.69 1l7x s GLU 475 N -2.48 2.15 0.05 1.13 2.02 -0.60 -4.95 118.70 116.02 1l7x s GLU 475 Ca -0.14 -3.06 -0.21 0.00 0.02 0.00 0.00 54.97 51.59 1l7x s GLU 475 Cb 0.02 -3.08 -0.13 0.00 0.10 0.00 0.00 34.13 31.04 1l7x s GLU 475 CO 0.84 -1.28 1.43 -1.35 0.02 0.00 0.00 175.26 174.93 1l7x h PRO 476 N 5.58 0.31 0.00 0.39 0.11 -1.45 -3.10 132.00 133.84 1l7x h PRO 476 Ca 0.14 -0.12 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1l7x h PRO 476 Cb 0.79 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1l7x h PRO 476 CO 0.66 0.60 0.00 -0.25 -0.21 0.00 0.00 178.00 178.79 1l7x n ASP 477 N -4.67 0.00 0.10 -2.05 8.00 -1.26 -2.39 116.55 114.28 1l7x n ASP 477 Ca -0.05 0.11 -0.18 0.00 0.71 0.00 0.00 54.79 55.38 1l7x n ASP 477 Cb 0.27 -0.26 -0.12 0.00 -0.02 0.00 0.00 41.12 40.99 1l7x n ASP 477 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1l7x h LYS 478 N 0.00 0.39 -6.43 -1.24 3.64 -1.81 -3.46 116.57 107.67 1l7x h LYS 478 Ca 0.00 -0.59 -0.54 0.00 -1.27 0.00 0.00 60.65 58.25 1l7x h LYS 478 Cb 0.08 0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 1l7x h LYS 478 CO 0.00 1.26 0.11 -0.06 -2.27 0.00 0.00 179.45 178.48 1l7x s PHE 479 N -2.81 3.86 0.36 1.91 0.40 -1.01 -1.70 117.98 118.99 1l7x s PHE 479 Ca -0.06 1.50 -0.01 0.00 -0.60 0.00 0.00 56.93 57.76 1l7x s PHE 479 Cb 0.07 -2.67 0.00 0.00 0.51 0.00 0.00 43.02 40.93 1l7x s PHE 479 CO 0.90 0.53 0.47 -0.65 0.70 0.00 0.00 175.22 177.17 1l7x s GLN 480 N -1.18 1.96 0.06 0.44 -0.21 0.30 -4.94 119.66 116.08 1l7x s GLN 480 Ca 0.34 -1.82 0.08 0.00 0.02 0.00 0.00 55.36 53.97 1l7x s GLN 480 Cb -0.22 0.44 -0.03 0.00 1.00 0.00 0.00 33.01 34.20 1l7x s GLN 480 CO 0.24 -0.81 -0.21 1.21 -2.12 0.00 0.00 175.29 173.60 1l7x s ASN 481 N -3.27 2.53 -0.42 5.90 2.47 -1.26 -2.48 114.94 118.41 1l7x s ASN 481 Ca 0.32 -0.58 0.04 0.00 0.42 0.00 0.00 52.86 53.06 1l7x s ASN 481 Cb -0.00 -0.19 0.17 0.00 -1.45 0.00 0.00 41.25 39.78 1l7x s ASN 481 CO 0.22 0.13 0.45 -0.54 -3.72 0.00 0.00 177.10 173.64 1l7x s LYS 482 N -1.42 0.84 0.23 0.43 -0.14 -1.10 -4.92 119.74 113.65 1l7x s LYS 482 Ca 0.07 -1.36 -0.32 0.00 -1.36 0.00 0.00 55.97 53.01 1l7x s LYS 482 Cb -0.09 -0.81 -0.13 0.00 -1.68 0.00 0.00 37.83 35.11 1l7x s LYS 482 CO 0.03 -1.30 1.47 2.41 -0.76 0.00 0.00 175.35 177.20 1l7x n THR 483 N 3.43 0.76 -0.62 2.17 -1.04 -1.26 -4.35 114.28 113.37 1l7x n THR 483 Ca 0.19 -0.19 -0.30 0.00 -2.04 0.00 0.00 64.05 61.71 1l7x n THR 483 Cb 0.49 -1.56 0.19 0.00 -1.82 0.00 0.00 70.33 67.63 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 2.42 -0.84 -3.98 8.00 5.03 -0.58 -4.67 115.26 120.65 1l7x n ASN 484 Ca 0.12 0.18 -0.09 0.00 0.87 0.00 0.00 54.58 55.66 1l7x n ASN 484 Cb 0.32 -1.34 -0.05 0.00 -1.02 0.00 0.00 39.78 37.69 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 -2.43 0.53 0.02 7.41 0.00 -1.26 -4.82 107.32 106.77 1l7x s GLY 485 Ca 0.65 -0.87 0.02 0.00 0.00 0.00 0.00 44.72 44.53 1l7x s GLY 485 CO 0.62 -0.61 -0.08 -0.26 0.00 0.00 0.00 173.10 172.77 1l7x s ILE 486 N -4.00 0.58 -0.04 0.90 -4.36 0.40 -4.51 121.20 110.17 1l7x s ILE 486 Ca 0.22 -0.74 -0.30 0.00 -0.26 0.00 0.00 60.65 59.57 1l7x s ILE 486 Cb -0.01 -0.57 -0.04 0.00 1.25 0.00 0.00 42.46 43.09 1l7x s ILE 486 CO 0.09 -0.13 1.20 0.28 0.24 0.00 0.00 174.94 176.62 1l7x s THR 487 N -0.82 4.23 -1.75 8.37 -1.32 -1.26 -1.73 115.64 121.36 1l7x s THR 487 Ca -0.04 1.57 0.18 0.00 -1.21 0.00 0.00 61.69 62.19 1l7x s THR 487 Cb -0.07 -4.01 0.42 0.00 -1.51 0.00 0.00 72.50 67.34 1l7x s THR 487 CO 0.00 0.02 1.50 -0.81 -2.21 0.00 0.00 174.62 173.12 1l7x n PRO 488 N 5.02 0.43 -0.04 7.08 -0.04 -1.26 -1.60 135.00 144.58 1l7x n PRO 488 Ca 0.11 0.05 -0.01 0.00 -0.04 0.00 0.00 63.50 63.61 1l7x n PRO 488 Cb 0.46 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.42 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 0.00 -0.30 0.54 -0.00 -1.91 -2.22 114.38 110.49 1l7x h ARG 489 Ca 0.00 0.00 -0.09 0.00 -0.50 0.00 0.00 59.98 59.39 1l7x h ARG 489 Cb 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.03 1l7x h ARG 489 CO 0.00 0.00 -0.16 -0.09 0.00 0.00 0.00 179.97 179.72 1l7x h ARG 490 N -0.70 0.63 -0.69 0.04 2.43 -1.95 0.66 114.38 114.80 1l7x h ARG 490 Ca 0.00 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1l7x h ARG 490 Cb 0.06 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1l7x h ARG 490 CO 0.00 0.87 0.00 0.91 -1.51 0.00 0.00 179.97 180.24 1l7x n TRP 491 N -4.39 0.63 0.01 2.20 7.02 -0.63 -1.90 117.44 120.39 1l7x n TRP 491 Ca -0.03 -0.23 0.00 0.00 -1.02 0.00 0.00 57.50 56.21 1l7x n TRP 491 Cb 0.38 -0.18 0.00 0.00 -2.42 0.00 0.00 31.31 29.10 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 0.24 -0.21 -0.24 -0.99 7.94 -1.18 -4.78 117.00 117.78 1l7x n LEU 492 Ca 0.10 0.05 -0.02 0.00 -1.11 0.00 0.00 56.01 55.03 1l7x n LEU 492 Cb 0.48 0.50 0.10 0.00 0.53 0.00 0.00 43.42 45.04 1l7x n LEU 492 CO 0.10 -0.47 1.10 -0.07 -1.11 0.00 0.00 177.39 176.95 1l7x h LEU 493 N 0.00 0.60 0.00 -1.96 4.07 -0.71 0.25 115.31 117.55 1l7x h LEU 493 Ca 0.00 0.02 -0.01 0.00 0.08 0.00 0.00 57.88 57.98 1l7x h LEU 493 Cb 0.00 -0.10 -0.00 0.00 1.08 0.00 0.00 40.66 41.64 1l7x h LEU 493 CO 0.00 0.39 -0.05 0.25 -1.08 0.00 0.00 178.44 177.95 1l7x h LEU 494 N 0.73 0.00 -0.20 1.67 6.46 0.20 -3.30 115.31 120.87 1l7x h LEU 494 Ca 0.30 -0.87 -0.12 0.00 -0.12 0.00 0.00 57.88 57.07 1l7x h LEU 494 Cb 0.16 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.07 1l7x h LEU 494 CO -0.17 0.96 -0.58 0.00 -0.62 0.00 0.00 178.44 178.03 1l7x n ASN 496 N -3.32 0.93 -0.24 0.00 2.85 0.87 -4.82 115.26 111.53 1l7x n ASN 496 Ca 0.01 -2.89 0.11 0.00 -0.11 0.00 0.00 54.58 51.70 1l7x n ASN 496 Cb 0.73 -0.64 0.39 0.00 1.24 0.00 0.00 39.78 41.50 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 3.78 0.65 -0.84 1.20 0.13 -1.64 -1.90 132.00 133.38 1l7x h PRO 497 Ca 0.09 -0.04 0.04 0.00 -0.87 0.00 0.00 66.00 65.22 1l7x h PRO 497 Cb 0.86 -0.15 -0.05 0.00 0.13 0.00 0.00 31.00 31.79 1l7x h PRO 497 CO 0.53 0.43 0.53 0.78 -0.23 0.00 0.00 178.00 180.04 1l7x h GLY 498 N 0.67 1.22 1.46 1.56 0.00 -1.91 0.33 103.07 106.40 1l7x h GLY 498 Ca 0.42 -0.40 -0.21 0.00 0.00 0.00 0.00 47.33 47.13 1l7x h GLY 498 CO -0.18 0.33 -0.84 -2.00 0.00 0.00 0.00 176.54 173.85 1l7x h LEU 499 N 1.02 0.63 -0.67 3.11 5.85 -1.72 -1.88 115.31 121.65 1l7x h LEU 499 Ca 0.34 -0.45 -0.10 0.00 0.84 0.00 0.00 57.88 58.51 1l7x h LEU 499 Cb 0.04 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1l7x h LEU 499 CO -0.13 1.23 -0.01 0.00 -0.34 0.00 0.00 178.44 179.19 1l7x h ALA 500 N 0.75 0.88 -0.33 1.25 0.00 -1.06 -0.83 119.26 119.92 1l7x h ALA 500 Ca -0.06 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.44 1l7x h ALA 500 Cb 1.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1l7x h ALA 500 CO 0.15 0.66 -0.19 1.49 0.00 0.00 0.00 179.25 181.36 1l7x h GLU 501 N 0.93 0.70 0.08 0.00 4.81 -0.92 0.12 114.58 120.30 1l7x h GLU 501 Ca 0.17 -0.32 -0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1l7x h GLU 501 Cb 0.56 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1l7x h GLU 501 CO 0.03 0.92 -0.04 1.25 -0.73 0.00 0.00 179.01 180.45 1l7x h LEU 502 N 0.47 -0.09 0.02 1.64 5.85 -1.19 0.53 115.31 122.54 1l7x h LEU 502 Ca 0.07 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.79 1l7x h LEU 502 Cb 0.73 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 1l7x h LEU 502 CO 0.05 -0.05 -0.07 0.40 -0.34 0.00 0.00 178.44 178.44 1l7x h ILE 503 N -0.12 0.83 -1.00 4.05 2.04 -1.11 -2.72 117.51 119.47 1l7x h ILE 503 Ca -0.01 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.97 1l7x h ILE 503 Cb 0.10 0.83 -0.08 0.00 -0.74 0.00 0.00 36.82 36.92 1l7x h ILE 503 CO 0.02 0.00 0.63 0.00 0.00 0.00 0.00 178.15 178.80 1l7x h ALA 504 N 0.84 1.52 0.00 1.87 0.00 -0.50 -0.51 119.26 122.47 1l7x h ALA 504 Ca 0.02 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1l7x h ALA 504 Cb 0.16 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1l7x h ALA 504 CO -0.06 0.24 -0.04 1.49 0.00 0.00 0.00 179.25 180.88 1l7x h GLU 505 N 1.01 0.00 0.06 0.00 4.81 -0.58 0.92 114.58 120.80 1l7x h GLU 505 Ca 0.49 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 59.35 1l7x h GLU 505 Cb 0.47 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.80 1l7x h GLU 505 CO -0.25 0.04 -2.22 1.63 -0.73 0.00 0.00 179.01 177.48 1l7x n LYS 506 N -3.21 0.71 -0.02 1.92 4.76 -0.31 -4.69 118.16 117.32 1l7x n LYS 506 Ca -0.01 0.21 0.01 0.00 -2.87 0.00 0.00 58.31 55.65 1l7x n LYS 506 Cb 0.26 -1.62 0.01 0.00 -1.84 0.00 0.00 35.03 31.83 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 -3.35 0.78 0.00 -0.18 -5.35 -0.56 -5.11 119.36 105.59 1l7x n ILE 507 Ca -0.38 -0.81 0.00 0.00 -0.27 0.00 0.00 62.75 61.29 1l7x n ILE 507 Cb 1.03 0.57 0.00 0.00 -1.74 0.00 0.00 39.64 39.50 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 -0.43 -0.72 0.82 3.28 0.00 0.32 -4.56 105.19 103.90 1l7x n GLY 508 Ca 0.01 -1.71 0.10 0.00 0.00 0.00 0.00 46.02 44.42 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 -0.77 2.06 -0.32 1.61 1.02 -1.26 -4.23 120.64 118.75 1l7x n GLU 509 Ca 0.00 -1.62 0.10 0.00 -0.02 0.00 0.00 57.16 55.62 1l7x n GLU 509 Cb 0.00 -1.41 0.32 0.00 -0.02 0.00 0.00 31.44 30.32 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 2.97 0.78 -0.11 1.62 3.32 -1.96 -2.72 116.42 120.33 1l7x h ASP 510 Ca 0.00 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.13 1l7x h ASP 510 Cb 0.66 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 1l7x h ASP 510 CO 0.00 0.39 0.14 0.10 -1.72 0.00 0.00 179.24 178.14 1l7x h TYR 511 N 0.82 0.00 -0.71 4.55 -0.00 -1.76 -2.92 116.97 116.96 1l7x h TYR 511 Ca 0.49 0.00 0.04 0.00 -0.00 0.00 0.00 58.73 59.26 1l7x h TYR 511 Cb 0.66 0.00 -0.04 0.00 -0.00 0.00 0.00 36.73 37.35 1l7x h TYR 511 CO -0.00 0.00 0.47 0.28 -0.00 0.00 0.00 178.16 178.90 1l7x h VAL 512 N 0.00 1.08 0.00 -0.90 2.07 -1.83 -2.28 116.25 114.39 1l7x h VAL 512 Ca 0.05 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1l7x h VAL 512 Cb 0.32 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1l7x h VAL 512 CO -0.00 0.15 -1.74 0.29 0.02 0.00 0.00 177.57 176.29 1l7x n LYS 513 N -4.46 0.54 -3.52 1.57 5.02 -1.12 -4.69 118.16 111.50 1l7x n LYS 513 Ca 0.09 -0.14 -0.28 0.00 -2.02 0.00 0.00 58.31 55.96 1l7x n LYS 513 Cb 0.15 -1.54 -0.12 0.00 -0.02 0.00 0.00 35.03 33.51 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 -4.31 2.71 0.48 4.39 3.68 -1.03 -5.00 116.67 117.59 1l7x s ASP 514 Ca -0.05 -2.68 0.32 0.00 2.13 0.00 0.00 52.55 52.28 1l7x s ASP 514 Cb 0.14 -0.62 1.67 0.00 -1.45 0.00 0.00 42.92 42.66 1l7x s ASP 514 CO 0.89 -0.24 1.99 0.25 0.13 0.00 0.00 175.17 178.19 1l7x h LEU 515 N 6.40 0.00 0.00 -1.34 5.85 -1.68 -1.98 115.31 122.55 1l7x h LEU 515 Ca 0.12 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1l7x h LEU 515 Cb 0.93 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.96 1l7x h LEU 515 CO 0.37 0.00 0.00 -1.54 -0.34 0.00 0.00 178.44 176.93 1l7x n SER 516 N -2.68 0.00 0.12 1.25 3.41 -1.26 -1.65 113.62 112.81 1l7x n SER 516 Ca -0.01 0.17 0.12 0.00 -0.26 0.00 0.00 58.87 58.89 1l7x n SER 516 Cb 0.10 -0.32 0.46 0.00 -0.26 0.00 0.00 64.21 64.20 1l7x n SER 516 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1l7x n GLN 517 N -1.32 0.21 0.12 4.33 1.13 -0.74 -2.98 117.38 118.13 1l7x n GLN 517 Ca 0.05 0.34 0.10 0.00 -1.94 0.00 0.00 57.00 55.56 1l7x n GLN 517 Cb 0.10 -1.84 0.47 0.00 0.11 0.00 0.00 30.24 29.08 1l7x n GLN 517 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1l7x n LEU 518 N -2.23 0.51 0.25 1.08 4.77 -0.66 -2.13 117.00 118.59 1l7x n LEU 518 Ca 0.03 0.68 0.11 0.00 -0.03 0.00 0.00 56.01 56.80 1l7x n LEU 518 Cb 0.30 -0.67 0.66 0.00 -2.33 0.00 0.00 43.42 41.37 1l7x n LEU 518 CO 0.23 -0.70 0.93 0.71 -1.33 0.00 0.00 177.39 177.24 1l7x h THR 519 N 0.00 0.65 -0.00 -5.08 1.35 -1.50 -0.56 112.91 107.76 1l7x h THR 519 Ca 0.00 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 1l7x h THR 519 Cb 0.16 1.41 -0.00 0.00 -1.73 0.00 0.00 68.15 68.00 1l7x h THR 519 CO 0.00 0.15 0.01 0.11 -0.25 0.00 0.00 175.52 175.54 1l7x h LYS 520 N 0.00 0.00 -0.04 4.72 1.57 -1.70 -1.24 116.57 119.87 1l7x h LYS 520 Ca -0.00 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1l7x h LYS 520 Cb 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 1l7x h LYS 520 CO 0.02 0.00 0.10 -0.07 -0.57 0.00 0.00 179.45 178.93 1l7x h LEU 521 N 0.00 0.00 -2.32 2.94 3.38 -1.30 -0.93 115.31 117.08 1l7x h LEU 521 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1l7x h LEU 521 Cb 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1l7x h LEU 521 CO -0.00 0.00 -0.04 0.45 0.09 0.00 0.00 178.44 178.94 1l7x h HIS 522 N 0.00 0.00 0.00 1.13 3.86 -1.43 -1.97 115.15 116.75 1l7x h HIS 522 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1l7x h HIS 522 Cb 0.22 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.69 1l7x h HIS 522 CO 0.00 0.04 0.00 0.77 0.86 0.00 0.00 177.93 179.60 1l7x h SER 523 N 0.00 0.00 -0.33 2.45 0.02 -1.38 -2.74 113.55 111.57 1l7x h SER 523 Ca -0.00 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1l7x h SER 523 Cb 0.18 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 1l7x h SER 523 CO 0.01 0.00 0.01 0.49 -1.14 0.00 0.00 176.83 176.20 1l7x n PHE 524 N -3.04 1.12 0.26 3.45 3.01 -0.74 -4.71 117.46 116.81 1l7x n PHE 524 Ca -0.03 -1.15 0.10 0.00 1.01 0.00 0.00 57.45 57.38 1l7x n PHE 524 Cb 0.09 -0.41 0.69 0.00 -0.01 0.00 0.00 39.48 39.84 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 1.55 0.00 -2.62 4.37 3.38 -1.64 -2.04 115.31 118.31 1l7x h LEU 525 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1l7x h LEU 525 Cb 1.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.35 1l7x h LEU 525 CO 0.32 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.52 1l7x n GLY 526 N -1.29 2.25 3.54 0.83 0.00 -1.26 -4.87 105.19 104.38 1l7x n GLY 526 Ca -0.03 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 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 -1.11 6.37 0.26 1.61 3.68 -0.77 -4.89 116.67 121.82 1l7x s ASP 527 Ca 0.38 -1.13 -0.02 0.00 2.13 0.00 0.00 52.55 53.91 1l7x s ASP 527 Cb 0.20 -2.54 0.51 0.00 -1.45 0.00 0.00 42.92 39.65 1l7x s ASP 527 CO 0.27 -1.57 1.77 0.44 0.13 0.00 0.00 175.17 176.21 1l7x h ASP 528 N 9.76 0.54 -0.23 -0.34 5.19 -1.89 -2.00 116.42 127.45 1l7x h ASP 528 Ca -0.01 0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 56.46 1l7x h ASP 528 Cb 1.03 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.53 1l7x h ASP 528 CO 1.32 0.24 0.06 0.58 -3.12 0.00 0.00 179.24 178.32 1l7x h VAL 529 N 0.64 1.21 0.00 -1.35 2.07 -1.97 -1.18 116.25 115.67 1l7x h VAL 529 Ca 0.45 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 1l7x h VAL 529 Cb 0.61 1.22 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1l7x h VAL 529 CO -0.35 0.21 -0.04 0.15 0.02 0.00 0.00 177.57 177.56 1l7x h PHE 530 N 0.19 0.00 0.01 1.57 3.57 -1.83 0.32 116.94 120.76 1l7x h PHE 530 Ca 0.07 0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.37 1l7x h PHE 530 Cb 0.27 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 1l7x h PHE 530 CO 0.01 0.04 -0.89 -0.07 -2.23 0.00 0.00 178.31 175.17 1l7x h LEU 531 N 0.00 0.26 -0.44 0.59 3.38 -0.91 -0.78 115.31 117.41 1l7x h LEU 531 Ca -0.00 -0.21 -0.18 0.00 0.09 0.00 0.00 57.88 57.58 1l7x h LEU 531 Cb 0.08 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1l7x h LEU 531 CO 0.01 1.02 -0.75 0.03 0.09 0.00 0.00 178.44 178.84 1l7x h ARG 532 N 0.11 0.26 -0.07 1.13 3.08 0.05 -2.23 114.38 116.70 1l7x h ARG 532 Ca -0.05 -0.23 -0.15 0.00 0.07 0.00 0.00 59.98 59.63 1l7x h ARG 532 Cb 1.52 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.61 1l7x h ARG 532 CO 0.14 0.89 -0.60 0.93 -1.07 0.00 0.00 179.97 180.25 1l7x h GLU 533 N 0.17 0.24 -0.27 0.04 5.08 -0.93 -0.88 114.58 118.03 1l7x h GLU 533 Ca -0.03 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 58.11 1l7x h GLU 533 Cb 1.32 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 1l7x h GLU 533 CO 0.12 0.77 -0.06 1.25 -1.00 0.00 0.00 179.01 180.09 1l7x h LEU 534 N 0.18 0.53 -0.67 1.33 5.85 -1.04 -2.59 115.31 118.91 1l7x h LEU 534 Ca -0.01 -0.36 -0.05 0.00 0.84 0.00 0.00 57.88 58.30 1l7x h LEU 534 Cb 1.11 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.97 1l7x h LEU 534 CO 0.09 0.76 0.20 0.00 -0.34 0.00 0.00 178.44 179.16 1l7x h ALA 535 N 0.78 0.87 -0.70 1.25 0.00 -1.27 -2.83 119.26 117.36 1l7x h ALA 535 Ca 0.07 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.80 1l7x h ALA 535 Cb 0.53 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 1l7x h ALA 535 CO 0.03 0.55 0.43 -0.22 0.00 0.00 0.00 179.25 180.04 1l7x h LYS 536 N 0.97 0.81 -0.17 0.00 3.64 -1.05 -0.50 116.57 120.26 1l7x h LYS 536 Ca 0.21 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1l7x h LYS 536 Cb 0.30 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 31.90 1l7x h LYS 536 CO -0.01 0.53 -0.07 0.28 -2.27 0.00 0.00 179.45 177.92 1l7x h VAL 537 N 0.83 0.76 -0.54 2.00 2.07 -1.24 0.17 116.25 120.30 1l7x h VAL 537 Ca 0.29 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.81 1l7x h VAL 537 Cb 0.06 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1l7x h VAL 537 CO -0.12 0.00 0.36 0.50 0.02 0.00 0.00 177.57 178.32 1l7x h LYS 538 N -0.05 0.72 -0.72 1.57 1.63 -1.20 -1.79 116.57 116.73 1l7x h LYS 538 Ca 0.09 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.81 1l7x h LYS 538 Cb 0.19 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 31.62 1l7x h LYS 538 CO -0.20 0.48 0.32 0.37 -3.45 0.00 0.00 179.45 176.96 1l7x h GLN 539 N 0.74 1.05 -0.57 1.90 5.75 -0.66 0.06 115.11 123.38 1l7x h GLN 539 Ca 0.20 -0.16 -0.06 0.00 -0.15 0.00 0.00 58.65 58.48 1l7x h GLN 539 Cb -0.08 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.26 1l7x h GLN 539 CO -0.04 0.83 0.11 0.93 -2.65 0.00 0.00 178.83 178.00 1l7x h GLU 540 N 1.03 0.93 -0.38 1.69 5.08 -0.63 0.17 114.58 122.48 1l7x h GLU 540 Ca 0.25 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1l7x h GLU 540 Cb 0.15 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1l7x h GLU 540 CO -0.03 0.88 0.12 -0.91 -1.00 0.00 0.00 179.01 178.07 1l7x h ASN 541 N 0.82 0.49 0.44 1.42 2.35 -0.68 -0.73 115.58 119.69 1l7x h ASN 541 Ca 0.17 -0.06 -0.20 0.00 -0.55 0.00 0.00 56.30 55.66 1l7x h ASN 541 Cb 0.39 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 1l7x h ASN 541 CO 0.01 0.47 -0.87 0.11 -1.65 0.00 0.00 177.43 175.50 1l7x h LYS 542 N 0.53 0.31 -0.25 0.81 1.57 -0.26 -1.38 116.57 117.90 1l7x h LYS 542 Ca 0.13 -0.31 -0.15 0.00 -1.87 0.00 0.00 60.65 58.45 1l7x h LYS 542 Cb 0.16 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 1l7x h LYS 542 CO -0.01 1.00 -0.43 1.25 -0.57 0.00 0.00 179.45 180.70 1l7x h LEU 543 N 0.18 0.81 0.01 2.94 5.85 -0.24 -0.71 115.31 124.14 1l7x h LEU 543 Ca -0.05 -0.53 -0.00 0.00 0.84 0.00 0.00 57.88 58.14 1l7x h LEU 543 Cb 1.49 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1l7x h LEU 543 CO 0.14 1.18 -0.00 0.50 -0.34 0.00 0.00 178.44 179.92 1l7x h LYS 544 N 0.46 -0.01 0.00 1.25 3.64 -1.16 -2.48 116.57 118.26 1l7x h LYS 544 Ca 0.02 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1l7x h LYS 544 Cb 1.02 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1l7x h LYS 544 CO 0.10 0.31 -0.06 0.35 -2.27 0.00 0.00 179.45 177.87 1l7x h PHE 545 N -0.33 0.00 -0.60 1.91 3.57 -1.27 -1.10 116.94 119.12 1l7x h PHE 545 Ca -0.00 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.40 1l7x h PHE 545 Cb 0.32 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1l7x h PHE 545 CO 0.03 0.06 0.00 0.77 -2.23 0.00 0.00 178.31 176.95 1l7x h SER 546 N 0.00 1.04 -0.31 0.41 0.02 -0.86 -1.70 113.55 112.15 1l7x h SER 546 Ca -0.00 -0.31 -0.02 0.00 -0.84 0.00 0.00 61.79 60.62 1l7x h SER 546 Cb 0.13 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 1l7x h SER 546 CO 0.01 1.09 0.14 1.56 -1.14 0.00 0.00 176.83 178.49 1l7x h GLN 547 N 0.96 0.51 -0.35 3.45 4.20 -0.76 -0.83 115.11 122.29 1l7x h GLN 547 Ca 0.17 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.70 1l7x h GLN 547 Cb 0.56 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 1l7x h GLN 547 CO 0.03 0.43 -0.28 0.35 -0.67 0.00 0.00 178.83 178.69 1l7x h PHE 548 N 0.51 0.85 -0.14 2.96 3.57 -1.10 -2.38 116.94 121.22 1l7x h PHE 548 Ca 0.13 -0.21 -0.21 0.00 3.53 0.00 0.00 57.97 61.21 1l7x h PHE 548 Cb 0.11 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.66 1l7x h PHE 548 CO 0.00 0.93 -0.74 -0.07 -2.23 0.00 0.00 178.31 176.20 1l7x h LEU 549 N 0.63 0.78 -0.50 0.59 3.38 -0.37 -0.92 115.31 118.90 1l7x h LEU 549 Ca 0.08 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1l7x h LEU 549 Cb 0.79 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1l7x h LEU 549 CO 0.07 1.28 0.00 -0.33 0.09 0.00 0.00 178.44 179.54 1l7x h GLU 550 N 0.45 0.00 0.16 1.13 5.08 -1.22 0.15 114.58 120.33 1l7x h GLU 550 Ca -0.04 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.98 1l7x h GLU 550 Cb 1.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1l7x h GLU 550 CO 0.15 0.00 -1.70 1.15 -1.00 0.00 0.00 179.01 177.60 1l7x h THR 551 N 0.00 0.98 0.06 1.13 2.02 -1.31 -3.38 112.91 112.41 1l7x h THR 551 Ca 0.00 -2.60 -0.30 0.00 0.77 0.00 0.00 66.41 64.28 1l7x h THR 551 Cb 0.77 2.73 -0.03 0.00 -1.74 0.00 0.00 68.15 69.89 1l7x h THR 551 CO 0.00 0.84 -1.65 -0.33 0.37 0.00 0.00 175.52 174.74 1l7x h GLU 552 N 0.09 0.13 -6.31 6.66 4.39 -1.15 -3.47 114.58 114.91 1l7x h GLU 552 Ca -0.32 -0.22 -0.59 0.00 0.34 0.00 0.00 59.36 58.58 1l7x h GLU 552 Cb 2.07 0.08 -0.19 0.00 -0.10 0.00 0.00 28.75 30.61 1l7x h GLU 552 CO 0.16 0.86 -0.81 0.71 -1.16 0.00 0.00 179.01 178.78 1l7x s TYR 553 N -2.61 2.03 0.08 4.33 1.51 0.53 -5.06 117.35 118.17 1l7x s TYR 553 Ca -0.09 -0.41 -0.35 0.00 -1.01 0.00 0.00 57.07 55.21 1l7x s TYR 553 Cb 0.08 -1.03 -0.17 0.00 -0.11 0.00 0.00 41.96 40.72 1l7x s TYR 553 CO 0.82 0.37 1.58 -0.22 -1.11 0.00 0.00 175.55 177.00 1l7x h LYS 554 N 3.42 -0.97 -0.06 -0.62 1.63 -1.81 -3.36 116.57 114.80 1l7x h LYS 554 Ca -0.45 0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 59.41 1l7x h LYS 554 Cb 1.20 0.22 0.00 0.00 -0.60 0.00 0.00 32.23 33.05 1l7x h LYS 554 CO 0.47 -0.65 -0.01 0.28 -3.45 0.00 0.00 179.45 176.10 1l7x n VAL 555 N -5.56 0.02 -3.59 2.00 0.31 -1.26 -4.87 118.33 105.38 1l7x n VAL 555 Ca -0.13 -0.01 -0.36 0.00 -0.01 0.00 0.00 64.34 63.84 1l7x n VAL 555 Cb 0.45 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.30 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 -0.01 4.19 -0.19 5.55 2.36 -1.26 -4.47 119.74 125.91 1l7x s LYS 556 Ca 0.01 -0.05 -0.10 0.00 -2.55 0.00 0.00 55.97 53.28 1l7x s LYS 556 Cb -0.01 -3.47 -0.05 0.00 -1.05 0.00 0.00 37.83 33.26 1l7x s LYS 556 CO 0.01 0.17 0.15 0.42 1.55 0.00 0.00 175.35 177.64 1l7x s ILE 557 N 0.70 5.41 -0.65 5.43 -1.09 -1.26 -4.98 121.20 124.76 1l7x s ILE 557 Ca 0.13 0.23 -0.26 0.00 -2.23 0.00 0.00 60.65 58.52 1l7x s ILE 557 Cb -0.13 -3.48 0.04 0.00 -1.58 0.00 0.00 42.46 37.31 1l7x s ILE 557 CO 0.03 0.45 1.13 0.21 -1.23 0.00 0.00 174.94 175.53 1l7x s ASN 558 N 0.27 6.27 0.14 3.58 3.84 -1.26 -4.87 114.94 122.91 1l7x s ASN 558 Ca 0.09 -0.39 0.13 0.00 0.21 0.00 0.00 52.86 52.91 1l7x s ASN 558 Cb -0.11 -2.51 0.64 0.00 -0.55 0.00 0.00 41.25 38.72 1l7x s ASN 558 CO -0.01 -1.55 1.41 -0.81 -2.79 0.00 0.00 177.10 173.35 1l7x n PRO 559 N 8.45 0.08 0.01 0.43 -0.04 -1.26 -1.78 135.00 140.89 1l7x n PRO 559 Ca 0.03 0.48 0.11 0.00 -0.04 0.00 0.00 63.50 64.08 1l7x n PRO 559 Cb 0.48 -1.70 -0.09 0.00 -0.04 0.00 0.00 33.50 32.14 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 -1.86 0.47 -4.54 3.54 3.41 -1.26 -4.89 113.62 108.49 1l7x n SER 560 Ca 0.01 -0.29 -0.28 0.00 -0.26 0.00 0.00 58.87 58.04 1l7x n SER 560 Cb 0.08 1.33 0.23 0.00 -0.26 0.00 0.00 64.21 65.59 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 -4.03 1.37 -0.13 4.04 1.04 -0.73 -4.97 113.70 110.29 1l7x s SER 561 Ca -0.00 1.45 -0.23 0.00 0.48 0.00 0.00 55.95 57.65 1l7x s SER 561 Cb 0.14 -2.20 -0.03 0.00 0.10 0.00 0.00 66.02 64.03 1l7x s SER 561 CO 0.86 -3.95 0.70 -0.32 0.98 0.00 0.00 173.24 171.51 1l7x s MET 562 N -4.58 4.34 -0.84 4.02 1.75 -0.00 -4.81 119.30 119.17 1l7x s MET 562 Ca 0.68 0.81 -0.23 0.00 -1.25 0.00 0.00 55.69 55.70 1l7x s MET 562 Cb -0.23 -3.51 0.07 0.00 2.84 0.00 0.00 34.83 33.99 1l7x s MET 562 CO 0.63 -0.10 1.22 -0.06 -0.65 0.00 0.00 175.02 176.06 1l7x s PHE 563 N 1.40 2.62 -0.53 4.11 0.40 -1.26 -0.60 117.98 124.13 1l7x s PHE 563 Ca 0.34 -0.68 -0.23 0.00 -0.60 0.00 0.00 56.93 55.76 1l7x s PHE 563 Cb -0.17 -4.50 0.04 0.00 0.51 0.00 0.00 43.02 38.91 1l7x s PHE 563 CO 0.14 -1.81 0.87 0.34 0.70 0.00 0.00 175.22 175.46 1l7x s ASP 564 N 4.07 6.34 -0.07 1.36 -1.08 -0.75 -1.49 116.67 125.05 1l7x s ASP 564 Ca 0.35 -0.39 0.05 0.00 -0.52 0.00 0.00 52.55 52.04 1l7x s ASP 564 Cb -0.07 -2.41 -0.00 0.00 -1.46 0.00 0.00 42.92 38.98 1l7x s ASP 564 CO 0.01 -1.13 -0.23 -0.69 0.52 0.00 0.00 175.17 173.66 1l7x s VAL 565 N 3.65 1.89 -0.31 1.11 1.01 0.70 -0.07 120.40 128.37 1l7x s VAL 565 Ca 0.28 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 1l7x s VAL 565 Cb -0.13 -1.62 0.10 0.00 0.00 0.00 0.00 36.38 34.73 1l7x s VAL 565 CO 0.19 0.53 0.12 -1.58 0.00 0.00 0.00 175.10 174.36 1l7x s GLN 566 N 0.08 0.47 -0.13 2.72 0.74 -0.35 -0.98 119.66 122.22 1l7x s GLN 566 Ca -0.09 -0.86 0.00 0.00 0.05 0.00 0.00 55.36 54.47 1l7x s GLN 566 Cb -0.15 -1.58 0.02 0.00 1.10 0.00 0.00 33.01 32.41 1l7x s GLN 566 CO 0.05 -1.02 -0.11 0.14 -0.55 0.00 0.00 175.29 173.80 1l7x s VAL 567 N 1.78 1.30 -0.07 1.34 -7.23 -1.26 -1.86 120.40 114.41 1l7x s VAL 567 Ca 0.10 -0.47 -0.32 0.00 -1.81 0.00 0.00 61.98 59.48 1l7x s VAL 567 Cb -0.17 -1.26 0.13 0.00 0.56 0.00 0.00 36.38 35.65 1l7x s VAL 567 CO -0.29 0.41 1.39 -1.59 -0.31 0.00 0.00 175.10 174.71 1l7x s LYS 568 N 1.52 0.14 0.39 4.82 -2.85 -0.63 -4.98 119.74 118.14 1l7x s LYS 568 Ca 0.03 -0.08 -0.28 0.00 -1.00 0.00 0.00 55.97 54.65 1l7x s LYS 568 Cb -0.13 0.05 -0.11 0.00 -2.06 0.00 0.00 37.83 35.58 1l7x s LYS 568 CO -0.08 -0.06 1.49 1.03 0.10 0.00 0.00 175.35 177.83 1l7x s ARG 569 N -2.12 4.06 -0.05 1.78 1.81 -1.26 -3.89 118.95 119.26 1l7x s ARG 569 Ca 0.17 2.59 -0.30 0.00 -1.72 0.00 0.00 55.73 56.47 1l7x s ARG 569 Cb 0.06 -2.94 -0.04 0.00 -0.45 0.00 0.00 34.95 31.58 1l7x s ARG 569 CO -0.05 -0.58 1.42 0.42 -0.68 0.00 0.00 175.30 175.83 1l7x s ILE 570 N -1.13 3.83 0.04 1.52 -1.09 -0.72 -4.93 121.20 118.73 1l7x s ILE 570 Ca 0.54 1.12 -0.10 0.00 -2.23 0.00 0.00 60.65 59.98 1l7x s ILE 570 Cb -0.47 -3.72 0.01 0.00 -1.58 0.00 0.00 42.46 36.70 1l7x s ILE 570 CO 0.63 -0.05 0.20 -1.00 -1.23 0.00 0.00 174.94 173.50 1l7x s HIS 571 N 3.03 0.04 0.13 3.97 3.76 -1.26 -4.70 115.29 120.27 1l7x s HIS 571 Ca 0.64 -0.24 -0.05 0.00 -0.15 0.00 0.00 55.06 55.26 1l7x s HIS 571 Cb -0.29 -0.02 -0.07 0.00 1.11 0.00 0.00 32.58 33.30 1l7x s HIS 571 CO 0.24 -0.43 1.33 0.93 -0.85 0.00 0.00 174.74 175.96 1l7x h GLU 572 N 3.49 0.45 0.00 1.40 5.08 -1.95 -3.01 114.58 120.03 1l7x h GLU 572 Ca -0.32 -0.44 -0.09 0.00 -1.00 0.00 0.00 59.36 57.51 1l7x h GLU 572 Cb 1.19 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.55 1l7x h GLU 572 CO 0.48 1.10 -0.41 0.10 -1.00 0.00 0.00 179.01 179.27 1l7x h TYR 573 N 0.27 0.00 0.00 4.33 -0.00 -1.97 -2.43 116.97 117.17 1l7x h TYR 573 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.66 1l7x h TYR 573 Cb 1.51 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.24 1l7x h TYR 573 CO 0.06 0.41 0.00 0.87 -0.00 0.00 0.00 178.16 179.50 1l7x h LYS 574 N 0.00 0.00 -5.03 0.10 1.57 -1.90 -2.75 116.57 108.56 1l7x h LYS 574 Ca -0.00 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.51 1l7x h LYS 574 Cb 0.79 0.00 0.14 0.00 0.08 0.00 0.00 32.23 33.25 1l7x h LYS 574 CO 0.05 0.00 -0.65 0.54 -0.57 0.00 0.00 179.45 178.83 1l7x n ARG 575 N -2.85 -5.05 0.30 3.15 1.74 -0.92 -3.57 116.66 109.46 1l7x n ARG 575 Ca 0.04 0.71 0.19 0.00 -0.77 0.00 0.00 57.85 58.01 1l7x n ARG 575 Cb 0.45 -5.27 0.87 0.00 -1.02 0.00 0.00 32.46 27.50 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 -1.49 0.00 -0.41 5.56 7.50 -1.85 -2.22 115.11 122.20 1l7x h GLN 576 Ca -0.49 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 58.61 1l7x h GLN 576 Cb 1.28 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.79 1l7x h GLN 576 CO 0.41 0.01 0.05 -0.07 -1.50 0.00 0.00 178.83 177.73 1l7x h LEU 577 N 0.00 0.67 -0.39 1.46 3.38 -1.90 -1.04 115.31 117.49 1l7x h LEU 577 Ca -0.00 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.72 1l7x h LEU 577 Cb 0.33 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1l7x h LEU 577 CO 0.00 0.77 0.20 0.25 0.09 0.00 0.00 178.44 179.76 1l7x h LEU 578 N 0.54 0.30 -0.59 1.67 5.85 -1.78 -0.62 115.31 120.68 1l7x h LEU 578 Ca 0.12 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.90 1l7x h LEU 578 Cb 0.40 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 1l7x h LEU 578 CO 0.01 0.22 0.34 -1.13 -0.34 0.00 0.00 178.44 177.54 1l7x h ASN 579 N 0.41 0.51 -0.75 1.25 -0.73 -1.45 -1.63 115.58 113.18 1l7x h ASN 579 Ca 0.16 0.02 0.02 0.00 1.87 0.00 0.00 56.30 58.37 1l7x h ASN 579 Cb 0.06 -0.08 -0.04 0.00 0.27 0.00 0.00 38.32 38.52 1l7x h ASN 579 CO -0.10 0.35 0.50 0.00 -0.37 0.00 0.00 177.43 177.80 1l7x h LEU 581 N 0.98 0.76 -1.15 0.00 3.38 -0.20 -2.23 115.31 116.85 1l7x h LEU 581 Ca 0.29 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1l7x h LEU 581 Cb -0.04 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1l7x h LEU 581 CO -0.07 0.73 0.22 -0.74 0.09 0.00 0.00 178.44 178.66 1l7x h HIS 582 N 0.75 0.82 -0.08 1.13 2.76 -0.86 -0.01 115.15 119.66 1l7x h HIS 582 Ca 0.18 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 1l7x h HIS 582 Cb 0.20 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 28.91 1l7x h HIS 582 CO 0.01 0.64 0.01 0.28 -1.30 0.00 0.00 177.93 177.57 1l7x h VAL 583 N 0.80 1.21 -0.46 5.26 2.07 -0.99 0.49 116.25 124.63 1l7x h VAL 583 Ca 0.19 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 1l7x h VAL 583 Cb 0.17 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1l7x h VAL 583 CO -0.02 0.18 0.26 0.40 0.02 0.00 0.00 177.57 178.42 1l7x h ILE 584 N -0.11 1.14 0.73 4.57 2.04 -1.21 -0.42 117.51 124.25 1l7x h ILE 584 Ca 0.02 -0.34 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 1l7x h ILE 584 Cb 0.28 0.51 0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1l7x h ILE 584 CO 0.00 0.15 -0.36 0.74 0.00 0.00 0.00 178.15 178.68 1l7x h THR 585 N 0.64 0.27 -0.95 -0.27 2.02 -0.48 -1.61 112.91 112.53 1l7x h THR 585 Ca 0.17 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.47 1l7x h THR 585 Cb 0.00 0.27 -0.08 0.00 -1.74 0.00 0.00 68.15 66.61 1l7x h THR 585 CO -0.03 0.00 0.61 0.24 0.37 0.00 0.00 175.52 176.71 1l7x h MET 586 N -0.99 0.87 -0.46 6.66 2.86 -0.34 -1.81 114.93 121.72 1l7x h MET 586 Ca -0.10 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 1l7x h MET 586 Cb 0.76 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 1l7x h MET 586 CO 0.16 0.57 0.29 -0.92 1.06 0.00 0.00 176.91 178.07 1l7x h TYR 587 N 0.89 0.60 -0.56 -0.22 3.20 -0.76 -2.30 116.97 117.82 1l7x h TYR 587 Ca 0.47 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 62.25 1l7x h TYR 587 Cb 0.53 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 1l7x h TYR 587 CO -0.00 0.40 -0.01 -0.91 -1.64 0.00 0.00 178.16 176.00 1l7x h ASN 588 N 0.62 0.98 -0.55 -2.11 2.35 -0.49 -1.85 115.58 114.52 1l7x h ASN 588 Ca 0.17 -0.31 0.03 0.00 -0.55 0.00 0.00 56.30 55.64 1l7x h ASN 588 Cb -0.03 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.05 1l7x h ASN 588 CO -0.03 1.05 0.37 0.03 -1.65 0.00 0.00 177.43 177.19 1l7x h ARG 589 N 0.88 0.62 -0.19 0.81 3.08 -1.21 0.21 114.38 118.57 1l7x h ARG 589 Ca 0.16 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 60.04 1l7x h ARG 589 Cb 0.56 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1l7x h ARG 589 CO 0.03 0.41 -0.40 0.82 -1.07 0.00 0.00 179.97 179.76 1l7x h ILE 590 N 0.64 1.33 -0.65 2.04 2.04 -1.00 -2.46 117.51 119.44 1l7x h ILE 590 Ca 0.22 -1.63 -0.08 0.00 1.00 0.00 0.00 64.86 64.36 1l7x h ILE 590 Cb 0.09 1.88 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 1l7x h ILE 590 CO -0.06 0.51 0.08 0.11 0.00 0.00 0.00 178.15 178.79 1l7x h LYS 591 N 0.29 1.09 -0.23 2.37 1.79 -0.67 -2.16 116.57 119.06 1l7x h LYS 591 Ca 0.01 -0.31 0.01 0.00 -2.18 0.00 0.00 60.65 58.18 1l7x h LYS 591 Cb 1.00 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.51 1l7x h LYS 591 CO 0.09 1.02 0.12 -0.22 -1.08 0.00 0.00 179.45 179.38 1l7x h LYS 592 N 1.02 0.25 -2.51 3.15 3.64 -0.57 -3.36 116.57 118.18 1l7x h LYS 592 Ca 0.20 -0.01 -0.59 0.00 -1.27 0.00 0.00 60.65 58.97 1l7x h LYS 592 Cb 0.47 -0.06 -0.39 0.00 -0.41 0.00 0.00 32.23 31.85 1l7x h LYS 592 CO 0.02 0.16 -0.90 0.34 -2.27 0.00 0.00 179.45 176.80 1l7x s ASP 593 N -5.36 2.16 0.52 4.20 -1.08 -0.93 -4.99 116.67 111.19 1l7x s ASP 593 Ca -0.13 -2.99 0.22 0.00 -0.52 0.00 0.00 52.55 49.14 1l7x s ASP 593 Cb 0.09 -0.59 1.34 0.00 -1.46 0.00 0.00 42.92 42.30 1l7x s ASP 593 CO 0.69 -0.19 2.03 -0.65 0.52 0.00 0.00 175.17 177.57 1l7x h PRO 594 N 5.89 0.04 -0.06 4.34 0.11 -1.55 -1.04 132.00 139.72 1l7x h PRO 594 Ca 0.21 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1l7x h PRO 594 Cb 0.90 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1l7x h PRO 594 CO 0.40 0.02 0.00 1.63 -0.21 0.00 0.00 178.00 179.84 1l7x n LYS 595 N -4.42 1.53 -2.83 1.05 5.02 -1.26 -4.85 118.16 112.40 1l7x n LYS 595 Ca 0.07 -0.79 -0.42 0.00 -2.02 0.00 0.00 58.31 55.15 1l7x n LYS 595 Cb 0.48 -1.44 -0.04 0.00 -0.02 0.00 0.00 35.03 34.01 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 -1.94 4.17 -0.43 1.97 2.20 -0.40 -4.96 119.74 120.36 1l7x s LYS 596 Ca 0.37 1.01 -0.46 0.00 -0.36 0.00 0.00 55.97 56.53 1l7x s LYS 596 Cb 0.19 -3.66 -0.20 0.00 -1.51 0.00 0.00 37.83 32.66 1l7x s LYS 596 CO 0.31 -0.58 1.54 1.28 -0.36 0.00 0.00 175.35 177.55 1l7x n LEU 597 N 6.13 1.13 -3.86 5.43 7.99 -1.26 -4.95 117.00 127.61 1l7x n LEU 597 Ca 0.07 1.18 -0.26 0.00 -0.01 0.00 0.00 56.01 56.99 1l7x n LEU 597 Cb 0.47 -0.90 -0.17 0.00 -0.11 0.00 0.00 43.42 42.71 1l7x n LEU 597 CO 0.49 -0.95 -0.42 0.12 -1.51 0.00 0.00 177.39 175.12 1l7x s PHE 598 N 2.65 1.25 -0.29 -1.77 5.36 -1.26 -5.09 117.98 118.84 1l7x s PHE 598 Ca 1.03 -0.59 -0.29 0.00 -0.96 0.00 0.00 56.93 56.12 1l7x s PHE 598 Cb -1.45 -1.11 -0.02 0.00 -0.34 0.00 0.00 43.02 40.10 1l7x s PHE 598 CO 0.78 -0.47 1.81 0.08 -1.46 0.00 0.00 175.22 175.96 1l7x s VAL 599 N 1.78 3.46 0.39 3.12 1.01 -1.26 -4.93 120.40 123.97 1l7x s VAL 599 Ca 0.05 0.48 -0.26 0.00 0.00 0.00 0.00 61.98 62.25 1l7x s VAL 599 Cb -0.13 -3.58 -0.11 0.00 0.00 0.00 0.00 36.38 32.56 1l7x s VAL 599 CO -0.07 -0.34 1.22 -0.81 0.00 0.00 0.00 175.10 175.09 1l7x n PRO 600 N 8.29 1.87 -3.97 2.72 -0.04 -1.26 -4.90 135.00 137.71 1l7x n PRO 600 Ca 0.23 0.66 -0.09 0.00 -0.04 0.00 0.00 63.50 64.26 1l7x n PRO 600 Cb 0.46 -2.28 -0.11 0.00 -0.04 0.00 0.00 33.50 31.54 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 -2.03 0.36 -0.34 0.54 0.52 -0.80 -0.82 118.95 116.38 1l7x s ARG 601 Ca 0.59 -0.62 0.04 0.00 -0.52 0.00 0.00 55.73 55.22 1l7x s ARG 601 Cb -0.55 0.13 0.10 0.00 0.52 0.00 0.00 34.95 35.15 1l7x s ARG 601 CO 0.59 -0.06 0.05 0.99 0.02 0.00 0.00 175.30 176.89 1l7x s THR 602 N -1.62 2.25 -0.15 0.02 2.01 0.23 -2.35 115.64 116.03 1l7x s THR 602 Ca -0.14 -2.33 -0.25 0.00 0.31 0.00 0.00 61.69 59.28 1l7x s THR 602 Cb -0.08 -2.67 -0.02 0.00 0.01 0.00 0.00 72.50 69.74 1l7x s THR 602 CO -0.01 -0.60 0.82 -0.69 -0.69 0.00 0.00 174.62 173.45 1l7x s VAL 603 N 0.92 4.90 -0.17 3.82 1.01 0.38 -1.80 120.40 129.46 1l7x s VAL 603 Ca 0.11 1.62 0.01 0.00 0.00 0.00 0.00 61.98 63.72 1l7x s VAL 603 Cb -0.19 -4.13 0.01 0.00 0.00 0.00 0.00 36.38 32.07 1l7x s VAL 603 CO -0.08 0.06 -0.19 -0.63 0.00 0.00 0.00 175.10 174.26 1l7x s ILE 604 N 1.91 2.24 -0.08 2.22 1.01 0.89 -0.72 121.20 128.67 1l7x s ILE 604 Ca 0.39 -0.89 0.01 0.00 0.00 0.00 0.00 60.65 60.16 1l7x s ILE 604 Cb -0.17 -1.94 0.02 0.00 0.01 0.00 0.00 42.46 40.38 1l7x s ILE 604 CO 0.14 0.53 -0.11 -0.63 0.00 0.00 0.00 174.94 174.87 1l7x s ILE 605 N 1.09 1.11 0.09 2.92 1.01 0.12 -1.21 121.20 126.34 1l7x s ILE 605 Ca -0.00 -0.43 -0.11 0.00 0.00 0.00 0.00 60.65 60.11 1l7x s ILE 605 Cb -0.14 -1.05 0.01 0.00 0.01 0.00 0.00 42.46 41.29 1l7x s ILE 605 CO -0.07 0.36 0.26 -0.83 0.00 0.00 0.00 174.94 174.66 1l7x s GLY 606 N 0.99 -0.03 0.00 6.18 0.00 -0.78 -0.49 107.32 113.19 1l7x s GLY 606 Ca -0.08 -0.36 0.00 0.00 0.00 0.00 0.00 44.72 44.28 1l7x s GLY 606 CO -0.00 -0.57 0.00 0.61 0.00 0.00 0.00 173.10 173.14 1l7x n GLY 607 N 0.06 4.02 3.86 0.20 0.00 -1.25 -1.61 105.19 110.47 1l7x n GLY 607 Ca -0.16 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.79 3.89 -0.04 1.61 1.02 -1.26 -4.58 119.74 117.59 1l7x s LYS 608 Ca 0.00 0.42 0.01 0.00 0.02 0.00 0.00 55.97 56.43 1l7x s LYS 608 Cb 0.00 -2.62 -0.03 0.00 -0.52 0.00 0.00 37.83 34.66 1l7x s LYS 608 CO 0.00 0.29 -0.04 0.00 -0.92 0.00 0.00 175.35 174.68 1l7x s ALA 609 N -1.82 3.11 0.31 5.17 0.00 -1.26 -1.75 121.76 125.51 1l7x s ALA 609 Ca 0.48 -0.92 -0.30 0.00 0.00 0.00 0.00 51.96 51.23 1l7x s ALA 609 Cb -0.11 -1.27 -0.12 0.00 0.00 0.00 0.00 23.12 21.61 1l7x s ALA 609 CO 0.20 0.60 1.51 0.00 0.00 0.00 0.00 175.76 178.07 1l7x n ALA 610 N 1.87 2.18 -0.33 0.00 0.00 -1.26 -4.87 120.51 118.10 1l7x n ALA 610 Ca -0.17 0.37 0.16 0.00 0.00 0.00 0.00 53.44 53.80 1l7x n ALA 610 Cb 0.53 -2.41 0.36 0.00 0.00 0.00 0.00 19.45 17.93 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 4.07 0.53 -0.35 0.00 0.11 -1.98 -0.17 132.00 134.20 1l7x h PRO 611 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1l7x h PRO 611 Cb 1.24 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1l7x h PRO 611 CO 0.74 0.35 0.00 0.41 -0.21 0.00 0.00 178.00 179.29 1l7x n GLY 612 N -1.32 1.06 3.47 -0.55 0.00 -1.26 -4.74 105.19 101.84 1l7x n GLY 612 Ca 0.25 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.54 2.99 0.15 1.61 5.04 -0.08 -4.90 117.35 120.63 1l7x s TYR 613 Ca 0.34 -1.23 -0.17 0.00 -2.44 0.00 0.00 57.07 53.57 1l7x s TYR 613 Cb 0.19 -4.35 0.06 0.00 0.35 0.00 0.00 41.96 38.21 1l7x s TYR 613 CO 0.26 -1.57 1.72 1.25 -1.34 0.00 0.00 175.55 175.86 1l7x h HIS 614 N 9.05 0.03 -0.05 4.97 -0.00 -1.85 -2.25 115.15 125.05 1l7x h HIS 614 Ca 0.12 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.46 1l7x h HIS 614 Cb 1.03 0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 28.46 1l7x h HIS 614 CO 1.17 -0.03 -0.23 1.98 -0.00 0.00 0.00 177.93 180.82 1l7x h MET 615 N 0.13 0.09 -0.34 5.26 1.85 -1.97 -1.39 114.93 118.56 1l7x h MET 615 Ca 0.16 -0.02 -0.13 0.00 -0.61 0.00 0.00 59.70 59.10 1l7x h MET 615 Cb 0.21 -0.01 -0.01 0.00 0.43 0.00 0.00 31.60 32.22 1l7x h MET 615 CO -0.25 0.32 -0.30 0.00 -0.40 0.00 0.00 176.91 176.28 1l7x h ALA 616 N 1.69 0.49 -0.58 0.39 0.00 -1.80 -1.61 119.26 117.84 1l7x h ALA 616 Ca 0.01 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 1l7x h ALA 616 Cb 0.46 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1l7x h ALA 616 CO 0.03 0.52 0.17 0.87 0.00 0.00 0.00 179.25 180.84 1l7x h LYS 617 N 0.57 0.91 -0.73 0.00 1.57 -0.98 -2.00 116.57 115.91 1l7x h LYS 617 Ca 0.06 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1l7x h LYS 617 Cb 0.87 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1l7x h LYS 617 CO 0.08 0.83 0.40 0.52 -0.57 0.00 0.00 179.45 180.70 1l7x h MET 618 N 0.82 1.01 -0.59 3.15 2.86 -1.20 -1.81 114.93 119.18 1l7x h MET 618 Ca 0.18 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1l7x h MET 618 Cb 0.31 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 1l7x h MET 618 CO -0.00 0.76 0.35 0.82 1.06 0.00 0.00 176.91 179.89 1l7x h ILE 619 N 1.00 1.17 -0.36 -1.22 2.04 -0.99 -0.66 117.51 118.49 1l7x h ILE 619 Ca 0.26 -0.38 -0.06 0.00 1.00 0.00 0.00 64.86 65.68 1l7x h ILE 619 Cb 0.04 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1l7x h ILE 619 CO -0.04 0.18 -0.01 0.40 0.00 0.00 0.00 178.15 178.68 1l7x h ILE 620 N 0.81 1.26 -0.94 -0.67 2.04 -0.64 -2.11 117.51 117.25 1l7x h ILE 620 Ca 0.21 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 65.08 1l7x h ILE 620 Cb -0.03 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 1l7x h ILE 620 CO -0.04 0.33 0.62 0.50 0.00 0.00 0.00 178.15 179.56 1l7x h LYS 621 N 0.46 1.25 0.29 2.37 1.63 -0.59 -1.23 116.57 120.74 1l7x h LYS 621 Ca 0.10 -0.08 -0.01 0.00 -0.85 0.00 0.00 60.65 59.81 1l7x h LYS 621 Cb 0.47 -0.28 0.00 0.00 -0.60 0.00 0.00 32.23 31.83 1l7x h LYS 621 CO 0.02 0.83 -0.14 1.25 -3.45 0.00 0.00 179.45 177.97 1l7x h LEU 622 N 1.28 -0.32 -0.35 5.20 5.85 -0.94 0.16 115.31 126.18 1l7x h LEU 622 Ca 0.35 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.11 1l7x h LEU 622 Cb -0.14 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.92 1l7x h LEU 622 CO -0.07 -0.20 -0.00 0.40 -0.34 0.00 0.00 178.44 178.22 1l7x h ILE 623 N -0.42 0.74 -0.13 4.05 2.04 -1.06 0.09 117.51 122.83 1l7x h ILE 623 Ca -0.04 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1l7x h ILE 623 Cb 0.32 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1l7x h ILE 623 CO 0.06 0.02 -0.07 0.71 0.00 0.00 0.00 178.15 178.88 1l7x h THR 624 N 0.10 1.13 -0.30 -0.27 1.35 -1.07 -1.23 112.91 112.61 1l7x h THR 624 Ca 0.17 -0.53 -0.15 0.00 -0.55 0.00 0.00 66.41 65.35 1l7x h THR 624 Cb 0.24 1.11 -0.00 0.00 -1.73 0.00 0.00 68.15 67.76 1l7x h THR 624 CO -0.29 0.17 -0.39 0.28 -0.25 0.00 0.00 175.52 175.04 1l7x h SER 625 N 0.18 0.86 -0.07 5.36 0.02 0.36 -2.70 113.55 117.56 1l7x h SER 625 Ca 0.04 -0.50 -0.01 0.00 -0.84 0.00 0.00 61.79 60.49 1l7x h SER 625 Cb 0.24 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 1l7x h SER 625 CO 0.01 1.19 0.02 0.58 -1.14 0.00 0.00 176.83 177.49 1l7x h VAL 626 N 0.55 1.16 -0.64 2.27 2.07 -0.52 -2.83 116.25 118.32 1l7x h VAL 626 Ca 0.04 -0.49 0.09 0.00 0.82 0.00 0.00 66.70 67.15 1l7x h VAL 626 Cb 0.98 1.36 -0.07 0.00 -1.52 0.00 0.00 31.29 32.04 1l7x h VAL 626 CO 0.09 0.14 0.29 0.00 0.02 0.00 0.00 177.57 178.11 1l7x h ALA 627 N 0.84 0.86 -0.83 1.67 0.00 -1.27 0.13 119.26 120.66 1l7x h ALA 627 Ca 0.02 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1l7x h ALA 627 Cb 0.20 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 1l7x h ALA 627 CO -0.00 -0.11 0.50 -0.44 0.00 0.00 0.00 179.25 179.20 1l7x h ASP 628 N 0.51 0.76 -0.09 0.00 5.19 -1.33 0.61 116.42 122.07 1l7x h ASP 628 Ca 0.32 0.03 -0.19 0.00 -0.62 0.00 0.00 57.03 56.56 1l7x h ASP 628 Cb 0.34 -0.13 0.01 0.00 0.18 0.00 0.00 39.33 39.74 1l7x h ASP 628 CO -0.27 0.47 -0.69 0.58 -3.12 0.00 0.00 179.24 176.21 1l7x h VAL 629 N 0.89 1.33 0.09 -1.35 2.07 -1.13 -3.19 116.25 114.96 1l7x h VAL 629 Ca 0.38 -1.97 -0.00 0.00 0.82 0.00 0.00 66.70 65.93 1l7x h VAL 629 Cb 0.25 2.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1l7x h VAL 629 CO -0.20 0.60 -0.04 0.58 0.02 0.00 0.00 177.57 178.53 1l7x h VAL 630 N 0.27 1.14 0.00 2.57 2.07 -0.25 -3.01 116.25 119.04 1l7x h VAL 630 Ca -0.06 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.58 1l7x h VAL 630 Cb 1.34 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.80 1l7x h VAL 630 CO 0.14 0.21 0.00 0.78 0.02 0.00 0.00 177.57 178.72 1l7x h ASN 631 N -0.52 0.00 -0.22 0.57 2.35 0.07 -3.06 115.58 114.76 1l7x h ASN 631 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1l7x h ASN 631 Cb 0.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.81 1l7x h ASN 631 CO 0.02 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.39 1l7x n ASN 632 N -2.61 3.03 -4.54 5.81 3.02 -1.20 -4.95 115.26 113.81 1l7x n ASN 632 Ca 0.00 -2.46 -0.41 0.00 -0.03 0.00 0.00 54.58 51.68 1l7x n ASN 632 Cb 0.20 -0.32 -0.09 0.00 -0.61 0.00 0.00 39.78 38.96 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 -1.53 6.19 0.39 6.41 3.68 -1.14 -4.96 116.67 125.71 1l7x s ASP 633 Ca 0.27 -0.24 0.16 0.00 2.13 0.00 0.00 52.55 54.87 1l7x s ASP 633 Cb 0.19 -2.20 1.02 0.00 -1.45 0.00 0.00 42.92 40.48 1l7x s ASP 633 CO 0.10 -0.36 1.81 -0.65 0.13 0.00 0.00 175.17 176.20 1l7x h PRO 634 N 8.47 0.46 -0.09 4.34 0.11 -1.92 -1.84 132.00 141.53 1l7x h PRO 634 Ca -0.29 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.72 1l7x h PRO 634 Cb 1.14 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1l7x h PRO 634 CO 0.70 0.31 -0.26 1.98 -0.21 0.00 0.00 178.00 180.51 1l7x h MET 635 N 0.48 0.17 0.21 1.05 4.05 -1.97 -3.16 114.93 115.75 1l7x h MET 635 Ca 0.54 -0.05 -0.35 0.00 -0.28 0.00 0.00 59.70 59.56 1l7x h MET 635 Cb 1.24 -0.02 0.02 0.00 -0.80 0.00 0.00 31.60 32.05 1l7x h MET 635 CO -0.26 0.43 -1.64 -0.24 0.23 0.00 0.00 176.91 175.43 1l7x h VAL 636 N 0.15 1.08 0.00 -5.77 3.04 -1.68 -3.48 116.25 109.59 1l7x h VAL 636 Ca 0.02 -2.60 0.00 0.00 -1.01 0.00 0.00 66.70 63.11 1l7x h VAL 636 Cb 0.55 2.88 0.00 0.00 -2.01 0.00 0.00 31.29 32.71 1l7x h VAL 636 CO 0.04 0.84 0.00 0.61 -1.01 0.00 0.00 177.57 178.05 1l7x n GLY 637 N 1.80 2.38 0.00 3.17 0.00 -1.05 -1.71 105.19 109.78 1l7x n GLY 637 Ca -0.21 -0.27 0.02 0.00 0.00 0.00 0.00 46.02 45.56 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 0.35 0.00 0.05 1.61 3.41 -1.26 -3.44 113.62 114.34 1l7x n SER 638 Ca 0.00 -1.29 -0.10 0.00 -0.26 0.00 0.00 58.87 57.22 1l7x n SER 638 Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 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 0.00 0.41 -2.65 4.33 1.57 -1.69 -3.44 116.57 115.10 1l7x h LYS 639 Ca 0.00 -0.34 -0.13 0.00 -1.87 0.00 0.00 60.65 58.31 1l7x h LYS 639 Cb 0.00 0.07 -0.28 0.00 0.08 0.00 0.00 32.23 32.10 1l7x h LYS 639 CO 0.00 0.98 -0.37 -1.17 -0.57 0.00 0.00 179.45 178.32 1l7x s LEU 640 N -7.96 -0.30 0.01 2.94 2.96 -1.22 -1.91 118.68 113.19 1l7x s LEU 640 Ca -0.06 0.86 0.06 0.00 -0.22 0.00 0.00 54.13 54.77 1l7x s LEU 640 Cb 0.10 1.21 -0.02 0.00 0.50 0.00 0.00 46.19 47.98 1l7x s LEU 640 CO 0.84 -0.21 -0.19 -0.54 -1.32 0.00 0.00 176.35 174.93 1l7x s LYS 641 N 2.01 1.43 -0.07 1.98 -0.14 -0.99 -4.55 119.74 119.42 1l7x s LYS 641 Ca -0.05 -0.76 0.03 0.00 -1.36 0.00 0.00 55.97 53.83 1l7x s LYS 641 Cb -0.10 -1.44 0.01 0.00 -1.68 0.00 0.00 37.83 34.61 1l7x s LYS 641 CO -0.12 0.38 -0.17 0.08 -0.76 0.00 0.00 175.35 174.77 1l7x s VAL 642 N -0.58 1.49 -0.07 3.17 1.01 -1.26 -0.47 120.40 123.69 1l7x s VAL 642 Ca 0.07 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1l7x s VAL 642 Cb -0.08 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 35.01 1l7x s VAL 642 CO 0.00 0.43 -0.09 -0.63 0.00 0.00 0.00 175.10 174.82 1l7x s ILE 643 N 0.44 0.94 -0.53 2.22 -1.09 0.10 -4.80 121.20 118.48 1l7x s ILE 643 Ca -0.14 -0.32 -0.19 0.00 -2.23 0.00 0.00 60.65 57.76 1l7x s ILE 643 Cb -0.16 -0.91 0.07 0.00 -1.58 0.00 0.00 42.46 39.88 1l7x s ILE 643 CO 0.05 0.33 0.67 0.12 -1.23 0.00 0.00 174.94 174.88 1l7x s PHE 644 N 1.05 3.01 -0.37 3.97 5.36 -1.25 -0.70 117.98 129.05 1l7x s PHE 644 Ca -0.08 -0.60 -0.28 0.00 -0.96 0.00 0.00 56.93 55.02 1l7x s PHE 644 Cb -0.14 -3.70 -0.02 0.00 -0.34 0.00 0.00 43.02 38.82 1l7x s PHE 644 CO -0.01 -1.13 1.84 -1.17 -1.46 0.00 0.00 175.22 173.29 1l7x s LEU 645 N 2.77 3.47 0.37 6.12 2.96 0.36 -4.94 118.68 129.79 1l7x s LEU 645 Ca 0.15 1.18 -0.26 0.00 -0.22 0.00 0.00 54.13 54.99 1l7x s LEU 645 Cb -0.20 -3.34 -0.09 0.00 0.50 0.00 0.00 46.19 43.06 1l7x s LEU 645 CO 0.11 -1.84 1.08 -1.61 -1.32 0.00 0.00 176.35 172.76 1l7x s GLU 646 N 5.95 4.28 -1.20 1.98 2.02 -1.26 -3.81 118.70 126.66 1l7x s GLU 646 Ca 0.79 1.63 -0.04 0.00 0.02 0.00 0.00 54.97 57.37 1l7x s GLU 646 Cb -0.21 -2.74 -0.02 0.00 0.10 0.00 0.00 34.13 31.27 1l7x s GLU 646 CO 0.32 -0.06 0.83 -1.71 0.02 0.00 0.00 175.26 174.66 1l7x n ASN 647 N 0.29 -3.18 -4.68 -0.19 5.15 -1.25 -4.89 115.26 106.52 1l7x n ASN 647 Ca 0.03 -0.77 -0.42 0.00 -0.60 0.00 0.00 54.58 52.82 1l7x n ASN 647 Cb 0.48 -4.49 -0.03 0.00 -0.53 0.00 0.00 39.78 35.21 1l7x n ASN 647 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1l7x s TYR 648 N -3.50 2.22 0.30 1.20 5.04 -1.26 -4.87 117.35 116.48 1l7x s TYR 648 Ca 0.17 0.22 -0.10 0.00 -2.44 0.00 0.00 57.07 54.92 1l7x s TYR 648 Cb -0.04 -3.98 0.01 0.00 0.35 0.00 0.00 41.96 38.30 1l7x s TYR 648 CO 0.78 -4.03 0.52 -0.98 -1.34 0.00 0.00 175.55 170.50 1l7x s ARG 649 N 3.08 1.76 0.19 4.97 1.70 -1.26 -4.69 118.95 124.70 1l7x s ARG 649 Ca 0.75 -1.44 -0.14 0.00 -0.47 0.00 0.00 55.73 54.43 1l7x s ARG 649 Cb -0.39 0.48 0.18 0.00 -0.57 0.00 0.00 34.95 34.66 1l7x s ARG 649 CO 0.33 -0.75 1.68 0.28 -1.08 0.00 0.00 175.30 175.76 1l7x h VAL 650 N 2.17 0.61 -0.05 4.99 2.07 -1.95 0.17 116.25 124.26 1l7x h VAL 650 Ca -0.28 -0.04 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1l7x h VAL 650 Cb 1.25 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1l7x h VAL 650 CO 0.37 0.02 -0.17 0.77 0.02 0.00 0.00 177.57 178.58 1l7x h SER 651 N 0.10 0.07 0.56 0.57 4.64 -1.96 -1.83 113.55 115.71 1l7x h SER 651 Ca 0.25 -0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 61.32 1l7x h SER 651 Cb 0.37 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 1l7x h SER 651 CO -0.42 0.26 -1.04 0.25 -0.87 0.00 0.00 176.83 175.01 1l7x h LEU 652 N 0.07 0.38 -1.37 5.97 6.46 -1.52 -3.08 115.31 122.22 1l7x h LEU 652 Ca 0.01 -0.35 -0.05 0.00 -0.12 0.00 0.00 57.88 57.38 1l7x h LEU 652 Cb 0.35 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.15 1l7x h LEU 652 CO 0.02 1.20 -0.07 0.00 -0.62 0.00 0.00 178.44 178.97 1l7x h ALA 653 N 0.76 1.49 0.00 1.25 0.00 -0.24 -1.56 119.26 120.96 1l7x h ALA 653 Ca -0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 1l7x h ALA 653 Cb 1.72 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.40 1l7x h ALA 653 CO 0.17 0.36 -0.12 0.93 0.00 0.00 0.00 179.25 180.60 1l7x h GLU 654 N 0.31 0.00 0.00 0.00 5.08 -1.26 -1.68 114.58 117.03 1l7x h GLU 654 Ca 0.07 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.26 1l7x h GLU 654 Cb 0.33 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1l7x h GLU 654 CO 0.02 0.12 -0.92 0.87 -1.00 0.00 0.00 179.01 178.09 1l7x h LYS 655 N 0.00 0.00 -0.05 2.33 1.57 -1.33 -3.40 116.57 115.69 1l7x h LYS 655 Ca -0.00 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.58 1l7x h LYS 655 Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 1l7x h LYS 655 CO 0.02 0.94 -0.80 -0.24 -0.57 0.00 0.00 179.45 178.80 1l7x h VAL 656 N -1.00 1.40 -0.46 0.50 3.04 -1.34 -3.32 116.25 115.07 1l7x h VAL 656 Ca -0.25 -2.27 0.03 0.00 -1.01 0.00 0.00 66.70 63.20 1l7x h VAL 656 Cb 1.18 2.23 -0.04 0.00 -2.01 0.00 0.00 31.29 32.66 1l7x h VAL 656 CO -0.15 0.68 0.24 0.40 -1.01 0.00 0.00 177.57 177.73 1l7x h ILE 657 N 0.24 0.98 0.00 3.17 2.04 -1.54 -1.40 117.51 121.01 1l7x h ILE 657 Ca -0.04 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 1l7x h ILE 657 Cb 1.39 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 37.94 1l7x h ILE 657 CO 0.13 0.09 -0.07 -0.65 0.00 0.00 0.00 178.15 177.65 1l7x h PRO 658 N 0.48 0.00 -0.21 2.37 0.11 -1.77 -2.62 132.00 130.36 1l7x h PRO 658 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1l7x h PRO 658 Cb 0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.20 1l7x h PRO 658 CO -0.13 0.07 0.00 0.00 -0.21 0.00 0.00 178.00 177.73 1l7x n ALA 659 N -2.16 2.50 -2.44 -0.75 0.00 -0.57 -4.78 120.51 112.31 1l7x n ALA 659 Ca -0.01 -0.60 -0.37 0.00 0.00 0.00 0.00 53.44 52.46 1l7x n ALA 659 Cb 0.26 -1.05 -0.06 0.00 0.00 0.00 0.00 19.45 18.61 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 -1.73 4.95 -0.26 0.00 2.01 -0.95 -4.67 115.64 114.98 1l7x s THR 660 Ca 0.33 0.86 -0.04 0.00 0.31 0.00 0.00 61.69 63.16 1l7x s THR 660 Cb 0.18 -3.75 -0.16 0.00 0.01 0.00 0.00 72.50 68.78 1l7x s THR 660 CO 0.27 0.48 -0.22 0.47 -0.69 0.00 0.00 174.62 174.93 1l7x n ASP 661 N 1.51 1.98 -4.00 3.53 8.00 -0.78 -4.08 116.55 122.71 1l7x n ASP 661 Ca -0.11 0.03 -0.28 0.00 0.71 0.00 0.00 54.79 55.14 1l7x n ASP 661 Cb 0.52 -0.57 -0.17 0.00 -0.02 0.00 0.00 41.12 40.89 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 -6.86 1.54 -0.26 0.64 2.96 -0.56 -0.63 118.68 115.51 1l7x s LEU 662 Ca -0.35 -0.39 -0.10 0.00 -0.22 0.00 0.00 54.13 53.07 1l7x s LEU 662 Cb 0.10 -1.01 -0.04 0.00 0.50 0.00 0.00 46.19 45.74 1l7x s LEU 662 CO 0.58 -0.04 0.14 -0.55 -1.32 0.00 0.00 176.35 175.16 1l7x s SER 663 N 1.31 5.80 -0.35 3.68 0.15 0.44 -0.22 113.70 124.51 1l7x s SER 663 Ca -0.01 -0.02 -0.22 0.00 0.70 0.00 0.00 55.95 56.40 1l7x s SER 663 Cb -0.14 -2.06 0.01 0.00 -1.71 0.00 0.00 66.02 62.12 1l7x s SER 663 CO -0.06 -0.00 0.73 -1.61 1.20 0.00 0.00 173.24 173.50 1l7x s GLU 664 N 1.46 3.75 -0.50 5.44 0.41 -0.15 -1.61 118.70 127.50 1l7x s GLU 664 Ca 0.07 0.25 0.07 0.00 -0.41 0.00 0.00 54.97 54.95 1l7x s GLU 664 Cb -0.15 -3.80 0.25 0.00 -1.78 0.00 0.00 34.13 28.65 1l7x s GLU 664 CO 0.07 -0.79 0.61 1.04 -0.49 0.00 0.00 175.26 175.70 1l7x n GLN 665 N 6.25 1.45 -1.16 1.61 1.13 -0.69 -4.75 117.38 121.22 1l7x n GLN 665 Ca 0.02 -3.83 -0.14 0.00 -1.94 0.00 0.00 57.00 51.10 1l7x n GLN 665 Cb 0.48 -1.67 0.14 0.00 0.11 0.00 0.00 30.24 29.31 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 1.24 2.75 -1.63 5.09 -5.35 -1.26 -2.85 119.36 117.36 1l7x n ILE 666 Ca 0.25 -3.03 -0.32 0.00 -0.27 0.00 0.00 62.75 59.37 1l7x n ILE 666 Cb 0.48 -0.62 0.06 0.00 -1.74 0.00 0.00 39.64 37.82 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 -2.58 4.97 0.23 7.28 1.04 -1.23 -4.66 113.70 118.74 1l7x s SER 667 Ca 0.50 1.95 -0.31 0.00 0.48 0.00 0.00 55.95 58.56 1l7x s SER 667 Cb 0.43 -2.54 -0.11 0.00 0.10 0.00 0.00 66.02 63.89 1l7x s SER 667 CO 0.01 -1.73 1.63 -0.89 0.98 0.00 0.00 173.24 173.25 1l7x s THR 668 N -2.49 2.21 -0.04 2.02 2.01 -1.04 -4.66 115.64 113.65 1l7x s THR 668 Ca 0.65 0.16 -0.38 0.00 0.31 0.00 0.00 61.69 62.43 1l7x s THR 668 Cb -0.19 -3.10 -0.17 0.00 0.01 0.00 0.00 72.50 69.04 1l7x s THR 668 CO 0.45 0.02 1.43 0.00 -0.69 0.00 0.00 174.62 175.83 1l7x n ALA 669 N 3.35 -1.07 -0.28 7.40 0.00 -1.26 -1.18 120.51 127.47 1l7x n ALA 669 Ca 0.13 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.06 1l7x n ALA 669 Cb 0.37 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.74 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 2.91 0.77 0.06 0.00 0.00 -1.26 -4.69 105.19 102.98 1l7x n GLY 670 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.00 0.83 -3.27 2.61 -2.24 -0.32 -4.83 114.28 105.05 1l7x n THR 671 Ca 0.00 -0.71 -0.44 0.00 -2.27 0.00 0.00 64.05 60.63 1l7x n THR 671 Cb 0.00 -0.28 -0.07 0.00 -2.10 0.00 0.00 70.33 67.88 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 -2.91 3.05 0.31 -0.78 2.56 -1.26 -4.82 118.70 114.84 1l7x s GLU 672 Ca -0.09 -1.14 0.07 0.00 0.00 0.00 0.00 54.97 53.80 1l7x s GLU 672 Cb 0.09 -4.12 0.83 0.00 2.00 0.00 0.00 34.13 32.93 1l7x s GLU 672 CO 0.86 -1.14 1.67 0.00 -0.56 0.00 0.00 175.26 176.09 1l7x h ALA 673 N 8.88 1.55 0.00 6.30 0.00 -1.88 -2.52 119.26 131.59 1l7x h ALA 673 Ca -0.28 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1l7x h ALA 673 Cb 1.10 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1l7x h ALA 673 CO 0.93 -0.44 0.00 0.45 0.00 0.00 0.00 179.25 180.19 1l7x n SER 674 N -5.10 -0.90 0.00 0.00 2.88 -1.26 -4.18 113.62 105.06 1l7x n SER 674 Ca 0.25 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 58.00 1l7x n SER 674 Cb 0.76 1.15 0.00 0.00 -0.75 0.00 0.00 64.21 65.37 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 -0.93 1.17 0.00 0.46 0.00 -1.26 -0.12 105.19 104.51 1l7x n GLY 675 Ca 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.38 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 1.30 0.00 -0.37 2.61 -2.24 -1.26 -4.71 114.28 109.60 1l7x n THR 676 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1l7x n THR 676 Cb 0.00 -0.11 0.11 0.00 -2.10 0.00 0.00 70.33 68.23 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 1.41 0.31 3.38 0.00 -1.95 -0.35 103.07 105.87 1l7x h GLY 677 Ca 0.00 -0.52 0.14 0.00 0.00 0.00 0.00 47.33 46.95 1l7x h GLY 677 CO 0.00 0.50 0.54 3.45 0.00 0.00 0.00 176.54 181.03 1l7x h ASN 678 N 1.34 0.72 -0.37 0.19 -1.07 -1.95 -0.24 115.58 114.20 1l7x h ASN 678 Ca 0.37 0.08 -0.15 0.00 0.07 0.00 0.00 56.30 56.67 1l7x h ASN 678 Cb -0.14 -0.06 -0.01 0.00 -2.07 0.00 0.00 38.32 36.05 1l7x h ASN 678 CO -0.09 0.33 -0.32 0.24 0.07 0.00 0.00 177.43 177.66 1l7x h MET 679 N 0.78 0.91 -0.35 4.14 2.86 -1.40 -2.52 114.93 119.35 1l7x h MET 679 Ca 0.49 -0.44 0.03 0.00 -2.06 0.00 0.00 59.70 57.72 1l7x h MET 679 Cb 0.63 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.25 1l7x h MET 679 CO -0.33 1.09 0.15 0.87 1.06 0.00 0.00 176.91 179.76 1l7x h LYS 680 N 0.76 0.31 -0.34 1.72 1.57 0.06 -1.56 116.57 119.09 1l7x h LYS 680 Ca 0.08 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 1l7x h LYS 680 Cb 0.90 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 1l7x h LYS 680 CO 0.08 0.21 -0.08 0.74 -0.57 0.00 0.00 179.45 179.83 1l7x h PHE 681 N 0.32 0.60 -0.44 -1.35 0.04 -1.29 -2.45 116.94 112.36 1l7x h PHE 681 Ca 0.15 -0.09 -0.07 0.00 2.80 0.00 0.00 57.97 60.77 1l7x h PHE 681 Cb 0.09 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 1l7x h PHE 681 CO -0.12 0.63 0.00 1.98 -0.60 0.00 0.00 178.31 180.21 1l7x h MET 682 N 0.53 0.78 0.00 1.51 4.05 -1.00 -1.71 114.93 119.08 1l7x h MET 682 Ca 0.10 -0.25 -0.06 0.00 -0.28 0.00 0.00 59.70 59.21 1l7x h MET 682 Cb 0.46 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.18 1l7x h MET 682 CO 0.02 0.84 -0.31 1.25 0.23 0.00 0.00 176.91 178.95 1l7x h LEU 683 N 0.62 0.00 -3.30 3.39 5.85 -1.12 -3.23 115.31 117.53 1l7x h LEU 683 Ca 0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1l7x h LEU 683 Cb 0.49 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.52 1l7x h LEU 683 CO 0.02 0.31 0.00 0.59 -0.34 0.00 0.00 178.44 179.02 1l7x n ASN 684 N -3.58 5.26 0.00 1.25 3.02 -0.94 -4.90 115.26 115.36 1l7x n ASN 684 Ca -0.01 -2.82 0.00 0.00 -0.03 0.00 0.00 54.58 51.73 1l7x n ASN 684 Cb 0.44 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.95 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 0.61 0.68 3.73 7.41 0.00 -1.16 -4.78 105.19 111.68 1l7x n GLY 685 Ca 0.25 -0.67 -0.26 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.00 3.39 0.35 4.61 0.00 -0.66 -4.80 121.76 122.65 1l7x s ALA 686 Ca 0.00 -1.29 -0.00 0.00 0.00 0.00 0.00 51.96 50.67 1l7x s ALA 686 Cb 0.00 -1.18 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 1l7x s ALA 686 CO 0.00 0.50 0.56 -0.51 0.00 0.00 0.00 175.76 176.31 1l7x s LEU 687 N -3.01 3.99 -0.00 0.00 1.43 0.19 -4.48 118.68 116.80 1l7x s LEU 687 Ca 0.29 0.49 0.06 0.00 -1.03 0.00 0.00 54.13 53.94 1l7x s LEU 687 Cb -0.10 -3.35 -0.03 0.00 0.03 0.00 0.00 46.19 42.74 1l7x s LEU 687 CO 0.21 -0.31 -0.19 -0.89 0.23 0.00 0.00 176.35 175.41 1l7x s THR 688 N -2.33 2.71 -0.16 5.49 2.01 -1.26 -0.42 115.64 121.68 1l7x s THR 688 Ca 0.41 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1l7x s THR 688 Cb -0.10 -2.07 0.03 0.00 0.01 0.00 0.00 72.50 70.38 1l7x s THR 688 CO 0.36 0.48 -0.10 -0.51 -0.69 0.00 0.00 174.62 174.17 1l7x s ILE 689 N -0.78 1.36 0.09 1.82 2.07 -0.64 -0.94 121.20 124.18 1l7x s ILE 689 Ca 0.12 -0.63 -0.09 0.00 -1.41 0.00 0.00 60.65 58.64 1l7x s ILE 689 Cb -0.10 -1.39 0.03 0.00 0.13 0.00 0.00 42.46 41.13 1l7x s ILE 689 CO 0.02 0.30 0.42 0.61 -1.91 0.00 0.00 174.94 174.38 1l7x n GLY 690 N 4.82 1.08 3.98 1.50 0.00 -0.61 -1.70 105.19 114.26 1l7x n GLY 690 Ca -0.14 -1.03 -0.20 0.00 0.00 0.00 0.00 46.02 44.65 1l7x n GLY 690 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1l7x s THR 691 N -2.39 4.48 -1.24 2.61 -4.23 -1.13 -1.68 115.64 112.06 1l7x s THR 691 Ca 0.09 -0.95 -0.20 0.00 -1.18 0.00 0.00 61.69 59.46 1l7x s THR 691 Cb -0.01 -3.57 0.04 0.00 1.34 0.00 0.00 72.50 70.29 1l7x s THR 691 CO 0.03 -0.24 1.74 -0.04 -0.54 0.00 0.00 174.62 175.58 1l7x s MET 692 N -4.14 3.66 0.08 3.99 -1.94 -1.26 -4.66 119.30 115.02 1l7x s MET 692 Ca 0.42 -1.72 -0.06 0.00 -1.71 0.00 0.00 55.69 52.62 1l7x s MET 692 Cb -0.09 -5.46 -0.02 0.00 2.01 0.00 0.00 34.83 31.27 1l7x s MET 692 CO 0.31 -2.57 0.11 0.34 -0.01 0.00 0.00 175.02 173.20 1l7x s ASP 693 N 4.79 0.25 0.44 3.03 3.68 -1.26 -4.59 116.67 123.00 1l7x s ASP 693 Ca 0.56 -0.79 0.00 0.00 2.13 0.00 0.00 52.55 54.45 1l7x s ASP 693 Cb 0.02 0.29 0.00 0.00 -1.45 0.00 0.00 42.92 41.79 1l7x s ASP 693 CO 0.07 -0.68 0.00 0.61 0.13 0.00 0.00 175.17 175.29 1l7x n GLY 694 N -0.00 1.45 0.00 2.66 0.00 -0.95 -1.11 105.19 107.24 1l7x n GLY 694 Ca -0.14 -0.46 0.09 0.00 0.00 0.00 0.00 46.02 45.51 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 5.28 1.89 -0.33 4.61 0.00 0.83 -2.98 120.51 129.80 1l7x n ALA 695 Ca 0.00 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.48 1l7x n ALA 695 Cb 0.00 -1.30 0.31 0.00 0.00 0.00 0.00 19.45 18.46 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 0.79 -0.76 0.00 4.21 -1.30 0.84 115.58 119.36 1l7x h ASN 696 Ca 0.00 0.06 0.04 0.00 1.21 0.00 0.00 56.30 57.61 1l7x h ASN 696 Cb 0.30 -0.10 -0.05 0.00 -1.12 0.00 0.00 38.32 37.35 1l7x h ASN 696 CO 0.00 0.38 0.47 0.58 -1.29 0.00 0.00 177.43 177.57 1l7x h VAL 697 N 0.83 1.08 0.00 2.81 2.07 -1.54 -2.21 116.25 119.29 1l7x h VAL 697 Ca 0.50 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.64 1l7x h VAL 697 Cb 0.69 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1l7x h VAL 697 CO -0.27 0.17 -0.33 -0.33 0.02 0.00 0.00 177.57 176.82 1l7x h GLU 698 N 0.91 0.00 -0.33 1.57 5.08 -1.09 -2.79 114.58 117.94 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 0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1l7x h GLU 698 CO -0.13 0.33 -0.09 0.52 -1.00 0.00 0.00 179.01 178.65 1l7x h MET 699 N 0.00 0.64 -0.94 2.33 2.86 -0.68 -1.84 114.93 117.29 1l7x h MET 699 Ca -0.00 -0.25 0.01 0.00 -2.06 0.00 0.00 59.70 57.40 1l7x h MET 699 Cb 1.02 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.60 1l7x h MET 699 CO 0.04 0.82 0.61 0.00 1.06 0.00 0.00 176.91 179.44 1l7x h ALA 700 N 0.80 1.31 -0.53 6.32 0.00 -1.34 -0.67 119.26 125.15 1l7x h ALA 700 Ca 0.08 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1l7x h ALA 700 Cb 0.58 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1l7x h ALA 700 CO 0.03 0.63 0.08 0.93 0.00 0.00 0.00 179.25 180.93 1l7x h GLU 701 N 1.28 0.87 -0.10 0.00 5.08 -1.25 0.70 114.58 121.17 1l7x h GLU 701 Ca 0.34 -0.24 -0.10 0.00 -1.00 0.00 0.00 59.36 58.36 1l7x h GLU 701 Cb -0.13 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.03 1l7x h GLU 701 CO -0.07 0.86 -0.33 0.93 -1.00 0.00 0.00 179.01 179.39 1l7x h GLU 702 N 0.76 0.40 0.00 2.33 4.39 -1.00 -3.33 114.58 118.12 1l7x h GLU 702 Ca 0.16 -0.30 0.00 0.00 0.34 0.00 0.00 59.36 59.56 1l7x h GLU 702 Cb 0.41 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1l7x h GLU 702 CO 0.01 0.92 -1.11 0.00 -1.16 0.00 0.00 179.01 177.67 1l7x n ALA 703 N -2.50 2.59 0.00 3.43 0.00 -0.29 -4.83 120.51 118.90 1l7x n ALA 703 Ca -0.08 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1l7x n ALA 703 Cb 0.50 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.89 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 1.20 1.73 0.37 0.00 0.00 0.23 -4.66 105.19 104.06 1l7x n GLY 704 Ca -0.00 -1.31 0.15 0.00 0.00 0.00 0.00 46.02 44.86 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 0.62 0.00 1.61 4.81 -1.68 -0.70 114.58 119.24 1l7x h GLU 705 Ca 0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1l7x h GLU 705 Cb 0.00 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.24 1l7x h GLU 705 CO 0.00 0.41 -0.06 1.05 -0.73 0.00 0.00 179.01 179.68 1l7x h GLU 706 N 0.64 0.00 -0.64 1.92 9.09 -1.90 -2.25 114.58 121.45 1l7x h GLU 706 Ca 0.54 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.95 1l7x h GLU 706 Cb 1.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.11 1l7x h GLU 706 CO -0.31 0.06 0.00 0.09 0.05 0.00 0.00 179.01 178.90 1l7x n ASN 707 N -3.51 2.16 -4.04 3.06 3.02 -0.27 -4.79 115.26 110.89 1l7x n ASN 707 Ca -0.02 -2.20 -0.08 0.00 -0.03 0.00 0.00 54.58 52.25 1l7x n ASN 707 Cb 0.18 -0.42 -0.10 0.00 -0.61 0.00 0.00 39.78 38.83 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 -0.96 2.38 -1.03 3.41 1.02 -0.85 -4.79 118.68 117.87 1l7x s LEU 708 Ca 0.18 -0.79 -0.11 0.00 0.02 0.00 0.00 54.13 53.43 1l7x s LEU 708 Cb 0.12 0.16 0.26 0.00 0.02 0.00 0.00 46.19 46.75 1l7x s LEU 708 CO 0.08 -0.48 1.02 -0.36 0.02 0.00 0.00 176.35 176.63 1l7x s PHE 709 N -2.91 4.11 0.33 0.29 0.40 -0.12 -4.97 117.98 115.11 1l7x s PHE 709 Ca -0.02 -2.47 -0.16 0.00 -0.60 0.00 0.00 56.93 53.67 1l7x s PHE 709 Cb 0.01 -3.85 -0.09 0.00 0.51 0.00 0.00 43.02 39.60 1l7x s PHE 709 CO -0.06 -0.98 0.76 0.42 0.70 0.00 0.00 175.22 176.06 1l7x s ILE 710 N -0.77 4.64 0.24 0.64 -1.09 -1.26 -1.57 121.20 122.03 1l7x s ILE 710 Ca 0.27 1.02 -0.21 0.00 -2.23 0.00 0.00 60.65 59.51 1l7x s ILE 710 Cb -0.10 -3.62 0.06 0.00 -1.58 0.00 0.00 42.46 37.23 1l7x s ILE 710 CO -0.08 -0.19 0.94 0.72 -1.23 0.00 0.00 174.94 175.10 1l7x s PHE 711 N -1.99 0.03 0.02 3.97 -0.12 -0.68 -4.92 117.98 114.29 1l7x s PHE 711 Ca 0.55 -0.49 0.00 0.00 -0.05 0.00 0.00 56.93 56.94 1l7x s PHE 711 Cb -0.10 0.73 0.00 0.00 -0.63 0.00 0.00 43.02 43.01 1l7x s PHE 711 CO 0.17 -1.10 0.00 0.41 -0.05 0.00 0.00 175.22 174.65 1l7x n GLY 712 N -0.59 -2.24 3.76 1.99 0.00 -1.26 -4.22 105.19 102.62 1l7x n GLY 712 Ca -0.05 -1.51 -0.32 0.00 0.00 0.00 0.00 46.02 44.13 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 -1.08 2.51 0.48 1.61 -1.94 -1.26 -4.93 119.30 114.69 1l7x s MET 713 Ca 0.00 1.35 0.05 0.00 -1.71 0.00 0.00 55.69 55.38 1l7x s MET 713 Cb 0.00 -1.92 -0.01 0.00 2.01 0.00 0.00 34.83 34.91 1l7x s MET 713 CO 0.00 -1.47 0.20 1.03 -0.01 0.00 0.00 175.02 174.77 1l7x s ARG 714 N -4.36 2.22 0.37 2.03 0.52 -1.26 -4.55 118.95 113.92 1l7x s ARG 714 Ca 0.66 -2.06 0.20 0.00 -0.52 0.00 0.00 55.73 54.00 1l7x s ARG 714 Cb -0.20 -1.89 1.22 0.00 0.52 0.00 0.00 34.95 34.61 1l7x s ARG 714 CO 0.47 -0.34 1.64 0.97 0.02 0.00 0.00 175.30 178.06 1l7x h ILE 715 N 1.20 0.20 0.09 1.52 6.09 -1.84 0.12 117.51 124.89 1l7x h ILE 715 Ca -0.41 -0.07 -0.27 0.00 -1.37 0.00 0.00 64.86 62.74 1l7x h ILE 715 Cb 1.29 -0.02 0.01 0.00 0.47 0.00 0.00 36.82 38.57 1l7x h ILE 715 CO 0.67 0.04 -1.14 0.44 -3.07 0.00 0.00 178.15 175.09 1l7x h ASP 716 N 0.20 0.59 -0.52 2.19 5.19 -1.96 -3.12 116.42 118.99 1l7x h ASP 716 Ca 0.77 -0.55 -0.05 0.00 -0.62 0.00 0.00 57.03 56.58 1l7x h ASP 716 Cb 1.99 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 41.30 1l7x h ASP 716 CO -0.59 1.38 0.12 0.44 -3.12 0.00 0.00 179.24 177.48 1l7x h ASP 717 N 0.18 0.80 -0.56 6.45 3.32 -1.17 -2.04 116.42 123.39 1l7x h ASP 717 Ca -0.13 -0.24 -0.05 0.00 0.02 0.00 0.00 57.03 56.63 1l7x h ASP 717 Cb 1.82 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 41.13 1l7x h ASP 717 CO 0.20 0.83 0.18 0.58 -1.72 0.00 0.00 179.24 179.31 1l7x h VAL 718 N 0.73 1.23 -0.40 -1.35 2.07 -1.38 -1.50 116.25 115.66 1l7x h VAL 718 Ca 0.16 -0.82 -0.07 0.00 0.82 0.00 0.00 66.70 66.80 1l7x h VAL 718 Cb 0.35 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1l7x h VAL 718 CO 0.00 0.31 -0.03 0.00 0.02 0.00 0.00 177.57 177.88 1l7x h ALA 719 N 1.30 0.54 -0.26 1.67 0.00 -1.44 -1.74 119.26 119.33 1l7x h ALA 719 Ca 0.20 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1l7x h ALA 719 Cb 0.28 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1l7x h ALA 719 CO -0.01 0.34 0.16 0.00 0.00 0.00 0.00 179.25 179.75 1l7x h ALA 720 N 0.87 0.33 0.00 0.00 0.00 -1.13 0.29 119.26 119.63 1l7x h ALA 720 Ca 0.11 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1l7x h ALA 720 Cb 0.52 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1l7x h ALA 720 CO 0.03 -0.18 -0.02 1.25 0.00 0.00 0.00 179.25 180.33 1l7x h LEU 721 N 0.34 0.00 0.03 0.00 5.85 -1.16 -0.99 115.31 119.38 1l7x h LEU 721 Ca 0.09 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1l7x h LEU 721 Cb -0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.02 1l7x h LEU 721 CO -0.02 0.02 -0.02 0.44 -0.34 0.00 0.00 178.44 178.53 1l7x h ASP 722 N 0.00 -0.04 -0.58 1.25 3.32 -0.28 -0.05 116.42 120.03 1l7x h ASP 722 Ca -0.00 -0.64 0.09 0.00 0.02 0.00 0.00 57.03 56.50 1l7x h ASP 722 Cb 0.05 0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.54 1l7x h ASP 722 CO 0.00 0.74 0.19 0.50 -1.72 0.00 0.00 179.24 178.96 1l7x h LYS 723 N -0.93 0.35 0.84 3.56 3.64 -0.70 -2.63 116.57 120.70 1l7x h LYS 723 Ca -0.00 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1l7x h LYS 723 Cb 0.68 -0.08 0.01 0.00 -0.41 0.00 0.00 32.23 32.43 1l7x h LYS 723 CO 0.01 0.23 -0.41 -0.22 -2.27 0.00 0.00 179.45 176.79 1l7x h LYS 724 N 0.36 -1.09 0.00 1.90 3.64 -1.28 -3.49 116.57 116.61 1l7x h LYS 724 Ca 0.30 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 1l7x h LYS 724 Cb 0.38 0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1l7x h LYS 724 CO -0.32 -0.73 0.00 0.41 -2.27 0.00 0.00 179.45 176.55 1l7x n GLY 725 N -1.21 3.44 3.59 5.01 0.00 -0.05 -5.07 105.19 110.90 1l7x n GLY 725 Ca -0.14 -0.71 -0.43 0.00 0.00 0.00 0.00 46.02 44.74 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 2.90 -0.63 1.61 5.04 -1.14 -4.90 117.35 120.23 1l7x s TYR 726 Ca 0.00 0.66 -0.03 0.00 -2.44 0.00 0.00 57.07 55.26 1l7x s TYR 726 Cb 0.00 -4.15 0.16 0.00 0.35 0.00 0.00 41.96 38.33 1l7x s TYR 726 CO 0.00 -1.13 0.46 -1.21 -1.34 0.00 0.00 175.55 172.33 1l7x s GLU 727 N 4.07 2.62 0.58 4.97 0.41 -1.26 -4.95 118.70 125.13 1l7x s GLU 727 Ca 0.43 -2.52 0.27 0.00 -0.41 0.00 0.00 54.97 52.74 1l7x s GLU 727 Cb -0.09 -3.77 1.63 0.00 -1.78 0.00 0.00 34.13 30.13 1l7x s GLU 727 CO 0.27 -1.18 2.12 0.00 -0.49 0.00 0.00 175.26 175.99 1l7x h ALA 728 N 7.07 1.83 0.00 5.21 0.00 -1.86 -1.97 119.26 129.54 1l7x h ALA 728 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1l7x h ALA 728 Cb 0.96 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1l7x h ALA 728 CO 0.72 -0.24 0.00 0.36 0.00 0.00 0.00 179.25 180.08 1l7x n LYS 729 N -3.92 0.03 0.03 0.00 2.85 -1.26 -2.85 118.16 113.04 1l7x n LYS 729 Ca 0.01 0.29 -0.19 0.00 -1.05 0.00 0.00 58.31 57.37 1l7x n LYS 729 Cb 0.28 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 33.02 1l7x n LYS 729 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1l7x h GLU 730 N 0.00 0.29 -0.11 -1.58 5.08 -1.78 -2.96 114.58 113.52 1l7x h GLU 730 Ca 0.00 -0.45 -0.09 0.00 -1.00 0.00 0.00 59.36 57.82 1l7x h GLU 730 Cb 0.17 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1l7x h GLU 730 CO 0.00 1.19 -0.33 1.88 -1.00 0.00 0.00 179.01 180.75 1l7x h TYR 731 N -0.37 0.23 -0.27 4.33 -1.99 -1.72 -0.27 116.97 116.91 1l7x h TYR 731 Ca -0.11 -0.05 -0.11 0.00 2.00 0.00 0.00 58.73 60.46 1l7x h TYR 731 Cb 1.51 -0.06 -0.01 0.00 2.00 0.00 0.00 36.73 40.17 1l7x h TYR 731 CO 0.19 0.52 -0.29 -0.92 -0.00 0.00 0.00 178.16 177.66 1l7x h TYR 732 N 0.18 0.61 0.00 4.88 3.20 -1.65 -0.41 116.97 123.78 1l7x h TYR 732 Ca 0.02 -0.14 -0.11 0.00 3.14 0.00 0.00 58.73 61.64 1l7x h TYR 732 Cb 0.67 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 1l7x h TYR 732 CO 0.01 0.77 -0.52 0.93 -1.64 0.00 0.00 178.16 177.71 1l7x h GLU 733 N 0.46 0.00 -0.02 1.82 3.07 -1.24 -3.33 114.58 115.35 1l7x h GLU 733 Ca 0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1l7x h GLU 733 Cb 0.74 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.65 1l7x h GLU 733 CO 0.06 0.52 -0.37 0.00 -1.40 0.00 0.00 179.01 177.82 1l7x n ALA 734 N -2.24 3.29 -3.81 3.43 0.00 -0.17 -4.84 120.51 116.18 1l7x n ALA 734 Ca 0.02 -0.63 -0.30 0.00 0.00 0.00 0.00 53.44 52.53 1l7x n ALA 734 Cb 0.72 -0.73 -0.15 0.00 0.00 0.00 0.00 19.45 19.29 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 -2.27 2.63 0.19 0.00 1.43 -0.19 -5.02 118.68 115.45 1l7x s LEU 735 Ca 0.19 -1.61 -0.12 0.00 -1.03 0.00 0.00 54.13 51.55 1l7x s LEU 735 Cb 0.17 -1.01 0.16 0.00 0.03 0.00 0.00 46.19 45.54 1l7x s LEU 735 CO 0.48 -0.38 1.79 1.55 0.23 0.00 0.00 176.35 180.03 1l7x h PRO 736 N 8.00 0.54 -0.95 1.29 0.13 -1.88 -0.69 132.00 138.45 1l7x h PRO 736 Ca -0.13 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 65.03 1l7x h PRO 736 Cb 1.03 -0.12 -0.06 0.00 0.13 0.00 0.00 31.00 31.97 1l7x h PRO 736 CO 0.46 0.36 0.61 0.93 -0.23 0.00 0.00 178.00 180.13 1l7x h GLU 737 N 0.56 1.08 -0.37 0.86 5.08 -1.96 -0.11 114.58 119.73 1l7x h GLU 737 Ca 0.24 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.40 1l7x h GLU 737 Cb 0.14 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1l7x h GLU 737 CO -0.16 0.71 -0.33 1.25 -1.00 0.00 0.00 179.01 179.48 1l7x h LEU 738 N 1.11 0.87 -0.79 1.33 5.85 -1.81 -2.86 115.31 119.01 1l7x h LEU 738 Ca 0.41 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 1l7x h LEU 738 Cb 0.15 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1l7x h LEU 738 CO -0.17 1.13 0.37 0.50 -0.34 0.00 0.00 178.44 179.93 1l7x h LYS 739 N 0.70 1.15 -0.35 1.25 3.64 0.03 0.23 116.57 123.22 1l7x h LYS 739 Ca 0.07 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1l7x h LYS 739 Cb 0.89 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 1l7x h LYS 739 CO 0.08 0.90 0.20 1.25 -2.27 0.00 0.00 179.45 179.61 1l7x h LEU 740 N 1.13 0.42 0.19 5.20 5.85 -1.01 0.11 115.31 127.20 1l7x h LEU 740 Ca 0.27 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 1l7x h LEU 740 Cb 0.14 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 1l7x h LEU 740 CO -0.03 0.37 -0.11 0.58 -0.34 0.00 0.00 178.44 178.91 1l7x h VAL 741 N 0.44 0.76 -0.64 1.05 2.07 -1.24 -1.16 116.25 117.54 1l7x h VAL 741 Ca 0.12 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.70 1l7x h VAL 741 Cb 0.03 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 1l7x h VAL 741 CO -0.02 0.00 0.35 0.40 0.02 0.00 0.00 177.57 178.32 1l7x h ILE 742 N -0.29 0.97 -0.62 4.57 1.08 -0.76 -1.19 117.51 121.27 1l7x h ILE 742 Ca -0.02 -0.23 -0.05 0.00 -0.39 0.00 0.00 64.86 64.18 1l7x h ILE 742 Cb 0.24 0.26 -0.03 0.00 -3.07 0.00 0.00 36.82 34.22 1l7x h ILE 742 CO 0.02 0.12 0.20 0.44 -0.69 0.00 0.00 178.15 178.24 1l7x h ASP 743 N 0.66 0.90 -0.52 1.72 3.32 -0.56 0.73 116.42 122.66 1l7x h ASP 743 Ca 0.28 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1l7x h ASP 743 Cb 0.17 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 1l7x h ASP 743 CO -0.17 0.86 0.34 1.56 -1.72 0.00 0.00 179.24 180.10 1l7x h GLN 744 N 0.89 0.70 -0.38 3.56 4.20 -0.73 0.39 115.11 123.73 1l7x h GLN 744 Ca 0.20 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.75 1l7x h GLN 744 Cb 0.28 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1l7x h GLN 744 CO -0.01 0.48 -0.22 0.82 -0.67 0.00 0.00 178.83 179.23 1l7x h ILE 745 N 0.71 1.27 0.07 2.54 2.04 -0.93 0.02 117.51 123.23 1l7x h ILE 745 Ca 0.19 -1.33 -0.25 0.00 1.00 0.00 0.00 64.86 64.47 1l7x h ILE 745 Cb -0.06 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1l7x h ILE 745 CO -0.04 0.44 -1.13 -0.78 0.00 0.00 0.00 178.15 176.64 1l7x h ASP 746 N 0.66 0.26 -0.01 1.72 3.58 -0.51 -3.34 116.42 118.79 1l7x h ASP 746 Ca 0.09 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.27 1l7x h ASP 746 Cb 0.73 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.69 1l7x h ASP 746 CO 0.06 1.21 -0.01 0.59 -2.88 0.00 0.00 179.24 178.21 1l7x n ASN 747 N -3.48 1.56 0.00 2.28 3.02 0.14 -4.70 115.26 114.08 1l7x n ASN 747 Ca -0.05 -1.51 0.00 0.00 -0.03 0.00 0.00 54.58 52.99 1l7x n ASN 747 Cb 0.98 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.15 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 1.19 0.84 0.39 7.41 0.00 -1.07 -4.85 105.19 109.10 1l7x n GLY 748 Ca 0.19 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.42 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 0.00 -0.39 1.61 3.57 -1.29 0.68 116.94 121.12 1l7x h PHE 749 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1l7x h PHE 749 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1l7x h PHE 749 CO 0.00 0.00 0.00 1.19 -2.23 0.00 0.00 178.31 177.27 1l7x n PHE 750 N -4.23 0.51 -2.80 0.41 3.72 -1.25 -4.62 117.46 109.21 1l7x n PHE 750 Ca 0.10 -0.39 -0.10 0.00 -0.05 0.00 0.00 57.45 57.01 1l7x n PHE 750 Cb 0.65 -0.01 0.06 0.00 -0.94 0.00 0.00 39.48 39.24 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 0.94 -2.01 -0.27 4.37 3.41 0.14 -4.76 113.62 115.44 1l7x n SER 751 Ca 0.15 -3.53 0.07 0.00 -0.26 0.00 0.00 58.87 55.30 1l7x n SER 751 Cb 0.48 1.55 0.21 0.00 -0.26 0.00 0.00 64.21 66.19 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 3.21 0.39 0.00 4.33 0.13 -1.55 0.19 132.00 138.70 1l7x h PRO 752 Ca -0.08 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1l7x h PRO 752 Cb 1.07 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1l7x h PRO 752 CO 0.22 0.26 0.00 0.87 -0.23 0.00 0.00 178.00 179.12 1l7x h LYS 753 N 0.40 0.00 -1.89 0.86 1.79 -1.95 -3.32 116.57 112.46 1l7x h LYS 753 Ca 0.44 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 58.39 1l7x h LYS 753 Cb 0.72 0.00 -0.36 0.00 -1.58 0.00 0.00 32.23 31.02 1l7x h LYS 753 CO -0.45 0.00 -0.99 1.04 -1.08 0.00 0.00 179.45 177.96 1l7x n GLN 754 N -2.52 0.56 -0.40 3.15 6.02 0.63 -5.02 117.38 119.80 1l7x n GLN 754 Ca 0.01 -3.03 0.36 0.00 -0.01 0.00 0.00 57.00 54.33 1l7x n GLN 754 Cb 0.21 -1.37 0.63 0.00 1.02 0.00 0.00 30.24 30.73 1l7x n GLN 754 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1l7x n PRO 755 N 1.90 -0.05 -0.46 -1.09 -0.02 -0.95 -0.61 135.00 133.73 1l7x n PRO 755 Ca 0.22 1.32 0.08 0.00 -2.02 0.00 0.00 63.50 63.10 1l7x n PRO 755 Cb 0.53 -2.48 0.27 0.00 -0.02 0.00 0.00 33.50 31.80 1l7x n PRO 755 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1l7x n ASP 756 N -4.99 4.01 -0.32 2.55 5.75 -1.26 -3.23 116.55 119.07 1l7x n ASP 756 Ca 0.39 -2.63 0.11 0.00 -0.01 0.00 0.00 54.79 52.65 1l7x n ASP 756 Cb 1.43 -0.49 0.28 0.00 -1.03 0.00 0.00 41.12 41.32 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 2.56 0.56 -3.15 -2.12 5.85 -1.19 -1.37 115.31 116.45 1l7x h LEU 757 Ca 0.00 0.11 -0.09 0.00 0.84 0.00 0.00 57.88 58.75 1l7x h LEU 757 Cb 1.32 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.33 1l7x h LEU 757 CO 0.19 0.17 0.11 0.49 -0.34 0.00 0.00 178.44 179.06 1l7x n PHE 758 N -4.89 1.83 -0.11 1.25 3.72 -1.26 -4.55 117.46 113.46 1l7x n PHE 758 Ca 0.21 -0.79 -0.05 0.00 -0.05 0.00 0.00 57.45 56.77 1l7x n PHE 758 Cb 0.55 -0.51 0.02 0.00 -0.94 0.00 0.00 39.48 38.60 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 2.67 0.07 -0.46 -1.08 3.64 -1.57 -1.90 116.57 117.94 1l7x h LYS 759 Ca 0.11 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 1l7x h LYS 759 Cb 1.86 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.64 1l7x h LYS 759 CO 0.50 0.04 0.31 -0.44 -2.27 0.00 0.00 179.45 177.59 1l7x h ASP 760 N 0.07 0.37 0.06 4.20 3.45 -1.83 0.53 116.42 123.26 1l7x h ASP 760 Ca 0.18 -0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.63 1l7x h ASP 760 Cb 0.26 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 38.95 1l7x h ASP 760 CO -0.32 0.25 -0.03 0.40 -1.57 0.00 0.00 179.24 177.97 1l7x h ILE 761 N 0.42 1.21 -0.74 0.35 2.04 -1.70 -2.18 117.51 116.91 1l7x h ILE 761 Ca 0.19 -0.94 0.06 0.00 1.00 0.00 0.00 64.86 65.17 1l7x h ILE 761 Cb 0.24 1.81 -0.06 0.00 -0.74 0.00 0.00 36.82 38.08 1l7x h ILE 761 CO -0.05 0.23 0.44 0.40 0.00 0.00 0.00 178.15 179.17 1l7x h ILE 762 N -0.50 1.01 -0.66 -0.67 1.08 -0.90 -0.78 117.51 116.08 1l7x h ILE 762 Ca -0.01 -0.28 -0.01 0.00 -0.39 0.00 0.00 64.86 64.17 1l7x h ILE 762 Cb 0.44 0.13 -0.03 0.00 -3.07 0.00 0.00 36.82 34.29 1l7x h ILE 762 CO 0.01 0.15 0.36 -1.13 -0.69 0.00 0.00 178.15 176.85 1l7x h ASN 763 N 0.81 0.84 -0.37 1.72 -1.24 -0.90 -1.47 115.58 114.97 1l7x h ASN 763 Ca 0.32 -0.10 -0.14 0.00 0.71 0.00 0.00 56.30 57.09 1l7x h ASN 763 Cb 0.16 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 38.99 1l7x h ASN 763 CO -0.17 0.70 -0.31 -0.03 -1.29 0.00 0.00 177.43 176.33 1l7x h MET 764 N 0.91 0.90 -0.74 6.67 4.05 -0.88 -1.43 114.93 124.42 1l7x h MET 764 Ca 0.23 -0.43 -0.05 0.00 -0.28 0.00 0.00 59.70 59.17 1l7x h MET 764 Cb 0.05 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.81 1l7x h MET 764 CO -0.04 1.08 0.25 -0.07 0.23 0.00 0.00 176.91 178.37 1l7x h LEU 765 N 0.76 1.06 0.00 3.39 3.38 -0.81 0.21 115.31 123.30 1l7x h LEU 765 Ca 0.08 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 1l7x h LEU 765 Cb 0.88 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1l7x h LEU 765 CO 0.08 0.97 -0.62 -0.26 0.09 0.00 0.00 178.44 178.70 1l7x h PHE 766 N 1.09 0.00 0.00 1.13 -1.00 -1.25 -3.41 116.94 113.50 1l7x h PHE 766 Ca 0.24 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.02 1l7x h PHE 766 Cb 0.28 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.84 1l7x h PHE 766 CO 0.02 0.19 -0.29 0.66 -1.61 0.00 0.00 178.31 177.28 1l7x n TYR 767 N -2.97 0.00 -2.59 -0.55 4.02 -0.54 -4.57 117.16 109.96 1l7x n TYR 767 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.81 1l7x n TYR 767 Cb 0.63 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.98 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 -0.45 1.73 -3.36 -0.72 8.25 0.54 -5.02 115.22 116.19 1l7x n HIS 768 Ca 0.00 -2.28 -0.46 0.00 -0.26 0.00 0.00 57.72 54.73 1l7x n HIS 768 Cb 0.00 -0.27 -0.03 0.00 1.12 0.00 0.00 29.99 30.81 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 -3.67 6.49 0.00 0.41 2.15 0.02 -4.81 116.67 117.25 1l7x s ASP 769 Ca 0.34 -2.43 0.16 0.00 0.43 0.00 0.00 52.55 51.05 1l7x s ASP 769 Cb 0.36 -2.18 0.74 0.00 -0.30 0.00 0.00 42.92 41.54 1l7x s ASP 769 CO -0.02 -0.64 1.49 0.54 -0.17 0.00 0.00 175.17 176.37 1l7x n ARG 770 N 4.32 0.10 -0.32 4.34 1.74 -1.26 -2.68 116.66 122.89 1l7x n ARG 770 Ca 0.05 0.19 0.08 0.00 -0.77 0.00 0.00 57.85 57.40 1l7x n ARG 770 Cb 0.44 -1.50 0.23 0.00 -1.02 0.00 0.00 32.46 30.61 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 -1.41 0.79 -3.85 -1.55 3.72 -1.26 -5.01 117.46 108.89 1l7x n PHE 771 Ca 0.05 -0.58 -0.32 0.00 -0.05 0.00 0.00 57.45 56.56 1l7x n PHE 771 Cb 0.16 -0.10 0.01 0.00 -0.94 0.00 0.00 39.48 38.61 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 0.64 -0.77 -0.06 -1.08 5.02 -1.09 -4.77 118.16 116.06 1l7x n LYS 772 Ca 0.18 0.26 -0.11 0.00 -2.02 0.00 0.00 58.31 56.62 1l7x n LYS 772 Cb 0.61 -1.89 -0.04 0.00 -0.02 0.00 0.00 35.03 33.68 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 -1.03 1.18 0.00 -0.18 2.07 -1.93 -2.95 116.25 113.40 1l7x h VAL 773 Ca -0.58 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 66.37 1l7x h VAL 773 Cb 1.19 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 32.13 1l7x h VAL 773 CO 0.38 0.17 -0.10 -0.26 0.02 0.00 0.00 177.57 177.79 1l7x h PHE 774 N 0.16 0.00 0.00 1.57 0.05 -1.91 -2.75 116.94 114.06 1l7x h PHE 774 Ca 0.07 0.00 -0.06 0.00 3.82 0.00 0.00 57.97 61.79 1l7x h PHE 774 Cb 0.21 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.15 1l7x h PHE 774 CO -0.00 0.10 -0.30 0.00 -0.18 0.00 0.00 178.31 177.92 1l7x h ALA 775 N 1.90 1.18 -0.02 2.45 0.00 -1.89 -3.07 119.26 119.81 1l7x h ALA 775 Ca -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1l7x h ALA 775 Cb 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1l7x h ALA 775 CO 0.01 0.38 -0.08 -0.25 0.00 0.00 0.00 179.25 179.31 1l7x n ASP 776 N -3.71 2.16 0.01 0.00 8.00 -1.07 -4.66 116.55 117.27 1l7x n ASP 776 Ca -0.01 -1.58 -0.10 0.00 0.71 0.00 0.00 54.79 53.81 1l7x n ASP 776 Cb 0.40 0.11 -0.04 0.00 -0.02 0.00 0.00 41.12 41.58 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 2.81 -0.83 -0.34 1.24 3.20 -1.39 0.28 116.97 121.94 1l7x h TYR 777 Ca 0.00 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.91 1l7x h TYR 777 Cb 0.63 0.38 -0.02 0.00 1.54 0.00 0.00 36.73 39.27 1l7x h TYR 777 CO 0.00 -0.38 0.22 1.49 -1.64 0.00 0.00 178.16 177.84 1l7x h GLU 778 N -0.38 0.43 -0.54 1.82 4.81 -1.83 -1.52 114.58 117.37 1l7x h GLU 778 Ca 0.09 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.22 1l7x h GLU 778 Cb 0.53 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 1l7x h GLU 778 CO -0.33 0.28 0.03 0.00 -0.73 0.00 0.00 179.01 178.26 1l7x h ALA 779 N 1.13 0.72 0.20 2.92 0.00 -1.83 -2.42 119.26 119.98 1l7x h ALA 779 Ca 0.13 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1l7x h ALA 779 Cb -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1l7x h ALA 779 CO -0.04 0.51 -0.22 -0.92 0.00 0.00 0.00 179.25 178.58 1l7x h TYR 780 N 0.80 -0.58 -0.71 0.00 3.20 -0.70 -0.58 116.97 118.40 1l7x h TYR 780 Ca 0.16 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.07 1l7x h TYR 780 Cb 0.49 0.23 -0.05 0.00 1.54 0.00 0.00 36.73 38.94 1l7x h TYR 780 CO 0.04 -0.33 0.44 0.28 -1.64 0.00 0.00 178.16 176.95 1l7x h VAL 781 N -0.46 1.07 -0.21 1.81 2.07 -1.24 0.13 116.25 119.42 1l7x h VAL 781 Ca 0.00 -0.29 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 1l7x h VAL 781 Cb 0.44 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1l7x h VAL 781 CO -0.06 0.15 -0.14 0.11 0.02 0.00 0.00 177.57 177.65 1l7x h LYS 782 N 0.84 0.34 -0.21 1.57 1.57 -1.27 -0.61 116.57 118.80 1l7x h LYS 782 Ca 0.29 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 58.92 1l7x h LYS 782 Cb 0.06 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1l7x h LYS 782 CO -0.13 0.48 -0.10 0.00 -0.57 0.00 0.00 179.45 179.13 1l7x h GLN 784 N 0.14 0.59 -0.50 0.00 1.08 -0.15 -1.51 115.11 114.75 1l7x h GLN 784 Ca 0.05 -0.04 -0.09 0.00 -1.45 0.00 0.00 58.65 57.12 1l7x h GLN 784 Cb 0.60 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.88 1l7x h GLN 784 CO 0.03 0.39 -0.07 -0.44 -0.95 0.00 0.00 178.83 177.79 1l7x h ASP 785 N 0.60 0.88 -0.24 1.46 3.32 -0.94 -2.42 116.42 119.08 1l7x h ASP 785 Ca 0.20 -0.26 -0.09 0.00 0.02 0.00 0.00 57.03 56.90 1l7x h ASP 785 Cb 0.05 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1l7x h ASP 785 CO -0.05 0.98 -0.14 0.11 -1.72 0.00 0.00 179.24 178.42 1l7x h LYS 786 N 0.81 0.66 -0.51 3.56 1.57 -1.03 -2.21 116.57 119.42 1l7x h LYS 786 Ca 0.14 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1l7x h LYS 786 Cb 0.58 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 1l7x h LYS 786 CO 0.04 0.77 0.32 0.28 -0.57 0.00 0.00 179.45 180.29 1l7x h VAL 787 N 0.60 1.15 -0.75 0.50 2.07 -1.07 -1.34 116.25 117.40 1l7x h VAL 787 Ca 0.10 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.33 1l7x h VAL 787 Cb 0.58 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 30.74 1l7x h VAL 787 CO 0.04 0.15 0.49 0.28 0.02 0.00 0.00 177.57 178.55 1l7x h SER 788 N 0.69 0.85 0.21 0.57 0.02 -1.14 -0.43 113.55 114.33 1l7x h SER 788 Ca 0.19 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.12 1l7x h SER 788 Cb -0.04 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 1l7x h SER 788 CO -0.04 0.61 -0.25 1.56 -1.14 0.00 0.00 176.83 177.58 1l7x h GLN 789 N 1.01 -0.49 -0.81 3.45 4.20 -0.83 -2.81 115.11 118.82 1l7x h GLN 789 Ca 0.28 0.03 0.01 0.00 0.06 0.00 0.00 58.65 59.03 1l7x h GLN 789 Cb -0.11 0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.75 1l7x h GLN 789 CO -0.06 -0.33 0.54 1.25 -0.67 0.00 0.00 178.83 179.55 1l7x h LEU 790 N -0.51 0.92 -1.88 1.46 5.85 -0.93 -2.33 115.31 117.89 1l7x h LEU 790 Ca 0.00 -0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.77 1l7x h LEU 790 Cb 0.49 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1l7x h LEU 790 CO -0.08 0.67 0.23 0.22 -0.34 0.00 0.00 178.44 179.13 1l7x h TYR 791 N 1.09 0.14 0.00 1.25 3.20 -0.83 0.59 116.97 122.42 1l7x h TYR 791 Ca 0.30 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.17 1l7x h TYR 791 Cb -0.12 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.10 1l7x h TYR 791 CO -0.00 0.08 0.00 -1.33 -1.64 0.00 0.00 178.16 175.27 1l7x n MET 792 N -4.47 0.60 -3.55 1.82 2.81 -0.88 -4.01 117.12 109.44 1l7x n MET 792 Ca 0.04 0.03 -0.27 0.00 -1.81 0.00 0.00 57.70 55.68 1l7x n MET 792 Cb 0.30 -1.50 -0.09 0.00 -0.71 0.00 0.00 33.22 31.22 1l7x n MET 792 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1l7x n ASN 793 N -1.11 3.45 -0.30 7.83 2.85 0.20 -4.98 115.26 123.21 1l7x n ASN 793 Ca 0.16 -3.36 0.13 0.00 -0.11 0.00 0.00 54.58 51.40 1l7x n ASN 793 Cb 0.12 -0.69 0.26 0.00 1.24 0.00 0.00 39.78 40.71 1l7x n ASN 793 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1l7x n PRO 794 N 1.19 -0.07 0.02 1.20 -0.02 -1.26 -0.05 135.00 136.02 1l7x n PRO 794 Ca 0.27 1.29 -0.11 0.00 -2.02 0.00 0.00 63.50 62.93 1l7x n PRO 794 Cb 0.40 -2.06 -0.06 0.00 -0.02 0.00 0.00 33.50 31.75 1l7x n PRO 794 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1l7x h LYS 795 N 0.00 0.04 -0.30 -0.52 1.63 -1.93 -0.79 116.57 114.70 1l7x h LYS 795 Ca 0.53 -0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 60.27 1l7x h LYS 795 Cb 1.10 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.71 1l7x h LYS 795 CO -0.81 0.03 -0.03 0.00 -3.45 0.00 0.00 179.45 175.18 1l7x h ALA 796 N 1.03 0.41 0.03 5.00 0.00 -0.80 -1.90 119.26 123.03 1l7x h ALA 796 Ca 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1l7x h ALA 796 Cb 0.01 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1l7x h ALA 796 CO -0.02 0.19 -0.04 2.35 0.00 0.00 0.00 179.25 181.73 1l7x h TRP 797 N 0.34 -0.10 0.00 0.00 2.91 -0.66 -2.00 115.95 116.45 1l7x h TRP 797 Ca 0.08 0.00 -0.08 0.00 1.13 0.00 0.00 58.89 60.02 1l7x h TRP 797 Cb 0.49 0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 29.17 1l7x h TRP 797 CO 0.04 -0.06 -0.40 -0.91 -1.03 0.00 0.00 178.44 176.08 1l7x h ASN 798 N -0.08 0.00 -0.50 2.65 2.35 -1.18 -0.90 115.58 117.91 1l7x h ASN 798 Ca 0.01 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1l7x h ASN 798 Cb 0.09 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 1l7x h ASN 798 CO -0.02 0.40 0.18 0.74 -1.65 0.00 0.00 177.43 177.08 1l7x h THR 799 N 0.00 1.22 -0.38 2.81 2.02 -1.06 0.16 112.91 117.68 1l7x h THR 799 Ca -0.00 -0.70 -0.07 0.00 0.77 0.00 0.00 66.41 66.40 1l7x h THR 799 Cb 0.81 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.95 1l7x h THR 799 CO 0.05 0.26 -0.04 -0.03 0.37 0.00 0.00 175.52 176.13 1l7x h MET 800 N 0.67 0.71 -0.58 6.66 1.85 -1.00 -2.36 114.93 120.88 1l7x h MET 800 Ca 0.16 -0.25 0.10 0.00 -0.61 0.00 0.00 59.70 59.11 1l7x h MET 800 Cb 0.23 -0.05 -0.08 0.00 0.43 0.00 0.00 31.60 32.12 1l7x h MET 800 CO -0.01 0.83 0.14 0.28 -0.40 0.00 0.00 176.91 177.75 1l7x h VAL 801 N 0.52 0.68 -0.59 -5.77 2.07 -0.66 -0.58 116.25 111.92 1l7x h VAL 801 Ca 0.10 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1l7x h VAL 801 Cb 0.54 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1l7x h VAL 801 CO 0.03 0.05 0.26 0.25 0.02 0.00 0.00 177.57 178.18 1l7x h LEU 802 N 0.29 0.77 -0.73 2.57 5.85 -0.44 -0.97 115.31 122.64 1l7x h LEU 802 Ca 0.30 -0.09 -0.13 0.00 0.84 0.00 0.00 57.88 58.81 1l7x h LEU 802 Cb 0.42 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1l7x h LEU 802 CO -0.37 0.67 -0.38 0.11 -0.34 0.00 0.00 178.44 178.13 1l7x h LYS 803 N 0.84 0.53 0.52 1.25 1.57 -0.69 0.11 116.57 120.70 1l7x h LYS 803 Ca 0.21 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 1l7x h LYS 803 Cb 0.12 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.44 1l7x h LYS 803 CO -0.02 0.83 -0.25 -0.91 -0.57 0.00 0.00 179.45 178.53 1l7x h ASN 804 N 0.44 -0.59 -0.96 0.86 2.35 -0.55 -0.85 115.58 116.28 1l7x h ASN 804 Ca 0.04 -0.06 0.12 0.00 -0.55 0.00 0.00 56.30 55.85 1l7x h ASN 804 Cb 0.86 0.15 -0.08 0.00 0.05 0.00 0.00 38.32 39.31 1l7x h ASN 804 CO 0.07 -0.24 0.61 0.40 -1.65 0.00 0.00 177.43 176.62 1l7x h ILE 805 N -0.97 0.90 0.00 2.81 2.04 -1.19 0.15 117.51 121.26 1l7x h ILE 805 Ca -0.07 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.42 1l7x h ILE 805 Cb 0.61 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1l7x h ILE 805 CO 0.12 0.16 -0.28 0.00 0.00 0.00 0.00 178.15 178.15 1l7x h ALA 806 N 1.56 1.43 -0.59 1.87 0.00 -0.83 -2.61 119.26 120.09 1l7x h ALA 806 Ca 0.47 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1l7x h ALA 806 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1l7x h ALA 806 CO -0.24 0.35 0.00 0.00 0.00 0.00 0.00 179.25 179.37 1l7x n ALA 807 N -2.44 2.75 0.54 0.00 0.00 0.45 -3.22 120.51 118.60 1l7x n ALA 807 Ca -0.02 -1.23 0.12 0.00 0.00 0.00 0.00 53.44 52.31 1l7x n ALA 807 Cb 0.34 -0.99 0.16 0.00 0.00 0.00 0.00 19.45 18.96 1l7x n ALA 807 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1l7x h SER 808 N 3.57 0.00 -0.97 0.00 4.64 -0.92 -3.40 113.55 116.48 1l7x h SER 808 Ca 0.00 -0.20 0.29 0.00 -0.47 0.00 0.00 61.79 61.41 1l7x h SER 808 Cb 1.08 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.99 1l7x h SER 808 CO 0.11 0.10 0.10 0.61 -0.87 0.00 0.00 176.83 176.88 1l7x n GLY 809 N 1.33 -1.23 0.43 -0.77 0.00 -1.25 -0.60 105.19 103.10 1l7x n GLY 809 Ca 0.03 0.92 0.25 0.00 0.00 0.00 0.00 46.02 47.22 1l7x n GLY 809 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1l7x h LYS 810 N 0.00 0.00 -0.60 1.61 3.64 -1.84 -2.65 116.57 116.73 1l7x h LYS 810 Ca 0.62 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.00 1l7x h LYS 810 Cb 1.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 1l7x h LYS 810 CO -0.88 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 177.49 1l7x n PHE 811 N -3.99 0.93 -2.48 1.91 3.72 0.23 -4.79 117.46 112.98 1l7x n PHE 811 Ca 0.14 -0.37 -0.41 0.00 -0.05 0.00 0.00 57.45 56.77 1l7x n PHE 811 Cb 0.84 -0.17 -0.04 0.00 -0.94 0.00 0.00 39.48 39.16 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 -0.74 7.25 0.00 4.37 0.15 -1.00 -0.46 113.70 123.28 1l7x s SER 812 Ca 0.31 2.21 0.14 0.00 0.70 0.00 0.00 55.95 59.31 1l7x s SER 812 Cb 0.20 -2.62 0.58 0.00 -1.71 0.00 0.00 66.02 62.48 1l7x s SER 812 CO 0.15 -0.19 1.43 -1.54 1.20 0.00 0.00 173.24 174.29 1l7x n SER 813 N 1.69 0.00 -0.01 5.45 3.41 -0.71 -1.89 113.62 121.55 1l7x n SER 813 Ca 0.01 0.49 -0.10 0.00 -0.26 0.00 0.00 58.87 59.01 1l7x n SER 813 Cb 0.45 -0.49 0.05 0.00 -0.26 0.00 0.00 64.21 63.96 1l7x n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1l7x h ASP 814 N 0.00 0.67 -0.23 4.04 3.45 -1.90 -1.29 116.42 121.16 1l7x h ASP 814 Ca 0.00 -0.35 -0.18 0.00 0.43 0.00 0.00 57.03 56.93 1l7x h ASP 814 Cb 0.23 -0.19 0.00 0.00 -0.56 0.00 0.00 39.33 38.81 1l7x h ASP 814 CO 0.00 1.07 -0.56 -0.09 -1.57 0.00 0.00 179.24 178.09 1l7x h ARG 815 N 0.48 0.83 0.14 3.56 1.12 -1.71 -1.16 114.38 117.64 1l7x h ARG 815 Ca 0.02 -0.53 -0.01 0.00 -1.11 0.00 0.00 59.98 58.35 1l7x h ARG 815 Cb 1.07 0.07 0.00 0.00 -0.01 0.00 0.00 29.97 31.09 1l7x h ARG 815 CO 0.10 1.17 -0.07 1.15 -3.11 0.00 0.00 179.97 179.21 1l7x h THR 816 N 0.63 0.87 -0.18 0.20 2.02 -1.48 -2.18 112.91 112.79 1l7x h THR 816 Ca 0.01 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 1l7x h THR 816 Cb 1.16 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1l7x h THR 816 CO 0.12 0.01 -0.07 0.40 0.37 0.00 0.00 175.52 176.35 1l7x h ILE 817 N -0.20 1.16 -0.57 3.11 1.08 -1.22 -1.49 117.51 119.38 1l7x h ILE 817 Ca -0.02 -0.67 -0.01 0.00 -0.39 0.00 0.00 64.86 63.77 1l7x h ILE 817 Cb 0.16 1.10 -0.03 0.00 -3.07 0.00 0.00 36.82 34.99 1l7x h ILE 817 CO 0.03 0.21 0.31 0.50 -0.69 0.00 0.00 178.15 178.51 1l7x h LYS 818 N 0.26 0.80 -0.03 2.37 3.64 -0.89 0.36 116.57 123.08 1l7x h LYS 818 Ca 0.06 -0.10 -0.12 0.00 -1.27 0.00 0.00 60.65 59.22 1l7x h LYS 818 Cb 0.30 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1l7x h LYS 818 CO 0.01 0.62 -0.55 0.93 -2.27 0.00 0.00 179.45 178.19 1l7x h GLU 819 N 0.77 0.08 -0.25 1.90 5.08 -0.89 -1.80 114.58 119.48 1l7x h GLU 819 Ca 0.20 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.40 1l7x h GLU 819 Cb 0.06 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 1l7x h GLU 819 CO -0.03 0.62 -0.26 1.88 -1.00 0.00 0.00 179.01 180.21 1l7x h TYR 820 N 0.06 0.74 -0.27 4.33 0.05 -0.63 -1.39 116.97 119.86 1l7x h TYR 820 Ca -0.00 -0.23 0.00 0.00 0.05 0.00 0.00 58.73 58.55 1l7x h TYR 820 Cb 1.00 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.57 1l7x h TYR 820 CO 0.01 0.95 0.18 0.00 -1.05 0.00 0.00 178.16 178.24 1l7x h ALA 821 N 0.67 0.35 -0.09 3.88 0.00 -0.14 -1.13 119.26 122.80 1l7x h ALA 821 Ca 0.04 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 1l7x h ALA 821 Cb 0.83 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.52 1l7x h ALA 821 CO 0.06 -0.19 -0.64 1.96 0.00 0.00 0.00 179.25 180.44 1l7x h GLN 822 N 0.36 0.59 0.00 0.00 4.20 -1.34 0.14 115.11 119.06 1l7x h GLN 822 Ca 0.10 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.29 1l7x h GLN 822 Cb -0.03 0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1l7x h GLN 822 CO -0.03 1.14 -1.29 0.09 -0.67 0.00 0.00 178.83 178.07 1l7x n ASN 823 N -4.12 0.56 0.02 1.46 3.02 -0.53 -4.46 115.26 111.21 1l7x n ASN 823 Ca -0.09 -0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.09 1l7x n ASN 823 Cb 0.68 1.19 0.00 0.00 -0.61 0.00 0.00 39.78 41.03 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 -1.92 0.21 0.16 2.41 5.41 -0.53 -4.87 119.36 120.23 1l7x n ILE 824 Ca 0.01 0.07 0.11 0.00 1.00 0.00 0.00 62.75 63.94 1l7x n ILE 824 Cb 0.44 -1.28 0.09 0.00 -0.71 0.00 0.00 39.64 38.18 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 -5.95 1.39 6.55 -1.41 -3.49 115.95 113.04 1l7x h TRP 825 Ca 0.00 0.00 -0.37 0.00 0.95 0.00 0.00 58.89 59.47 1l7x h TRP 825 Cb 0.60 0.00 0.12 0.00 -0.86 0.00 0.00 29.16 29.02 1l7x h TRP 825 CO 0.00 0.04 -0.90 -1.71 -1.05 0.00 0.00 178.44 174.82 1l7x n ASN 826 N -2.93 -5.33 -4.15 -3.49 5.15 0.44 -4.92 115.26 100.02 1l7x n ASN 826 Ca 0.02 -0.90 -0.12 0.00 -0.60 0.00 0.00 54.58 52.99 1l7x n ASN 826 Cb 0.56 -4.06 -0.10 0.00 -0.53 0.00 0.00 39.78 35.64 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 -3.46 0.71 0.15 3.44 -7.23 -0.85 -4.95 120.40 108.21 1l7x s VAL 827 Ca 0.42 -1.72 0.09 0.00 -1.81 0.00 0.00 61.98 58.96 1l7x s VAL 827 Cb -0.12 -1.42 -0.04 0.00 0.56 0.00 0.00 36.38 35.37 1l7x s VAL 827 CO 0.82 -0.72 -0.20 -1.61 -0.31 0.00 0.00 175.10 173.08 1l7x s GLU 828 N -3.20 1.24 0.00 4.82 2.02 -1.26 -4.43 118.70 117.89 1l7x s GLU 828 Ca 0.06 -1.34 0.06 0.00 0.02 0.00 0.00 54.97 53.78 1l7x s GLU 828 Cb 0.01 -1.39 0.38 0.00 0.10 0.00 0.00 34.13 33.23 1l7x s GLU 828 CO -0.03 0.30 0.84 -2.30 0.02 0.00 0.00 175.26 174.09