#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p6x h ARG 4 N 0.00 0.36 0.01 -1.09 -0.00 -1.99 -1.65 114.38 110.03 2p6x h ARG 4 Ca 0.00 -0.02 -0.21 0.00 -0.50 0.00 0.00 59.98 59.25 2p6x h ARG 4 Cb 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 29.97 29.86 2p6x h ARG 4 CO 0.00 0.24 -1.11 1.05 0.00 0.00 0.00 179.97 180.15 2p6x h GLU 5 N 0.37 0.03 -0.63 0.04 -0.00 -2.03 -2.78 114.58 109.58 2p6x h GLU 5 Ca 0.36 -0.05 0.12 0.00 -0.00 0.00 0.00 59.36 59.80 2p6x h GLU 5 Cb 0.88 0.02 -0.09 0.00 -0.00 0.00 0.00 28.75 29.55 2p6x h GLU 5 CO -0.11 1.02 0.12 0.82 -0.00 0.00 0.00 179.01 180.86 2p6x h ILE 6 N -0.91 0.60 -0.56 -1.06 2.04 -1.96 0.37 117.51 116.01 2p6x h ILE 6 Ca -0.30 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 2p6x h ILE 6 Cb 1.32 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 2p6x h ILE 6 CO -0.15 0.04 0.26 -0.07 0.00 0.00 0.00 178.15 178.23 2p6x h LEU 7 N 0.24 0.75 -1.11 1.44 4.07 -1.41 -0.39 115.31 118.90 2p6x h LEU 7 Ca 0.33 -0.14 -0.09 0.00 0.08 0.00 0.00 57.88 58.06 2p6x h LEU 7 Cb 0.52 -0.19 -0.01 0.00 1.08 0.00 0.00 40.66 42.05 2p6x h LEU 7 CO -0.44 0.69 -0.41 -0.61 -1.08 0.00 0.00 178.44 176.59 2p6x h GLN 8 N 0.77 0.00 0.73 1.13 5.75 -0.87 -0.09 115.11 122.53 2p6x h GLN 8 Ca 0.19 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.66 2p6x h GLN 8 Cb 0.15 0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.70 2p6x h GLN 8 CO -0.02 0.41 -0.35 0.87 -2.65 0.00 0.00 178.83 177.09 2p6x h LYS 9 N 0.00 -0.94 -0.72 1.69 6.56 0.18 0.15 116.57 123.49 2p6x h LYS 9 Ca -0.00 0.06 0.14 0.00 -1.06 0.00 0.00 60.65 59.79 2p6x h LYS 9 Cb 0.80 0.21 -0.10 0.00 -0.57 0.00 0.00 32.23 32.58 2p6x h LYS 9 CO 0.05 -0.61 0.24 0.35 -2.06 0.00 0.00 179.45 177.43 2p6x h PHE 10 N -1.11 0.40 -0.35 -1.35 3.57 -0.89 0.34 116.94 117.55 2p6x h PHE 10 Ca -0.10 0.04 -0.13 0.00 3.53 0.00 0.00 57.97 61.31 2p6x h PHE 10 Cb 0.77 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 2p6x h PHE 10 CO -0.01 0.01 -0.29 -0.07 -2.23 0.00 0.00 178.31 175.73 2p6x h LEU 11 N 0.37 0.86 -0.52 0.59 3.38 -0.95 -1.97 115.31 117.06 2p6x h LEU 11 Ca 0.39 -0.45 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2p6x h LEU 11 Cb 0.61 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2p6x h LEU 11 CO -0.42 1.13 -0.04 0.44 0.09 0.00 0.00 178.44 179.63 2p6x h ASP 12 N 0.59 0.94 -0.03 -0.43 3.32 0.66 -1.01 116.42 120.47 2p6x h ASP 12 Ca 0.06 -0.33 0.03 0.00 0.02 0.00 0.00 57.03 56.81 2p6x h ASP 12 Cb 0.86 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.13 2p6x h ASP 12 CO 0.07 1.04 -0.15 -0.33 -1.72 0.00 0.00 179.24 178.15 2p6x h GLU 13 N 0.81 -0.23 -1.01 3.56 5.08 -0.31 0.12 114.58 122.61 2p6x h GLU 13 Ca 0.14 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.55 2p6x h GLU 13 Cb 0.58 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.83 2p6x h GLU 13 CO 0.03 -0.16 0.66 0.00 -1.00 0.00 0.00 179.01 178.55 2p6x h ALA 14 N 0.72 1.33 -0.22 3.43 0.00 -1.10 0.88 119.26 124.29 2p6x h ALA 14 Ca 0.06 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2p6x h ALA 14 Cb 0.32 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2p6x h ALA 14 CO -0.17 0.56 -0.37 0.37 0.00 0.00 0.00 179.25 179.65 2p6x h GLN 15 N 1.28 0.49 0.04 0.00 -0.00 -0.96 -3.29 115.11 112.67 2p6x h GLN 15 Ca 0.40 -0.23 -0.24 0.00 -0.00 0.00 0.00 58.65 58.58 2p6x h GLN 15 Cb -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 27.48 27.47 2p6x h GLN 15 CO -0.12 0.78 -1.03 0.77 0.00 0.00 0.00 178.83 179.23 2p6x h SER 16 N 0.41 0.47 -3.07 -0.69 0.02 0.45 -3.42 113.55 107.72 2p6x h SER 16 Ca 0.04 -0.42 -0.50 0.00 -0.84 0.00 0.00 61.79 60.08 2p6x h SER 16 Cb 0.83 -0.15 -0.40 0.00 0.14 0.00 0.00 62.40 62.82 2p6x h SER 16 CO 0.07 1.25 -0.76 -0.75 -1.14 0.00 0.00 176.83 175.50 2p6x s LYS 17 N -3.07 0.29 0.29 3.45 2.47 0.19 -5.08 119.74 118.28 2p6x s LYS 17 Ca -0.05 -0.33 -0.28 0.00 -1.56 0.00 0.00 55.97 53.75 2p6x s LYS 17 Cb 0.08 -1.80 -0.09 0.00 -1.46 0.00 0.00 37.83 34.56 2p6x s LYS 17 CO 0.87 -0.75 0.98 0.21 0.16 0.00 0.00 175.35 176.82 2p6x s LYS 18 N 2.02 4.67 -0.21 4.03 2.36 -1.25 -4.52 119.74 126.84 2p6x s LYS 18 Ca 0.03 1.51 -0.19 0.00 -2.55 0.00 0.00 55.97 54.76 2p6x s LYS 18 Cb -0.16 -3.06 -0.03 0.00 -1.05 0.00 0.00 37.83 33.53 2p6x s LYS 18 CO -0.15 0.33 0.55 0.42 1.55 0.00 0.00 175.35 178.05 2p6x s ILE 19 N -1.35 5.07 0.61 5.43 -1.09 -1.26 -5.06 121.20 123.56 2p6x s ILE 19 Ca 0.46 1.02 -0.08 0.00 -2.23 0.00 0.00 60.65 59.82 2p6x s ILE 19 Cb -0.25 -3.87 0.00 0.00 -1.58 0.00 0.00 42.46 36.77 2p6x s ILE 19 CO 0.31 0.14 0.95 0.42 -1.23 0.00 0.00 174.94 175.53 2p6x s THR 20 N 1.82 3.77 0.21 2.92 -4.23 -1.26 -4.91 115.64 113.96 2p6x s THR 20 Ca 0.25 0.19 -0.09 0.00 -1.18 0.00 0.00 61.69 60.86 2p6x s THR 20 Cb -0.16 -3.51 0.16 0.00 1.34 0.00 0.00 72.50 70.33 2p6x s THR 20 CO 0.10 -0.58 1.73 0.11 -0.54 0.00 0.00 174.62 175.44 2p6x h LYS 21 N -0.28 0.33 -0.62 3.99 1.79 -1.99 -0.63 116.57 119.15 2p6x h LYS 21 Ca -0.45 -0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 57.95 2p6x h LYS 21 Cb 1.25 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.79 2p6x h LYS 21 CO 0.62 0.22 0.22 1.49 -1.08 0.00 0.00 179.45 180.92 2p6x h GLU 22 N 0.34 0.93 -0.52 3.15 4.81 -1.99 -1.28 114.58 120.03 2p6x h GLU 22 Ca 0.32 -0.17 -0.04 0.00 -0.13 0.00 0.00 59.36 59.34 2p6x h GLU 22 Cb 0.44 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 2p6x h GLU 22 CO -0.36 0.79 0.17 0.93 -0.73 0.00 0.00 179.01 179.81 2p6x h GLU 23 N 0.91 0.81 -0.90 1.92 5.08 -1.71 -1.41 114.58 119.27 2p6x h GLU 23 Ca 0.21 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2p6x h GLU 23 Cb 0.23 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 2p6x h GLU 23 CO -0.01 0.74 0.54 0.74 -1.00 0.00 0.00 179.01 180.01 2p6x h PHE 24 N 0.71 1.20 -0.68 4.33 0.04 -0.96 0.78 116.94 122.37 2p6x h PHE 24 Ca 0.17 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.91 2p6x h PHE 24 Cb 0.26 -0.39 -0.03 0.00 2.20 0.00 0.00 35.95 37.98 2p6x h PHE 24 CO 0.01 0.81 0.36 0.00 -0.60 0.00 0.00 178.31 178.88 2p6x h ALA 25 N 1.29 0.87 -0.31 2.45 0.00 -0.87 -0.35 119.26 122.35 2p6x h ALA 25 Ca 0.32 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 2p6x h ALA 25 Cb -0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2p6x h ALA 25 CO -0.06 0.40 -0.25 -0.91 0.00 0.00 0.00 179.25 178.43 2p6x h ASN 26 N 0.93 0.75 -0.31 0.00 2.35 -0.97 -1.26 115.58 117.07 2p6x h ASN 26 Ca 0.24 -0.45 0.01 0.00 -0.55 0.00 0.00 56.30 55.55 2p6x h ASN 26 Cb 0.07 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 2p6x h ASN 26 CO -0.04 1.04 0.18 -0.33 -1.65 0.00 0.00 177.43 176.64 2p6x h GLU 27 N 0.46 0.36 -0.14 0.81 5.08 -0.56 -2.61 114.58 117.99 2p6x h GLU 27 Ca 0.06 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 2p6x h GLU 27 Cb 0.81 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 2p6x h GLU 27 CO 0.06 0.24 -0.22 0.35 -1.00 0.00 0.00 179.01 178.45 2p6x h PHE 28 N 0.37 0.25 -0.87 4.33 3.57 -0.87 -2.28 116.94 121.44 2p6x h PHE 28 Ca 0.12 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 2p6x h PHE 28 Cb -0.00 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 2p6x h PHE 28 CO -0.08 0.44 0.52 1.25 -2.23 0.00 0.00 178.31 178.21 2p6x h LEU 29 N 0.22 1.05 -1.34 0.59 5.85 -0.87 -1.89 115.31 118.91 2p6x h LEU 29 Ca 0.04 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 2p6x h LEU 29 Cb 0.51 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2p6x h LEU 29 CO 0.03 0.81 -0.16 0.11 -0.34 0.00 0.00 178.44 178.89 2p6x h LYS 30 N 1.20 0.24 -0.37 1.25 1.57 -1.12 0.28 116.57 119.63 2p6x h LYS 30 Ca 0.31 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.89 2p6x h LYS 30 Cb -0.04 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2p6x h LYS 30 CO -0.06 0.41 -0.31 -0.07 -0.57 0.00 0.00 179.45 178.85 2p6x h LEU 31 N 0.23 0.91 -0.47 2.94 3.38 -1.19 -1.83 115.31 119.28 2p6x h LEU 31 Ca 0.04 -0.45 -0.11 0.00 0.09 0.00 0.00 57.88 57.45 2p6x h LEU 31 Cb 0.42 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2p6x h LEU 31 CO 0.03 1.17 -0.14 0.11 0.09 0.00 0.00 178.44 179.70 2p6x h LYS 32 N 0.66 0.93 -0.73 1.13 1.57 -1.02 -2.52 116.57 116.58 2p6x h LYS 32 Ca 0.07 -0.37 0.13 0.00 -1.87 0.00 0.00 60.65 58.61 2p6x h LYS 32 Cb 0.89 -0.05 -0.09 0.00 0.08 0.00 0.00 32.23 33.06 2p6x h LYS 32 CO 0.08 1.02 0.28 0.00 -0.57 0.00 0.00 179.45 180.26 2p6x h ARG 33 N 0.78 0.41 -0.64 3.15 3.08 -0.85 -1.41 114.38 118.89 2p6x h ARG 33 Ca 0.12 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 2p6x h ARG 33 Cb 0.69 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.62 2p6x h ARG 33 CO 0.05 0.27 0.34 1.96 -1.07 0.00 0.00 179.97 181.52 2p6x h GLN 34 N 0.42 0.91 -0.23 0.04 4.20 -0.97 -1.93 115.11 117.55 2p6x h GLN 34 Ca 0.40 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.99 2p6x h GLN 34 Cb 0.59 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 2p6x h GLN 34 CO -0.40 0.70 0.15 0.77 -0.67 0.00 0.00 178.83 179.39 2p6x h SER 35 N 0.88 0.27 -0.66 1.46 0.02 -1.01 -0.67 113.55 113.84 2p6x h SER 35 Ca 0.22 -0.01 0.12 0.00 -0.84 0.00 0.00 61.79 61.28 2p6x h SER 35 Cb 0.07 -0.07 -0.08 0.00 0.14 0.00 0.00 62.40 62.46 2p6x h SER 35 CO -0.03 0.20 0.23 0.74 -1.14 0.00 0.00 176.83 176.83 2p6x h THR 36 N 0.32 0.70 -0.21 -2.27 2.02 -1.08 -1.28 112.91 111.10 2p6x h THR 36 Ca 0.09 -0.13 -0.16 0.00 0.77 0.00 0.00 66.41 66.97 2p6x h THR 36 Cb -0.04 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 2p6x h THR 36 CO -0.02 0.07 -0.52 0.50 0.37 0.00 0.00 175.52 175.93 2p6x h LYS 37 N 0.39 0.60 -0.59 6.66 1.63 -0.96 -2.05 116.57 122.26 2p6x h LYS 37 Ca 0.35 -0.36 0.03 0.00 -0.85 0.00 0.00 60.65 59.82 2p6x h LYS 37 Cb 0.49 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.11 2p6x h LYS 37 CO -0.36 0.97 0.34 1.88 -3.45 0.00 0.00 179.45 178.83 2p6x h TYR 38 N 0.47 0.64 -0.13 1.91 0.05 -0.38 0.08 116.97 119.61 2p6x h TYR 38 Ca 0.02 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 2p6x h TYR 38 Cb 1.06 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 38.59 2p6x h TYR 38 CO 0.05 0.35 0.06 -0.22 -1.05 0.00 0.00 178.16 177.35 2p6x h LYS 39 N 0.67 0.19 -0.56 4.88 1.63 -1.02 0.45 116.57 122.81 2p6x h LYS 39 Ca 0.24 -0.03 0.05 0.00 -0.85 0.00 0.00 60.65 60.07 2p6x h LYS 39 Cb 0.06 -0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 31.61 2p6x h LYS 39 CO -0.12 0.24 0.29 0.00 -3.45 0.00 0.00 179.45 176.41 2p6x h ALA 40 N 0.94 0.73 0.00 5.00 0.00 -1.16 -2.01 119.26 122.76 2p6x h ALA 40 Ca 0.05 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2p6x h ALA 40 Cb 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2p6x h ALA 40 CO -0.01 -0.05 0.00 -0.25 0.00 0.00 0.00 179.25 178.94 2p6x n ASP 41 N -4.86 0.10 -3.25 0.00 8.00 -0.00 -4.92 116.55 111.62 2p6x n ASP 41 Ca 0.06 0.51 -0.23 0.00 0.71 0.00 0.00 54.79 55.84 2p6x n ASP 41 Cb 0.15 -0.54 0.04 0.00 -0.02 0.00 0.00 41.12 40.76 2p6x n ASP 41 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2p6x n LYS 42 N -1.60 -5.68 -0.17 -1.24 5.02 0.05 -4.91 118.16 109.63 2p6x n LYS 42 Ca 0.06 0.84 -0.05 0.00 -2.02 0.00 0.00 58.31 57.15 2p6x n LYS 42 Cb 0.32 -5.75 0.13 0.00 -0.02 0.00 0.00 35.03 29.71 2p6x n LYS 42 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2p6x h THR 43 N -1.76 1.24 -2.14 -0.18 2.02 -1.56 -3.34 112.91 107.19 2p6x h THR 43 Ca -0.54 -0.93 -0.58 0.00 0.77 0.00 0.00 66.41 65.13 2p6x h THR 43 Cb 1.36 0.67 -0.40 0.00 -1.74 0.00 0.00 68.15 68.04 2p6x h THR 43 CO 0.57 0.35 -0.84 -1.22 0.37 0.00 0.00 175.52 174.74 2p6x n TYR 44 N -4.24 1.62 -1.33 3.16 4.01 -1.26 -5.09 117.16 114.03 2p6x n TYR 44 Ca 0.04 -3.86 -0.36 0.00 -0.16 0.00 0.00 57.90 53.57 2p6x n TYR 44 Cb 0.26 -0.43 0.09 0.00 -0.31 0.00 0.00 39.34 38.94 2p6x n TYR 44 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2p6x n PRO 45 N 1.22 0.47 -2.30 -0.72 -0.02 -1.26 -4.69 135.00 127.70 2p6x n PRO 45 Ca 0.25 0.21 -0.18 0.00 -2.02 0.00 0.00 63.50 61.77 2p6x n PRO 45 Cb 0.47 -2.20 0.03 0.00 -0.02 0.00 0.00 33.50 31.77 2p6x n PRO 45 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2p6x n THR 46 N -2.55 2.14 -0.15 3.45 -2.24 -1.26 -0.53 114.28 113.13 2p6x n THR 46 Ca 0.13 -3.91 -0.06 0.00 -2.27 0.00 0.00 64.05 57.93 2p6x n THR 46 Cb 0.49 -0.46 0.11 0.00 -2.10 0.00 0.00 70.33 68.37 2p6x n THR 46 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2p6x h THR 47 N 3.12 1.25 -0.24 4.28 1.35 -1.92 -2.80 112.91 117.95 2p6x h THR 47 Ca 0.22 -1.05 -0.08 0.00 -0.55 0.00 0.00 66.41 64.95 2p6x h THR 47 Cb 1.40 0.82 -0.01 0.00 -1.73 0.00 0.00 68.15 68.64 2p6x h THR 47 CO 0.61 0.38 -0.15 0.58 -0.25 0.00 0.00 175.52 176.69 2p6x h VAL 48 N 0.85 1.31 0.00 6.82 2.07 -1.91 -2.80 116.25 122.59 2p6x h VAL 48 Ca 0.16 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.41 2p6x h VAL 48 Cb 0.48 1.61 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 2p6x h VAL 48 CO 0.02 0.39 -0.09 0.00 0.02 0.00 0.00 177.57 177.91 2p6x h ALA 49 N 0.70 1.59 0.00 1.67 0.00 -1.81 -2.39 119.26 119.02 2p6x h ALA 49 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2p6x h ALA 49 Cb 0.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2p6x h ALA 49 CO 0.04 0.11 -0.34 0.39 0.00 0.00 0.00 179.25 179.45 2p6x n GLU 50 N -4.05 0.01 -1.75 0.00 1.02 -1.07 -3.60 120.64 111.19 2p6x n GLU 50 Ca -0.03 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.72 2p6x n GLU 50 Cb 0.17 -1.51 0.02 0.00 -0.02 0.00 0.00 31.44 30.10 2p6x n GLU 50 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2p6x n LYS 51 N -1.52 2.24 -0.33 3.49 5.02 -0.90 -4.71 118.16 121.44 2p6x n LYS 51 Ca 0.06 0.79 0.23 0.00 -2.02 0.00 0.00 58.31 57.38 2p6x n LYS 51 Cb 0.34 -2.59 0.51 0.00 -0.02 0.00 0.00 35.03 33.27 2p6x n LYS 51 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 2p6x h PRO 52 N 2.31 0.37 0.00 1.97 0.11 -1.91 0.12 132.00 134.98 2p6x h PRO 52 Ca -0.50 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 2p6x h PRO 52 Cb 1.27 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2p6x h PRO 52 CO 0.61 0.24 -0.17 -0.22 -0.21 0.00 0.00 178.00 178.26 2p6x h LYS 53 N 0.38 0.00 0.00 1.05 3.64 -1.94 -3.28 116.57 116.42 2p6x h LYS 53 Ca 0.61 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.99 2p6x h LYS 53 Cb 1.56 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.38 2p6x h LYS 53 CO -0.31 0.17 -1.02 0.09 -2.27 0.00 0.00 179.45 176.11 2p6x n ASN 54 N -3.77 2.17 -0.06 4.20 3.02 0.23 -4.77 115.26 116.29 2p6x n ASN 54 Ca -0.02 -0.24 0.06 0.00 -0.03 0.00 0.00 54.58 54.35 2p6x n ASN 54 Cb 0.27 1.24 0.42 0.00 -0.61 0.00 0.00 39.78 41.10 2p6x n ASN 54 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2p6x h ILE 55 N 0.00 1.06 0.00 2.41 6.09 -1.06 0.41 117.51 126.42 2p6x h ILE 55 Ca 0.00 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 63.29 2p6x h ILE 55 Cb 0.31 0.42 0.00 0.00 0.47 0.00 0.00 36.82 38.01 2p6x h ILE 55 CO 0.00 0.11 0.00 0.29 -3.07 0.00 0.00 178.15 175.48 2p6x n LYS 56 N -4.47 0.55 -0.05 2.19 4.76 -1.26 -2.62 118.16 117.25 2p6x n LYS 56 Ca 0.06 0.02 0.11 0.00 -2.87 0.00 0.00 58.31 55.62 2p6x n LYS 56 Cb 0.14 -1.50 0.46 0.00 -1.84 0.00 0.00 35.03 32.29 2p6x n LYS 56 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2p6x n LYS 57 N -1.20 1.53 -3.82 1.97 5.02 0.13 -4.78 118.16 117.01 2p6x n LYS 57 Ca 0.16 -0.80 -0.36 0.00 -2.02 0.00 0.00 58.31 55.29 2p6x n LYS 57 Cb 0.19 -1.39 -0.11 0.00 -0.02 0.00 0.00 35.03 33.70 2p6x n LYS 57 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2p6x s ASN 58 N -1.64 5.46 0.21 4.39 0.01 -1.08 -4.56 114.94 117.74 2p6x s ASN 58 Ca 0.33 -0.07 -0.07 0.00 -0.71 0.00 0.00 52.86 52.33 2p6x s ASN 58 Cb 0.17 -1.97 0.16 0.00 0.41 0.00 0.00 41.25 40.02 2p6x s ASN 58 CO 0.27 0.04 1.77 -0.09 -1.51 0.00 0.00 177.10 177.57 2p6x h ARG 59 N 7.71 1.18 -4.87 -0.60 2.43 -1.89 -3.41 114.38 114.94 2p6x h ARG 59 Ca -0.37 -0.23 -0.60 0.00 -0.81 0.00 0.00 59.98 57.97 2p6x h ARG 59 Cb 1.18 -0.18 -0.34 0.00 -0.42 0.00 0.00 29.97 30.20 2p6x h ARG 59 CO 0.61 0.97 -0.84 0.71 -1.51 0.00 0.00 179.97 179.91 2p6x s TYR 60 N -5.50 2.09 0.33 2.20 2.02 -1.26 -5.04 117.35 112.19 2p6x s TYR 60 Ca -0.12 -0.95 0.28 0.00 -0.37 0.00 0.00 57.07 55.91 2p6x s TYR 60 Cb 0.16 -1.47 1.37 0.00 -0.40 0.00 0.00 41.96 41.61 2p6x s TYR 60 CO 0.84 -0.46 2.02 1.57 -1.57 0.00 0.00 175.55 177.95 2p6x h LYS 61 N 7.24 0.00 -0.00 -0.62 2.10 -1.94 -2.03 116.57 121.32 2p6x h LYS 61 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 2p6x h LYS 61 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 2p6x h LYS 61 CO 0.49 0.13 -0.33 -0.40 -2.00 0.00 0.00 179.45 177.35 2p6x n ASP 62 N -3.48 0.48 -4.11 7.07 5.75 -1.26 -4.68 116.55 116.32 2p6x n ASP 62 Ca -0.01 -0.25 -0.37 0.00 -0.01 0.00 0.00 54.79 54.15 2p6x n ASP 62 Cb 0.28 0.06 -0.10 0.00 -1.03 0.00 0.00 41.12 40.33 2p6x n ASP 62 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2p6x s ILE 63 N -2.86 3.62 -0.07 2.12 -1.09 -0.76 -5.06 121.20 117.09 2p6x s ILE 63 Ca 0.16 -2.65 0.04 0.00 -2.23 0.00 0.00 60.65 55.97 2p6x s ILE 63 Cb 0.18 -3.39 -0.02 0.00 -1.58 0.00 0.00 42.46 37.65 2p6x s ILE 63 CO 0.61 -0.82 -0.19 -0.76 -1.23 0.00 0.00 174.94 172.55 2p6x s LEU 64 N 0.34 2.42 0.29 2.97 1.43 -1.26 -4.73 118.68 120.13 2p6x s LEU 64 Ca 0.14 -0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 52.57 2p6x s LEU 64 Cb -0.21 -1.48 -0.10 0.00 0.03 0.00 0.00 46.19 44.42 2p6x s LEU 64 CO -0.04 0.26 1.42 -2.16 0.23 0.00 0.00 176.35 176.07 2p6x s PRO 65 N -0.22 4.26 0.29 1.29 0.04 -1.26 -4.65 135.00 134.75 2p6x s PRO 65 Ca -0.01 2.34 -0.30 0.00 0.04 0.00 0.00 61.00 63.07 2p6x s PRO 65 Cb -0.13 -3.07 -0.12 0.00 0.04 0.00 0.00 34.50 31.21 2p6x s PRO 65 CO 0.03 -0.39 1.52 0.66 0.04 0.00 0.00 177.00 178.86 2p6x n TYR 66 N 1.69 2.65 -0.18 0.56 4.01 -1.26 -4.63 117.16 120.01 2p6x n TYR 66 Ca 0.04 0.33 -0.01 0.00 -0.16 0.00 0.00 57.90 58.11 2p6x n TYR 66 Cb 0.40 -2.55 0.08 0.00 -0.31 0.00 0.00 39.34 36.97 2p6x n TYR 66 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2p6x h ASP 67 N 4.37 -0.11 0.56 7.72 3.32 -1.09 -2.53 116.42 128.66 2p6x h ASP 67 Ca -0.47 0.12 -0.05 0.00 0.02 0.00 0.00 57.03 56.65 2p6x h ASP 67 Cb 1.24 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.97 2p6x h ASP 67 CO 0.76 -0.03 -0.26 0.10 -1.72 0.00 0.00 179.24 178.09 2p6x h TYR 68 N 0.18 0.00 -0.24 4.55 -0.00 -1.91 -2.92 116.97 116.64 2p6x h TYR 68 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.01 2p6x h TYR 68 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.15 2p6x h TYR 68 CO -0.28 0.26 0.00 -1.13 -0.00 0.00 0.00 178.16 177.01 2p6x n SER 69 N -3.70 2.58 -4.78 0.10 3.41 -1.16 -5.04 113.62 105.04 2p6x n SER 69 Ca -0.01 -1.88 -0.33 0.00 -0.26 0.00 0.00 58.87 56.38 2p6x n SER 69 Cb 0.37 -0.16 0.03 0.00 -0.26 0.00 0.00 64.21 64.20 2p6x n SER 69 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2p6x s ARG 70 N -0.96 2.99 -0.25 4.33 1.70 -0.96 -0.86 118.95 124.94 2p6x s ARG 70 Ca 0.18 1.41 -0.20 0.00 -0.47 0.00 0.00 55.73 56.65 2p6x s ARG 70 Cb 0.10 -1.97 -0.02 0.00 -0.57 0.00 0.00 34.95 32.48 2p6x s ARG 70 CO 0.13 -1.10 0.60 0.08 -1.08 0.00 0.00 175.30 173.93 2p6x s VAL 71 N -2.23 5.01 -0.07 4.99 1.01 -0.83 -4.73 120.40 123.55 2p6x s VAL 71 Ca 0.68 1.07 -0.11 0.00 0.00 0.00 0.00 61.98 63.61 2p6x s VAL 71 Cb -0.21 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.22 2p6x s VAL 71 CO 0.38 0.05 0.28 -1.61 0.00 0.00 0.00 175.10 174.20 2p6x s GLU 72 N 2.39 3.73 -0.17 2.72 2.02 -1.26 -4.20 118.70 123.93 2p6x s GLU 72 Ca 0.25 0.14 -0.07 0.00 0.02 0.00 0.00 54.97 55.31 2p6x s GLU 72 Cb -0.16 -3.22 -0.04 0.00 0.10 0.00 0.00 34.13 30.81 2p6x s GLU 72 CO 0.09 0.69 0.06 -0.51 0.02 0.00 0.00 175.26 175.61 2p6x s LEU 73 N -0.92 3.82 0.00 1.80 1.43 -0.18 -4.98 118.68 119.65 2p6x s LEU 73 Ca 0.19 0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.40 2p6x s LEU 73 Cb -0.14 -1.95 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2p6x s LEU 73 CO 0.08 0.21 0.21 -1.54 0.23 0.00 0.00 176.35 175.54 2p6x n SER 74 N 3.28 0.42 -4.61 2.29 3.41 -1.26 -4.08 113.62 113.06 2p6x n SER 74 Ca -0.17 -0.79 -0.43 0.00 -0.26 0.00 0.00 58.87 57.22 2p6x n SER 74 Cb 0.53 0.18 -0.02 0.00 -0.26 0.00 0.00 64.21 64.63 2p6x n SER 74 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2p6x s LEU 75 N -0.36 3.69 -0.27 1.04 2.96 -1.26 -4.97 118.68 119.52 2p6x s LEU 75 Ca 0.00 1.08 -0.16 0.00 -0.22 0.00 0.00 54.13 54.83 2p6x s LEU 75 Cb 0.00 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.12 2p6x s LEU 75 CO 0.00 -1.35 0.43 -0.63 -1.32 0.00 0.00 176.35 173.48 2p6x s ILE 76 N 5.29 5.13 -0.73 6.68 1.01 -1.26 -4.88 121.20 132.44 2p6x s ILE 76 Ca 0.63 0.69 0.11 0.00 0.00 0.00 0.00 60.65 62.09 2p6x s ILE 76 Cb -0.17 -3.76 -0.07 0.00 0.01 0.00 0.00 42.46 38.48 2p6x s ILE 76 CO 0.30 0.12 0.55 0.35 0.00 0.00 0.00 174.94 176.26 2p6x n THR 77 N 5.14 0.00 -3.60 2.92 -2.24 -1.26 -5.08 114.28 110.16 2p6x n THR 77 Ca -0.07 -0.30 0.01 0.00 -2.27 0.00 0.00 64.05 61.42 2p6x n THR 77 Cb 0.50 1.06 -0.01 0.00 -2.10 0.00 0.00 70.33 69.78 2p6x n THR 77 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2p6x s SER 78 N -1.79 -0.05 0.58 3.42 1.04 -1.26 -4.98 113.70 110.67 2p6x s SER 78 Ca 0.06 -0.06 0.36 0.00 0.48 0.00 0.00 55.95 56.79 2p6x s SER 78 Cb 0.09 0.09 1.75 0.00 0.10 0.00 0.00 66.02 68.05 2p6x s SER 78 CO 0.37 -0.17 2.14 0.44 0.98 0.00 0.00 173.24 177.00 2p6x h ASP 79 N 2.00 0.00 1.34 7.02 3.32 -2.03 -2.50 116.42 125.58 2p6x h ASP 79 Ca -0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.82 2p6x h ASP 79 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2p6x h ASP 79 CO 0.26 0.04 -0.56 -0.33 -1.72 0.00 0.00 179.24 176.93 2p6x h GLU 80 N 0.00 0.00 -6.65 3.56 4.39 -2.04 -3.46 114.58 110.38 2p6x h GLU 80 Ca -0.00 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.18 2p6x h GLU 80 Cb 0.30 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 29.00 2p6x h GLU 80 CO 0.00 0.00 0.93 -0.51 -1.16 0.00 0.00 179.01 178.27 2p6x s ASP 81 N -5.44 6.49 0.50 1.42 1.01 -0.94 -5.03 116.67 114.68 2p6x s ASP 81 Ca 0.04 2.74 0.02 0.00 0.71 0.00 0.00 52.55 56.05 2p6x s ASP 81 Cb 0.09 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.40 2p6x s ASP 81 CO 0.73 -0.88 0.00 -0.55 0.21 0.00 0.00 175.17 174.68 2p6x s SER 82 N 1.07 4.09 0.00 0.27 0.15 -1.26 -4.97 113.70 113.05 2p6x s SER 82 Ca 0.71 -1.62 0.25 0.00 0.70 0.00 0.00 55.95 55.99 2p6x s SER 82 Cb -0.46 0.42 0.51 0.00 -1.71 0.00 0.00 66.02 64.78 2p6x s SER 82 CO 0.33 -0.81 1.41 -1.54 1.20 0.00 0.00 173.24 173.84 2p6x n SER 83 N -1.23 1.59 -4.72 5.45 3.41 -1.26 -4.76 113.62 112.10 2p6x n SER 83 Ca -0.18 -1.28 -0.37 0.00 -0.26 0.00 0.00 58.87 56.78 2p6x n SER 83 Cb 0.67 0.21 -0.06 0.00 -0.26 0.00 0.00 64.21 64.77 2p6x n SER 83 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2p6x s TYR 84 N -2.38 3.48 0.02 7.33 5.04 -1.26 -1.01 117.35 128.56 2p6x s TYR 84 Ca 0.25 0.77 0.00 0.00 -2.44 0.00 0.00 57.07 55.65 2p6x s TYR 84 Cb 0.19 -2.48 -0.02 0.00 0.35 0.00 0.00 41.96 40.00 2p6x s TYR 84 CO 0.49 0.17 -0.03 -1.50 -1.34 0.00 0.00 175.55 173.34 2p6x s ILE 85 N 0.66 0.11 -0.94 3.14 2.07 -1.26 -4.97 121.20 120.01 2p6x s ILE 85 Ca 0.22 -0.72 -0.24 0.00 -1.41 0.00 0.00 60.65 58.50 2p6x s ILE 85 Cb -0.14 -0.23 0.02 0.00 0.13 0.00 0.00 42.46 42.24 2p6x s ILE 85 CO 0.08 -0.38 1.58 0.21 -1.91 0.00 0.00 174.94 174.51 2p6x s ASN 86 N -1.14 6.07 -0.15 4.50 3.84 -1.26 -4.66 114.94 122.13 2p6x s ASN 86 Ca -0.12 -1.08 -0.29 0.00 0.21 0.00 0.00 52.86 51.59 2p6x s ASN 86 Cb -0.08 -2.56 0.08 0.00 -0.55 0.00 0.00 41.25 38.14 2p6x s ASN 86 CO -0.01 -1.89 0.78 0.00 -2.79 0.00 0.00 177.10 173.19 2p6x s ALA 87 N 6.52 -1.82 0.05 1.71 0.00 -1.26 -3.21 121.76 123.74 2p6x s ALA 87 Ca 0.52 1.62 0.04 0.00 0.00 0.00 0.00 51.96 54.14 2p6x s ALA 87 Cb -0.03 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 2p6x s ALA 87 CO -0.04 -0.34 -0.12 -0.80 0.00 0.00 0.00 175.76 174.46 2p6x s ASN 88 N -0.58 1.45 0.25 0.00 -0.87 -0.08 -1.96 114.94 113.16 2p6x s ASN 88 Ca -0.05 -0.50 -0.30 0.00 -1.57 0.00 0.00 52.86 50.45 2p6x s ASN 88 Cb -0.02 -0.06 -0.09 0.00 -0.02 0.00 0.00 41.25 41.06 2p6x s ASN 88 CO 0.04 -0.04 1.21 -0.36 -2.57 0.00 0.00 177.10 175.38 2p6x s PHE 89 N -1.02 3.37 -0.08 2.20 0.08 -0.04 -0.65 117.98 121.83 2p6x s PHE 89 Ca -0.02 1.48 0.04 0.00 0.12 0.00 0.00 56.93 58.56 2p6x s PHE 89 Cb -0.08 -3.46 -0.01 0.00 -0.57 0.00 0.00 43.02 38.89 2p6x s PHE 89 CO 0.01 -1.23 -0.20 0.42 -0.10 0.00 0.00 175.22 174.12 2p6x s ILE 90 N -0.64 2.48 0.39 0.64 -1.09 0.04 -4.82 121.20 118.19 2p6x s ILE 90 Ca 0.50 -0.90 -0.26 0.00 -2.23 0.00 0.00 60.65 57.76 2p6x s ILE 90 Cb -0.35 -1.95 -0.09 0.00 -1.58 0.00 0.00 42.46 38.49 2p6x s ILE 90 CO 0.42 0.56 1.19 -0.54 -1.23 0.00 0.00 174.94 175.34 2p6x s LYS 91 N -0.12 4.09 0.00 2.79 1.02 -1.26 -2.10 119.74 124.16 2p6x s LYS 91 Ca -0.03 1.89 0.00 0.00 0.02 0.00 0.00 55.97 57.85 2p6x s LYS 91 Cb -0.14 -2.73 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 2p6x s LYS 91 CO 0.04 -0.30 0.00 0.41 -0.92 0.00 0.00 175.35 174.58 2p6x n GLY 92 N 0.67 1.60 0.31 -3.33 0.00 0.12 -4.80 105.19 99.77 2p6x n GLY 92 Ca 0.04 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 44.00 2p6x n GLY 92 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2p6x h VAL 93 N -0.09 1.18 0.00 1.61 2.07 -1.97 -3.24 116.25 115.81 2p6x h VAL 93 Ca 0.00 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2p6x h VAL 93 Cb 0.00 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2p6x h VAL 93 CO 0.00 0.21 -0.68 -1.22 0.02 0.00 0.00 177.57 175.90 2p6x n TYR 94 N -4.37 0.00 -0.41 1.57 4.01 -1.26 -5.08 117.16 111.62 2p6x n TYR 94 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 2p6x n TYR 94 Cb 0.12 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 2p6x n TYR 94 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2p6x n GLY 95 N 1.34 -1.72 3.87 2.72 0.00 -1.23 -5.15 105.19 105.03 2p6x n GLY 95 Ca 0.02 -1.11 -0.30 0.00 0.00 0.00 0.00 46.02 44.63 2p6x n GLY 95 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2p6x s PRO 96 N -1.85 2.93 -1.50 1.61 0.04 -1.26 0.12 135.00 135.09 2p6x s PRO 96 Ca 0.00 0.56 -0.03 0.00 0.04 0.00 0.00 61.00 61.58 2p6x s PRO 96 Cb 0.00 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.52 2p6x s PRO 96 CO 0.00 -1.01 0.34 1.63 0.04 0.00 0.00 177.00 178.00 2p6x n LYS 97 N -3.01 -3.31 -0.00 4.56 5.02 -1.25 -4.73 118.16 115.43 2p6x n LYS 97 Ca 0.07 0.87 -0.08 0.00 -2.02 0.00 0.00 58.31 57.14 2p6x n LYS 97 Cb 0.56 -5.50 0.08 0.00 -0.02 0.00 0.00 35.03 30.16 2p6x n LYS 97 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2p6x h ALA 98 N 0.91 0.79 -3.62 7.82 0.00 -1.68 -3.31 119.26 120.17 2p6x h ALA 98 Ca -0.47 -0.47 -0.46 0.00 0.00 0.00 0.00 54.91 53.51 2p6x h ALA 98 Cb 1.33 -0.10 -0.23 0.00 0.00 0.00 0.00 17.79 18.80 2p6x h ALA 98 CO 0.52 0.66 -0.80 0.71 0.00 0.00 0.00 179.25 180.35 2p6x s TYR 99 N -4.14 1.36 -0.25 0.00 2.02 -0.89 -1.37 117.35 114.08 2p6x s TYR 99 Ca -0.07 -0.41 -0.06 0.00 -0.37 0.00 0.00 57.07 56.15 2p6x s TYR 99 Cb 0.12 -0.78 -0.02 0.00 -0.40 0.00 0.00 41.96 40.89 2p6x s TYR 99 CO 0.83 0.08 0.04 0.42 -1.57 0.00 0.00 175.55 175.35 2p6x s ILE 100 N -1.08 4.02 -0.27 2.71 1.01 0.14 -0.78 121.20 126.95 2p6x s ILE 100 Ca 0.01 -0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.23 2p6x s ILE 100 Cb -0.09 -2.90 -0.05 0.00 0.01 0.00 0.00 42.46 39.43 2p6x s ILE 100 CO 0.02 0.33 0.19 0.00 0.00 0.00 0.00 174.94 175.48 2p6x s ALA 101 N 1.56 3.54 0.20 9.38 0.00 0.17 -0.92 121.76 135.70 2p6x s ALA 101 Ca 0.06 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 50.93 2p6x s ALA 101 Cb -0.15 -2.47 -0.03 0.00 0.00 0.00 0.00 23.12 20.47 2p6x s ALA 101 CO 0.02 -0.50 0.19 -0.08 0.00 0.00 0.00 175.76 175.39 2p6x s THR 102 N 1.67 0.01 0.56 0.00 -1.32 -0.83 -0.90 115.64 114.83 2p6x s THR 102 Ca 0.07 -1.86 -0.04 0.00 -1.21 0.00 0.00 61.69 58.66 2p6x s THR 102 Cb -0.16 -2.37 0.01 0.00 -1.51 0.00 0.00 72.50 68.47 2p6x s THR 102 CO 0.10 -0.06 0.83 0.00 -2.21 0.00 0.00 174.62 173.29 2p6x s GLN 103 N -4.11 2.87 -0.07 7.08 -2.07 -1.20 -3.54 119.66 118.62 2p6x s GLN 103 Ca 0.34 -0.23 -0.30 0.00 -1.82 0.00 0.00 55.36 53.35 2p6x s GLN 103 Cb 0.05 -2.36 -0.04 0.00 -1.09 0.00 0.00 33.01 29.57 2p6x s GLN 103 CO 0.10 -0.62 1.43 0.20 -1.32 0.00 0.00 175.29 175.07 2p6x s GLY 104 N -4.31 1.70 0.71 2.60 0.00 0.12 -4.86 107.32 103.28 2p6x s GLY 104 Ca 0.53 0.75 -0.16 0.00 0.00 0.00 0.00 44.72 45.84 2p6x s GLY 104 CO 0.42 2.66 1.13 -1.05 0.00 0.00 0.00 173.10 176.26 2p6x n PRO 105 N 6.31 0.66 -2.74 2.90 -0.01 -1.26 -4.72 135.00 136.15 2p6x n PRO 105 Ca 0.15 0.29 -0.24 0.00 -0.01 0.00 0.00 63.50 63.68 2p6x n PRO 105 Cb 0.44 -2.37 0.02 0.00 -0.01 0.00 0.00 33.50 31.58 2p6x n PRO 105 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 175.50 174.98 2p6x s LEU 106 N -4.03 3.46 0.32 2.45 1.43 -1.26 -1.60 118.68 119.45 2p6x s LEU 106 Ca 0.77 0.41 0.09 0.00 -1.03 0.00 0.00 54.13 54.37 2p6x s LEU 106 Cb -0.35 -3.27 0.84 0.00 0.03 0.00 0.00 46.19 43.45 2p6x s LEU 106 CO 0.47 -0.88 1.76 0.28 0.23 0.00 0.00 176.35 178.20 2p6x h SER 107 N 0.15 0.70 0.41 2.29 0.02 -1.97 0.15 113.55 115.31 2p6x h SER 107 Ca -0.45 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2p6x h SER 107 Cb 1.26 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2p6x h SER 107 CO 0.58 0.18 -0.13 0.35 -1.14 0.00 0.00 176.83 176.67 2p6x n THR 108 N -4.81 0.00 -0.01 -2.27 -2.24 -1.26 -3.60 114.28 100.09 2p6x n THR 108 Ca 0.25 -0.05 0.01 0.00 -2.27 0.00 0.00 64.05 61.99 2p6x n THR 108 Cb 0.68 -0.09 0.02 0.00 -2.10 0.00 0.00 70.33 68.84 2p6x n THR 108 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2p6x n THR 109 N -1.02 0.85 -0.29 4.28 -2.24 -0.01 -4.72 114.28 111.13 2p6x n THR 109 Ca 0.13 -0.93 -0.05 0.00 -2.27 0.00 0.00 64.05 60.94 2p6x n THR 109 Cb 0.29 0.58 0.07 0.00 -2.10 0.00 0.00 70.33 69.16 2p6x n THR 109 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2p6x h LEU 110 N 0.37 1.01 -0.40 3.22 3.38 -1.46 0.16 115.31 121.57 2p6x h LEU 110 Ca 0.00 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 2p6x h LEU 110 Cb 0.47 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2p6x h LEU 110 CO 0.00 0.83 -0.33 0.25 0.09 0.00 0.00 178.44 179.29 2p6x h LEU 111 N 1.10 0.98 -0.97 1.67 5.85 -1.85 -2.39 115.31 119.71 2p6x h LEU 111 Ca 0.27 -0.45 0.04 0.00 0.84 0.00 0.00 57.88 58.59 2p6x h LEU 111 Cb 0.07 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.77 2p6x h LEU 111 CO -0.04 1.22 0.63 0.44 -0.34 0.00 0.00 178.44 180.36 2p6x h ASP 112 N 0.75 1.06 -0.14 1.25 3.32 -1.76 0.47 116.42 121.37 2p6x h ASP 112 Ca 0.07 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 2p6x h ASP 112 Cb 0.92 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 2p6x h ASP 112 CO 0.09 0.72 0.08 0.15 -1.72 0.00 0.00 179.24 178.55 2p6x h PHE 113 N 1.23 0.19 -0.33 4.55 3.57 -0.70 -1.24 116.94 124.20 2p6x h PHE 113 Ca 0.39 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.80 2p6x h PHE 113 Cb 0.01 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 2p6x h PHE 113 CO -0.01 0.18 -0.18 -1.49 -2.23 0.00 0.00 178.31 174.59 2p6x h TRP 114 N 0.14 0.66 -0.98 0.41 4.06 -1.11 0.16 115.95 119.29 2p6x h TRP 114 Ca 0.05 -0.12 0.05 0.00 2.06 0.00 0.00 58.89 60.92 2p6x h TRP 114 Cb 0.06 -0.17 -0.06 0.00 -1.00 0.00 0.00 29.16 27.99 2p6x h TRP 114 CO -0.05 0.74 0.64 0.00 -3.56 0.00 0.00 178.44 176.21 2p6x h ARG 115 N 0.54 1.17 0.03 0.49 3.08 -0.62 0.29 114.38 119.36 2p6x h ARG 115 Ca 0.09 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 2p6x h ARG 115 Cb 0.61 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.39 2p6x h ARG 115 CO 0.04 0.77 -0.02 1.98 -1.07 0.00 0.00 179.97 181.68 2p6x h MET 116 N 1.21 -0.04 -0.57 0.04 4.05 -0.72 0.22 114.93 119.11 2p6x h MET 116 Ca 0.40 0.00 0.08 0.00 -0.28 0.00 0.00 59.70 59.91 2p6x h MET 116 Cb 0.06 0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 30.81 2p6x h MET 116 CO -0.14 0.34 0.20 0.82 0.23 0.00 0.00 176.91 178.36 2p6x h ILE 117 N -0.43 0.79 -0.01 1.77 1.08 -0.71 -2.16 117.51 117.83 2p6x h ILE 117 Ca -0.00 -0.13 -0.00 0.00 -0.39 0.00 0.00 64.86 64.33 2p6x h ILE 117 Cb 0.40 0.37 -0.00 0.00 -3.07 0.00 0.00 36.82 34.52 2p6x h ILE 117 CO 0.01 0.07 -0.01 -0.25 -0.69 0.00 0.00 178.15 177.28 2p6x h TRP 118 N 0.38 0.03 -0.94 1.37 2.91 -0.82 -1.74 115.95 117.15 2p6x h TRP 118 Ca 0.28 -0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.35 2p6x h TRP 118 Cb 0.33 -0.01 -0.06 0.00 -0.51 0.00 0.00 29.16 28.92 2p6x h TRP 118 CO -0.17 0.51 0.61 1.49 -1.03 0.00 0.00 178.44 179.85 2p6x h GLU 119 N -0.46 1.06 -0.66 2.65 4.81 -0.44 -1.96 114.58 119.57 2p6x h GLU 119 Ca 0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2p6x h GLU 119 Cb 0.51 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.65 2p6x h GLU 119 CO 0.00 0.70 0.00 0.66 -0.73 0.00 0.00 179.01 179.64 2p6x n TYR 120 N -4.48 1.37 -4.21 0.92 4.01 -0.82 -4.94 117.16 109.00 2p6x n TYR 120 Ca 0.14 -0.55 -0.35 0.00 -0.16 0.00 0.00 57.90 56.97 2p6x n TYR 120 Cb 0.18 -0.21 -0.03 0.00 -0.31 0.00 0.00 39.34 38.96 2p6x n TYR 120 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2p6x n SER 121 N 1.11 -2.69 -4.77 7.72 7.64 -0.74 -4.43 113.62 117.47 2p6x n SER 121 Ca 0.24 -1.03 -0.41 0.00 1.01 0.00 0.00 58.87 58.68 2p6x n SER 121 Cb 0.82 -2.70 -0.02 0.00 -1.01 0.00 0.00 64.21 61.31 2p6x n SER 121 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2p6x s VAL 122 N -3.42 2.53 -0.19 0.44 1.01 -0.68 -4.82 120.40 115.27 2p6x s VAL 122 Ca 0.62 0.51 0.06 0.00 0.00 0.00 0.00 61.98 63.18 2p6x s VAL 122 Cb -0.34 -3.33 -0.22 0.00 0.00 0.00 0.00 36.38 32.50 2p6x s VAL 122 CO 0.93 0.11 0.07 -0.11 0.00 0.00 0.00 175.10 176.11 2p6x n LEU 123 N 1.07 1.84 -4.29 3.92 7.94 -1.26 -4.89 117.00 121.33 2p6x n LEU 123 Ca 0.02 0.03 -0.32 0.00 -1.11 0.00 0.00 56.01 54.63 2p6x n LEU 123 Cb 0.41 -0.43 -0.16 0.00 0.53 0.00 0.00 43.42 43.77 2p6x n LEU 123 CO 0.61 0.74 -0.52 -0.63 -1.11 0.00 0.00 177.39 176.48 2p6x s ILE 124 N -2.53 2.45 -0.12 1.96 -1.09 -1.26 -0.54 121.20 120.08 2p6x s ILE 124 Ca -0.22 -0.89 0.03 0.00 -2.23 0.00 0.00 60.65 57.34 2p6x s ILE 124 Cb 0.08 -1.97 -0.00 0.00 -1.58 0.00 0.00 42.46 38.98 2p6x s ILE 124 CO 0.72 0.55 -0.21 -0.63 -1.23 0.00 0.00 174.94 174.14 2p6x s ILE 125 N 0.24 2.26 -0.24 2.92 1.01 -0.41 -1.53 121.20 125.46 2p6x s ILE 125 Ca -0.13 -0.94 -0.05 0.00 0.00 0.00 0.00 60.65 59.53 2p6x s ILE 125 Cb -0.16 -1.89 -0.01 0.00 0.01 0.00 0.00 42.46 40.40 2p6x s ILE 125 CO 0.07 0.55 -0.00 -0.69 0.00 0.00 0.00 174.94 174.87 2p6x s VAL 126 N 0.46 3.65 -0.34 2.92 1.01 0.11 -0.42 120.40 127.80 2p6x s VAL 126 Ca -0.15 -0.45 -0.08 0.00 0.00 0.00 0.00 61.98 61.30 2p6x s VAL 126 Cb -0.17 -2.71 0.03 0.00 0.00 0.00 0.00 36.38 33.53 2p6x s VAL 126 CO 0.06 0.36 0.14 -0.32 0.00 0.00 0.00 175.10 175.33 2p6x s MET 127 N 1.51 2.77 -0.65 2.72 0.00 0.26 -0.98 119.30 124.93 2p6x s MET 127 Ca 0.05 -1.09 0.01 0.00 0.00 0.00 0.00 55.69 54.66 2p6x s MET 127 Cb -0.15 -3.54 0.40 0.00 0.00 0.00 0.00 34.83 31.54 2p6x s MET 127 CO -0.01 -0.64 1.70 0.00 0.00 0.00 0.00 175.02 176.07 2p6x n ALA 128 N 4.89 5.95 -3.19 4.11 0.00 0.25 -0.34 120.51 132.18 2p6x n ALA 128 Ca -0.13 -4.03 -0.11 0.00 0.00 0.00 0.00 53.44 49.18 2p6x n ALA 128 Cb 0.46 -1.40 -0.04 0.00 0.00 0.00 0.00 19.45 18.47 2p6x n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2p6x s MET 130 N -3.54 3.29 0.35 0.00 1.00 -1.26 -4.76 119.30 114.38 2p6x s MET 130 Ca 0.24 -0.54 0.05 0.00 0.00 0.00 0.00 55.69 55.44 2p6x s MET 130 Cb -0.01 -2.68 0.65 0.00 0.00 0.00 0.00 34.83 32.79 2p6x s MET 130 CO 0.12 0.04 1.91 0.93 0.00 0.00 0.00 175.02 178.02 2p6x h GLU 131 N 0.71 0.52 -4.87 2.03 5.08 -1.96 -3.41 114.58 112.68 2p6x h GLU 131 Ca -0.48 -0.10 -0.51 0.00 -1.00 0.00 0.00 59.36 57.27 2p6x h GLU 131 Cb 1.24 -0.08 -0.32 0.00 0.50 0.00 0.00 28.75 30.09 2p6x h GLU 131 CO 0.59 0.51 -0.82 0.71 -1.00 0.00 0.00 179.01 179.00 2p6x s TYR 132 N -5.05 1.43 -0.05 4.33 2.02 -1.26 0.61 117.35 119.38 2p6x s TYR 132 Ca -0.08 -0.44 -0.02 0.00 -0.37 0.00 0.00 57.07 56.16 2p6x s TYR 132 Cb 0.16 -1.00 0.03 0.00 -0.40 0.00 0.00 41.96 40.75 2p6x s TYR 132 CO 0.76 -0.18 0.12 -1.21 -1.57 0.00 0.00 175.55 173.47 2p6x s GLU 133 N 0.28 0.07 -1.36 -0.62 2.02 -0.33 -4.90 118.70 113.86 2p6x s GLU 133 Ca -0.07 0.32 -0.15 0.00 0.02 0.00 0.00 54.97 55.08 2p6x s GLU 133 Cb -0.12 -0.17 0.02 0.00 0.10 0.00 0.00 34.13 33.95 2p6x s GLU 133 CO 0.02 -0.15 0.39 -1.33 0.02 0.00 0.00 175.26 174.21 2p6x n MET 134 N 4.10 -1.03 -1.10 1.61 2.81 -1.26 -1.74 117.12 120.52 2p6x n MET 134 Ca -0.26 0.16 -0.03 0.00 -1.81 0.00 0.00 57.70 55.76 2p6x n MET 134 Cb 0.52 -3.35 -0.01 0.00 -0.71 0.00 0.00 33.22 29.66 2p6x n MET 134 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2p6x n GLY 135 N -2.23 0.60 3.13 3.03 0.00 -1.26 -5.01 105.19 103.44 2p6x n GLY 135 Ca -0.22 -0.29 -0.17 0.00 0.00 0.00 0.00 46.02 45.35 2p6x n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p6x s LYS 136 N -1.56 0.72 0.04 1.61 1.02 -0.71 -5.11 119.74 115.74 2p6x s LYS 136 Ca 0.00 -0.85 -0.30 0.00 0.02 0.00 0.00 55.97 54.83 2p6x s LYS 136 Cb 0.00 -0.65 -0.05 0.00 -0.52 0.00 0.00 37.83 36.62 2p6x s LYS 136 CO 0.00 0.14 1.09 0.21 -0.92 0.00 0.00 175.35 175.87 2p6x s LYS 137 N -1.60 4.51 -0.01 1.68 2.20 -1.26 -1.18 119.74 124.08 2p6x s LYS 137 Ca -0.04 1.60 0.10 0.00 -0.36 0.00 0.00 55.97 57.27 2p6x s LYS 137 Cb -0.10 -3.39 -0.14 0.00 -1.51 0.00 0.00 37.83 32.69 2p6x s LYS 137 CO 0.01 -0.13 0.32 1.63 -0.36 0.00 0.00 175.35 176.83 2p6x n LYS 138 N 3.78 1.84 -3.64 4.03 4.76 0.20 -4.93 118.16 124.21 2p6x n LYS 138 Ca 0.07 -0.05 -0.08 0.00 -2.87 0.00 0.00 58.31 55.38 2p6x n LYS 138 Cb 0.49 -1.12 -0.07 0.00 -1.84 0.00 0.00 35.03 32.48 2p6x n LYS 138 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2p6x s GLU 140 N 0.82 3.79 -0.30 0.00 0.41 -0.63 -4.77 118.70 118.02 2p6x s GLU 140 Ca -0.03 0.78 -0.29 0.00 -0.41 0.00 0.00 54.97 55.02 2p6x s GLU 140 Cb -0.05 -2.17 -0.01 0.00 -1.78 0.00 0.00 34.13 30.12 2p6x s GLU 140 CO -0.10 -0.33 1.61 0.50 -0.49 0.00 0.00 175.26 176.46 2p6x s ARG 141 N -4.43 3.60 0.00 1.61 6.06 -1.26 -4.71 118.95 119.83 2p6x s ARG 141 Ca 0.56 1.40 0.05 0.00 -2.50 0.00 0.00 55.73 55.25 2p6x s ARG 141 Cb -0.10 -4.08 -0.05 0.00 0.06 0.00 0.00 34.95 30.78 2p6x s ARG 141 CO 0.39 -1.53 0.25 2.48 -2.50 0.00 0.00 175.30 174.40 2p6x n TYR 142 N 9.08 0.00 -3.66 5.12 0.18 -1.26 -5.04 117.16 121.58 2p6x n TYR 142 Ca 0.19 0.00 -0.21 0.00 1.88 0.00 0.00 57.90 59.76 2p6x n TYR 142 Cb 0.46 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.39 2p6x n TYR 142 CO 0.00 0.00 0.00 1.67 -2.08 0.00 0.00 176.86 176.45 2p6x s TRP 143 N -1.44 2.73 0.19 -3.48 -2.14 -1.26 -5.02 118.94 108.52 2p6x s TRP 143 Ca 0.02 -0.47 0.09 0.00 2.66 0.00 0.00 56.10 58.41 2p6x s TRP 143 Cb 0.04 -2.08 -0.04 0.00 -3.10 0.00 0.00 33.47 28.29 2p6x s TRP 143 CO 0.21 -0.04 -0.08 0.00 -2.66 0.00 0.00 176.95 174.38 2p6x s ALA 144 N -2.45 2.99 0.29 2.67 0.00 -1.26 -5.00 121.76 118.99 2p6x s ALA 144 Ca 0.46 -1.49 0.11 0.00 0.00 0.00 0.00 51.96 51.04 2p6x s ALA 144 Cb -0.03 -0.76 -0.05 0.00 0.00 0.00 0.00 23.12 22.28 2p6x s ALA 144 CO 0.27 0.44 -0.10 -1.21 0.00 0.00 0.00 175.76 175.17 2p6x s GLU 145 N -2.94 1.95 0.27 0.00 2.02 -1.26 -4.46 118.70 114.28 2p6x s GLU 145 Ca 0.26 -1.66 -0.30 0.00 0.02 0.00 0.00 54.97 53.28 2p6x s GLU 145 Cb -0.08 -1.92 -0.13 0.00 0.10 0.00 0.00 34.13 32.09 2p6x s GLU 145 CO 0.16 0.30 1.29 -2.30 0.02 0.00 0.00 175.26 174.73 2p6x n PRO 146 N -0.77 1.87 0.00 0.39 -0.02 -1.26 -2.29 135.00 132.92 2p6x n PRO 146 Ca -0.05 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 2p6x n PRO 146 Cb 0.60 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 2p6x n PRO 146 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2p6x n GLY 147 N 1.63 2.92 0.02 -1.23 0.00 -1.26 -4.89 105.19 102.37 2p6x n GLY 147 Ca 0.10 -0.07 0.15 0.00 0.00 0.00 0.00 46.02 46.20 2p6x n GLY 147 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2p6x n GLU 148 N 0.00 0.56 0.00 1.61 1.02 -0.97 -5.00 120.64 117.86 2p6x n GLU 148 Ca 0.00 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 2p6x n GLU 148 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 2p6x n GLU 148 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2p6x n MET 149 N -1.18 0.00 -3.58 3.49 2.81 -1.26 -4.62 117.12 112.78 2p6x n MET 149 Ca 0.16 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.66 2p6x n MET 149 Cb 0.23 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.63 2p6x n MET 149 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2p6x s GLN 150 N 0.00 3.79 0.38 0.03 -0.21 -1.26 -4.35 119.66 118.03 2p6x s GLN 150 Ca 0.00 -0.44 -0.24 0.00 0.02 0.00 0.00 55.36 54.71 2p6x s GLN 150 Cb 0.00 -3.69 -0.10 0.00 1.00 0.00 0.00 33.01 30.22 2p6x s GLN 150 CO 0.00 -0.27 0.97 -0.51 -2.12 0.00 0.00 175.29 173.36 2p6x s LEU 151 N 1.74 4.15 -0.15 2.90 1.02 -0.21 -4.84 118.68 123.28 2p6x s LEU 151 Ca 0.07 1.83 0.00 0.00 0.02 0.00 0.00 54.13 56.05 2p6x s LEU 151 Cb -0.16 -4.24 -0.00 0.00 0.02 0.00 0.00 46.19 41.80 2p6x s LEU 151 CO 0.11 -0.27 -0.15 -1.61 0.02 0.00 0.00 176.35 174.44 2p6x s GLU 152 N -2.56 3.22 -0.32 1.70 0.41 -1.26 -0.66 118.70 119.23 2p6x s GLU 152 Ca 0.56 -0.75 0.02 0.00 -0.41 0.00 0.00 54.97 54.40 2p6x s GLU 152 Cb -0.16 -2.62 0.10 0.00 -1.78 0.00 0.00 34.13 29.66 2p6x s GLU 152 CO 0.21 0.03 0.06 -0.06 -0.49 0.00 0.00 175.26 175.00 2p6x s PHE 153 N 0.79 3.08 0.00 1.61 0.08 0.61 -4.99 117.98 119.16 2p6x s PHE 153 Ca -0.06 -2.55 0.00 0.00 0.12 0.00 0.00 56.93 54.44 2p6x s PHE 153 Cb -0.15 -2.48 0.00 0.00 -0.57 0.00 0.00 43.02 39.82 2p6x s PHE 153 CO 0.00 -0.92 0.00 0.41 -0.10 0.00 0.00 175.22 174.61 2p6x n GLY 154 N 4.45 3.36 0.09 4.36 0.00 -1.26 -1.20 105.19 115.00 2p6x n GLY 154 Ca 0.01 0.01 0.15 0.00 0.00 0.00 0.00 46.02 46.19 2p6x n GLY 154 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2p6x n PRO 155 N 14.00 0.85 -3.05 1.61 -0.04 -1.26 -4.82 135.00 142.28 2p6x n PRO 155 Ca 0.00 -0.19 -0.40 0.00 -0.04 0.00 0.00 63.50 62.88 2p6x n PRO 155 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.92 2p6x n PRO 155 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2p6x s PHE 156 N -2.28 3.56 -0.20 0.54 0.08 -0.34 -4.46 117.98 114.89 2p6x s PHE 156 Ca 0.36 1.22 -0.04 0.00 0.12 0.00 0.00 56.93 58.59 2p6x s PHE 156 Cb 0.21 -2.80 -0.02 0.00 -0.57 0.00 0.00 43.02 39.84 2p6x s PHE 156 CO 0.42 0.07 -0.03 -1.12 -0.10 0.00 0.00 175.22 174.46 2p6x s SER 157 N 0.82 4.57 -0.16 1.36 0.01 -0.20 -0.28 113.70 119.82 2p6x s SER 157 Ca 0.37 -0.27 0.01 0.00 1.31 0.00 0.00 55.95 57.36 2p6x s SER 157 Cb -0.17 -1.77 0.02 0.00 0.21 0.00 0.00 66.02 64.31 2p6x s SER 157 CO 0.17 0.06 -0.15 -0.69 0.41 0.00 0.00 173.24 173.04 2p6x s VAL 158 N 1.03 1.69 0.28 3.43 1.01 0.16 -0.72 120.40 127.28 2p6x s VAL 158 Ca 0.01 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.33 2p6x s VAL 158 Cb -0.15 -1.58 -0.06 0.00 0.00 0.00 0.00 36.38 34.59 2p6x s VAL 158 CO 0.01 0.45 -0.09 -0.94 0.00 0.00 0.00 175.10 174.53 2p6x s SER 159 N 1.43 2.97 -0.23 3.32 1.04 -0.36 -1.05 113.70 120.83 2p6x s SER 159 Ca 0.04 -1.15 -0.00 0.00 0.48 0.00 0.00 55.95 55.32 2p6x s SER 159 Cb -0.13 -0.20 0.03 0.00 0.10 0.00 0.00 66.02 65.81 2p6x s SER 159 CO -0.11 -0.26 -0.11 0.00 0.98 0.00 0.00 173.24 173.74 2p6x h GLU 161 N 7.95 0.47 -2.69 0.00 4.81 -1.31 -3.37 114.58 120.45 2p6x h GLU 161 Ca -0.35 -0.81 -0.08 0.00 -0.13 0.00 0.00 59.36 57.99 2p6x h GLU 161 Cb 1.11 0.30 -0.18 0.00 0.63 0.00 0.00 28.75 30.61 2p6x h GLU 161 CO 0.58 1.38 -0.05 0.00 -0.73 0.00 0.00 179.01 180.19 2p6x s ALA 162 N -2.61 -1.21 -0.13 2.92 0.00 -1.23 -5.00 121.76 114.49 2p6x s ALA 162 Ca -0.08 0.66 -0.01 0.00 0.00 0.00 0.00 51.96 52.53 2p6x s ALA 162 Cb 0.05 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.37 2p6x s ALA 162 CO 0.93 -0.38 -0.06 -1.21 0.00 0.00 0.00 175.76 175.03 2p6x s GLU 163 N -1.74 1.45 -0.30 0.00 2.02 -1.26 -0.62 118.70 118.25 2p6x s GLU 163 Ca -0.10 -0.30 -0.11 0.00 0.02 0.00 0.00 54.97 54.49 2p6x s GLU 163 Cb -0.02 -1.67 -0.03 0.00 0.10 0.00 0.00 34.13 32.52 2p6x s GLU 163 CO 0.03 -0.31 0.18 0.21 0.02 0.00 0.00 175.26 175.39 2p6x s LYS 164 N 1.71 3.63 -0.24 1.61 2.47 0.83 -4.95 119.74 124.80 2p6x s LYS 164 Ca 0.04 -0.53 -0.16 0.00 -1.56 0.00 0.00 55.97 53.76 2p6x s LYS 164 Cb -0.13 -3.63 -0.04 0.00 -1.46 0.00 0.00 37.83 32.57 2p6x s LYS 164 CO -0.08 -0.32 0.40 1.03 0.16 0.00 0.00 175.35 176.54 2p6x s ARG 165 N 1.69 4.08 0.54 4.03 0.52 -1.26 -0.67 118.95 127.88 2p6x s ARG 165 Ca 0.06 0.13 0.05 0.00 -0.52 0.00 0.00 55.73 55.45 2p6x s ARG 165 Cb -0.17 -3.61 0.03 0.00 0.52 0.00 0.00 34.95 31.73 2p6x s ARG 165 CO 0.09 -0.20 0.37 0.15 0.02 0.00 0.00 175.30 175.73 2p6x s LYS 166 N 1.82 2.25 0.00 3.54 3.01 0.35 -5.01 119.74 125.70 2p6x s LYS 166 Ca 0.17 -2.04 0.00 0.00 -1.01 0.00 0.00 55.97 53.09 2p6x s LYS 166 Cb -0.15 -2.06 0.00 0.00 -1.01 0.00 0.00 37.83 34.61 2p6x s LYS 166 CO 0.09 -0.59 0.73 0.43 0.51 0.00 0.00 175.35 176.51 2p6x n SER 167 N -1.72 0.00 -0.56 2.83 7.64 -1.26 -3.25 113.62 117.30 2p6x n SER 167 Ca -0.03 0.73 0.05 0.00 1.01 0.00 0.00 58.87 60.63 2p6x n SER 167 Cb 0.64 -0.33 0.12 0.00 -1.01 0.00 0.00 64.21 63.64 2p6x n SER 167 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2p6x n ASP 168 N -2.45 2.64 -3.81 6.43 8.00 -1.26 -5.01 116.55 121.10 2p6x n ASP 168 Ca 0.00 -1.87 -0.10 0.00 0.71 0.00 0.00 54.79 53.53 2p6x n ASP 168 Cb 0.00 -0.17 -0.06 0.00 -0.02 0.00 0.00 41.12 40.88 2p6x n ASP 168 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2p6x s TYR 169 N -0.97 0.08 -0.07 1.24 -0.85 -1.20 -0.90 117.35 114.69 2p6x s TYR 169 Ca 0.20 -0.44 0.04 0.00 -0.52 0.00 0.00 57.07 56.35 2p6x s TYR 169 Cb 0.11 0.13 -0.00 0.00 0.38 0.00 0.00 41.96 42.57 2p6x s TYR 169 CO 0.14 -0.73 -0.20 0.42 -1.52 0.00 0.00 175.55 173.66 2p6x s ILE 170 N -3.89 1.71 -0.33 -3.49 1.01 -0.50 -0.50 121.20 115.22 2p6x s ILE 170 Ca 0.09 -0.85 -0.10 0.00 0.00 0.00 0.00 60.65 59.80 2p6x s ILE 170 Cb 0.02 -1.47 0.00 0.00 0.01 0.00 0.00 42.46 41.02 2p6x s ILE 170 CO -0.06 0.48 0.16 -0.63 0.00 0.00 0.00 174.94 174.90 2p6x s ILE 171 N 0.17 4.54 -0.24 2.92 1.01 0.16 -0.05 121.20 129.70 2p6x s ILE 171 Ca -0.10 -0.56 -0.10 0.00 0.00 0.00 0.00 60.65 59.89 2p6x s ILE 171 Cb -0.14 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 38.90 2p6x s ILE 171 CO 0.05 -0.01 0.16 -0.13 0.00 0.00 0.00 174.94 175.00 2p6x s ARG 172 N 1.59 4.08 -0.57 2.79 0.52 0.40 -0.12 118.95 127.63 2p6x s ARG 172 Ca 0.04 -0.27 -0.23 0.00 -0.52 0.00 0.00 55.73 54.75 2p6x s ARG 172 Cb -0.18 -3.53 0.05 0.00 0.52 0.00 0.00 34.95 31.82 2p6x s ARG 172 CO 0.06 0.08 0.88 0.99 0.02 0.00 0.00 175.30 177.33 2p6x s THR 173 N 1.01 4.47 -0.05 0.02 2.01 0.21 -1.62 115.64 121.70 2p6x s THR 173 Ca 0.08 -0.07 -0.11 0.00 0.31 0.00 0.00 61.69 61.90 2p6x s THR 173 Cb -0.13 -4.53 -0.05 0.00 0.01 0.00 0.00 72.50 67.80 2p6x s THR 173 CO 0.04 -1.15 0.28 -0.76 -0.69 0.00 0.00 174.62 172.35 2p6x s LEU 174 N 3.70 4.43 -0.21 4.42 1.43 0.59 -0.76 118.68 132.27 2p6x s LEU 174 Ca 0.25 0.72 -0.04 0.00 -1.03 0.00 0.00 54.13 54.03 2p6x s LEU 174 Cb -0.15 -2.39 -0.01 0.00 0.03 0.00 0.00 46.19 43.67 2p6x s LEU 174 CO 0.15 0.35 -0.05 -0.54 0.23 0.00 0.00 176.35 176.49 2p6x s LYS 175 N -1.15 3.39 -0.15 1.70 -0.14 -0.07 -1.33 119.74 122.00 2p6x s LYS 175 Ca 0.21 -0.62 0.01 0.00 -1.36 0.00 0.00 55.97 54.21 2p6x s LYS 175 Cb -0.14 -2.98 0.02 0.00 -1.68 0.00 0.00 37.83 33.04 2p6x s LYS 175 CO 0.10 -0.15 -0.17 0.08 -0.76 0.00 0.00 175.35 174.45 2p6x s VAL 176 N 1.35 1.78 -0.13 3.17 1.01 -0.04 -1.23 120.40 126.31 2p6x s VAL 176 Ca 0.04 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.24 2p6x s VAL 176 Cb -0.14 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 2p6x s VAL 176 CO -0.02 0.49 -0.14 -0.75 0.00 0.00 0.00 175.10 174.68 2p6x s LYS 177 N 1.22 3.34 -0.05 2.72 2.47 0.10 -0.08 119.74 129.46 2p6x s LYS 177 Ca 0.01 -0.71 -0.02 0.00 -1.56 0.00 0.00 55.97 53.69 2p6x s LYS 177 Cb -0.14 -2.62 0.04 0.00 -1.46 0.00 0.00 37.83 33.65 2p6x s LYS 177 CO -0.08 0.17 0.09 0.12 0.16 0.00 0.00 175.35 175.81 2p6x s PHE 178 N 0.46 -0.07 0.00 4.03 5.36 -0.28 -1.03 117.98 126.45 2p6x s PHE 178 Ca -0.10 0.34 0.00 0.00 -0.96 0.00 0.00 56.93 56.21 2p6x s PHE 178 Cb -0.16 -0.22 0.00 0.00 -0.34 0.00 0.00 43.02 42.30 2p6x s PHE 178 CO 0.05 -0.16 0.00 0.09 -1.46 0.00 0.00 175.22 173.74 2p6x n ASN 179 N 4.50 0.00 -0.19 6.13 3.02 -1.26 -1.49 115.26 125.97 2p6x n ASN 179 Ca -0.21 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.40 2p6x n ASN 179 Cb 0.51 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.66 2p6x n ASN 179 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2p6x n SER 180 N 7.94 1.10 -4.89 6.41 3.41 -1.26 -5.00 113.62 121.33 2p6x n SER 180 Ca 0.00 -1.05 -0.34 0.00 -0.26 0.00 0.00 58.87 57.22 2p6x n SER 180 Cb 0.00 0.61 -0.05 0.00 -0.26 0.00 0.00 64.21 64.51 2p6x n SER 180 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2p6x s GLU 181 N -1.63 3.56 -0.06 4.33 2.12 -0.56 -5.09 118.70 121.37 2p6x s GLU 181 Ca 0.08 -0.12 0.03 0.00 0.36 0.00 0.00 54.97 55.32 2p6x s GLU 181 Cb 0.09 -3.07 0.01 0.00 0.26 0.00 0.00 34.13 31.42 2p6x s GLU 181 CO 0.33 0.65 -0.14 0.99 -0.54 0.00 0.00 175.26 176.55 2p6x s THR 182 N -1.32 1.21 0.23 -1.70 2.01 -1.26 -1.13 115.64 113.69 2p6x s THR 182 Ca 0.28 -0.54 0.11 0.00 0.31 0.00 0.00 61.69 61.85 2p6x s THR 182 Cb -0.13 -1.08 -0.05 0.00 0.01 0.00 0.00 72.50 71.25 2p6x s THR 182 CO 0.17 0.37 -0.16 -0.13 -0.69 0.00 0.00 174.62 174.18 2p6x s ARG 183 N 0.48 1.81 -0.22 4.92 0.52 0.88 -4.94 118.95 122.40 2p6x s ARG 183 Ca -0.12 -1.55 -0.10 0.00 -0.52 0.00 0.00 55.73 53.45 2p6x s ARG 183 Cb -0.14 -1.93 -0.05 0.00 0.52 0.00 0.00 34.95 33.35 2p6x s ARG 183 CO 0.03 0.38 0.14 0.99 0.02 0.00 0.00 175.30 176.86 2p6x s THR 184 N -2.09 5.27 -0.04 0.02 2.01 -1.26 -0.86 115.64 118.69 2p6x s THR 184 Ca 0.27 0.15 0.06 0.00 0.31 0.00 0.00 61.69 62.48 2p6x s THR 184 Cb -0.07 -3.44 -0.01 0.00 0.01 0.00 0.00 72.50 68.99 2p6x s THR 184 CO 0.14 0.38 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.59 2p6x s ILE 185 N 0.82 1.92 -0.26 1.82 -1.09 -0.44 -4.85 121.20 119.12 2p6x s ILE 185 Ca 0.07 -1.01 -0.07 0.00 -2.23 0.00 0.00 60.65 57.42 2p6x s ILE 185 Cb -0.13 -1.61 -0.01 0.00 -1.58 0.00 0.00 42.46 39.13 2p6x s ILE 185 CO 0.02 0.54 0.06 -0.31 -1.23 0.00 0.00 174.94 174.02 2p6x s TYR 186 N -0.27 3.09 -0.25 3.97 2.02 0.30 -0.30 117.35 125.91 2p6x s TYR 186 Ca 0.01 -0.74 -0.09 0.00 -0.37 0.00 0.00 57.07 55.88 2p6x s TYR 186 Cb -0.12 -2.22 -0.04 0.00 -0.40 0.00 0.00 41.96 39.18 2p6x s TYR 186 CO 0.02 -0.48 0.13 -1.14 -1.57 0.00 0.00 175.55 172.51 2p6x s GLN 187 N 1.55 3.87 -0.47 -0.62 0.74 -0.64 -1.29 119.66 122.79 2p6x s GLN 187 Ca 0.05 -0.37 -0.18 0.00 0.05 0.00 0.00 55.36 54.91 2p6x s GLN 187 Cb -0.16 -3.48 0.05 0.00 1.10 0.00 0.00 33.01 30.52 2p6x s GLN 187 CO 0.02 -0.10 0.51 -0.06 -0.55 0.00 0.00 175.29 175.11 2p6x s PHE 188 N 1.47 3.14 -0.46 1.67 0.08 0.44 -0.45 117.98 123.87 2p6x s PHE 188 Ca 0.06 -0.58 -0.16 0.00 0.12 0.00 0.00 56.93 56.37 2p6x s PHE 188 Cb -0.15 -3.24 0.05 0.00 -0.57 0.00 0.00 43.02 39.11 2p6x s PHE 188 CO 0.07 -0.87 0.42 -1.58 -0.10 0.00 0.00 175.22 173.15 2p6x s HIS 189 N 2.23 3.20 -0.35 0.36 2.46 0.92 -0.57 115.29 123.54 2p6x s HIS 189 Ca 0.11 -0.73 -0.17 0.00 0.47 0.00 0.00 55.06 54.74 2p6x s HIS 189 Cb -0.20 -3.08 -0.00 0.00 -0.13 0.00 0.00 32.58 29.17 2p6x s HIS 189 CO 0.11 -0.78 0.48 -0.47 -2.47 0.00 0.00 174.74 171.61 2p6x s TYR 190 N 1.86 3.18 -0.20 3.88 5.04 0.54 -1.41 117.35 130.25 2p6x s TYR 190 Ca 0.07 0.12 0.15 0.00 -2.44 0.00 0.00 57.07 54.97 2p6x s TYR 190 Cb -0.22 -2.87 0.49 0.00 0.35 0.00 0.00 41.96 39.71 2p6x s TYR 190 CO 0.09 -0.52 1.39 1.63 -1.34 0.00 0.00 175.55 176.80 2p6x n LYS 191 N 5.67 2.43 -3.62 4.97 5.02 -0.07 -3.89 118.16 128.66 2p6x n LYS 191 Ca -0.06 -2.89 -0.14 0.00 -2.02 0.00 0.00 58.31 53.21 2p6x n LYS 191 Cb 0.49 -1.79 -0.05 0.00 -0.02 0.00 0.00 35.03 33.66 2p6x n LYS 191 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2p6x n ASN 192 N -0.79 -0.67 -3.66 4.39 2.85 -1.23 -5.00 115.26 111.14 2p6x n ASN 192 Ca 0.23 -2.61 -0.14 0.00 -0.11 0.00 0.00 54.58 51.96 2p6x n ASN 192 Cb 0.89 1.45 -0.08 0.00 1.24 0.00 0.00 39.78 43.28 2p6x n ASN 192 CO 0.00 0.00 0.00 0.86 -2.11 0.00 0.00 177.26 176.01 2p6x s TRP 193 N -3.13 -0.63 0.52 1.20 -0.11 -1.26 -4.99 118.94 110.54 2p6x s TRP 193 Ca 0.28 1.48 -0.22 0.00 1.22 0.00 0.00 56.10 58.86 2p6x s TRP 193 Cb 0.01 0.24 -0.07 0.00 -1.50 0.00 0.00 33.47 32.15 2p6x s TRP 193 CO 0.20 -0.35 1.18 -2.30 -4.62 0.00 0.00 176.95 171.06 2p6x n PRO 194 N 2.48 1.45 -3.90 5.86 -0.02 -1.26 -5.02 135.00 134.59 2p6x n PRO 194 Ca -0.15 0.53 -0.36 0.00 -2.02 0.00 0.00 63.50 61.50 2p6x n PRO 194 Cb 0.56 -2.34 -0.06 0.00 -0.02 0.00 0.00 33.50 31.64 2p6x n PRO 194 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 2p6x s ASP 195 N -0.92 6.35 0.33 2.55 1.47 -1.26 -5.01 116.67 120.18 2p6x s ASP 195 Ca 0.70 0.44 0.01 0.00 1.18 0.00 0.00 52.55 54.88 2p6x s ASP 195 Cb -0.45 -2.04 0.58 0.00 -0.34 0.00 0.00 42.92 40.67 2p6x s ASP 195 CO 0.51 0.39 1.99 0.45 0.68 0.00 0.00 175.17 179.19 2p6x h HIS 196 N 4.84 0.84 0.00 2.11 -0.00 -1.96 -3.07 115.15 117.90 2p6x h HIS 196 Ca -0.54 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 59.84 2p6x h HIS 196 Cb 1.22 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 28.35 2p6x h HIS 196 CO 0.74 0.55 -0.00 -0.40 -0.00 0.00 0.00 177.93 178.82 2p6x n ASP 197 N -4.42 0.22 -3.92 2.45 5.68 -1.26 -4.54 116.55 110.76 2p6x n ASP 197 Ca 0.07 0.52 -0.31 0.00 -0.50 0.00 0.00 54.79 54.57 2p6x n ASP 197 Cb 0.06 -0.58 -0.15 0.00 -1.14 0.00 0.00 41.12 39.31 2p6x n ASP 197 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2p6x s VAL 198 N -3.03 1.80 0.21 2.12 0.11 -1.16 -5.03 120.40 115.43 2p6x s VAL 198 Ca 0.13 -2.01 -0.14 0.00 -2.93 0.00 0.00 61.98 57.04 2p6x s VAL 198 Cb 0.17 -2.33 0.25 0.00 -1.53 0.00 0.00 36.38 32.94 2p6x s VAL 198 CO 0.55 -0.61 1.62 -0.65 -3.33 0.00 0.00 175.10 172.68 2p6x h PRO 199 N 7.78 -0.01 0.00 1.54 0.11 -1.80 0.15 132.00 139.77 2p6x h PRO 199 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2p6x h PRO 199 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2p6x h PRO 199 CO 0.50 -0.01 0.20 0.66 -0.21 0.00 0.00 178.00 179.14 2p6x h SER 200 N -0.01 0.00 0.56 -2.05 4.64 -1.95 -1.27 113.55 113.46 2p6x h SER 200 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 2p6x h SER 200 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2p6x h SER 200 CO -0.68 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 173.74 2p6x n SER 201 N -2.81 0.00 0.22 4.97 3.41 0.04 -1.93 113.62 117.51 2p6x n SER 201 Ca -0.02 0.40 0.10 0.00 -0.26 0.00 0.00 58.87 59.09 2p6x n SER 201 Cb 0.25 -0.46 0.43 0.00 -0.26 0.00 0.00 64.21 64.17 2p6x n SER 201 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 2p6x h ILE 202 N 0.00 0.54 -0.82 -1.33 2.04 -1.36 -3.37 117.51 113.21 2p6x h ILE 202 Ca 0.00 -1.16 0.19 0.00 1.00 0.00 0.00 64.86 64.88 2p6x h ILE 202 Cb 0.28 1.80 -0.12 0.00 -0.74 0.00 0.00 36.82 38.05 2p6x h ILE 202 CO 0.00 0.22 0.29 0.44 0.00 0.00 0.00 178.15 179.10 2p6x h ASP 203 N 0.00 0.18 0.03 1.72 3.32 -1.58 -2.11 116.42 117.97 2p6x h ASP 203 Ca -0.00 0.15 -0.08 0.00 0.02 0.00 0.00 57.03 57.11 2p6x h ASP 203 Cb 0.78 0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 2p6x h ASP 203 CO 0.03 -0.01 -0.24 -0.65 -1.72 0.00 0.00 179.24 176.66 2p6x h PRO 204 N 0.35 0.35 -0.22 3.56 0.11 -1.81 -0.81 132.00 133.53 2p6x h PRO 204 Ca 0.48 -0.12 -0.12 0.00 0.11 0.00 0.00 66.00 66.36 2p6x h PRO 204 Cb 0.86 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 2p6x h PRO 204 CO -0.51 0.57 -0.35 0.97 -0.21 0.00 0.00 178.00 178.47 2p6x h ILE 205 N 0.32 1.29 -0.32 4.15 2.10 -1.64 0.75 117.51 124.16 2p6x h ILE 205 Ca 0.05 -1.46 -0.13 0.00 1.08 0.00 0.00 64.86 64.40 2p6x h ILE 205 Cb 0.59 1.51 -0.01 0.00 -1.09 0.00 0.00 36.82 37.82 2p6x h ILE 205 CO 0.04 0.46 -0.32 -0.07 -1.08 0.00 0.00 178.15 177.18 2p6x h LEU 206 N 0.41 0.71 -0.56 2.19 3.38 -1.39 -1.74 115.31 118.30 2p6x h LEU 206 Ca 0.04 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 2p6x h LEU 206 Cb 0.81 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2p6x h LEU 206 CO 0.07 0.98 0.13 -0.33 0.09 0.00 0.00 178.44 179.37 2p6x h GLU 207 N 0.58 0.91 -0.14 1.13 5.08 -0.68 -2.07 114.58 119.38 2p6x h GLU 207 Ca 0.07 -0.22 0.04 0.00 -1.00 0.00 0.00 59.36 58.24 2p6x h GLU 207 Cb 0.82 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 2p6x h GLU 207 CO 0.07 0.85 -0.09 1.25 -1.00 0.00 0.00 179.01 180.09 2p6x h LEU 208 N 0.81 -0.30 -0.60 1.33 5.85 -0.68 -1.03 115.31 120.68 2p6x h LEU 208 Ca 0.18 0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.88 2p6x h LEU 208 Cb 0.36 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.52 2p6x h LEU 208 CO 0.00 -0.12 0.04 0.40 -0.34 0.00 0.00 178.44 178.41 2p6x h ILE 209 N -0.09 1.26 -0.51 4.05 2.04 -1.19 -0.60 117.51 122.47 2p6x h ILE 209 Ca 0.09 -1.10 0.08 0.00 1.00 0.00 0.00 64.86 64.92 2p6x h ILE 209 Cb 0.22 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 2p6x h ILE 209 CO -0.20 0.40 0.15 -0.25 0.00 0.00 0.00 178.15 178.25 2p6x h TRP 210 N 0.94 0.26 -0.40 1.37 2.91 -1.15 -1.02 115.95 118.87 2p6x h TRP 210 Ca 0.18 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.20 2p6x h TRP 210 Cb 0.51 -0.04 -0.02 0.00 -0.51 0.00 0.00 29.16 29.11 2p6x h TRP 210 CO 0.04 0.06 0.16 -0.44 -1.03 0.00 0.00 178.44 177.22 2p6x h ASP 211 N 0.31 0.55 -0.81 2.65 5.19 -0.49 -1.14 116.42 122.68 2p6x h ASP 211 Ca 0.25 -0.17 0.12 0.00 -0.62 0.00 0.00 57.03 56.62 2p6x h ASP 211 Cb 0.31 -0.14 -0.08 0.00 0.18 0.00 0.00 39.33 39.59 2p6x h ASP 211 CO -0.29 0.56 0.42 0.58 -3.12 0.00 0.00 179.24 177.39 2p6x h VAL 212 N 0.50 0.80 0.00 -1.35 2.07 -0.76 -0.86 116.25 116.64 2p6x h VAL 212 Ca 0.13 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2p6x h VAL 212 Cb 0.19 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 2p6x h VAL 212 CO -0.01 0.12 0.00 0.54 0.02 0.00 0.00 177.57 178.24 2p6x n ARG 213 N -4.84 0.07 0.03 1.57 5.12 -0.42 -1.42 116.66 116.76 2p6x n ARG 213 Ca 0.15 0.08 -0.06 0.00 -1.93 0.00 0.00 57.85 56.09 2p6x n ARG 213 Cb 0.36 -1.58 0.14 0.00 -1.16 0.00 0.00 32.46 30.21 2p6x n ARG 213 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2p6x h TYR 215 N 0.37 0.74 -3.04 0.00 -1.99 -1.00 -3.43 116.97 108.62 2p6x h TYR 215 Ca 0.03 -0.54 -0.48 0.00 2.00 0.00 0.00 58.73 59.74 2p6x h TYR 215 Cb 0.90 -0.03 -0.41 0.00 2.00 0.00 0.00 36.73 39.19 2p6x h TYR 215 CO 0.03 1.50 -0.76 -1.14 -0.00 0.00 0.00 178.16 177.79 2p6x s GLN 216 N -2.61 0.15 0.26 4.88 0.74 -0.51 -5.01 119.66 117.56 2p6x s GLN 216 Ca -0.09 -0.20 0.06 0.00 0.05 0.00 0.00 55.36 55.18 2p6x s GLN 216 Cb 0.05 -1.76 0.32 0.00 1.10 0.00 0.00 33.01 32.72 2p6x s GLN 216 CO 0.90 -0.72 1.60 0.93 -0.55 0.00 0.00 175.29 177.45 2p6x h GLU 217 N 8.40 0.19 0.00 1.67 5.08 -1.82 -3.38 114.58 124.71 2p6x h GLU 217 Ca -0.16 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2p6x h GLU 217 Cb 1.12 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2p6x h GLU 217 CO 0.32 0.70 0.00 -0.40 -1.00 0.00 0.00 179.01 178.63 2p6x n ASP 218 N -3.90 1.40 -0.42 1.42 5.75 -1.26 -5.05 116.55 114.49 2p6x n ASP 218 Ca -0.02 -0.70 0.07 0.00 -0.01 0.00 0.00 54.79 54.14 2p6x n ASP 218 Cb 0.58 0.00 0.19 0.00 -1.03 0.00 0.00 41.12 40.86 2p6x n ASP 218 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 2p6x n ASP 219 N -1.12 1.93 0.14 -1.12 5.75 -1.26 -4.74 116.55 116.13 2p6x n ASP 219 Ca 0.00 -3.63 0.04 0.00 -0.01 0.00 0.00 54.79 51.18 2p6x n ASP 219 Cb 0.00 -0.50 0.44 0.00 -1.03 0.00 0.00 41.12 40.03 2p6x n ASP 219 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2p6x h SER 220 N 0.66 0.18 -4.84 -1.12 4.64 -1.97 -3.43 113.55 107.68 2p6x h SER 220 Ca 0.00 -0.03 -0.20 0.00 -0.47 0.00 0.00 61.79 61.09 2p6x h SER 220 Cb 1.00 -0.05 -0.17 0.00 -0.31 0.00 0.00 62.40 62.88 2p6x h SER 220 CO 0.00 0.30 -0.70 0.68 -0.87 0.00 0.00 176.83 176.24 2p6x s VAL 221 N -4.80 0.48 0.56 0.95 -7.23 -1.26 -5.13 120.40 103.97 2p6x s VAL 221 Ca -0.05 -1.62 -0.19 0.00 -1.81 0.00 0.00 61.98 58.31 2p6x s VAL 221 Cb 0.16 -1.28 -0.05 0.00 0.56 0.00 0.00 36.38 35.77 2p6x s VAL 221 CO 0.72 -0.77 1.11 -2.84 -0.31 0.00 0.00 175.10 173.01 2p6x s PRO 222 N -3.15 3.33 -0.12 4.82 0.02 -1.25 -4.91 135.00 133.74 2p6x s PRO 222 Ca 0.03 1.53 -0.16 0.00 0.02 0.00 0.00 61.00 62.43 2p6x s PRO 222 Cb 0.01 -2.01 -0.05 0.00 0.02 0.00 0.00 34.50 32.48 2p6x s PRO 222 CO -0.05 -0.85 0.39 0.42 -0.33 0.00 0.00 177.00 176.58 2p6x s ILE 223 N -1.91 5.22 -0.25 2.83 1.01 -0.47 -4.37 121.20 123.26 2p6x s ILE 223 Ca 0.71 0.76 -0.14 0.00 0.00 0.00 0.00 60.65 61.97 2p6x s ILE 223 Cb -0.22 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 2p6x s ILE 223 CO 0.29 0.39 0.34 0.00 0.00 0.00 0.00 174.94 175.96 2p6x s ILE 225 N 1.75 1.46 0.01 0.00 1.01 -0.10 0.08 121.20 125.42 2p6x s ILE 225 Ca 0.14 -0.68 -0.11 0.00 0.00 0.00 0.00 60.65 60.00 2p6x s ILE 225 Cb -0.15 -1.29 0.01 0.00 0.01 0.00 0.00 42.46 41.04 2p6x s ILE 225 CO 0.09 0.43 0.24 -1.38 0.00 0.00 0.00 174.94 174.31 2p6x s HIS 226 N 0.44 -0.06 0.00 3.97 -3.43 -0.16 -1.96 115.29 114.10 2p6x s HIS 226 Ca -0.14 0.00 0.00 0.00 -0.80 0.00 0.00 55.06 54.13 2p6x s HIS 226 Cb -0.16 0.03 0.00 0.00 -1.43 0.00 0.00 32.58 31.02 2p6x s HIS 226 CO 0.05 -0.38 0.00 0.00 -2.00 0.00 0.00 174.74 172.40 2p6x h SER 228 N 0.00 0.00 1.12 0.00 0.87 -1.86 -2.23 113.55 111.45 2p6x h SER 228 Ca 0.00 -0.30 -0.17 0.00 -1.23 0.00 0.00 61.79 60.09 2p6x h SER 228 Cb 0.00 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 61.93 2p6x h SER 228 CO 0.00 0.81 -0.90 0.00 -0.53 0.00 0.00 176.83 176.21 2p6x h ALA 229 N -0.70 0.52 0.00 6.23 0.00 -1.88 0.37 119.26 123.80 2p6x h ALA 229 Ca -0.05 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.08 2p6x h ALA 229 Cb 0.53 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2p6x h ALA 229 CO -0.03 1.02 0.00 0.41 0.00 0.00 0.00 179.25 180.65 2p6x n GLY 230 N 1.32 0.55 3.13 0.00 0.00 -1.23 -4.13 105.19 104.83 2p6x n GLY 230 Ca -0.01 -0.78 -0.13 0.00 0.00 0.00 0.00 46.02 45.10 2p6x n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2p6x n GLY 232 N 3.15 1.41 0.37 0.00 0.00 0.36 -4.61 105.19 105.88 2p6x n GLY 232 Ca -0.15 -0.81 0.02 0.00 0.00 0.00 0.00 46.02 45.09 2p6x n GLY 232 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2p6x h ARG 233 N 0.00 1.14 -0.51 1.61 3.08 -1.92 -0.89 114.38 116.90 2p6x h ARG 233 Ca 0.00 -0.07 0.04 0.00 0.07 0.00 0.00 59.98 60.02 2p6x h ARG 233 Cb 0.00 -0.26 -0.04 0.00 0.08 0.00 0.00 29.97 29.75 2p6x h ARG 233 CO 0.00 0.76 0.27 1.15 -1.07 0.00 0.00 179.97 181.07 2p6x h THR 234 N 1.18 0.97 -0.47 2.04 2.02 -1.81 -1.80 112.91 115.04 2p6x h THR 234 Ca 0.42 -0.18 -0.09 0.00 0.77 0.00 0.00 66.41 67.33 2p6x h THR 234 Cb 0.14 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 2p6x h THR 234 CO -0.17 0.09 -0.08 1.23 0.37 0.00 0.00 175.52 176.97 2p6x h GLY 235 N 0.52 0.90 0.95 2.16 0.00 -0.71 -1.89 103.07 105.00 2p6x h GLY 235 Ca 0.22 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 2p6x h GLY 235 CO -0.14 0.61 0.18 -2.08 0.00 0.00 0.00 176.54 175.11 2p6x h VAL 236 N 0.76 1.15 -0.16 4.60 2.07 -0.71 -0.71 116.25 123.25 2p6x h VAL 236 Ca 0.13 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 2p6x h VAL 236 Cb 0.57 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 2p6x h VAL 236 CO 0.03 0.15 0.08 0.40 0.02 0.00 0.00 177.57 178.26 2p6x h ILE 237 N 0.42 1.11 -0.62 4.57 2.04 -1.07 -2.17 117.51 121.78 2p6x h ILE 237 Ca 0.12 -0.30 0.07 0.00 1.00 0.00 0.00 64.86 65.75 2p6x h ILE 237 Cb 0.08 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.12 2p6x h ILE 237 CO -0.02 0.10 0.31 0.00 0.00 0.00 0.00 178.15 178.54 2p6x h ALA 239 N 1.36 0.55 -0.20 0.00 0.00 -0.97 -0.06 119.26 119.93 2p6x h ALA 239 Ca 0.29 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 2p6x h ALA 239 Cb 0.25 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2p6x h ALA 239 CO -0.22 0.31 -0.16 0.82 0.00 0.00 0.00 179.25 180.01 2p6x h ILE 240 N 0.55 1.32 -0.07 0.00 2.04 -1.21 -1.25 117.51 118.89 2p6x h ILE 240 Ca 0.12 -1.29 0.03 0.00 1.00 0.00 0.00 64.86 64.71 2p6x h ILE 240 Cb 0.45 1.73 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 2p6x h ILE 240 CO 0.02 0.39 -0.09 -0.78 0.00 0.00 0.00 178.15 177.69 2p6x h ASP 241 N 0.13 -0.27 -0.58 1.72 3.58 -0.90 0.91 116.42 121.01 2p6x h ASP 241 Ca 0.04 0.05 0.07 0.00 0.42 0.00 0.00 57.03 57.61 2p6x h ASP 241 Cb 0.69 0.13 -0.06 0.00 1.72 0.00 0.00 39.33 41.81 2p6x h ASP 241 CO 0.04 -0.12 0.26 0.22 -2.88 0.00 0.00 179.24 176.76 2p6x h TYR 242 N -0.12 0.47 -0.35 0.28 3.20 -0.97 -0.78 116.97 118.70 2p6x h TYR 242 Ca 0.06 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.82 2p6x h TYR 242 Cb 0.20 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 2p6x h TYR 242 CO -0.19 0.18 -0.32 1.15 -1.64 0.00 0.00 178.16 177.35 2p6x h THR 243 N 0.48 1.28 -0.48 1.81 2.02 -0.92 -2.48 112.91 114.63 2p6x h THR 243 Ca 0.27 -1.47 -0.05 0.00 0.77 0.00 0.00 66.41 65.94 2p6x h THR 243 Cb 0.26 1.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.99 2p6x h THR 243 CO -0.23 0.48 0.10 -0.25 0.37 0.00 0.00 175.52 176.00 2p6x h TRP 244 N 0.65 0.75 -0.28 3.16 2.91 -0.38 -1.93 115.95 120.84 2p6x h TRP 244 Ca 0.07 -0.07 -0.05 0.00 1.13 0.00 0.00 58.89 59.98 2p6x h TRP 244 Cb 0.85 -0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 29.27 2p6x h TRP 244 CO 0.04 0.65 -0.01 1.98 -1.03 0.00 0.00 178.44 180.08 2p6x h MET 245 N 0.71 0.50 -0.73 2.65 4.05 -0.96 0.15 114.93 121.29 2p6x h MET 245 Ca 0.16 -0.16 0.12 0.00 -0.28 0.00 0.00 59.70 59.53 2p6x h MET 245 Cb 0.29 -0.04 -0.08 0.00 -0.80 0.00 0.00 31.60 30.96 2p6x h MET 245 CO -0.00 0.66 0.33 -0.07 0.23 0.00 0.00 176.91 178.06 2p6x h LEU 246 N 0.28 0.38 0.64 3.39 3.38 -1.16 0.74 115.31 122.95 2p6x h LEU 246 Ca 0.08 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 2p6x h LEU 246 Cb 0.44 0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.23 2p6x h LEU 246 CO 0.02 0.19 -0.31 -0.07 0.09 0.00 0.00 178.44 178.36 2p6x h LEU 247 N 0.53 -0.73 -0.88 1.67 3.38 -0.95 0.15 115.31 118.49 2p6x h LEU 247 Ca 0.38 -0.01 0.19 0.00 0.09 0.00 0.00 57.88 58.53 2p6x h LEU 247 Cb 0.49 0.19 -0.11 0.00 0.09 0.00 0.00 40.66 41.32 2p6x h LEU 247 CO -0.33 -0.37 0.41 0.11 0.09 0.00 0.00 178.44 178.35 2p6x h LYS 248 N -1.12 0.47 -0.13 1.13 1.57 -0.64 -2.00 116.57 115.86 2p6x h LYS 248 Ca -0.09 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2p6x h LYS 248 Cb 0.70 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.90 2p6x h LYS 248 CO 0.14 0.31 0.00 -0.25 -0.57 0.00 0.00 179.45 179.08 2p6x n ASP 249 N -4.98 1.27 -1.62 0.86 8.00 0.24 -4.94 116.55 115.39 2p6x n ASP 249 Ca 0.20 -1.65 -0.14 0.00 0.71 0.00 0.00 54.79 53.92 2p6x n ASP 249 Cb 0.58 -0.08 -0.00 0.00 -0.02 0.00 0.00 41.12 41.59 2p6x n ASP 249 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2p6x n GLY 250 N 1.05 -0.19 1.73 0.44 0.00 -0.60 -4.94 105.19 102.68 2p6x n GLY 250 Ca 0.15 -0.30 -0.03 0.00 0.00 0.00 0.00 46.02 45.85 2p6x n GLY 250 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2p6x n ILE 251 N -4.02 1.43 -1.78 -0.61 -5.35 0.43 -4.85 119.36 104.60 2p6x n ILE 251 Ca -0.15 -2.75 -0.42 0.00 -0.27 0.00 0.00 62.75 59.15 2p6x n ILE 251 Cb 0.62 0.30 -0.03 0.00 -1.74 0.00 0.00 39.64 38.79 2p6x n ILE 251 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2p6x s ILE 252 N -2.78 2.98 0.67 7.28 -1.09 -1.19 -4.90 121.20 122.17 2p6x s ILE 252 Ca 0.37 0.22 -0.14 0.00 -2.23 0.00 0.00 60.65 58.87 2p6x s ILE 252 Cb 0.37 -3.14 0.01 0.00 -1.58 0.00 0.00 42.46 38.12 2p6x s ILE 252 CO -0.07 -0.01 1.11 -2.16 -1.23 0.00 0.00 174.94 172.58 2p6x s PRO 253 N 3.57 2.72 0.31 2.79 0.04 -1.26 -4.94 135.00 138.24 2p6x s PRO 253 Ca 0.81 1.36 0.04 0.00 0.04 0.00 0.00 61.00 63.25 2p6x s PRO 253 Cb -0.42 -1.94 0.63 0.00 0.04 0.00 0.00 34.50 32.81 2p6x s PRO 253 CO 0.36 -1.31 1.86 1.05 0.04 0.00 0.00 177.00 179.01 2p6x h GLU 254 N -0.13 0.88 -0.22 4.56 9.09 -1.99 -2.83 114.58 123.94 2p6x h GLU 254 Ca -0.46 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 58.89 2p6x h GLU 254 Cb 1.24 -0.20 0.00 0.00 -1.65 0.00 0.00 28.75 28.15 2p6x h GLU 254 CO 0.54 0.58 0.00 0.27 0.05 0.00 0.00 179.01 180.45 2p6x n ASN 255 N -4.58 0.29 -4.75 3.06 0.23 -1.26 -4.96 115.26 103.29 2p6x n ASN 255 Ca 0.18 -2.00 -0.42 0.00 -0.53 0.00 0.00 54.58 51.81 2p6x n ASN 255 Cb 0.36 -0.11 -0.01 0.00 -2.08 0.00 0.00 39.78 37.94 2p6x n ASN 255 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 2p6x n PHE 256 N -0.36 2.81 -3.67 -2.53 7.35 -1.07 -4.99 117.46 115.00 2p6x n PHE 256 Ca 0.00 0.40 -0.09 0.00 -0.76 0.00 0.00 57.45 57.00 2p6x n PHE 256 Cb 0.07 -2.54 -0.10 0.00 0.35 0.00 0.00 39.48 37.26 2p6x n PHE 256 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2p6x s SER 257 N 0.08 -0.51 0.26 -2.13 0.15 -1.26 -5.03 113.70 105.26 2p6x s SER 257 Ca 0.58 1.03 -0.05 0.00 0.70 0.00 0.00 55.95 58.22 2p6x s SER 257 Cb -0.50 1.12 0.32 0.00 -1.71 0.00 0.00 66.02 65.24 2p6x s SER 257 CO 0.58 -0.21 1.92 0.58 1.20 0.00 0.00 173.24 177.30 2p6x h VAL 258 N 5.72 1.20 -0.06 4.45 2.07 -1.99 -1.54 116.25 126.10 2p6x h VAL 258 Ca -0.28 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 66.83 2p6x h VAL 258 Cb 1.16 -0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.68 2p6x h VAL 258 CO 0.21 0.24 -0.16 0.15 0.02 0.00 0.00 177.57 178.03 2p6x h PHE 259 N 1.30 -0.42 -0.92 1.57 3.57 -1.99 -1.53 116.94 118.52 2p6x h PHE 259 Ca 0.39 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.93 2p6x h PHE 259 Cb -0.05 0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.84 2p6x h PHE 259 CO -0.00 -0.23 0.61 0.77 -2.23 0.00 0.00 178.31 177.22 2p6x h SER 260 N -0.24 1.03 -0.08 0.41 0.02 -1.83 -1.39 113.55 111.47 2p6x h SER 260 Ca 0.07 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 61.04 2p6x h SER 260 Cb 0.34 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 2p6x h SER 260 CO -0.20 0.73 -0.15 0.25 -1.14 0.00 0.00 176.83 176.32 2p6x h LEU 261 N 1.21 -0.47 -0.75 5.07 5.85 -0.91 -0.01 115.31 125.31 2p6x h LEU 261 Ca 0.35 0.08 -0.11 0.00 0.84 0.00 0.00 57.88 59.04 2p6x h LEU 261 Cb -0.08 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 2p6x h LEU 261 CO -0.09 -0.20 -0.28 0.40 -0.34 0.00 0.00 178.44 177.92 2p6x h ILE 262 N -0.22 1.28 -0.25 4.05 2.04 -1.13 -1.75 117.51 121.54 2p6x h ILE 262 Ca 0.08 -1.38 0.04 0.00 1.00 0.00 0.00 64.86 64.60 2p6x h ILE 262 Cb 0.32 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.70 2p6x h ILE 262 CO -0.21 0.45 0.01 -0.09 0.00 0.00 0.00 178.15 178.31 2p6x h ARG 263 N 0.55 0.09 -0.33 2.37 2.43 -1.01 0.58 114.38 119.06 2p6x h ARG 263 Ca 0.07 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2p6x h ARG 263 Cb 0.76 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 2p6x h ARG 263 CO 0.06 0.06 0.14 1.49 -1.51 0.00 0.00 179.97 180.21 2p6x h GLU 264 N 0.09 0.48 -0.57 0.20 4.81 -0.73 -2.78 114.58 116.08 2p6x h GLU 264 Ca 0.12 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.22 2p6x h GLU 264 Cb 0.14 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 2p6x h GLU 264 CO -0.19 0.48 0.17 0.52 -0.73 0.00 0.00 179.01 179.26 2p6x h MET 265 N 0.39 0.86 0.00 1.92 2.86 -1.01 -2.50 114.93 117.44 2p6x h MET 265 Ca 0.11 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 2p6x h MET 265 Cb 0.17 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.69 2p6x h MET 265 CO -0.01 0.74 0.00 0.54 1.06 0.00 0.00 176.91 179.24 2p6x n ARG 266 N -4.29 0.09 0.00 1.72 1.74 0.17 -1.45 116.66 114.64 2p6x n ARG 266 Ca 0.04 0.37 0.14 0.00 -0.77 0.00 0.00 57.85 57.63 2p6x n ARG 266 Cb 0.21 -1.68 0.53 0.00 -1.02 0.00 0.00 32.46 30.50 2p6x n ARG 266 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2p6x n THR 267 N -1.85 0.00 -0.09 0.55 -2.24 -0.94 -4.25 114.28 105.46 2p6x n THR 267 Ca 0.02 -0.05 -0.11 0.00 -2.27 0.00 0.00 64.05 61.65 2p6x n THR 267 Cb 0.17 -0.07 -0.12 0.00 -2.10 0.00 0.00 70.33 68.21 2p6x n THR 267 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2p6x n GLN 268 N -1.11 0.99 -3.77 -0.78 6.02 -0.53 -4.96 117.38 113.24 2p6x n GLN 268 Ca 0.12 0.04 -0.13 0.00 -0.01 0.00 0.00 57.00 57.02 2p6x n GLN 268 Cb 0.30 -1.43 -0.13 0.00 1.02 0.00 0.00 30.24 30.01 2p6x n GLN 268 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2p6x s ARG 269 N -2.41 0.21 0.50 -1.09 3.52 -1.15 -4.70 118.95 113.83 2p6x s ARG 269 Ca -0.16 0.39 -0.23 0.00 -0.13 0.00 0.00 55.73 55.60 2p6x s ARG 269 Cb 0.06 -0.01 -0.06 0.00 -1.56 0.00 0.00 34.95 33.38 2p6x s ARG 269 CO 0.61 -0.10 1.33 -1.25 -0.81 0.00 0.00 175.30 175.08 2p6x s PRO 270 N 0.67 3.44 -1.69 5.12 0.04 -1.26 -2.60 135.00 138.73 2p6x s PRO 270 Ca -0.05 2.17 0.00 0.00 0.04 0.00 0.00 61.00 63.17 2p6x s PRO 270 Cb -0.06 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 32.07 2p6x s PRO 270 CO -0.04 -0.93 0.00 0.43 0.04 0.00 0.00 177.00 176.50 2p6x n SER 271 N -0.66 -4.67 -0.29 6.66 7.64 -1.26 -4.84 113.62 116.20 2p6x n SER 271 Ca 0.08 0.30 0.07 0.00 1.01 0.00 0.00 58.87 60.33 2p6x n SER 271 Cb 0.45 -4.11 0.22 0.00 -1.01 0.00 0.00 64.21 59.76 2p6x n SER 271 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2p6x h LEU 272 N 0.00 0.44 -8.58 -3.43 5.85 -1.80 -2.90 115.31 104.89 2p6x h LEU 272 Ca -0.37 0.10 -0.67 0.00 0.84 0.00 0.00 57.88 57.78 2p6x h LEU 272 Cb 1.18 0.04 -0.22 0.00 0.37 0.00 0.00 40.66 42.03 2p6x h LEU 272 CO 0.50 0.17 -0.56 -0.69 -0.34 0.00 0.00 178.44 177.51 2p6x s VAL 273 N -5.98 4.58 -0.18 1.05 1.01 -1.26 0.14 120.40 119.75 2p6x s VAL 273 Ca -0.12 -0.38 0.17 0.00 0.00 0.00 0.00 61.98 61.66 2p6x s VAL 273 Cb 0.22 -3.31 -0.24 0.00 0.00 0.00 0.00 36.38 33.05 2p6x s VAL 273 CO 0.77 0.11 0.09 1.67 0.00 0.00 0.00 175.10 177.74 2p6x n GLN 274 N 4.97 0.81 -4.36 2.72 7.27 -1.09 -4.86 117.38 122.83 2p6x n GLN 274 Ca -0.14 -0.02 -0.21 0.00 0.07 0.00 0.00 57.00 56.71 2p6x n GLN 274 Cb 0.49 -1.50 -0.10 0.00 2.41 0.00 0.00 30.24 31.54 2p6x n GLN 274 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2p6x s THR 275 N -2.52 1.90 0.30 1.69 -4.23 -1.26 -5.03 115.64 106.49 2p6x s THR 275 Ca -0.10 -2.16 0.01 0.00 -1.18 0.00 0.00 61.69 58.27 2p6x s THR 275 Cb 0.06 -2.03 0.28 0.00 1.34 0.00 0.00 72.50 72.16 2p6x s THR 275 CO 0.80 -0.47 1.90 -0.61 -0.54 0.00 0.00 174.62 175.70 2p6x h GLN 276 N 2.72 0.98 -0.45 3.99 4.15 -1.94 -1.73 115.11 122.83 2p6x h GLN 276 Ca -0.40 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 58.89 2p6x h GLN 276 Cb 1.22 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 28.68 2p6x h GLN 276 CO 0.58 0.65 -0.01 0.93 -1.93 0.00 0.00 178.83 179.05 2p6x h GLU 277 N 1.01 0.81 -0.51 1.69 3.07 -1.98 -0.34 114.58 118.33 2p6x h GLU 277 Ca 0.41 -0.26 -0.09 0.00 -0.50 0.00 0.00 59.36 58.92 2p6x h GLU 277 Cb 0.27 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 2p6x h GLU 277 CO -0.17 0.87 -0.03 1.96 -1.40 0.00 0.00 179.01 180.24 2p6x h GLN 278 N 0.65 0.88 -0.33 2.33 4.20 -1.91 -1.38 115.11 119.55 2p6x h GLN 278 Ca 0.13 -0.27 0.03 0.00 0.06 0.00 0.00 58.65 58.60 2p6x h GLN 278 Cb 0.52 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 2p6x h GLN 278 CO 0.03 0.90 0.12 -0.92 -0.67 0.00 0.00 178.83 178.28 2p6x h TYR 279 N 0.81 0.22 -0.92 2.96 3.20 -0.99 -1.18 116.97 121.07 2p6x h TYR 279 Ca 0.15 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2p6x h TYR 279 Cb 0.53 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 2p6x h TYR 279 CO 0.03 0.10 0.57 0.93 -1.64 0.00 0.00 178.16 178.15 2p6x h GLU 280 N 0.27 1.23 -0.72 1.82 5.08 -0.85 -1.91 114.58 119.51 2p6x h GLU 280 Ca 0.15 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2p6x h GLU 280 Cb 0.11 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 2p6x h GLU 280 CO -0.14 0.85 0.44 1.25 -1.00 0.00 0.00 179.01 180.40 2p6x h LEU 281 N 1.26 0.86 -0.15 1.33 5.85 -0.81 0.55 115.31 124.19 2p6x h LEU 281 Ca 0.33 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 59.00 2p6x h LEU 281 Cb -0.09 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.71 2p6x h LEU 281 CO -0.07 0.66 0.07 0.58 -0.34 0.00 0.00 178.44 179.34 2p6x h VAL 282 N 0.98 0.99 -0.29 1.05 2.07 -0.97 -0.05 116.25 120.03 2p6x h VAL 282 Ca 0.26 -0.05 0.04 0.00 0.82 0.00 0.00 66.70 67.76 2p6x h VAL 282 Cb -0.04 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2p6x h VAL 282 CO -0.05 0.03 0.08 0.22 0.02 0.00 0.00 177.57 177.86 2p6x h TYR 283 N 0.15 0.13 -0.50 1.57 3.20 -0.84 0.07 116.97 120.76 2p6x h TYR 283 Ca 0.06 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.84 2p6x h TYR 283 Cb 0.02 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 2p6x h TYR 283 CO -0.09 0.05 -0.13 -0.91 -1.64 0.00 0.00 178.16 175.43 2p6x h ASN 284 N 0.19 0.94 -0.66 -2.11 2.35 -0.69 -1.16 115.58 114.44 2p6x h ASN 284 Ca 0.13 -0.31 -0.04 0.00 -0.55 0.00 0.00 56.30 55.53 2p6x h ASN 284 Cb 0.12 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 2p6x h ASN 284 CO -0.16 1.06 0.25 0.00 -1.65 0.00 0.00 177.43 176.94 2p6x h ALA 285 N 1.01 0.86 -0.48 -0.83 0.00 -0.81 -2.43 119.26 116.58 2p6x h ALA 285 Ca 0.13 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 2p6x h ALA 285 Cb 0.67 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2p6x h ALA 285 CO 0.05 0.49 0.00 0.28 0.00 0.00 0.00 179.25 180.07 2p6x h VAL 286 N 0.94 1.26 -0.59 0.00 2.07 -0.47 -1.56 116.25 117.91 2p6x h VAL 286 Ca 0.22 -1.06 0.02 0.00 0.82 0.00 0.00 66.70 66.69 2p6x h VAL 286 Cb 0.23 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 2p6x h VAL 286 CO -0.02 0.37 0.37 0.25 0.02 0.00 0.00 177.57 178.56 2p6x h LEU 287 N 0.71 0.61 -0.55 2.57 5.85 -1.19 0.25 115.31 123.56 2p6x h LEU 287 Ca 0.14 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 2p6x h LEU 287 Cb 0.51 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 2p6x h LEU 287 CO 0.02 0.43 0.34 -0.08 -0.34 0.00 0.00 178.44 178.82 2p6x h GLU 288 N 0.73 0.74 -0.36 1.25 4.57 -1.09 -0.70 114.58 119.72 2p6x h GLU 288 Ca 0.23 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.31 2p6x h GLU 288 Cb -0.01 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 2p6x h GLU 288 CO -0.08 0.52 0.04 -0.07 -1.18 0.00 0.00 179.01 178.24 2p6x h LEU 289 N 0.74 0.51 -0.44 1.64 3.38 -0.98 0.29 115.31 120.45 2p6x h LEU 289 Ca 0.20 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2p6x h LEU 289 Cb -0.04 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2p6x h LEU 289 CO -0.04 0.56 0.19 -0.26 0.09 0.00 0.00 178.44 178.98 2p6x h PHE 290 N 0.53 0.65 -0.16 1.13 -1.00 -0.17 -0.29 116.94 117.63 2p6x h PHE 290 Ca 0.12 -0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.86 2p6x h PHE 290 Cb 0.29 -0.20 -0.01 0.00 3.61 0.00 0.00 35.95 39.64 2p6x h PHE 290 CO 0.01 0.55 0.11 0.87 -1.61 0.00 0.00 178.31 178.23 2p6x h LYS 291 N 0.57 0.21 -0.66 1.51 1.57 -0.72 -2.33 116.57 116.72 2p6x h LYS 291 Ca 0.15 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.93 2p6x h LYS 291 Cb 0.15 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 2p6x h LYS 291 CO -0.02 0.14 0.43 0.00 -0.57 0.00 0.00 179.45 179.44 2p6x h ARG 292 N 0.22 0.84 -0.37 3.15 3.08 -0.73 -1.97 114.38 118.59 2p6x h ARG 292 Ca 0.06 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 2p6x h ARG 292 Cb -0.02 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 2p6x h ARG 292 CO -0.01 0.55 0.16 0.37 -1.07 0.00 0.00 179.97 179.97 2p6x h GLN 293 N 0.86 0.51 -0.19 0.04 5.75 -0.94 -1.88 115.11 119.26 2p6x h GLN 293 Ca 0.25 -0.06 -0.11 0.00 -0.15 0.00 0.00 58.65 58.59 2p6x h GLN 293 Cb -0.05 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.38 2p6x h GLN 293 CO -0.07 0.42 -0.34 0.52 -2.65 0.00 0.00 178.83 176.71 2p6x h MET 294 N 0.51 0.40 -0.24 1.69 2.86 -0.80 0.64 114.93 119.99 2p6x h MET 294 Ca 0.13 -0.17 0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2p6x h MET 294 Cb 0.09 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 2p6x h MET 294 CO -0.02 0.69 0.09 -0.44 1.06 0.00 0.00 176.91 178.30 2p6x h ASP 295 N 0.34 0.12 0.25 1.22 3.45 -0.96 -0.30 116.42 120.54 2p6x h ASP 295 Ca 0.04 0.02 0.01 0.00 0.43 0.00 0.00 57.03 57.53 2p6x h ASP 295 Cb 0.76 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.50 2p6x h ASP 295 CO 0.06 0.10 -0.33 0.58 -1.57 0.00 0.00 179.24 178.08 2p6x h VAL 296 N 0.21 0.32 -0.72 -1.35 2.07 -0.59 -2.94 116.25 113.25 2p6x h VAL 296 Ca 0.10 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.67 2p6x h VAL 296 Cb 0.06 0.32 -0.05 0.00 -1.52 0.00 0.00 31.29 30.09 2p6x h VAL 296 CO -0.09 0.00 0.43 0.40 0.02 0.00 0.00 177.57 178.33 2p6x h ILE 297 N -0.63 1.04 0.00 4.57 2.04 -0.72 -3.51 117.51 120.30 2p6x h ILE 297 Ca -0.00 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.58 2p6x h ILE 297 Cb 0.60 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2p6x h ILE 297 CO -0.11 0.15 0.00 0.54 0.00 0.00 0.00 178.15 178.73