#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yis h SER 3 N 0.00 0.00 0.92 0.00 4.64 -2.03 -2.09 113.55 114.99 1yis h SER 3 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yis h SER 3 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1yis h SER 3 CO 0.00 0.18 -0.02 -0.33 -0.87 0.00 0.00 176.83 175.80 1yis h GLU 4 N 0.00 0.00 0.00 4.77 3.07 -2.05 -3.00 114.58 117.37 1yis h GLU 4 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1yis h GLU 4 Cb 0.40 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1yis h GLU 4 CO 0.02 0.02 0.00 -0.25 -1.40 0.00 0.00 179.01 177.40 1yis n ASP 5 N -3.12 0.18 -4.21 1.42 8.00 -0.78 -4.74 116.55 113.29 1yis n ASP 5 Ca 0.00 0.54 -0.21 0.00 0.71 0.00 0.00 54.79 55.82 1yis n ASP 5 Cb 0.29 -0.58 -0.13 0.00 -0.02 0.00 0.00 41.12 40.69 1yis n ASP 5 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1yis s LYS 6 N -3.07 1.02 0.25 -1.24 -0.14 -1.14 -5.09 119.74 110.33 1yis s LYS 6 Ca 0.08 -0.97 -0.30 0.00 -1.36 0.00 0.00 55.97 53.42 1yis s LYS 6 Cb 0.11 -1.12 -0.14 0.00 -1.68 0.00 0.00 37.83 35.00 1yis s LYS 6 CO 0.36 0.27 1.13 0.34 -0.76 0.00 0.00 175.35 176.68 1yis n PHE 7 N 1.45 1.46 -4.22 3.18 7.35 -1.26 -4.99 117.46 120.43 1yis n PHE 7 Ca -0.19 0.65 -0.17 0.00 -0.76 0.00 0.00 57.45 56.97 1yis n PHE 7 Cb 0.54 -2.30 -0.11 0.00 0.35 0.00 0.00 39.48 37.96 1yis n PHE 7 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1yis s GLU 8 N -1.07 0.97 -0.13 -4.13 0.41 -1.26 -5.09 118.70 108.39 1yis s GLU 8 Ca 0.64 -1.19 -0.29 0.00 -0.41 0.00 0.00 54.97 53.71 1yis s GLU 8 Cb -0.73 -0.84 -0.03 0.00 -1.78 0.00 0.00 34.13 30.75 1yis s GLU 8 CO 0.56 0.16 1.41 0.45 -0.49 0.00 0.00 175.26 177.36 1yis s SER 9 N -2.36 6.83 0.45 -0.19 0.15 -1.26 -4.87 113.70 112.44 1yis s SER 9 Ca 0.07 1.88 0.24 0.00 0.70 0.00 0.00 55.95 58.83 1yis s SER 9 Cb -0.05 -2.54 0.99 0.00 -1.71 0.00 0.00 66.02 62.72 1yis s SER 9 CO 0.02 -0.84 1.86 1.62 1.20 0.00 0.00 173.24 177.11 1yis h VAL 10 N 5.55 0.63 0.07 4.45 3.04 -1.98 -1.43 116.25 126.57 1yis h VAL 10 Ca -0.31 -1.06 -0.00 0.00 -1.01 0.00 0.00 66.70 64.31 1yis h VAL 10 Cb 1.13 1.70 0.00 0.00 -2.01 0.00 0.00 31.29 32.11 1yis h VAL 10 CO 0.97 0.23 -0.03 -0.07 -1.01 0.00 0.00 177.57 177.65 1yis h LEU 11 N 0.00 -0.08 -0.44 3.16 3.38 -1.94 0.03 115.31 119.43 1yis h LEU 11 Ca -0.00 -0.47 -0.06 0.00 0.09 0.00 0.00 57.88 57.44 1yis h LEU 11 Cb 0.68 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 1yis h LEU 11 CO 0.03 0.45 0.04 -1.28 0.09 0.00 0.00 178.44 177.77 1yis h SER 12 N -0.64 0.72 1.01 -0.43 0.87 -1.89 0.50 113.55 113.70 1yis h SER 12 Ca -0.01 -0.28 -0.03 0.00 -1.23 0.00 0.00 61.79 60.24 1yis h SER 12 Cb 0.54 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 1yis h SER 12 CO 0.01 0.82 -1.01 0.71 -0.53 0.00 0.00 176.83 176.84 1yis h THR 13 N 0.59 0.11 0.00 2.23 1.35 -1.37 -3.17 112.91 112.65 1yis h THR 13 Ca 0.13 -1.21 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 1yis h THR 13 Cb 0.43 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.49 1yis h THR 13 CO 0.01 0.06 0.00 -1.14 -0.25 0.00 0.00 175.52 174.21 1yis n ARG 14 N -2.75 0.00 0.29 4.72 0.63 -0.09 -4.59 116.66 114.87 1yis n ARG 14 Ca -0.02 0.00 0.19 0.00 -0.92 0.00 0.00 57.85 57.10 1yis n ARG 14 Cb 0.61 -0.13 0.84 0.00 0.45 0.00 0.00 32.46 34.22 1yis n ARG 14 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 1yis h TYR 15 N 0.00 0.00 0.00 -0.14 0.05 -1.18 -3.27 116.97 112.43 1yis h TYR 15 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1yis h TYR 15 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1yis h TYR 15 CO 0.00 0.01 -0.24 0.00 -1.05 0.00 0.00 178.16 176.87 1yis h LYS 17 N 0.00 0.08 -0.70 0.00 2.10 -1.60 0.16 116.57 116.62 1yis h LYS 17 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1yis h LYS 17 Cb 1.15 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 1yis h LYS 17 CO 0.00 0.06 0.00 0.09 -2.00 0.00 0.00 179.45 177.60 1yis n ASN 18 N -4.29 3.89 -4.83 7.07 5.03 -1.26 -4.96 115.26 115.90 1yis n ASN 18 Ca 0.28 -2.00 -0.37 0.00 0.87 0.00 0.00 54.58 53.36 1yis n ASN 18 Cb 1.25 -0.46 -0.06 0.00 -1.02 0.00 0.00 39.78 39.49 1yis n ASN 18 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1yis s SER 19 N -1.06 6.92 0.00 6.41 0.15 0.57 -4.95 113.70 121.74 1yis s SER 19 Ca 0.48 1.13 0.12 0.00 0.70 0.00 0.00 55.95 58.38 1yis s SER 19 Cb 0.25 -2.31 0.50 0.00 -1.71 0.00 0.00 66.02 62.75 1yis s SER 19 CO 0.33 0.21 1.38 -0.81 1.20 0.00 0.00 173.24 175.55 1yis n PRO 20 N 1.34 0.00 0.19 5.44 -0.04 -1.26 -2.03 135.00 138.65 1yis n PRO 20 Ca -0.09 0.30 0.04 0.00 -0.04 0.00 0.00 63.50 63.71 1yis n PRO 20 Cb 0.51 -1.51 0.40 0.00 -0.04 0.00 0.00 33.50 32.86 1yis n PRO 20 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1yis h LEU 21 N 0.00 0.00 -1.67 1.53 4.07 -1.92 0.80 115.31 118.12 1yis h LEU 21 Ca 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 1yis h LEU 21 Cb 0.20 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.93 1yis h LEU 21 CO 0.00 0.34 -0.19 0.58 -1.08 0.00 0.00 178.44 178.09 1yis h VAL 22 N 0.00 0.94 0.07 1.22 2.07 -1.69 0.14 116.25 119.00 1yis h VAL 22 Ca -0.00 -0.71 -0.27 0.00 0.82 0.00 0.00 66.70 66.54 1yis h VAL 22 Cb 0.64 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1yis h VAL 22 CO 0.04 0.19 -1.41 0.28 0.02 0.00 0.00 177.57 176.69 1yis h SER 23 N 0.00 0.24 -1.00 0.57 0.02 -1.54 -3.28 113.55 108.56 1yis h SER 23 Ca -0.00 -0.77 0.04 0.00 -0.84 0.00 0.00 61.79 60.22 1yis h SER 23 Cb 0.39 -0.08 -0.06 0.00 0.14 0.00 0.00 62.40 62.79 1yis h SER 23 CO 0.02 1.60 0.66 0.40 -1.14 0.00 0.00 176.83 178.37 1yis h ILE 24 N -0.49 1.16 -0.47 3.27 2.04 -0.65 -2.47 117.51 119.90 1yis h ILE 24 Ca -0.33 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1yis h ILE 24 Cb 1.63 -0.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1yis h ILE 24 CO -0.03 0.23 0.00 0.18 0.00 0.00 0.00 178.15 178.53 1yis n LEU 25 N -4.45 2.88 -4.86 1.44 4.77 0.45 -4.58 117.00 112.65 1yis n LEU 25 Ca 0.14 -1.44 -0.31 0.00 -0.03 0.00 0.00 56.01 54.36 1yis n LEU 25 Cb 0.11 -0.38 -0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1yis n LEU 25 CO 0.34 0.63 0.71 -0.94 -1.33 0.00 0.00 177.39 176.80 1yis s SER 26 N -0.92 6.31 0.36 -1.43 1.04 -0.93 -4.92 113.70 113.21 1yis s SER 26 Ca 0.33 1.48 0.04 0.00 0.48 0.00 0.00 55.95 58.28 1yis s SER 26 Cb 0.19 -2.48 0.69 0.00 0.10 0.00 0.00 66.02 64.51 1yis s SER 26 CO 0.20 -0.81 1.98 -0.08 0.98 0.00 0.00 173.24 175.51 1yis h GLU 27 N 0.04 0.65 -0.59 4.02 4.81 -1.92 -1.70 114.58 119.89 1yis h GLU 27 Ca -0.45 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 58.67 1yis h GLU 27 Cb 1.19 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 1yis h GLU 27 CO 0.62 0.50 0.21 1.15 -0.73 0.00 0.00 179.01 180.75 1yis h THR 28 N 0.66 1.24 -0.32 0.32 2.02 -1.93 -0.47 112.91 114.42 1yis h THR 28 Ca 0.17 -0.77 -0.13 0.00 0.77 0.00 0.00 66.41 66.45 1yis h THR 28 Cb 0.05 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1yis h THR 28 CO -0.03 0.30 -0.33 -1.13 0.37 0.00 0.00 175.52 174.70 1yis h ASN 29 N 0.83 0.74 -0.31 4.18 -1.24 -1.66 -0.91 115.58 117.22 1yis h ASN 29 Ca 0.19 -0.31 -0.04 0.00 0.71 0.00 0.00 56.30 56.86 1yis h ASN 29 Cb 0.25 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.08 1yis h ASN 29 CO -0.01 1.01 0.05 0.11 -1.29 0.00 0.00 177.43 177.30 1yis h LYS 30 N 0.60 0.52 -0.28 6.67 1.79 -1.03 -0.32 116.57 124.53 1yis h LYS 30 Ca 0.06 -0.14 -0.07 0.00 -2.18 0.00 0.00 60.65 58.33 1yis h LYS 30 Cb 0.85 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.42 1yis h LYS 30 CO 0.07 0.62 -0.11 0.00 -1.08 0.00 0.00 179.45 178.95 1yis h ALA 31 N 0.88 1.30 -0.62 3.86 0.00 -1.01 -0.96 119.26 122.71 1yis h ALA 31 Ca 0.10 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 1yis h ALA 31 Cb 0.35 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1yis h ALA 31 CO 0.01 0.47 0.08 1.15 0.00 0.00 0.00 179.25 180.96 1yis h THR 32 N 0.43 1.26 -0.25 0.00 2.02 -0.84 -2.11 112.91 113.42 1yis h THR 32 Ca 0.08 -1.04 -0.09 0.00 0.77 0.00 0.00 66.41 66.13 1yis h THR 32 Cb 0.45 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1yis h THR 32 CO 0.03 0.38 -0.23 -0.07 0.37 0.00 0.00 175.52 175.99 1yis h LEU 33 N 0.94 0.48 -0.54 2.58 3.38 -0.37 -0.30 115.31 121.47 1yis h LEU 33 Ca 0.19 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1yis h LEU 33 Cb 0.45 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1yis h LEU 33 CO 0.02 0.71 0.32 -0.50 0.09 0.00 0.00 178.44 179.08 1yis h TRP 34 N 0.42 0.73 -0.47 1.13 4.06 -0.80 0.56 115.95 121.59 1yis h TRP 34 Ca 0.06 -0.01 -0.12 0.00 2.06 0.00 0.00 58.89 60.88 1yis h TRP 34 Cb 0.64 -0.24 -0.01 0.00 -1.00 0.00 0.00 29.16 28.55 1yis h TRP 34 CO 0.02 0.51 -0.20 0.00 -3.56 0.00 0.00 178.44 175.22 1yis h ARG 35 N 0.73 0.93 -0.77 0.49 3.08 -1.04 -0.85 114.38 116.95 1yis h ARG 35 Ca 0.19 -0.38 -0.05 0.00 0.07 0.00 0.00 59.98 59.82 1yis h ARG 35 Cb 0.01 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 29.98 1yis h ARG 35 CO -0.03 1.04 0.30 0.37 -1.07 0.00 0.00 179.97 180.57 1yis h GLN 36 N 0.81 1.16 -0.37 0.04 5.75 -0.65 0.48 115.11 122.33 1yis h GLN 36 Ca 0.11 -0.22 -0.08 0.00 -0.15 0.00 0.00 58.65 58.31 1yis h GLN 36 Cb 0.75 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.11 1yis h GLN 36 CO 0.06 0.95 -0.09 -0.07 -2.65 0.00 0.00 178.83 177.03 1yis h LEU 37 N 1.13 0.71 -1.38 -2.39 3.38 -0.66 0.30 115.31 116.40 1yis h LEU 37 Ca 0.26 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1yis h LEU 37 Cb 0.23 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1yis h LEU 37 CO -0.02 0.91 0.09 -0.50 0.09 0.00 0.00 178.44 179.02 1yis h TRP 38 N 0.51 0.51 0.12 1.13 6.55 -0.83 0.91 115.95 124.84 1yis h TRP 38 Ca 0.09 -0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.90 1yis h TRP 38 Cb 0.60 -0.16 0.00 0.00 -0.86 0.00 0.00 29.16 28.74 1yis h TRP 38 CO 0.05 0.44 -0.06 0.82 -1.05 0.00 0.00 178.44 178.65 1yis h ILE 39 N 0.51 1.02 -0.79 1.49 2.04 -0.35 -0.89 117.51 120.54 1yis h ILE 39 Ca 0.12 -0.56 -0.00 0.00 1.00 0.00 0.00 64.86 65.42 1yis h ILE 39 Cb 0.18 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 1yis h ILE 39 CO -0.01 0.13 0.49 -0.50 0.00 0.00 0.00 178.15 178.27 1yis h TRP 40 N -0.41 1.02 -0.28 1.37 6.55 -0.59 0.14 115.95 123.73 1yis h TRP 40 Ca -0.02 0.01 -0.01 0.00 0.95 0.00 0.00 58.89 59.82 1yis h TRP 40 Cb 0.34 -0.34 -0.01 0.00 -0.86 0.00 0.00 29.16 28.29 1yis h TRP 40 CO 0.01 0.67 0.15 1.25 -1.05 0.00 0.00 178.44 179.47 1yis h LEU 41 N 1.08 0.36 -0.54 -4.49 5.85 -0.70 -0.45 115.31 116.43 1yis h LEU 41 Ca 0.28 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 1yis h LEU 41 Cb -0.07 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 1yis h LEU 41 CO -0.06 0.36 0.33 0.00 -0.34 0.00 0.00 178.44 178.74 1yis h ALA 42 N 1.01 0.69 -0.17 1.25 0.00 -0.49 -0.52 119.26 121.02 1yis h ALA 42 Ca 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1yis h ALA 42 Cb 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1yis h ALA 42 CO -0.01 0.17 0.07 0.93 0.00 0.00 0.00 179.25 180.40 1yis h GLU 43 N 0.72 0.25 -0.39 0.00 5.08 -0.75 -1.64 114.58 117.86 1yis h GLU 43 Ca 0.19 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1yis h GLU 43 Cb -0.02 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 1yis h GLU 43 CO -0.04 0.31 0.16 0.00 -1.00 0.00 0.00 179.01 178.45 1yis h ALA 44 N 0.92 0.50 -0.92 3.43 0.00 -0.92 0.56 119.26 122.83 1yis h ALA 44 Ca 0.06 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1yis h ALA 44 Cb 0.15 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1yis h ALA 44 CO -0.01 0.10 0.61 0.93 0.00 0.00 0.00 179.25 180.88 1yis h GLU 45 N 0.48 1.21 -0.15 0.00 5.08 -1.02 -0.59 114.58 119.59 1yis h GLU 45 Ca 0.13 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1yis h GLU 45 Cb 0.17 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 1yis h GLU 45 CO -0.01 0.80 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.55 1yis h LYS 46 N 1.25 0.28 -0.20 2.33 3.64 -0.92 -1.32 116.57 121.62 1yis h LYS 46 Ca 0.34 -0.10 0.06 0.00 -1.27 0.00 0.00 60.65 59.68 1yis h LYS 46 Cb -0.14 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1yis h LYS 46 CO -0.08 0.55 0.17 0.93 -2.27 0.00 0.00 179.45 178.76 1yis h GLU 47 N -0.02 0.00 -0.46 1.90 5.08 -0.39 -1.01 114.58 119.67 1yis h GLU 47 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1yis h GLU 47 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1yis h GLU 47 CO 0.01 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.30 1yis n LEU 48 N -4.19 2.51 0.00 1.33 4.77 -0.27 -4.94 117.00 116.21 1yis n LEU 48 Ca 0.02 -1.25 0.00 0.00 -0.03 0.00 0.00 56.01 54.75 1yis n LEU 48 Cb 0.31 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1yis n LEU 48 CO 0.32 0.62 0.00 0.61 -1.33 0.00 0.00 177.39 177.61 1yis n GLY 49 N 1.25 0.48 3.56 -0.72 0.00 -0.38 -5.03 105.19 104.35 1yis n GLY 49 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1yis n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1yis s LEU 50 N 0.00 3.45 0.54 0.99 1.43 -0.53 -4.83 118.68 119.73 1yis s LEU 50 Ca 0.00 -1.34 0.25 0.00 -1.03 0.00 0.00 54.13 52.02 1yis s LEU 50 Cb 0.00 -2.57 1.43 0.00 0.03 0.00 0.00 46.19 45.08 1yis s LEU 50 CO 0.00 -1.66 2.02 0.11 0.23 0.00 0.00 176.35 177.04 1yis h LYS 51 N 9.99 0.00 0.00 1.70 1.57 -1.87 -2.50 116.57 125.46 1yis h LYS 51 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1yis h LYS 51 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1yis h LYS 51 CO 1.40 0.00 0.17 -0.56 -0.57 0.00 0.00 179.45 179.89 1yis h GLN 52 N 0.00 0.00 -5.14 3.15 -0.00 -1.98 -3.35 115.11 107.79 1yis h GLN 52 Ca 0.20 0.00 -0.67 0.00 -0.00 0.00 0.00 58.65 58.18 1yis h GLN 52 Cb 0.85 0.00 -0.17 0.00 -0.00 0.00 0.00 27.48 28.16 1yis h GLN 52 CO -0.00 0.00 0.05 0.08 -0.00 0.00 0.00 178.83 178.96 1yis s VAL 53 N -4.02 4.87 0.41 1.86 1.01 -0.94 -4.94 120.40 118.65 1yis s VAL 53 Ca -0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 61.70 1yis s VAL 53 Cb 0.10 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1yis s VAL 53 CO 0.31 -0.69 0.64 0.42 0.00 0.00 0.00 175.10 175.79 1yis s THR 54 N 2.67 4.80 0.30 3.92 -4.23 -1.26 -4.83 115.64 117.02 1yis s THR 54 Ca 0.18 -0.28 0.18 0.00 -1.18 0.00 0.00 61.69 60.59 1yis s THR 54 Cb -0.17 -3.78 0.15 0.00 1.34 0.00 0.00 72.50 70.04 1yis s THR 54 CO 0.15 -0.59 1.84 -0.61 -0.54 0.00 0.00 174.62 174.87 1yis h GLN 55 N 0.52 0.00 -0.28 3.99 5.75 -1.96 -2.41 115.11 120.72 1yis h GLN 55 Ca -0.48 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 57.87 1yis h GLN 55 Cb 1.22 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.76 1yis h GLN 55 CO 0.61 0.32 -0.43 -0.44 -2.65 0.00 0.00 178.83 176.23 1yis h ASP 56 N 0.00 0.74 -0.18 -0.69 3.32 -1.99 -0.45 116.42 117.17 1yis h ASP 56 Ca -0.00 -0.35 -0.02 0.00 0.02 0.00 0.00 57.03 56.68 1yis h ASP 56 Cb 0.68 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 1yis h ASP 56 CO 0.04 1.07 0.04 0.00 -1.72 0.00 0.00 179.24 178.67 1yis h ALA 57 N 0.96 0.24 -0.94 3.45 0.00 -1.79 -2.35 119.26 118.83 1yis h ALA 57 Ca 0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1yis h ALA 57 Cb 0.97 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.65 1yis h ALA 57 CO 0.09 -0.11 0.56 0.82 0.00 0.00 0.00 179.25 180.61 1yis h ILE 58 N 0.09 1.26 -0.49 0.00 2.04 -1.31 -2.62 117.51 116.48 1yis h ILE 58 Ca 0.06 -0.58 -0.05 0.00 1.00 0.00 0.00 64.86 65.28 1yis h ILE 58 Cb 0.29 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.28 1yis h ILE 58 CO 0.00 0.28 0.10 0.44 0.00 0.00 0.00 178.15 178.97 1yis h ASP 59 N 1.30 0.70 0.00 1.72 3.32 -0.91 -0.66 116.42 121.90 1yis h ASP 59 Ca 0.34 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1yis h ASP 59 Cb -0.04 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.33 1yis h ASP 59 CO -0.06 0.71 0.00 -0.62 -1.72 0.00 0.00 179.24 177.55 1yis n GLU 60 N -4.28 0.11 0.00 3.56 1.02 -0.90 -1.13 120.64 119.02 1yis n GLU 60 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1yis n GLU 60 Cb 0.23 -1.05 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 1yis n GLU 60 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1yis n LYS 62 N 0.38 0.00 0.04 3.49 5.02 -0.26 -0.64 118.16 126.19 1yis n LYS 62 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1yis n LYS 62 Cb 0.03 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.08 1yis n LYS 62 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1yis h SER 63 N 0.00 0.52 -0.59 4.39 0.87 -1.38 -3.25 113.55 114.11 1yis h SER 63 Ca 0.00 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 1yis h SER 63 Cb 0.00 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 1yis h SER 63 CO 0.00 1.03 0.00 0.59 -0.53 0.00 0.00 176.83 177.92 1yis n ASN 64 N -3.89 4.60 -0.29 6.23 3.02 0.19 -4.64 115.26 120.48 1yis n ASN 64 Ca -0.04 -2.49 0.03 0.00 -0.03 0.00 0.00 54.58 52.05 1yis n ASN 64 Cb 0.66 -0.55 0.17 0.00 -0.61 0.00 0.00 39.78 39.44 1yis n ASN 64 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1yis h ARG 65 N 3.71 0.74 -0.64 3.52 2.43 -1.79 -2.72 114.38 119.62 1yis h ARG 65 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1yis h ARG 65 Cb 1.42 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 1yis h ARG 65 CO 0.23 0.49 0.00 -0.25 -1.51 0.00 0.00 179.97 178.92 1yis n ASP 66 N -4.76 3.90 -4.50 -3.80 8.00 -1.26 -4.82 116.55 109.30 1yis n ASP 66 Ca 0.14 -2.23 -0.43 0.00 0.71 0.00 0.00 54.79 52.97 1yis n ASP 66 Cb 0.29 -0.49 -0.08 0.00 -0.02 0.00 0.00 41.12 40.81 1yis n ASP 66 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1yis s VAL 67 N -1.54 5.01 -0.16 2.53 1.01 -1.03 -5.05 120.40 121.16 1yis s VAL 67 Ca 0.44 -0.19 -0.00 0.00 0.00 0.00 0.00 61.98 62.23 1yis s VAL 67 Cb 0.26 -4.09 -0.00 0.00 0.00 0.00 0.00 36.38 32.55 1yis s VAL 67 CO 0.25 -0.47 -0.13 -0.36 0.00 0.00 0.00 175.10 174.39 1yis s PHE 68 N 2.35 2.82 -0.94 5.22 0.08 -1.26 -5.02 117.98 121.22 1yis s PHE 68 Ca 0.15 -0.99 -0.01 0.00 0.12 0.00 0.00 56.93 56.20 1yis s PHE 68 Cb -0.16 -1.92 0.28 0.00 -0.57 0.00 0.00 43.02 40.65 1yis s PHE 68 CO 0.15 -0.46 1.16 -3.47 -0.10 0.00 0.00 175.22 172.50 1yis n ASP 69 N 4.12 5.34 -0.27 1.36 -0.08 -1.26 -4.92 116.55 120.83 1yis n ASP 69 Ca -0.19 -3.35 0.08 0.00 -1.51 0.00 0.00 54.79 49.82 1yis n ASP 69 Cb 0.52 -1.09 0.22 0.00 2.34 0.00 0.00 41.12 43.11 1yis n ASP 69 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 1yis h TRP 70 N 5.28 0.51 -0.83 -0.67 4.06 -1.98 0.74 115.95 123.06 1yis h TRP 70 Ca 0.19 0.04 0.07 0.00 2.06 0.00 0.00 58.89 61.25 1yis h TRP 70 Cb 0.67 -0.10 -0.06 0.00 -1.00 0.00 0.00 29.16 28.67 1yis h TRP 70 CO 0.87 0.01 0.51 -1.00 -3.56 0.00 0.00 178.44 175.27 1yis h PRO 71 N 0.40 0.88 -0.07 0.49 0.13 -2.00 0.31 132.00 132.16 1yis h PRO 71 Ca 0.46 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.52 1yis h PRO 71 Cb 0.77 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 31.70 1yis h PRO 71 CO -0.46 0.58 -0.01 0.35 -0.23 0.00 0.00 178.00 178.23 1yis h PHE 72 N 0.91 0.15 -0.82 1.56 3.57 -1.56 -2.58 116.94 118.16 1yis h PHE 72 Ca 0.37 -0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.94 1yis h PHE 72 Cb 0.21 -0.04 -0.07 0.00 2.79 0.00 0.00 35.95 38.84 1yis h PHE 72 CO -0.04 0.45 0.46 0.82 -2.23 0.00 0.00 178.31 177.78 1yis h ILE 73 N -0.21 0.89 -0.32 1.41 2.04 -0.28 -0.77 117.51 120.28 1yis h ILE 73 Ca 0.02 -0.26 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 1yis h ILE 73 Cb 0.41 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.53 1yis h ILE 73 CO 0.01 0.14 0.18 0.03 0.00 0.00 0.00 178.15 178.51 1yis h ARG 74 N 0.77 0.44 -0.32 2.37 2.47 -0.31 0.23 114.38 120.02 1yis h ARG 74 Ca 0.40 -0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 59.03 1yis h ARG 74 Cb 0.39 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.60 1yis h ARG 74 CO -0.26 0.35 0.02 0.66 0.56 0.00 0.00 179.97 181.30 1yis h SER 75 N 0.40 0.46 -0.14 7.04 4.64 -0.99 -2.26 113.55 122.70 1yis h SER 75 Ca 0.11 -0.08 -0.13 0.00 -0.47 0.00 0.00 61.79 61.22 1yis h SER 75 Cb 0.03 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 1yis h SER 75 CO -0.02 0.51 -0.37 -0.33 -0.87 0.00 0.00 176.83 175.76 1yis h GLU 76 N 0.48 0.66 0.00 4.77 4.39 -0.58 -1.03 114.58 123.27 1yis h GLU 76 Ca 0.11 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.48 1yis h GLU 76 Cb 0.29 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1yis h GLU 76 CO 0.01 0.92 0.00 0.39 -1.16 0.00 0.00 179.01 179.17 1yis n GLU 77 N -4.05 0.05 -0.09 2.33 1.02 0.02 -2.39 120.64 117.52 1yis n GLU 77 Ca -0.01 0.27 -0.15 0.00 -0.02 0.00 0.00 57.16 57.25 1yis n GLU 77 Cb 0.50 -1.60 -0.07 0.00 -0.02 0.00 0.00 31.44 30.26 1yis n GLU 77 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1yis n ARG 78 N -1.69 0.52 -0.17 3.49 1.74 -0.75 -4.05 116.66 115.75 1yis n ARG 78 Ca 0.03 0.49 -0.01 0.00 -0.77 0.00 0.00 57.85 57.59 1yis n ARG 78 Cb 0.20 -1.67 0.07 0.00 -1.02 0.00 0.00 32.46 30.04 1yis n ARG 78 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1yis h LYS 79 N -1.00 0.10 -5.24 5.56 1.57 -1.21 -3.37 116.57 112.99 1yis h LYS 79 Ca -0.22 -0.01 -0.66 0.00 -1.87 0.00 0.00 60.65 57.89 1yis h LYS 79 Cb 1.00 -0.02 -0.30 0.00 0.08 0.00 0.00 32.23 32.99 1yis h LYS 79 CO -0.13 0.07 -0.80 -0.48 -0.57 0.00 0.00 179.45 177.54 1yis s LEU 80 N -10.62 2.52 -0.88 2.94 0.05 -1.01 -5.03 118.68 106.65 1yis s LEU 80 Ca -0.14 -0.44 -0.07 0.00 0.05 0.00 0.00 54.13 53.54 1yis s LEU 80 Cb 0.17 -1.57 -0.07 0.00 -2.05 0.00 0.00 46.19 42.67 1yis s LEU 80 CO 0.73 0.11 3.01 0.29 -0.55 0.00 0.00 176.35 179.93 1yis n LYS 81 N 3.88 3.16 -3.38 1.48 4.01 -1.26 -4.19 118.16 121.85 1yis n LYS 81 Ca -0.19 -2.14 -0.14 0.00 -0.51 0.00 0.00 58.31 55.34 1yis n LYS 81 Cb 0.52 -2.41 -0.09 0.00 -0.51 0.00 0.00 35.03 32.54 1yis n LYS 81 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 1yis s HIS 82 N 0.42 -0.63 0.19 2.13 3.76 -1.26 -5.05 115.29 114.85 1yis s HIS 82 Ca 0.64 0.23 -0.16 0.00 -0.15 0.00 0.00 55.06 55.62 1yis s HIS 82 Cb 0.26 -0.27 0.17 0.00 1.11 0.00 0.00 32.58 33.85 1yis s HIS 82 CO -0.08 -0.84 1.64 -0.44 -0.85 0.00 0.00 174.74 174.17 1yis h ASP 83 N 8.23 -0.54 0.00 1.40 5.19 -1.89 0.21 116.42 129.01 1yis h ASP 83 Ca -0.14 0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1yis h ASP 83 Cb 1.12 0.35 0.00 0.00 0.18 0.00 0.00 39.33 40.97 1yis h ASP 83 CO 0.30 -0.19 0.00 0.52 -3.12 0.00 0.00 179.24 176.75 1yis n VAL 84 N -5.38 0.00 0.00 -1.35 0.31 -1.26 -0.65 118.33 110.00 1yis n VAL 84 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 1yis n VAL 84 Cb 0.29 -0.12 0.00 0.00 -0.91 0.00 0.00 33.84 33.10 1yis n VAL 84 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yis n ALA 86 N 0.61 0.00 0.11 3.52 0.00 0.06 -0.69 120.51 124.12 1yis n ALA 86 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yis n ALA 86 Cb 0.00 0.00 0.30 0.00 0.00 0.00 0.00 19.45 19.75 1yis n ALA 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1yis h HIS 87 N 0.00 0.23 -0.14 0.00 3.86 -1.14 0.15 115.15 118.11 1yis h HIS 87 Ca 0.00 -0.05 -0.04 0.00 -1.16 0.00 0.00 60.37 59.13 1yis h HIS 87 Cb 0.00 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.41 1yis h HIS 87 CO 0.00 0.49 -0.06 -0.97 0.86 0.00 0.00 177.93 178.26 1yis h ASN 88 N 0.19 0.29 -0.09 2.45 -0.73 -1.15 0.15 115.58 116.69 1yis h ASN 88 Ca 0.03 -0.40 0.02 0.00 1.87 0.00 0.00 56.30 57.82 1yis h ASN 88 Cb 0.63 -0.08 -0.02 0.00 0.27 0.00 0.00 38.32 39.12 1yis h ASN 88 CO 0.05 0.62 -0.05 -0.74 -0.37 0.00 0.00 177.43 176.94 1yis h HIS 89 N -0.04 -0.12 -0.54 0.67 2.76 -1.72 0.56 115.15 116.71 1yis h HIS 89 Ca 0.03 0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.24 1yis h HIS 89 Cb 0.51 0.07 -0.04 0.00 1.55 0.00 0.00 27.41 29.50 1yis h HIS 89 CO 0.06 -0.08 0.32 0.00 -1.30 0.00 0.00 177.93 176.93 1yis h ALA 90 N 1.03 0.70 0.00 5.26 0.00 -0.61 -0.05 119.26 125.59 1yis h ALA 90 Ca 0.05 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1yis h ALA 90 Cb 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1yis h ALA 90 CO -0.12 0.03 -0.41 0.35 0.00 0.00 0.00 179.25 179.09 1yis h PHE 91 N 0.63 0.00 -0.46 0.00 3.57 -0.27 -2.80 116.94 117.61 1yis h PHE 91 Ca 0.22 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.64 1yis h PHE 91 Cb 0.04 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1yis h PHE 91 CO -0.07 0.41 -0.01 0.78 -2.23 0.00 0.00 178.31 177.19 1yis h GLY 92 N 1.35 0.88 1.85 2.40 0.00 0.15 -1.68 103.07 108.02 1yis h GLY 92 Ca -0.00 -0.66 -0.06 0.00 0.00 0.00 0.00 47.33 46.61 1yis h GLY 92 CO 0.05 0.61 -0.21 0.50 0.00 0.00 0.00 176.54 177.49 1yis h LYS 93 N 0.66 0.18 -0.00 4.80 1.57 -0.82 -2.08 116.57 120.87 1yis h LYS 93 Ca 0.13 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 58.71 1yis h LYS 93 Cb 0.52 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 1yis h LYS 93 CO 0.03 0.39 -0.70 -0.07 -0.57 0.00 0.00 179.45 178.52 1yis h LEU 94 N 0.17 0.01 -6.26 2.94 3.38 -1.29 -3.35 115.31 110.91 1yis h LEU 94 Ca 0.03 -0.01 -0.59 0.00 0.09 0.00 0.00 57.88 57.40 1yis h LEU 94 Cb 0.47 -0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.80 1yis h LEU 94 CO 0.03 0.71 -0.73 0.00 0.09 0.00 0.00 178.44 178.55 1yis h PRO 96 N 4.34 0.01 -0.01 0.00 0.13 -1.57 0.11 132.00 135.00 1yis h PRO 96 Ca 0.17 -0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.13 1yis h PRO 96 Cb 0.73 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.85 1yis h PRO 96 CO 0.72 0.00 -0.76 1.15 -0.23 0.00 0.00 178.00 178.88 1yis h THR 97 N 0.01 1.48 -0.00 1.56 2.02 -1.93 -3.22 112.91 112.83 1yis h THR 97 Ca 0.22 -2.44 0.00 0.00 0.77 0.00 0.00 66.41 64.97 1yis h THR 97 Cb 0.88 2.32 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 1yis h THR 97 CO -0.00 0.71 -0.70 0.00 0.37 0.00 0.00 175.52 175.89 1yis n ALA 98 N -2.44 4.06 -0.30 6.16 0.00 -0.47 -4.53 120.51 122.99 1yis n ALA 98 Ca -0.02 -0.49 0.07 0.00 0.00 0.00 0.00 53.44 52.99 1yis n ALA 98 Cb 0.73 -0.93 0.17 0.00 0.00 0.00 0.00 19.45 19.42 1yis n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yis h ALA 99 N 3.14 0.78 0.00 0.00 0.00 -0.86 -0.74 119.26 121.58 1yis h ALA 99 Ca 0.00 0.31 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1yis h ALA 99 Cb 0.52 0.57 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1yis h ALA 99 CO 0.00 -0.45 -0.11 0.78 0.00 0.00 0.00 179.25 179.48 1yis h GLY 100 N 0.04 0.00 -1.23 0.00 0.00 -1.81 -3.22 103.07 96.84 1yis h GLY 100 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.79 1yis h GLY 100 CO -0.83 0.00 0.00 0.29 0.00 0.00 0.00 176.54 176.00 1yis n ILE 101 N -3.33 0.19 -1.96 2.60 -6.64 -0.33 -4.87 119.36 105.01 1yis n ILE 101 Ca -0.00 -0.59 -0.42 0.00 -1.77 0.00 0.00 62.75 59.96 1yis n ILE 101 Cb 0.31 1.15 -0.03 0.00 -1.44 0.00 0.00 39.64 39.63 1yis n ILE 101 CO 0.00 0.00 0.00 -0.63 -1.77 0.00 0.00 176.55 174.15 1yis s ILE 102 N -1.15 2.73 -1.58 7.28 1.01 -0.93 -1.85 121.20 126.72 1yis s ILE 102 Ca 0.19 0.51 0.00 0.00 0.00 0.00 0.00 60.65 61.35 1yis s ILE 102 Cb 0.13 -3.33 0.00 0.00 0.01 0.00 0.00 42.46 39.27 1yis s ILE 102 CO 0.18 0.04 0.00 0.00 0.00 0.00 0.00 174.94 175.16 1yis n HIS 103 N 4.06 0.00 -1.47 3.97 1.44 -1.26 -4.89 115.22 117.07 1yis n HIS 103 Ca 0.14 0.00 -0.59 0.00 -2.01 0.00 0.00 57.72 55.26 1yis n HIS 103 Cb 0.39 -2.78 -0.10 0.00 0.12 0.00 0.00 29.99 27.63 1yis n HIS 103 CO 0.00 0.00 0.00 -0.11 -2.81 0.00 0.00 176.34 173.42 1yis n LEU 104 N -1.69 1.47 0.00 2.39 7.94 -0.77 -0.14 117.00 126.20 1yis n LEU 104 Ca -0.15 0.78 0.00 0.00 -1.11 0.00 0.00 56.01 55.53 1yis n LEU 104 Cb 0.55 -1.03 0.00 0.00 0.53 0.00 0.00 43.42 43.47 1yis n LEU 104 CO 0.23 -0.71 0.00 0.61 -1.11 0.00 0.00 177.39 176.41 1yis n GLY 105 N 6.05 2.87 3.92 -3.96 0.00 -1.26 -5.01 105.19 107.80 1yis n GLY 105 Ca 0.42 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.18 1yis n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yis s ALA 106 N -2.11 3.48 0.30 4.61 0.00 0.81 -4.43 121.76 124.41 1yis s ALA 106 Ca 0.00 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.30 1yis s ALA 106 Cb 0.00 -2.45 -0.02 0.00 0.00 0.00 0.00 23.12 20.65 1yis s ALA 106 CO 0.00 -0.47 0.38 0.99 0.00 0.00 0.00 175.76 176.67 1yis s THR 107 N -2.74 4.37 0.29 0.00 2.01 -1.26 -5.00 115.64 113.31 1yis s THR 107 Ca 0.49 -1.09 -0.01 0.00 0.31 0.00 0.00 61.69 61.39 1yis s THR 107 Cb -0.10 -3.51 0.28 0.00 0.01 0.00 0.00 72.50 69.18 1yis s THR 107 CO 0.43 -0.23 1.90 0.28 -0.69 0.00 0.00 174.62 176.31 1yis h SER 108 N 1.08 0.96 0.00 3.53 0.02 -1.97 0.37 113.55 117.55 1yis h SER 108 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1yis h SER 108 Cb 1.25 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.59 1yis h SER 108 CO 0.57 0.62 0.13 0.00 -1.14 0.00 0.00 176.83 177.01 1yis h PHE 110 N 0.00 0.36 0.18 0.00 3.57 -1.25 -0.43 116.94 119.37 1yis h PHE 110 Ca 0.00 0.02 -0.33 0.00 3.53 0.00 0.00 57.97 61.19 1yis h PHE 110 Cb 0.26 -0.10 0.01 0.00 2.79 0.00 0.00 35.95 38.91 1yis h PHE 110 CO 0.00 0.19 -1.62 -0.39 -2.23 0.00 0.00 178.31 174.26 1yis h VAL 111 N 0.40 1.01 0.56 1.41 -1.51 -1.44 -3.15 116.25 113.52 1yis h VAL 111 Ca 0.17 -2.50 -0.02 0.00 -1.23 0.00 0.00 66.70 63.12 1yis h VAL 111 Cb 0.08 2.79 -0.01 0.00 -2.13 0.00 0.00 31.29 32.03 1yis h VAL 111 CO -0.12 0.82 -0.39 1.56 -1.23 0.00 0.00 177.57 178.20 1yis h GLN 112 N -0.00 -0.87 -0.30 5.19 4.20 -1.38 0.20 115.11 122.14 1yis h GLN 112 Ca -0.32 0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.44 1yis h GLN 112 Cb 2.01 0.20 -0.01 0.00 0.30 0.00 0.00 27.48 29.98 1yis h GLN 112 CO 0.16 -0.58 0.15 -0.44 -0.67 0.00 0.00 178.83 177.45 1yis h ASP 113 N -0.90 0.39 0.50 1.46 5.19 -1.27 -2.05 116.42 119.73 1yis h ASP 113 Ca -0.07 -0.12 -0.10 0.00 -0.62 0.00 0.00 57.03 56.12 1yis h ASP 113 Cb 0.74 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.14 1yis h ASP 113 CO 0.04 0.40 -0.49 0.78 -3.12 0.00 0.00 179.24 176.85 1yis h ASN 114 N 0.36 0.00 -0.21 6.45 2.35 -1.57 -2.09 115.58 120.86 1yis h ASN 114 Ca 0.11 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.68 1yis h ASN 114 Cb 0.10 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 1yis h ASN 114 CO -0.01 0.49 -0.51 0.00 -1.65 0.00 0.00 177.43 175.74 1yis h ALA 115 N 1.51 0.56 0.01 -0.83 0.00 -0.48 -1.65 119.26 118.38 1yis h ALA 115 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1yis h ALA 115 Cb 0.87 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1yis h ALA 115 CO 0.06 0.68 -0.01 -0.44 0.00 0.00 0.00 179.25 179.54 1yis h ASP 116 N 0.62 -0.04 -0.95 0.00 3.32 -1.12 0.13 116.42 118.37 1yis h ASP 116 Ca 0.02 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.15 1yis h ASP 116 Cb 1.10 0.01 -0.07 0.00 0.22 0.00 0.00 39.33 40.59 1yis h ASP 116 CO 0.11 -0.02 0.60 -0.07 -1.72 0.00 0.00 179.24 178.14 1yis h LEU 117 N -0.03 0.93 -0.16 1.55 3.38 -1.29 0.55 115.31 120.25 1yis h LEU 117 Ca 0.00 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1yis h LEU 117 Cb 0.03 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1yis h LEU 117 CO -0.00 0.57 -0.17 0.40 0.09 0.00 0.00 178.44 179.33 1yis h ILE 118 N 1.06 1.35 -0.53 1.22 2.04 -0.89 -0.99 117.51 120.76 1yis h ILE 118 Ca 0.43 -1.35 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 1yis h ILE 118 Cb 0.25 1.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 1yis h ILE 118 CO -0.20 0.40 0.29 0.00 0.00 0.00 0.00 178.15 178.64 1yis h ALA 119 N 0.61 0.68 0.15 1.87 0.00 -0.23 -0.91 119.26 121.43 1yis h ALA 119 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1yis h ALA 119 Cb 0.71 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1yis h ALA 119 CO 0.04 0.20 -0.07 1.88 0.00 0.00 0.00 179.25 181.30 1yis h TYR 120 N 0.71 -0.19 -0.65 0.00 0.99 0.12 -0.95 116.97 116.99 1yis h TYR 120 Ca 0.19 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.92 1yis h TYR 120 Cb 0.05 0.06 -0.03 0.00 1.00 0.00 0.00 36.73 37.82 1yis h TYR 120 CO -0.01 -0.03 0.42 -0.09 -0.00 0.00 0.00 178.16 178.45 1yis h ARG 121 N -0.32 0.86 -0.53 4.88 2.43 -1.07 0.28 114.38 120.91 1yis h ARG 121 Ca -0.02 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.13 1yis h ARG 121 Cb 0.25 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.57 1yis h ARG 121 CO 0.03 0.58 0.30 -0.44 -1.51 0.00 0.00 179.97 178.94 1yis h ASP 122 N 0.88 0.47 -0.71 -3.80 3.32 -1.05 0.21 116.42 115.74 1yis h ASP 122 Ca 0.24 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.30 1yis h ASP 122 Cb -0.09 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 1yis h ASP 122 CO -0.05 0.32 0.42 0.28 -1.72 0.00 0.00 179.24 178.50 1yis h SER 123 N 0.59 0.86 -0.54 6.45 0.02 -0.34 -2.10 113.55 118.49 1yis h SER 123 Ca 0.22 -0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 61.06 1yis h SER 123 Cb 0.08 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1yis h SER 123 CO -0.12 0.67 0.17 0.40 -1.14 0.00 0.00 176.83 176.81 1yis h ILE 124 N 0.97 1.23 -0.87 3.27 2.04 0.42 -1.05 117.51 123.51 1yis h ILE 124 Ca 0.25 -0.80 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 1yis h ILE 124 Cb -0.02 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 1yis h ILE 124 CO -0.05 0.31 0.44 0.44 0.00 0.00 0.00 178.15 179.29 1yis h ASP 125 N 0.86 1.12 -0.16 1.72 3.32 0.04 0.94 116.42 124.27 1yis h ASP 125 Ca 0.19 -0.12 -0.15 0.00 0.02 0.00 0.00 57.03 56.97 1yis h ASP 125 Cb 0.27 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1yis h ASP 125 CO -0.01 0.93 -0.43 0.45 -1.72 0.00 0.00 179.24 178.46 1yis h HIS 126 N 1.24 0.86 -0.75 4.55 3.86 -1.07 -2.55 115.15 121.28 1yis h HIS 126 Ca 0.30 -0.26 -0.05 0.00 -1.16 0.00 0.00 60.37 59.19 1yis h HIS 126 Cb 0.08 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 28.34 1yis h HIS 126 CO 0.01 1.02 0.25 0.82 0.86 0.00 0.00 177.93 180.90 1yis h ILE 127 N 0.57 1.26 -0.36 2.45 2.04 -0.64 -2.15 117.51 120.69 1yis h ILE 127 Ca 0.04 -0.88 -0.07 0.00 1.00 0.00 0.00 64.86 64.95 1yis h ILE 127 Cb 0.98 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 1yis h ILE 127 CO 0.09 0.35 -0.08 -0.07 0.00 0.00 0.00 178.15 178.44 1yis h LEU 128 N 1.11 0.58 -0.39 1.44 3.38 -0.66 0.41 115.31 121.18 1yis h LEU 128 Ca 0.24 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 1yis h LEU 128 Cb 0.28 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1yis h LEU 128 CO -0.01 0.70 -0.36 0.11 0.09 0.00 0.00 178.44 178.97 1yis h LYS 129 N 0.56 0.92 -0.41 1.13 1.57 -1.13 -0.64 116.57 118.57 1yis h LYS 129 Ca 0.11 -0.48 -0.15 0.00 -1.87 0.00 0.00 60.65 58.26 1yis h LYS 129 Cb 0.47 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1yis h LYS 129 CO 0.03 1.13 -0.33 -0.09 -0.57 0.00 0.00 179.45 179.62 1yis h ARG 130 N 0.74 0.95 -0.07 3.15 9.65 -1.05 -2.55 114.38 125.21 1yis h ARG 130 Ca 0.07 -0.47 0.02 0.00 -1.10 0.00 0.00 59.98 58.49 1yis h ARG 130 Cb 0.95 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.51 1yis h ARG 130 CO 0.09 1.14 -0.04 0.35 2.80 0.00 0.00 179.97 184.31 1yis h PHE 131 N 0.79 -0.09 -0.76 2.20 3.04 -0.04 -0.35 116.94 121.72 1yis h PHE 131 Ca 0.08 0.01 0.07 0.00 3.98 0.00 0.00 57.97 62.10 1yis h PHE 131 Cb 0.92 0.05 -0.06 0.00 2.56 0.00 0.00 35.95 39.42 1yis h PHE 131 CO 0.06 -0.06 0.44 0.00 -2.02 0.00 0.00 178.31 176.73 1yis h ALA 132 N 1.03 1.05 -0.72 2.41 0.00 -1.05 -0.66 119.26 121.33 1yis h ALA 132 Ca 0.04 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1yis h ALA 132 Cb 0.10 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1yis h ALA 132 CO -0.09 0.13 0.32 1.15 0.00 0.00 0.00 179.25 180.75 1yis h THR 133 N 0.79 1.24 0.20 0.00 2.02 -0.99 0.55 112.91 116.72 1yis h THR 133 Ca 0.35 -0.72 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 1yis h THR 133 Cb 0.23 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 1yis h THR 133 CO -0.20 0.29 -0.10 0.58 0.37 0.00 0.00 175.52 176.46 1yis h VAL 134 N 1.01 0.79 -0.97 3.16 2.07 -0.11 -0.37 116.25 121.83 1yis h VAL 134 Ca 0.24 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.77 1yis h VAL 134 Cb 0.16 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.67 1yis h VAL 134 CO -0.03 0.00 0.64 0.40 0.02 0.00 0.00 177.57 178.60 1yis h ILE 135 N -0.28 1.25 -0.73 4.57 2.04 -0.94 -1.46 117.51 121.97 1yis h ILE 135 Ca -0.03 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 1yis h ILE 135 Cb 0.22 -0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.09 1yis h ILE 135 CO 0.04 0.24 0.41 -0.78 0.00 0.00 0.00 178.15 178.06 1yis h ASP 136 N 1.32 0.91 -0.60 1.72 1.82 -0.53 -0.02 116.42 121.02 1yis h ASP 136 Ca 0.35 -0.09 -0.05 0.00 -0.39 0.00 0.00 57.03 56.86 1yis h ASP 136 Cb -0.15 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 39.61 1yis h ASP 136 CO -0.08 0.74 0.20 0.03 -1.61 0.00 0.00 179.24 178.52 1yis h ARG 137 N 1.00 0.93 -0.39 0.28 2.47 -0.40 -1.10 114.38 117.18 1yis h ARG 137 Ca 0.26 -0.20 -0.08 0.00 -1.26 0.00 0.00 59.98 58.70 1yis h ARG 137 Cb 0.03 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.19 1yis h ARG 137 CO -0.04 0.82 -0.08 1.25 0.56 0.00 0.00 179.97 182.48 1yis h LEU 138 N 0.85 0.64 -0.76 3.04 5.85 -0.89 -1.37 115.31 122.67 1yis h LEU 138 Ca 0.20 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.65 1yis h LEU 138 Cb 0.28 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 1yis h LEU 138 CO -0.01 0.76 -0.11 0.00 -0.34 0.00 0.00 178.44 178.74 1yis h ALA 139 N 1.31 0.95 -0.16 1.25 0.00 -0.61 -0.66 119.26 121.33 1yis h ALA 139 Ca 0.11 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1yis h ALA 139 Cb 0.50 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1yis h ALA 139 CO 0.03 0.62 0.08 0.00 0.00 0.00 0.00 179.25 179.97 1yis h ALA 140 N 1.12 0.21 -0.54 0.00 0.00 -0.76 -0.43 119.26 118.86 1yis h ALA 140 Ca 0.12 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1yis h ALA 140 Cb 0.61 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1yis h ALA 140 CO 0.04 -0.23 0.27 0.35 0.00 0.00 0.00 179.25 179.68 1yis h PHE 141 N 0.13 0.50 -0.31 0.00 3.57 -1.01 -0.96 116.94 118.86 1yis h PHE 141 Ca 0.06 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 1yis h PHE 141 Cb 0.12 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1yis h PHE 141 CO -0.03 0.24 0.12 0.77 -2.23 0.00 0.00 178.31 177.18 1yis h SER 142 N 0.52 0.43 -0.49 0.41 0.02 -0.81 -2.20 113.55 111.43 1yis h SER 142 Ca 0.24 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1yis h SER 142 Cb 0.15 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 1yis h SER 142 CO -0.17 0.48 0.27 -0.07 -1.14 0.00 0.00 176.83 176.20 1yis h LEU 143 N 0.35 0.61 -1.57 5.07 3.38 -0.84 0.14 115.31 122.45 1yis h LEU 143 Ca 0.10 -0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.09 1yis h LEU 143 Cb 0.18 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 1yis h LEU 143 CO -0.01 0.52 0.44 0.50 0.09 0.00 0.00 178.44 179.98 1yis h LYS 144 N 0.65 0.47 -0.33 1.13 3.64 -1.00 -1.99 116.57 119.14 1yis h LYS 144 Ca 0.17 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1yis h LYS 144 Cb 0.04 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1yis h LYS 144 CO -0.03 0.31 0.01 0.09 -2.27 0.00 0.00 179.45 177.57 1yis n ASN 145 N -4.48 3.87 0.33 4.20 3.02 -0.81 -4.68 115.26 116.71 1yis n ASN 145 Ca 0.11 -3.14 0.21 0.00 -0.03 0.00 0.00 54.58 51.73 1yis n ASN 145 Cb 0.37 -0.58 1.10 0.00 -0.61 0.00 0.00 39.78 40.06 1yis n ASN 145 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 1yis h LYS 146 N 1.87 0.00 0.00 3.52 2.10 0.04 -1.65 116.57 122.45 1yis h LYS 146 Ca 0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 1yis h LYS 146 Cb 1.58 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.91 1yis h LYS 146 CO 0.30 0.00 -0.09 0.39 -2.00 0.00 0.00 179.45 178.05 1yis n GLU 147 N -3.00 1.24 -3.05 0.07 1.02 -1.26 -4.53 120.64 111.12 1yis n GLU 147 Ca -0.03 -2.04 -0.43 0.00 -0.02 0.00 0.00 57.16 54.64 1yis n GLU 147 Cb 0.15 -1.20 -0.06 0.00 -0.02 0.00 0.00 31.44 30.32 1yis n GLU 147 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1yis s VAL 148 N -1.94 4.74 0.30 2.62 1.01 -0.90 -4.96 120.40 121.26 1yis s VAL 148 Ca 0.20 0.05 -0.28 0.00 0.00 0.00 0.00 61.98 61.95 1yis s VAL 148 Cb 0.17 -4.30 -0.09 0.00 0.00 0.00 0.00 36.38 32.16 1yis s VAL 148 CO 0.02 -0.75 1.05 -0.69 0.00 0.00 0.00 175.10 174.74 1yis s VAL 149 N 3.03 3.66 0.29 2.92 1.01 -1.26 -0.63 120.40 129.42 1yis s VAL 149 Ca 0.23 1.58 -0.10 0.00 0.00 0.00 0.00 61.98 63.68 1yis s VAL 149 Cb -0.15 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.27 1yis s VAL 149 CO 0.18 0.30 0.51 0.28 0.00 0.00 0.00 175.10 176.37 1yis s THR 150 N -1.29 0.00 0.13 3.92 -1.32 -0.41 -4.77 115.64 111.90 1yis s THR 150 Ca 0.47 -1.42 -0.24 0.00 -1.21 0.00 0.00 61.69 59.29 1yis s THR 150 Cb -0.28 -2.39 -0.07 0.00 -1.51 0.00 0.00 72.50 68.24 1yis s THR 150 CO 0.36 0.00 0.75 0.68 -2.21 0.00 0.00 174.62 174.20 1yis s VAL 151 N -3.58 4.49 0.44 5.08 -7.23 -1.26 -0.89 120.40 117.45 1yis s VAL 151 Ca 0.24 1.63 -0.17 0.00 -1.81 0.00 0.00 61.98 61.86 1yis s VAL 151 Cb -0.01 -4.10 -0.09 0.00 0.56 0.00 0.00 36.38 32.73 1yis s VAL 151 CO 0.12 0.49 0.91 -0.83 -0.31 0.00 0.00 175.10 175.49 1yis s GLY 152 N -0.92 2.21 -0.02 2.32 0.00 0.14 -4.71 107.32 106.35 1yis s GLY 152 Ca 0.35 0.20 0.01 0.00 0.00 0.00 0.00 44.72 45.29 1yis s GLY 152 CO 0.25 0.46 -0.04 0.50 0.00 0.00 0.00 173.10 174.26 1yis s ARG 153 N -3.55 0.57 -0.05 2.90 0.52 -1.26 -0.55 118.95 117.53 1yis s ARG 153 Ca 0.59 -0.12 0.05 0.00 -0.52 0.00 0.00 55.73 55.73 1yis s ARG 153 Cb -0.10 -0.59 -0.01 0.00 0.52 0.00 0.00 34.95 34.77 1yis s ARG 153 CO 0.22 0.00 -0.20 0.95 0.02 0.00 0.00 175.30 176.30 1yis s THR 154 N 0.45 1.67 -1.71 0.02 -4.23 -0.28 -4.52 115.64 107.03 1yis s THR 154 Ca -0.05 -0.85 0.00 0.00 -1.18 0.00 0.00 61.69 59.61 1yis s THR 154 Cb -0.09 -1.42 0.00 0.00 1.34 0.00 0.00 72.50 72.33 1yis s THR 154 CO -0.00 0.47 0.00 1.41 -0.54 0.00 0.00 174.62 175.96 1yis n HIS 155 N 3.06 -0.61 -1.11 3.99 8.25 -1.26 -0.72 115.22 126.82 1yis n HIS 155 Ca -0.18 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.25 1yis n HIS 155 Cb 0.53 -3.50 -0.02 0.00 1.12 0.00 0.00 29.99 28.12 1yis n HIS 155 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1yis n TYR 156 N -3.54 0.00 -4.49 4.41 4.01 -1.26 -4.98 117.16 111.30 1yis n TYR 156 Ca -0.21 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.25 1yis n TYR 156 Cb 0.65 -1.69 -0.13 0.00 -0.31 0.00 0.00 39.34 37.85 1yis n TYR 156 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1yis s GLN 157 N -1.86 1.44 -0.27 -0.72 -0.21 0.10 -4.98 119.66 113.17 1yis s GLN 157 Ca 0.00 -1.25 -0.43 0.00 0.02 0.00 0.00 55.36 53.70 1yis s GLN 157 Cb 0.00 -1.82 -0.19 0.00 1.00 0.00 0.00 33.01 32.00 1yis s GLN 157 CO 0.00 0.44 1.44 2.41 -2.12 0.00 0.00 175.29 177.46 1yis n THR 158 N 1.17 0.04 0.00 -0.19 -1.04 -1.26 -1.13 114.28 111.87 1yis n THR 158 Ca -0.18 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.82 1yis n THR 158 Cb 0.53 -0.48 0.00 0.00 -1.82 0.00 0.00 70.33 68.56 1yis n THR 158 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1yis n ALA 159 N 3.31 1.02 0.00 2.41 0.00 0.29 -4.80 120.51 122.75 1yis n ALA 159 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1yis n ALA 159 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1yis n ALA 159 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1yis n SER 160 N -0.76 0.00 -4.24 0.00 3.41 -1.21 -4.96 113.62 105.86 1yis n SER 160 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.31 1yis n SER 160 Cb 0.00 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 63.79 1yis n SER 160 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1yis s LEU 161 N 0.00 2.04 0.00 1.04 1.43 -1.26 0.26 118.68 122.19 1yis s LEU 161 Ca 0.00 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 1yis s LEU 161 Cb 0.00 -1.30 -0.00 0.00 0.03 0.00 0.00 46.19 44.92 1yis s LEU 161 CO 0.00 0.23 0.03 1.33 0.23 0.00 0.00 176.35 178.17 1yis n VAL 162 N 2.97 0.00 -4.37 -1.59 0.24 -0.07 -4.33 118.33 111.18 1yis n VAL 162 Ca -0.17 -0.39 -0.29 0.00 -2.04 0.00 0.00 64.34 61.45 1yis n VAL 162 Cb 0.52 0.16 -0.12 0.00 -1.47 0.00 0.00 33.84 32.93 1yis n VAL 162 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1yis s THR 163 N -1.94 2.47 0.38 3.34 -4.23 -1.26 -1.28 115.64 113.12 1yis s THR 163 Ca 0.04 -1.72 0.09 0.00 -1.18 0.00 0.00 61.69 58.92 1yis s THR 163 Cb 0.00 -2.12 0.31 0.00 1.34 0.00 0.00 72.50 72.03 1yis s THR 163 CO 0.03 0.06 1.94 0.58 -0.54 0.00 0.00 174.62 176.69 1yis h VAL 164 N 3.65 0.94 -0.47 2.29 2.07 -0.97 -1.75 116.25 122.01 1yis h VAL 164 Ca -0.50 -0.22 -0.11 0.00 0.82 0.00 0.00 66.70 66.69 1yis h VAL 164 Cb 1.18 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1yis h VAL 164 CO 0.43 0.12 -0.15 1.23 0.02 0.00 0.00 177.57 179.22 1yis h GLY 165 N 0.64 0.96 1.00 2.17 0.00 -1.51 1.00 103.07 107.33 1yis h GLY 165 Ca 0.34 -0.78 -0.04 0.00 0.00 0.00 0.00 47.33 46.85 1yis h GLY 165 CO -0.12 0.71 0.19 1.70 0.00 0.00 0.00 176.54 179.02 1yis h LYS 166 N 0.79 0.90 -0.58 4.80 1.63 -1.61 0.31 116.57 122.82 1yis h LYS 166 Ca 0.12 -0.19 -0.08 0.00 -0.85 0.00 0.00 60.65 59.65 1yis h LYS 166 Cb 0.67 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.15 1yis h LYS 166 CO 0.05 0.81 0.03 -0.09 -3.45 0.00 0.00 179.45 176.79 1yis h ARG 167 N 0.82 0.99 -0.73 1.90 2.43 -1.22 0.04 114.38 118.62 1yis h ARG 167 Ca 0.19 -0.29 0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1yis h ARG 167 Cb 0.27 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.68 1yis h ARG 167 CO -0.01 0.96 0.48 0.78 -1.51 0.00 0.00 179.97 180.67 1yis h GLY 168 N 1.01 1.02 2.00 2.80 0.00 -0.16 -0.95 103.07 108.79 1yis h GLY 168 Ca 0.17 -0.38 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 1yis h GLY 168 CO 0.02 0.37 -0.39 -2.08 0.00 0.00 0.00 176.54 174.47 1yis h VAL 169 N 0.98 0.75 -0.35 4.60 2.07 -0.24 0.06 116.25 124.13 1yis h VAL 169 Ca 0.27 -1.76 -0.09 0.00 0.82 0.00 0.00 66.70 65.93 1yis h VAL 169 Cb -0.11 2.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1yis h VAL 169 CO -0.06 0.38 -0.15 0.25 0.02 0.00 0.00 177.57 178.01 1yis h LEU 170 N 0.00 0.73 -0.32 2.57 5.85 0.22 -0.77 115.31 123.60 1yis h LEU 170 Ca -0.00 -0.40 -0.07 0.00 0.84 0.00 0.00 57.88 58.25 1yis h LEU 170 Cb 1.12 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 1yis h LEU 170 CO 0.05 0.97 -0.07 -0.50 -0.34 0.00 0.00 178.44 178.55 1yis h TRP 171 N 0.50 0.69 -0.84 1.25 6.55 -1.06 -3.01 115.95 120.03 1yis h TRP 171 Ca 0.08 -0.14 0.10 0.00 0.95 0.00 0.00 58.89 59.88 1yis h TRP 171 Cb 0.68 -0.17 -0.06 0.00 -0.86 0.00 0.00 29.16 28.75 1yis h TRP 171 CO 0.06 0.78 0.54 0.00 -1.05 0.00 0.00 178.44 178.78 1yis h ALA 172 N 0.81 1.72 -0.52 1.49 0.00 -0.80 -1.76 119.26 120.20 1yis h ALA 172 Ca 0.08 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1yis h ALA 172 Cb 0.55 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1yis h ALA 172 CO 0.03 0.10 -0.14 0.37 0.00 0.00 0.00 179.25 179.61 1yis h GLN 173 N 0.78 1.01 0.00 0.00 4.15 -1.01 0.25 115.11 120.28 1yis h GLN 173 Ca 0.39 -0.39 0.01 0.00 0.77 0.00 0.00 58.65 59.43 1yis h GLN 173 Cb 0.45 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 1yis h GLN 173 CO -0.16 1.07 -0.05 0.93 -1.93 0.00 0.00 178.83 178.70 1yis h GLU 174 N 0.87 -0.09 -0.61 1.69 4.39 -1.21 -2.62 114.58 117.00 1yis h GLU 174 Ca 0.13 0.01 -0.07 0.00 0.34 0.00 0.00 59.36 59.76 1yis h GLU 174 Cb 0.71 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.36 1yis h GLU 174 CO 0.05 -0.06 0.10 -0.07 -1.16 0.00 0.00 179.01 177.87 1yis h LEU 175 N -0.09 0.95 -2.07 1.33 3.38 -1.30 -2.72 115.31 114.79 1yis h LEU 175 Ca 0.02 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1yis h LEU 175 Cb 0.11 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1yis h LEU 175 CO -0.05 0.95 0.00 -0.11 0.09 0.00 0.00 178.44 179.32 1yis n LEU 176 N -4.22 0.68 0.00 1.67 7.94 0.85 -0.60 117.00 123.32 1yis n LEU 176 Ca 0.04 -0.34 0.00 0.00 -1.11 0.00 0.00 56.01 54.60 1yis n LEU 176 Cb 0.28 -0.12 0.00 0.00 0.53 0.00 0.00 43.42 44.11 1yis n LEU 176 CO 0.42 0.11 0.00 0.00 -1.11 0.00 0.00 177.39 176.82 1yis n ALA 178 N 0.93 0.00 -0.07 1.96 0.00 -1.03 -0.52 120.51 121.77 1yis n ALA 178 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1yis n ALA 178 Cb 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.56 1yis n ALA 178 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1yis h PHE 179 N 0.00 0.15 -0.68 0.00 3.57 -1.14 -1.10 116.94 117.75 1yis h PHE 179 Ca 0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1yis h PHE 179 Cb 0.00 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 1yis h PHE 179 CO 0.00 0.06 0.38 1.96 -2.23 0.00 0.00 178.31 178.48 1yis h GLN 180 N 0.21 0.93 -0.02 1.11 4.20 -1.07 0.36 115.11 120.83 1yis h GLN 180 Ca 0.13 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1yis h GLN 180 Cb 0.11 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 27.70 1yis h GLN 180 CO -0.14 0.68 0.00 1.03 -0.67 0.00 0.00 178.83 179.73 1yis h SER 181 N 0.94 0.03 -0.32 1.46 0.87 -1.65 0.34 113.55 115.22 1yis h SER 181 Ca 0.24 -0.23 -0.07 0.00 -1.23 0.00 0.00 61.79 60.50 1yis h SER 181 Cb 0.01 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 1yis h SER 181 CO -0.04 0.25 -0.05 0.25 -0.53 0.00 0.00 176.83 176.71 1yis h LEU 182 N -0.20 0.68 -0.55 2.23 5.85 -0.86 -1.18 115.31 121.27 1yis h LEU 182 Ca 0.01 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.49 1yis h LEU 182 Cb 0.23 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1yis h LEU 182 CO 0.00 0.78 0.10 -1.28 -0.34 0.00 0.00 178.44 177.69 1yis h SER 183 N 0.65 0.87 -0.42 1.25 0.87 -0.12 -1.58 113.55 115.08 1yis h SER 183 Ca 0.12 -0.26 -0.15 0.00 -1.23 0.00 0.00 61.79 60.28 1yis h SER 183 Cb 0.47 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 1yis h SER 183 CO 0.02 0.90 -0.33 -0.08 -0.53 0.00 0.00 176.83 176.82 1yis h GLU 184 N 0.80 0.97 -0.95 2.24 4.81 -0.68 -2.59 114.58 119.17 1yis h GLU 184 Ca 0.17 -0.48 0.03 0.00 -0.13 0.00 0.00 59.36 58.95 1yis h GLU 184 Cb 0.40 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.73 1yis h GLU 184 CO 0.01 1.14 0.62 0.35 -0.73 0.00 0.00 179.01 180.40 1yis h PHE 185 N 0.80 1.17 -0.63 0.92 3.57 -1.06 -0.96 116.94 120.75 1yis h PHE 185 Ca 0.08 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 1yis h PHE 185 Cb 0.92 -0.39 -0.03 0.00 2.79 0.00 0.00 35.95 39.24 1yis h PHE 185 CO 0.06 0.69 0.28 -0.09 -2.23 0.00 0.00 178.31 177.02 1yis h ARG 186 N 1.22 0.93 -0.10 1.11 1.12 -1.11 -2.89 114.38 114.66 1yis h ARG 186 Ca 0.37 -0.16 -0.12 0.00 -1.11 0.00 0.00 59.98 58.96 1yis h ARG 186 Cb -0.03 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 29.76 1yis h ARG 186 CO -0.11 0.77 -0.49 -0.44 -3.11 0.00 0.00 179.97 176.59 1yis h ASP 187 N 0.88 0.28 -3.58 -3.80 3.32 -1.01 -3.48 116.42 109.03 1yis h ASP 187 Ca 0.21 -0.13 -0.64 0.00 0.02 0.00 0.00 57.03 56.49 1yis h ASP 187 Cb 0.17 -0.08 -0.14 0.00 0.22 0.00 0.00 39.33 39.50 1yis h ASP 187 CO -0.02 0.73 0.11 -0.54 -1.72 0.00 0.00 179.24 177.79 1yis s LYS 188 N -3.99 3.53 -0.25 3.56 1.02 -0.42 -4.90 119.74 118.28 1yis s LYS 188 Ca -0.04 -0.13 -0.21 0.00 0.02 0.00 0.00 55.97 55.61 1yis s LYS 188 Cb 0.13 -3.86 0.07 0.00 -0.52 0.00 0.00 37.83 33.65 1yis s LYS 188 CO 0.79 -0.82 0.66 1.03 -0.92 0.00 0.00 175.35 176.09 1yis s ARG 190 N 2.70 0.74 0.43 1.68 0.52 -1.26 -4.96 118.95 118.81 1yis s ARG 190 Ca 0.23 0.98 -0.21 0.00 -0.52 0.00 0.00 55.73 56.21 1yis s ARG 190 Cb -0.14 0.31 -0.10 0.00 0.52 0.00 0.00 34.95 35.53 1yis s ARG 190 CO 0.16 -0.11 0.97 0.12 0.02 0.00 0.00 175.30 176.46 1yis s PHE 191 N 0.67 3.27 -0.03 -0.53 5.99 0.02 -4.71 117.98 122.65 1yis s PHE 191 Ca -0.03 1.61 -0.22 0.00 0.00 0.00 0.00 56.93 58.30 1yis s PHE 191 Cb -0.05 -2.91 -0.27 0.00 0.00 0.00 0.00 43.02 39.79 1yis s PHE 191 CO -0.04 -0.26 0.98 -0.09 -0.00 0.00 0.00 175.22 175.82 1yis h ARG 192 N 1.93 0.32 0.00 10.12 2.43 -1.90 0.15 114.38 127.42 1yis h ARG 192 Ca -0.49 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 58.25 1yis h ARG 192 Cb 1.19 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.88 1yis h ARG 192 CO 0.61 1.15 0.00 0.41 -1.51 0.00 0.00 179.97 180.63 1yis n GLY 193 N 1.37 0.40 3.73 2.80 0.00 -1.26 -4.53 105.19 107.70 1yis n GLY 193 Ca -0.12 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.69 1yis n GLY 193 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1yis s ILE 194 N 0.00 5.31 0.00 -0.61 -4.36 -1.26 -4.87 121.20 115.41 1yis s ILE 194 Ca 0.00 0.15 0.00 0.00 -0.26 0.00 0.00 60.65 60.54 1yis s ILE 194 Cb 0.00 -3.41 0.00 0.00 1.25 0.00 0.00 42.46 40.30 1yis s ILE 194 CO 0.00 0.46 0.00 0.29 0.24 0.00 0.00 174.94 175.93 1yis n LYS 195 N 3.38 0.00 0.00 0.37 4.76 -1.26 -4.87 118.16 120.54 1yis n LYS 195 Ca -0.16 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.28 1yis n LYS 195 Cb 0.52 -0.11 0.00 0.00 -1.84 0.00 0.00 35.03 33.60 1yis n LYS 195 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1yis n GLY 196 N 0.00 -2.62 0.22 0.72 0.00 -1.26 -1.97 105.19 100.29 1yis n GLY 196 Ca 0.00 -1.64 0.11 0.00 0.00 0.00 0.00 46.02 44.48 1yis n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yis h ALA 197 N 0.00 0.97 0.00 4.61 0.00 -1.92 -3.30 119.26 119.63 1yis h ALA 197 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1yis h ALA 197 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1yis h ALA 197 CO 0.00 0.23 0.00 0.25 0.00 0.00 0.00 179.25 179.73 1yis n THR 198 N -3.28 0.14 -0.11 0.00 -2.24 -1.26 -4.06 114.28 103.47 1yis n THR 198 Ca 0.01 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1yis n THR 198 Cb 0.45 1.17 0.00 0.00 -2.10 0.00 0.00 70.33 69.86 1yis n THR 198 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yis n GLY 199 N -0.07 0.56 0.10 3.38 0.00 -0.83 -3.91 105.19 104.42 1yis n GLY 199 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1yis n GLY 199 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1yis h THR 200 N 0.00 0.00 -0.72 2.61 1.35 -1.76 -3.43 112.91 110.96 1yis h THR 200 Ca 0.00 -0.88 -0.28 0.00 -0.55 0.00 0.00 66.41 64.71 1yis h THR 200 Cb 0.00 1.40 -0.10 0.00 -1.73 0.00 0.00 68.15 67.71 1yis h THR 200 CO 0.00 0.00 -0.26 0.00 -0.25 0.00 0.00 175.52 175.01 1yis n GLN 201 N -2.55 -0.95 -0.33 4.72 6.02 -0.85 -4.90 117.38 118.53 1yis n GLN 201 Ca 0.01 0.96 0.06 0.00 -0.01 0.00 0.00 57.00 58.02 1yis n GLN 201 Cb 0.52 -5.04 0.25 0.00 1.02 0.00 0.00 30.24 26.99 1yis n GLN 201 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1yis h ASP 202 N 0.00 0.90 -0.47 1.08 3.58 -1.93 -1.01 116.42 118.56 1yis h ASP 202 Ca -0.28 0.03 -0.04 0.00 0.42 0.00 0.00 57.03 57.16 1yis h ASP 202 Cb 0.90 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.78 1yis h ASP 202 CO 0.40 0.52 0.15 0.28 -2.88 0.00 0.00 179.24 177.71 1yis h SER 203 N 0.99 0.69 -0.01 2.28 0.02 -1.91 -1.60 113.55 114.01 1yis h SER 203 Ca 0.45 -0.21 -0.13 0.00 -0.84 0.00 0.00 61.79 61.06 1yis h SER 203 Cb 0.40 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 1yis h SER 203 CO -0.21 0.72 -0.40 -0.26 -1.14 0.00 0.00 176.83 175.54 1yis h PHE 204 N 0.63 0.62 -0.08 3.45 0.04 -1.66 -1.69 116.94 118.26 1yis h PHE 204 Ca 0.15 -0.18 -0.00 0.00 2.80 0.00 0.00 57.97 60.74 1yis h PHE 204 Cb 0.27 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.28 1yis h PHE 204 CO 0.01 0.85 0.04 1.25 -0.60 0.00 0.00 178.31 179.86 1yis h LEU 205 N 0.44 0.10 -1.02 1.54 5.85 -0.93 -0.46 115.31 120.82 1yis h LEU 205 Ca 0.04 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1yis h LEU 205 Cb 0.89 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.85 1yis h LEU 205 CO 0.08 0.14 0.52 0.74 -0.34 0.00 0.00 178.44 179.58 1yis h THR 206 N 0.05 1.24 -0.04 1.05 2.02 -1.25 0.19 112.91 116.17 1yis h THR 206 Ca 0.03 -0.54 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 1yis h THR 206 Cb 0.06 0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.48 1yis h THR 206 CO -0.00 0.26 -0.06 0.25 0.37 0.00 0.00 175.52 176.33 1yis h LEU 207 N 1.21 0.06 -3.57 2.58 5.85 -0.69 -1.37 115.31 119.38 1yis h LEU 207 Ca 0.31 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.94 1yis h LEU 207 Cb -0.04 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 40.92 1yis h LEU 207 CO -0.06 0.13 0.10 0.49 -0.34 0.00 0.00 178.44 178.76 1yis n PHE 208 N -4.43 1.98 -3.95 1.25 3.72 -0.24 -4.95 117.46 110.84 1yis n PHE 208 Ca -0.02 -0.98 -0.31 0.00 -0.05 0.00 0.00 57.45 56.09 1yis n PHE 208 Cb 0.16 -0.55 0.02 0.00 -0.94 0.00 0.00 39.48 38.17 1yis n PHE 208 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1yis n ALA 209 N 0.03 -1.34 -0.63 4.37 0.00 -0.52 -2.03 120.51 120.40 1yis n ALA 209 Ca 0.32 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1yis n ALA 209 Cb 1.21 -4.14 0.00 0.00 0.00 0.00 0.00 19.45 16.53 1yis n ALA 209 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yis n GLY 210 N -1.65 1.15 3.58 0.00 0.00 0.56 -5.00 105.19 103.83 1yis n GLY 210 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1yis n GLY 210 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yis s ASP 211 N -3.10 6.43 0.29 1.61 -1.08 -0.86 -4.88 116.67 115.07 1yis s ASP 211 Ca 0.00 0.16 0.06 0.00 -0.52 0.00 0.00 52.55 52.25 1yis s ASP 211 Cb 0.00 -2.55 0.44 0.00 -1.46 0.00 0.00 42.92 39.35 1yis s ASP 211 CO 0.00 -1.49 1.70 -0.33 0.52 0.00 0.00 175.17 175.57 1yis h GLU 212 N 9.70 0.26 -0.01 4.34 5.08 -1.93 -2.92 114.58 129.10 1yis h GLU 212 Ca -0.25 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 57.94 1yis h GLU 212 Cb 1.06 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1yis h GLU 212 CO 1.18 0.63 -0.19 0.66 -1.00 0.00 0.00 179.01 180.29 1yis h SER 213 N 0.22 0.02 0.26 1.42 4.64 -1.99 -0.17 113.55 117.94 1yis h SER 213 Ca 0.02 -0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.16 1yis h SER 213 Cb 0.82 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 1yis h SER 213 CO 0.06 0.21 -0.68 0.11 -0.87 0.00 0.00 176.83 175.66 1yis h LYS 214 N 0.02 0.39 -0.30 4.77 1.57 -1.92 0.18 116.57 121.28 1yis h LYS 214 Ca 0.00 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.44 1yis h LYS 214 Cb 0.35 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1yis h LYS 214 CO 0.02 0.93 0.00 0.28 -0.57 0.00 0.00 179.45 180.11 1yis h VAL 215 N 0.27 1.26 -0.61 0.50 2.07 -1.24 0.65 116.25 119.14 1yis h VAL 215 Ca -0.02 -0.94 -0.07 0.00 0.82 0.00 0.00 66.70 66.49 1yis h VAL 215 Cb 1.24 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.26 1yis h VAL 215 CO 0.12 0.30 0.10 -0.08 0.02 0.00 0.00 177.57 178.03 1yis h GLU 216 N 0.32 1.00 -0.69 1.57 4.57 -0.96 -1.11 114.58 119.29 1yis h GLU 216 Ca 0.09 -0.27 -0.06 0.00 -1.18 0.00 0.00 59.36 57.94 1yis h GLU 216 Cb 0.43 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 1yis h GLU 216 CO 0.02 0.94 0.21 0.00 -1.18 0.00 0.00 179.01 179.00 1yis h ALA 217 N 1.02 1.07 -0.51 2.92 0.00 -0.45 -0.49 119.26 122.82 1yis h ALA 217 Ca 0.19 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1yis h ALA 217 Cb 0.42 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1yis h ALA 217 CO 0.01 0.63 0.09 1.25 0.00 0.00 0.00 179.25 181.23 1yis h LEU 218 N 1.03 0.81 -0.78 0.00 5.85 -0.52 0.44 115.31 122.14 1yis h LEU 218 Ca 0.23 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 1yis h LEU 218 Cb 0.29 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 1yis h LEU 218 CO -0.01 0.85 0.37 -0.78 -0.34 0.00 0.00 178.44 178.54 1yis h ASP 219 N 0.72 1.03 -0.20 1.25 3.58 -0.81 -0.40 116.42 121.59 1yis h ASP 219 Ca 0.16 -0.14 -0.19 0.00 0.42 0.00 0.00 57.03 57.28 1yis h ASP 219 Cb 0.39 -0.26 0.01 0.00 1.72 0.00 0.00 39.33 41.18 1yis h ASP 219 CO 0.01 0.88 -0.60 -0.08 -2.88 0.00 0.00 179.24 176.56 1yis h GLU 220 N 1.11 0.76 0.03 0.28 4.81 -0.84 -2.68 114.58 118.05 1yis h GLU 220 Ca 0.27 -0.55 -0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1yis h GLU 220 Cb 0.12 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1yis h GLU 220 CO -0.03 1.17 -0.02 1.25 -0.73 0.00 0.00 179.01 180.65 1yis h LEU 221 N 0.48 -0.04 -0.98 1.64 5.85 0.21 -0.52 115.31 121.95 1yis h LEU 221 Ca -0.02 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 1yis h LEU 221 Cb 1.22 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.22 1yis h LEU 221 CO 0.13 0.09 0.46 0.58 -0.34 0.00 0.00 178.44 179.35 1yis h VAL 222 N -0.16 1.25 -0.88 1.05 2.07 -1.16 -0.88 116.25 117.54 1yis h VAL 222 Ca -0.00 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 66.87 1yis h VAL 222 Cb 0.15 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 1yis h VAL 222 CO 0.01 0.28 0.45 0.74 0.02 0.00 0.00 177.57 179.06 1yis h THR 223 N 1.18 1.26 -0.55 2.57 2.02 -1.23 -1.39 112.91 116.77 1yis h THR 223 Ca 0.30 -0.70 -0.09 0.00 0.77 0.00 0.00 66.41 66.69 1yis h THR 223 Cb 0.03 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 1yis h THR 223 CO -0.05 0.31 -0.01 0.50 0.37 0.00 0.00 175.52 176.64 1yis h LYS 224 N 1.24 0.97 -0.38 6.66 3.64 -0.32 -1.67 116.57 126.71 1yis h LYS 224 Ca 0.30 -0.31 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1yis h LYS 224 Cb 0.08 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1yis h LYS 224 CO -0.04 0.98 -0.07 0.87 -2.27 0.00 0.00 179.45 178.92 1yis h LYS 225 N 0.85 0.64 0.00 1.90 1.57 -0.84 -1.76 116.57 118.93 1yis h LYS 225 Ca 0.15 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1yis h LYS 225 Cb 0.55 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1yis h LYS 225 CO 0.03 0.71 0.00 0.00 -0.57 0.00 0.00 179.45 179.62 1yis n ALA 226 N -2.48 2.42 -2.95 3.86 0.00 -0.56 -4.90 120.51 115.91 1yis n ALA 226 Ca 0.01 -0.15 -0.13 0.00 0.00 0.00 0.00 53.44 53.17 1yis n ALA 226 Cb 0.31 -1.42 0.04 0.00 0.00 0.00 0.00 19.45 18.38 1yis n ALA 226 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1yis n ASN 227 N -1.07 -4.39 -4.48 0.00 5.15 -0.66 -5.04 115.26 104.77 1yis n ASN 227 Ca 0.18 -0.25 -0.33 0.00 -0.60 0.00 0.00 54.58 53.58 1yis n ASN 227 Cb 0.12 -3.10 -0.13 0.00 -0.53 0.00 0.00 39.78 36.14 1yis n ASN 227 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1yis s PHE 228 N -3.06 2.85 -0.20 1.20 0.40 -0.66 -5.00 117.98 113.50 1yis s PHE 228 Ca 0.27 -0.28 0.19 0.00 -0.60 0.00 0.00 56.93 56.52 1yis s PHE 228 Cb -0.12 -1.77 -0.01 0.00 0.51 0.00 0.00 43.02 41.64 1yis s PHE 228 CO 0.33 0.07 1.07 0.77 0.70 0.00 0.00 175.22 178.16 1yis h SER 229 N 5.94 0.00 -4.12 1.36 0.02 -1.94 -3.38 113.55 111.43 1yis h SER 229 Ca -0.38 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 59.95 1yis h SER 229 Cb 1.18 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.49 1yis h SER 229 CO 0.54 0.29 -0.85 0.20 -1.14 0.00 0.00 176.83 175.87 1yis s ASN 230 N -5.75 2.83 0.03 3.07 0.02 -1.26 -5.08 114.94 108.80 1yis s ASN 230 Ca -0.00 -0.67 -0.14 0.00 -1.02 0.00 0.00 52.86 51.02 1yis s ASN 230 Cb 0.08 -0.19 0.02 0.00 0.02 0.00 0.00 41.25 41.19 1yis s ASN 230 CO 0.78 0.13 0.31 0.00 0.02 0.00 0.00 177.10 178.34 1yis s ARG 231 N -1.79 0.80 0.45 -0.60 1.70 -1.26 -0.80 118.95 117.45 1yis s ARG 231 Ca 0.09 -0.45 -0.21 0.00 -0.47 0.00 0.00 55.73 54.69 1yis s ARG 231 Cb -0.10 0.35 -0.09 0.00 -0.57 0.00 0.00 34.95 34.54 1yis s ARG 231 CO 0.04 -0.25 1.01 -0.06 -1.08 0.00 0.00 175.30 174.96 1yis s PHE 232 N -2.37 3.16 -0.12 5.89 0.08 0.52 -4.78 117.98 120.36 1yis s PHE 232 Ca -0.06 1.61 0.03 0.00 0.12 0.00 0.00 56.93 58.63 1yis s PHE 232 Cb -0.01 -3.01 -0.10 0.00 -0.57 0.00 0.00 43.02 39.32 1yis s PHE 232 CO -0.02 -0.56 -0.07 1.28 -0.10 0.00 0.00 175.22 175.74 1yis n LEU 233 N -0.66 2.14 -4.52 -0.37 4.77 -1.26 -4.88 117.00 112.23 1yis n LEU 233 Ca 0.08 -0.05 -0.36 0.00 -0.03 0.00 0.00 56.01 55.64 1yis n LEU 233 Cb 0.52 -0.26 -0.12 0.00 -2.33 0.00 0.00 43.42 41.24 1yis n LEU 233 CO 0.40 0.59 -0.26 -0.63 -1.33 0.00 0.00 177.39 176.16 1yis s ILE 234 N -2.26 4.55 0.28 -0.08 -1.09 -1.26 -5.07 121.20 116.27 1yis s ILE 234 Ca -0.14 -0.10 -0.17 0.00 -2.23 0.00 0.00 60.65 58.01 1yis s ILE 234 Cb 0.04 -3.11 0.02 0.00 -1.58 0.00 0.00 42.46 37.83 1yis s ILE 234 CO 0.34 0.36 0.64 0.42 -1.23 0.00 0.00 174.94 175.47 1yis s THR 235 N 1.26 0.00 0.00 2.92 -4.23 -1.26 -4.86 115.64 109.48 1yis s THR 235 Ca 0.05 -1.15 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 1yis s THR 235 Cb -0.15 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.51 1yis s THR 235 CO 0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 1yis n GLY 236 N -0.45 1.01 0.23 3.99 0.00 -1.26 -4.35 105.19 104.36 1yis n GLY 236 Ca -0.03 -0.42 -0.12 0.00 0.00 0.00 0.00 46.02 45.44 1yis n GLY 236 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1yis h GLN 237 N 0.00 0.69 -5.87 1.61 4.15 -1.37 -2.71 115.11 111.61 1yis h GLN 237 Ca 0.00 -0.46 -0.57 0.00 0.77 0.00 0.00 58.65 58.39 1yis h GLN 237 Cb 0.00 0.06 -0.08 0.00 0.21 0.00 0.00 27.48 27.67 1yis h GLN 237 CO 0.00 1.08 -0.46 0.95 -1.93 0.00 0.00 178.83 178.47 1yis s THR 238 N -4.00 2.14 0.47 2.39 -4.23 -1.26 -4.81 115.64 106.34 1yis s THR 238 Ca -0.09 -1.66 -0.19 0.00 -1.18 0.00 0.00 61.69 58.58 1yis s THR 238 Cb 0.11 -2.80 -0.09 0.00 1.34 0.00 0.00 72.50 71.06 1yis s THR 238 CO 0.87 0.00 0.98 -0.72 -0.54 0.00 0.00 174.62 175.20 1yis s TYR 239 N -2.64 3.31 0.03 3.99 -0.85 -1.26 -4.79 117.35 115.14 1yis s TYR 239 Ca 0.38 1.55 -0.36 0.00 -0.52 0.00 0.00 57.07 58.11 1yis s TYR 239 Cb 0.02 -2.86 -0.16 0.00 0.38 0.00 0.00 41.96 39.35 1yis s TYR 239 CO 0.21 -0.32 1.50 0.45 -1.52 0.00 0.00 175.55 175.87 1yis n SER 240 N -1.07 2.23 0.00 -0.18 2.88 -1.26 -4.82 113.62 111.39 1yis n SER 240 Ca 0.07 1.09 0.08 0.00 -1.33 0.00 0.00 58.87 58.79 1yis n SER 240 Cb 0.54 -1.25 0.44 0.00 -0.75 0.00 0.00 64.21 63.19 1yis n SER 240 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1yis n ARG 241 N 3.52 0.34 0.21 -1.46 5.12 -1.26 -1.62 116.66 121.51 1yis n ARG 241 Ca 0.20 0.08 0.08 0.00 -1.93 0.00 0.00 57.85 56.28 1yis n ARG 241 Cb 0.21 -1.50 0.46 0.00 -1.16 0.00 0.00 32.46 30.47 1yis n ARG 241 CO 0.00 0.00 0.00 0.37 -1.93 0.00 0.00 177.63 176.07 1yis h GLN 242 N 0.00 0.00 -0.25 5.56 4.15 -1.93 -2.30 115.11 120.34 1yis h GLN 242 Ca 0.00 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.29 1yis h GLN 242 Cb 0.10 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 1yis h GLN 242 CO 0.00 0.28 -0.37 0.37 -1.93 0.00 0.00 178.83 177.18 1yis h GLN 243 N 0.00 0.57 -0.11 1.69 4.15 -1.67 -2.31 115.11 117.42 1yis h GLN 243 Ca -0.00 -0.28 -0.11 0.00 0.77 0.00 0.00 58.65 59.03 1yis h GLN 243 Cb 0.69 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.36 1yis h GLN 243 CO 0.04 0.86 -0.43 -0.44 -1.93 0.00 0.00 178.83 176.92 1yis h ASP 244 N 0.48 0.28 -0.64 -0.69 3.32 -1.59 -1.87 116.42 115.71 1yis h ASP 244 Ca 0.05 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 56.88 1yis h ASP 244 Cb 0.86 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.31 1yis h ASP 244 CO 0.07 0.68 0.05 0.28 -1.72 0.00 0.00 179.24 178.60 1yis h SER 245 N 0.22 1.07 -0.71 6.45 0.02 -1.13 -1.00 113.55 118.48 1yis h SER 245 Ca 0.02 -0.29 -0.06 0.00 -0.84 0.00 0.00 61.79 60.63 1yis h SER 245 Cb 0.85 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 63.08 1yis h SER 245 CO 0.07 1.09 0.22 -0.61 -1.14 0.00 0.00 176.83 176.46 1yis h GLN 246 N 1.01 1.09 0.18 3.45 5.75 -1.16 0.13 115.11 125.56 1yis h GLN 246 Ca 0.19 -0.23 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 1yis h GLN 246 Cb 0.51 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 28.91 1yis h GLN 246 CO 0.02 0.94 -0.09 1.25 -2.65 0.00 0.00 178.83 178.31 1yis h LEU 247 N 1.04 -0.21 -0.87 -2.39 6.46 -0.88 -0.93 115.31 117.53 1yis h LEU 247 Ca 0.23 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.93 1yis h LEU 247 Cb 0.30 0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.25 1yis h LEU 247 CO -0.01 -0.12 0.32 0.58 -0.62 0.00 0.00 178.44 178.59 1yis h VAL 248 N -0.27 1.25 -0.48 1.05 2.07 -1.02 -2.75 116.25 116.11 1yis h VAL 248 Ca -0.02 -0.78 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 1yis h VAL 248 Cb 0.21 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 1yis h VAL 248 CO 0.04 0.32 0.14 0.15 0.02 0.00 0.00 177.57 178.24 1yis h PHE 249 N 1.12 0.79 -0.95 1.57 3.57 -0.51 -0.09 116.94 122.43 1yis h PHE 249 Ca 0.26 -0.09 0.08 0.00 3.53 0.00 0.00 57.97 61.75 1yis h PHE 249 Cb 0.19 -0.23 -0.07 0.00 2.79 0.00 0.00 35.95 38.64 1yis h PHE 249 CO 0.02 0.70 0.60 0.77 -2.23 0.00 0.00 178.31 178.17 1yis h SER 250 N 0.65 0.93 0.80 0.41 0.02 -0.97 0.31 113.55 115.69 1yis h SER 250 Ca 0.15 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 61.02 1yis h SER 250 Cb 0.30 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 1yis h SER 250 CO -0.00 0.56 -0.53 -0.07 -1.14 0.00 0.00 176.83 175.65 1yis h LEU 251 N 1.05 0.00 -1.17 5.07 3.38 -1.18 -2.62 115.31 119.84 1yis h LEU 251 Ca 0.43 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.34 1yis h LEU 251 Cb 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1yis h LEU 251 CO -0.20 0.53 -0.31 0.77 0.09 0.00 0.00 178.44 179.32 1yis h SER 252 N 0.00 0.00 -0.12 -0.43 4.64 0.92 -1.96 113.55 116.61 1yis h SER 252 Ca -0.01 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 1yis h SER 252 Cb 1.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.15 1yis h SER 252 CO 0.07 0.31 -0.34 -0.07 -0.87 0.00 0.00 176.83 175.93 1yis h LEU 253 N 0.00 0.64 -0.49 5.97 3.38 -0.75 -0.36 115.31 123.70 1yis h LEU 253 Ca -0.00 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 1yis h LEU 253 Cb 0.75 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1yis h LEU 253 CO 0.04 0.93 0.05 0.25 0.09 0.00 0.00 178.44 179.80 1yis h LEU 254 N 0.52 0.81 -0.35 1.67 6.46 -1.36 -1.44 115.31 121.62 1yis h LEU 254 Ca 0.06 -0.28 -0.02 0.00 -0.12 0.00 0.00 57.88 57.51 1yis h LEU 254 Cb 0.83 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.53 1yis h LEU 254 CO 0.07 0.89 0.13 1.23 -0.62 0.00 0.00 178.44 180.14 1yis h GLY 255 N 0.70 0.58 0.92 3.75 0.00 -0.98 0.15 103.07 108.19 1yis h GLY 255 Ca 0.15 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 1yis h GLY 255 CO 0.02 0.31 0.08 0.00 0.00 0.00 0.00 176.54 176.94 1yis h ALA 256 N 0.97 0.21 0.13 3.60 0.00 -0.97 0.26 119.26 123.46 1yis h ALA 256 Ca 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1yis h ALA 256 Cb 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1yis h ALA 256 CO -0.01 -0.24 -0.06 0.00 0.00 0.00 0.00 179.25 178.94 1yis h ALA 257 N 0.96 -0.18 -0.88 0.00 0.00 -1.20 -1.94 119.26 116.02 1yis h ALA 257 Ca 0.06 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yis h ALA 257 Cb 0.10 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1yis h ALA 257 CO -0.01 -0.58 0.54 0.00 0.00 0.00 0.00 179.25 179.20 1yis h ALA 258 N 0.64 1.12 -0.52 0.00 0.00 -0.63 -1.24 119.26 118.64 1yis h ALA 258 Ca -0.02 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1yis h ALA 258 Cb 0.17 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1yis h ALA 258 CO 0.03 0.57 0.01 -0.22 0.00 0.00 0.00 179.25 179.64 1yis h LYS 259 N 1.20 0.86 -0.38 0.00 3.64 -0.78 0.27 116.57 121.38 1yis h LYS 259 Ca 0.32 -0.24 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1yis h LYS 259 Cb -0.07 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.64 1yis h LYS 259 CO -0.06 0.85 0.03 -0.22 -2.27 0.00 0.00 179.45 177.78 1yis h LYS 260 N 0.80 0.65 -0.08 1.90 3.11 -0.93 -0.43 116.57 121.59 1yis h LYS 260 Ca 0.15 -0.19 -0.01 0.00 -2.81 0.00 0.00 60.65 57.80 1yis h LYS 260 Cb 0.46 -0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 31.62 1yis h LYS 260 CO 0.02 0.73 0.02 0.28 -2.81 0.00 0.00 179.45 177.68 1yis h VAL 261 N 0.48 1.20 -0.27 2.00 2.07 -0.85 -1.96 116.25 118.93 1yis h VAL 261 Ca 0.11 -0.62 -0.08 0.00 0.82 0.00 0.00 66.70 66.92 1yis h VAL 261 Cb 0.41 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1yis h VAL 261 CO 0.01 0.18 -0.20 0.00 0.02 0.00 0.00 177.57 177.58 1yis h THR 263 N 0.43 1.29 -0.28 0.00 2.02 -1.03 -0.26 112.91 115.08 1yis h THR 263 Ca 0.07 -1.49 -0.01 0.00 0.77 0.00 0.00 66.41 65.75 1yis h THR 263 Cb 0.59 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.42 1yis h THR 263 CO 0.04 0.48 0.13 0.44 0.37 0.00 0.00 175.52 176.98 1yis h ASP 264 N 0.56 0.37 -0.62 4.18 3.32 -0.95 -0.80 116.42 122.47 1yis h ASP 264 Ca 0.06 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 1yis h ASP 264 Cb 0.86 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.29 1yis h ASP 264 CO 0.07 0.39 0.31 0.40 -1.72 0.00 0.00 179.24 178.70 1yis h ILE 265 N 0.32 1.21 -0.86 0.35 2.04 -1.03 0.14 117.51 119.68 1yis h ILE 265 Ca 0.10 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 1yis h ILE 265 Cb 0.12 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 36.61 1yis h ILE 265 CO -0.01 0.24 0.46 0.03 0.00 0.00 0.00 178.15 178.87 1yis h ARG 266 N 0.86 1.21 -0.31 2.37 3.08 -0.79 0.22 114.38 121.01 1yis h ARG 266 Ca 0.22 -0.15 -0.12 0.00 0.07 0.00 0.00 59.98 59.99 1yis h ARG 266 Cb 0.10 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 1yis h ARG 266 CO -0.03 0.90 -0.29 0.28 -1.07 0.00 0.00 179.97 179.76 1yis h VAL 267 N 1.21 1.30 -0.32 2.04 2.07 -0.77 -1.93 116.25 119.84 1yis h VAL 267 Ca 0.30 -1.46 -0.07 0.00 0.82 0.00 0.00 66.70 66.29 1yis h VAL 267 Cb 0.05 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1yis h VAL 267 CO -0.05 0.47 -0.11 -0.07 0.02 0.00 0.00 177.57 177.84 1yis h LEU 268 N 0.49 0.53 -0.51 2.57 3.38 -0.40 -0.37 115.31 121.00 1yis h LEU 268 Ca 0.05 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.75 1yis h LEU 268 Cb 0.86 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1yis h LEU 268 CO 0.07 0.67 -0.25 -0.61 0.09 0.00 0.00 178.44 178.41 1yis h GLN 269 N 0.50 0.95 -0.35 1.13 4.15 -0.46 -0.19 115.11 120.83 1yis h GLN 269 Ca 0.09 -0.42 -0.04 0.00 0.77 0.00 0.00 58.65 59.06 1yis h GLN 269 Cb 0.49 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.13 1yis h GLN 269 CO 0.03 1.08 0.05 0.00 -1.93 0.00 0.00 178.83 178.07 1yis h ALA 270 N 0.89 1.44 0.00 3.38 0.00 -0.71 0.33 119.26 124.59 1yis h ALA 270 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1yis h ALA 270 Cb 0.82 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1yis h ALA 270 CO 0.07 0.40 0.00 1.19 0.00 0.00 0.00 179.25 180.92 1yis n PHE 271 N -4.32 0.16 -0.77 0.00 3.72 -0.21 -4.88 117.46 111.16 1yis n PHE 271 Ca 0.02 0.05 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 1yis n PHE 271 Cb 0.21 -0.59 0.00 0.00 -0.94 0.00 0.00 39.48 38.16 1yis n PHE 271 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1yis n GLY 272 N 0.56 0.56 0.09 1.37 0.00 0.11 -4.96 105.19 102.92 1yis n GLY 272 Ca 0.05 -0.48 -0.10 0.00 0.00 0.00 0.00 46.02 45.48 1yis n GLY 272 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1yis n GLU 273 N -2.77 0.65 -4.33 1.61 1.02 -0.15 -4.61 120.64 112.06 1yis n GLU 273 Ca 0.00 0.29 -0.17 0.00 -0.02 0.00 0.00 57.16 57.25 1yis n GLU 273 Cb 0.00 -1.78 -0.10 0.00 -0.02 0.00 0.00 31.44 29.54 1yis n GLU 273 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1yis s LEU 274 N -6.20 2.39 -0.08 -4.62 1.43 -1.19 -1.23 118.68 109.17 1yis s LEU 274 Ca -0.07 -1.13 -0.03 0.00 -1.03 0.00 0.00 54.13 51.87 1yis s LEU 274 Cb 0.08 -0.42 0.04 0.00 0.03 0.00 0.00 46.19 45.92 1yis s LEU 274 CO 0.82 -0.38 0.11 -0.76 0.23 0.00 0.00 176.35 176.37 1yis s LEU 275 N -3.30 0.04 0.54 1.79 1.43 -0.57 -4.22 118.68 114.40 1yis s LEU 275 Ca 0.25 0.14 -0.12 0.00 -1.03 0.00 0.00 54.13 53.36 1yis s LEU 275 Cb 0.04 0.06 -0.06 0.00 0.03 0.00 0.00 46.19 46.26 1yis s LEU 275 CO 0.07 -0.26 0.96 -1.83 0.23 0.00 0.00 176.35 175.52 1yis s GLU 276 N 2.23 3.74 0.00 1.70 -1.05 -1.26 -1.60 118.70 122.46 1yis s GLU 276 Ca 0.04 0.73 -0.09 0.00 -0.15 0.00 0.00 54.97 55.50 1yis s GLU 276 Cb -0.12 -2.17 -0.11 0.00 -0.44 0.00 0.00 34.13 31.29 1yis s GLU 276 CO -0.05 -0.36 0.80 -2.30 0.95 0.00 0.00 175.26 174.30 1yis n PRO 277 N -2.09 0.00 -0.04 -4.83 -0.02 -1.25 -4.93 135.00 121.84 1yis n PRO 277 Ca 0.05 -0.37 -0.02 0.00 -2.02 0.00 0.00 63.50 61.15 1yis n PRO 277 Cb 0.54 -1.59 -0.00 0.00 -0.02 0.00 0.00 33.50 32.43 1yis n PRO 277 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1yis n LYS 291 N 4.85 0.00 -3.73 -0.52 2.85 -1.26 -5.10 118.16 115.25 1yis n LYS 291 Ca 0.14 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 57.02 1yis n LYS 291 Cb 0.21 -0.04 -0.12 0.00 -0.65 0.00 0.00 35.03 34.43 1yis n LYS 291 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1yis s LYS 292 N 0.01 3.31 0.01 -1.58 -0.14 -1.26 -5.09 119.74 115.00 1yis s LYS 292 Ca 0.02 -0.72 -0.14 0.00 -1.36 0.00 0.00 55.97 53.78 1yis s LYS 292 Cb -0.03 -3.42 -0.06 0.00 -1.68 0.00 0.00 37.83 32.64 1yis s LYS 292 CO 0.02 -0.37 0.39 -0.80 -0.76 0.00 0.00 175.35 173.83 1yis s ASN 293 N 1.56 6.76 -0.00 2.83 0.01 -1.26 -5.01 114.94 119.83 1yis s ASN 293 Ca 0.04 0.91 -0.29 0.00 -0.71 0.00 0.00 52.86 52.81 1yis s ASN 293 Cb -0.17 -2.23 -0.03 0.00 0.41 0.00 0.00 41.25 39.23 1yis s ASN 293 CO 0.04 0.31 0.93 -2.16 -1.51 0.00 0.00 177.10 174.71 1yis s PRO 294 N -1.20 4.55 0.00 -0.60 0.04 -1.26 -4.95 135.00 131.57 1yis s PRO 294 Ca 0.25 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.62 1yis s PRO 294 Cb -0.16 -3.45 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1yis s PRO 294 CO 0.13 -0.01 0.00 1.63 0.04 0.00 0.00 177.00 178.79 1yis n LYS 296 N 3.80 0.00 0.06 4.56 5.02 -1.26 -1.65 118.16 128.69 1yis n LYS 296 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1yis n LYS 296 Cb 0.51 0.00 0.31 0.00 -0.02 0.00 0.00 35.03 35.83 1yis n LYS 296 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1yis h SER 297 N 0.00 0.36 -0.29 4.39 0.02 -1.94 -0.81 113.55 115.28 1yis h SER 297 Ca 0.00 -0.09 -0.16 0.00 -0.84 0.00 0.00 61.79 60.70 1yis h SER 297 Cb 0.00 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 1yis h SER 297 CO 0.00 0.53 -0.43 -0.33 -1.14 0.00 0.00 176.83 175.46 1yis h GLU 298 N 0.35 0.86 -0.34 3.45 5.08 -1.65 -1.23 114.58 121.09 1yis h GLU 298 Ca 0.07 -0.47 -0.06 0.00 -1.00 0.00 0.00 59.36 57.89 1yis h GLU 298 Cb 0.46 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1yis h GLU 298 CO 0.03 1.11 -0.04 -0.09 -1.00 0.00 0.00 179.01 179.02 1yis h ARG 299 N 0.69 0.55 -0.63 2.33 2.43 -1.74 -2.09 114.38 115.92 1yis h ARG 299 Ca 0.05 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1yis h ARG 299 Cb 1.02 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.47 1yis h ARG 299 CO 0.10 0.60 0.30 0.00 -1.51 0.00 0.00 179.97 179.46 1yis h ALA 302 N 1.29 0.28 -0.39 0.00 0.00 -1.09 0.51 119.26 119.86 1yis h ALA 302 Ca 0.06 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1yis h ALA 302 Cb 0.69 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1yis h ALA 302 CO 0.05 0.05 0.06 -0.07 0.00 0.00 0.00 179.25 179.34 1yis h LEU 303 N 0.11 0.61 -0.65 0.00 3.38 -1.23 -2.89 115.31 114.65 1yis h LEU 303 Ca 0.05 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1yis h LEU 303 Cb 0.49 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1yis h LEU 303 CO 0.02 0.72 0.43 0.28 0.09 0.00 0.00 178.44 179.97 1yis h SER 304 N 0.48 0.73 -0.88 -0.43 0.02 -0.98 -2.35 113.55 110.15 1yis h SER 304 Ca 0.12 -0.02 0.09 0.00 -0.84 0.00 0.00 61.79 61.14 1yis h SER 304 Cb 0.37 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 62.66 1yis h SER 304 CO 0.01 0.53 0.57 -0.09 -1.14 0.00 0.00 176.83 176.70 1yis h ARG 305 N 0.87 0.86 -0.36 3.45 2.43 -0.72 -1.29 114.38 119.61 1yis h ARG 305 Ca 0.24 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.31 1yis h ARG 305 Cb -0.08 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.26 1yis h ARG 305 CO -0.06 0.57 0.02 -0.22 -1.51 0.00 0.00 179.97 178.77 1yis h LYS 306 N 0.88 0.62 -0.41 0.20 3.64 -1.23 -2.40 116.57 117.87 1yis h LYS 306 Ca 0.40 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.53 1yis h LYS 306 Cb 0.38 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1yis h LYS 306 CO -0.17 0.71 -0.04 -0.07 -2.27 0.00 0.00 179.45 177.62 1yis h LEU 307 N 0.44 0.66 -1.26 5.20 3.38 -1.16 -2.77 115.31 119.81 1yis h LEU 307 Ca 0.11 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1yis h LEU 307 Cb 0.42 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1yis h LEU 307 CO 0.01 0.76 -0.20 0.40 0.09 0.00 0.00 178.44 179.50 1yis h ILE 308 N 0.64 1.22 -0.42 1.22 2.04 -1.08 -2.93 117.51 118.20 1yis h ILE 308 Ca 0.12 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 64.99 1yis h ILE 308 Cb 0.46 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 1yis h ILE 308 CO 0.02 0.31 0.00 0.59 0.00 0.00 0.00 178.15 179.07 1yis n ASN 309 N -4.20 4.08 -0.10 1.72 3.02 -0.92 -4.34 115.26 114.52 1yis n ASN 309 Ca -0.01 -2.55 -0.12 0.00 -0.03 0.00 0.00 54.58 51.87 1yis n ASN 309 Cb 0.33 -0.59 -0.13 0.00 -0.61 0.00 0.00 39.78 38.78 1yis n ASN 309 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yis n ALA 310 N 0.52 1.53 -0.26 5.41 0.00 -1.11 -4.66 120.51 121.94 1yis n ALA 310 Ca 0.19 -1.13 0.06 0.00 0.00 0.00 0.00 53.44 52.56 1yis n ALA 310 Cb 0.84 -0.10 0.18 0.00 0.00 0.00 0.00 19.45 20.37 1yis n ALA 310 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1yis h PRO 311 N 0.00 0.18 0.00 0.00 0.11 -1.76 -1.69 132.00 128.84 1yis h PRO 311 Ca -0.51 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1yis h PRO 311 Cb 2.01 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 33.08 1yis h PRO 311 CO -0.01 0.12 -0.07 1.96 -0.21 0.00 0.00 178.00 179.78 1yis h GLN 312 N 0.18 0.00 -0.03 1.05 4.20 -1.89 -1.16 115.11 117.46 1yis h GLN 312 Ca 0.43 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 59.01 1yis h GLN 312 Cb 0.77 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.56 1yis h GLN 312 CO -0.60 0.07 -0.50 1.49 -0.67 0.00 0.00 178.83 178.62 1yis h GLU 313 N 0.00 0.40 -0.69 1.46 4.81 -1.60 -1.91 114.58 117.06 1yis h GLU 313 Ca -0.00 -0.39 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1yis h GLU 313 Cb 0.20 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 1yis h GLU 313 CO 0.01 1.05 0.45 0.00 -0.73 0.00 0.00 179.01 179.78 1yis h ALA 314 N 0.37 0.87 -0.63 2.92 0.00 -1.32 0.09 119.26 121.56 1yis h ALA 314 Ca -0.05 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1yis h ALA 314 Cb 1.19 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1yis h ALA 314 CO 0.10 0.31 0.15 -0.07 0.00 0.00 0.00 179.25 179.73 1yis h LEU 315 N 0.93 0.93 -0.94 0.00 3.38 -1.26 -2.38 115.31 115.98 1yis h LEU 315 Ca 0.25 -0.19 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1yis h LEU 315 Cb -0.09 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1yis h LEU 315 CO -0.05 0.91 -0.28 0.74 0.09 0.00 0.00 178.44 179.84 1yis h THR 316 N 0.95 1.27 -0.38 0.22 2.02 -0.71 -1.58 112.91 114.70 1yis h THR 316 Ca 0.20 -1.31 0.01 0.00 0.77 0.00 0.00 66.41 66.08 1yis h THR 316 Cb 0.35 1.41 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1yis h THR 316 CO 0.00 0.41 0.23 0.40 0.37 0.00 0.00 175.52 176.93 1yis h ILE 317 N 0.38 1.05 0.18 3.11 2.04 -0.49 0.53 117.51 124.31 1yis h ILE 317 Ca 0.05 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1yis h ILE 317 Cb 0.70 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1yis h ILE 317 CO 0.05 0.08 -0.09 0.25 0.00 0.00 0.00 178.15 178.45 1yis h LEU 318 N 0.46 -0.20 -2.03 1.44 5.85 -1.22 -2.56 115.31 117.05 1yis h LEU 318 Ca 0.15 -0.08 0.13 0.00 0.84 0.00 0.00 57.88 58.91 1yis h LEU 318 Cb -0.01 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1yis h LEU 318 CO -0.06 -0.04 0.34 0.00 -0.34 0.00 0.00 178.44 178.34 1yis h ALA 319 N 0.44 2.34 -0.00 1.25 0.00 -1.02 -0.93 119.26 121.35 1yis h ALA 319 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1yis h ALA 319 Cb 0.28 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1yis h ALA 319 CO 0.04 -0.56 -0.23 -0.25 0.00 0.00 0.00 179.25 178.24 1yis n ASP 320 N -4.25 0.43 -4.65 0.00 8.00 0.15 -4.88 116.55 111.36 1yis n ASP 320 Ca 0.08 -0.25 -0.43 0.00 0.71 0.00 0.00 54.79 54.90 1yis n ASP 320 Cb 0.54 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.57 1yis n ASP 320 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1yis s GLN 321 N -2.78 4.09 -0.23 -1.24 -1.52 -0.36 -4.92 119.66 112.70 1yis s GLN 321 Ca 0.19 1.95 -0.19 0.00 -1.95 0.00 0.00 55.36 55.36 1yis s GLN 321 Cb 0.19 -3.96 -0.03 0.00 -0.22 0.00 0.00 33.01 28.99 1yis s GLN 321 CO 0.57 -0.94 0.55 0.20 -0.25 0.00 0.00 175.29 175.42 1yis s GLY 322 N 3.33 1.93 0.00 3.09 0.00 -1.26 -4.93 107.32 109.48 1yis s GLY 322 Ca 0.69 -0.47 0.00 0.00 0.00 0.00 0.00 44.72 44.94 1yis s GLY 322 CO 0.27 1.24 0.00 1.04 0.00 0.00 0.00 173.10 175.64 1yis n LEU 323 N 5.29 0.00 0.22 0.66 4.77 -1.26 -1.04 117.00 125.64 1yis n LEU 323 Ca -0.03 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.10 1yis n LEU 323 Cb 0.50 0.00 0.67 0.00 -2.33 0.00 0.00 43.42 42.25 1yis n LEU 323 CO 0.42 0.00 0.95 -0.33 -1.33 0.00 0.00 177.39 177.10 1yis h GLU 324 N 0.00 0.00 0.00 3.23 3.07 -1.93 -3.46 114.58 115.49 1yis h GLU 324 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1yis h GLU 324 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1yis h GLU 324 CO 0.00 0.00 0.00 -2.13 -1.40 0.00 0.00 179.01 175.48 1yis n ARG 325 N -2.70 0.00 -4.32 2.33 0.00 -0.20 -1.47 116.66 110.29 1yis n ARG 325 Ca 0.01 0.00 -0.18 0.00 -0.00 0.00 0.00 57.85 57.67 1yis n ARG 325 Cb 0.23 0.00 -0.15 0.00 0.00 0.00 0.00 32.46 32.54 1yis n ARG 325 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1yis s THR 326 N -0.98 0.65 -1.49 5.15 -4.23 -1.24 -4.73 115.64 108.76 1yis s THR 326 Ca 0.00 -0.34 0.03 0.00 -1.18 0.00 0.00 61.69 60.19 1yis s THR 326 Cb 0.00 -0.55 0.11 0.00 1.34 0.00 0.00 72.50 73.39 1yis s THR 326 CO 0.00 0.19 0.90 0.18 -0.54 0.00 0.00 174.62 175.34 1yis n LEU 327 N 2.94 1.08 0.00 4.79 4.32 -1.26 -4.00 117.00 124.86 1yis n LEU 327 Ca -0.14 -0.54 0.06 0.00 -0.02 0.00 0.00 56.01 55.36 1yis n LEU 327 Cb 0.57 -0.28 0.33 0.00 -1.62 0.00 0.00 43.42 42.42 1yis n LEU 327 CO 0.25 0.22 0.61 -0.90 -1.22 0.00 0.00 177.39 176.34 1yis n ASP 328 N -0.06 0.00 -0.06 -1.43 5.75 -1.26 -2.82 116.55 116.67 1yis n ASP 328 Ca 0.04 -1.09 -0.01 0.00 -0.01 0.00 0.00 54.79 53.72 1yis n ASP 328 Cb 0.23 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.16 1yis n ASP 328 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1yis n ASP 329 N -0.74 0.18 0.00 -1.12 5.75 -1.26 -4.47 116.55 114.88 1yis n ASP 329 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.86 1yis n ASP 329 Cb 0.04 1.40 0.00 0.00 -1.03 0.00 0.00 41.12 41.53 1yis n ASP 329 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1yis n SER 330 N -2.51 0.00 -0.29 -1.12 7.64 -1.13 0.66 113.62 116.87 1yis n SER 330 Ca -0.20 0.96 0.15 0.00 1.01 0.00 0.00 58.87 60.79 1yis n SER 330 Cb 0.88 -0.46 0.41 0.00 -1.01 0.00 0.00 64.21 64.03 1yis n SER 330 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1yis h ALA 331 N -1.65 1.91 -0.26 -0.43 0.00 -1.85 0.13 119.26 117.12 1yis h ALA 331 Ca 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1yis h ALA 331 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1yis h ALA 331 CO 0.00 -0.21 -0.01 0.78 0.00 0.00 0.00 179.25 179.81 1yis h GLY 332 N 0.62 0.50 1.13 0.00 0.00 -1.71 -3.18 103.07 100.43 1yis h GLY 332 Ca 0.50 -0.37 -0.14 0.00 0.00 0.00 0.00 47.33 47.32 1yis h GLY 332 CO -0.25 0.34 -0.24 3.21 0.00 0.00 0.00 176.54 179.60 1yis h ARG 333 N 0.23 0.98 -0.05 4.80 3.08 0.15 -0.29 114.38 123.28 1yis h ARG 333 Ca 0.07 -0.44 0.00 0.00 0.07 0.00 0.00 59.98 59.69 1yis h ARG 333 Cb 0.43 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1yis h ARG 333 CO 0.01 1.11 0.00 -2.13 -1.07 0.00 0.00 179.97 177.89 1yis n ARG 334 N -4.10 0.08 0.00 0.04 0.63 0.32 -2.24 116.66 111.39 1yis n ARG 334 Ca -0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1yis n ARG 334 Cb 0.47 -1.03 0.00 0.00 0.45 0.00 0.00 32.46 32.36 1yis n ARG 334 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1yis n LEU 336 N 0.16 0.00 0.04 6.15 7.94 -0.12 -4.42 117.00 126.75 1yis n LEU 336 Ca 0.00 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.78 1yis n LEU 336 Cb 0.01 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 43.89 1yis n LEU 336 CO 0.00 0.00 0.83 0.40 -1.11 0.00 0.00 177.39 177.51 1yis h ILE 337 N 0.00 1.04 -0.43 1.96 2.04 -1.68 -1.85 117.51 118.59 1yis h ILE 337 Ca 0.00 -0.18 0.01 0.00 1.00 0.00 0.00 64.86 65.69 1yis h ILE 337 Cb 0.00 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1yis h ILE 337 CO 0.00 0.05 0.28 -0.65 0.00 0.00 0.00 178.15 177.83 1yis h PRO 338 N -0.10 0.54 -0.47 2.37 0.11 -1.77 -1.39 132.00 131.29 1yis h PRO 338 Ca -0.00 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 1yis h PRO 338 Cb 0.09 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 1yis h PRO 338 CO 0.00 0.36 0.04 -0.44 -0.21 0.00 0.00 178.00 177.75 1yis h ASP 339 N 0.55 0.77 -0.18 -2.05 3.32 -1.77 -1.82 116.42 115.24 1yis h ASP 339 Ca 0.16 -0.28 -0.16 0.00 0.02 0.00 0.00 57.03 56.77 1yis h ASP 339 Cb -0.03 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 1yis h ASP 339 CO -0.04 0.86 -0.46 -0.37 -1.72 0.00 0.00 179.24 177.51 1yis h VAL 340 N 0.66 1.29 -0.35 -1.35 -1.51 -0.90 0.45 116.25 114.53 1yis h VAL 340 Ca 0.14 -1.65 0.00 0.00 -1.23 0.00 0.00 66.70 63.96 1yis h VAL 340 Cb 0.44 1.56 -0.02 0.00 -2.13 0.00 0.00 31.29 31.14 1yis h VAL 340 CO 0.02 0.53 0.23 -0.07 -1.23 0.00 0.00 177.57 177.05 1yis h LEU 341 N 0.59 0.40 -0.37 4.19 3.38 -1.18 0.03 115.31 122.35 1yis h LEU 341 Ca 0.03 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1yis h LEU 341 Cb 1.02 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1yis h LEU 341 CO 0.10 0.29 -0.16 -0.07 0.09 0.00 0.00 178.44 178.69 1yis h LEU 342 N 0.47 0.78 -0.89 1.67 3.38 -1.27 -2.41 115.31 117.04 1yis h LEU 342 Ca 0.13 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.71 1yis h LEU 342 Cb -0.05 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 1yis h LEU 342 CO -0.03 1.00 0.58 0.74 0.09 0.00 0.00 178.44 180.82 1yis h THR 343 N 0.56 1.23 -0.63 0.22 2.02 -0.64 -0.03 112.91 115.64 1yis h THR 343 Ca 0.09 -0.44 -0.06 0.00 0.77 0.00 0.00 66.41 66.76 1yis h THR 343 Cb 0.70 -0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.01 1yis h THR 343 CO 0.05 0.23 0.15 0.00 0.37 0.00 0.00 175.52 176.32 1yis h ALA 344 N 1.32 1.08 -0.33 6.16 0.00 -0.89 -0.00 119.26 126.60 1yis h ALA 344 Ca 0.33 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1yis h ALA 344 Cb -0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1yis h ALA 344 CO -0.07 0.61 -0.09 1.49 0.00 0.00 0.00 179.25 181.19 1yis h GLU 345 N 0.95 0.64 -0.68 0.00 4.22 -0.87 -0.30 114.58 118.55 1yis h GLU 345 Ca 0.20 -0.25 -0.05 0.00 0.08 0.00 0.00 59.36 59.34 1yis h GLU 345 Cb 0.34 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 1yis h GLU 345 CO 0.00 0.82 0.22 0.00 -2.18 0.00 0.00 179.01 177.88 1yis h ALA 346 N 0.80 1.11 -0.23 2.92 0.00 -0.78 -0.97 119.26 122.10 1yis h ALA 346 Ca 0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1yis h ALA 346 Cb 0.60 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1yis h ALA 346 CO 0.04 0.62 0.08 1.25 0.00 0.00 0.00 179.25 181.23 1yis h LEU 347 N 1.00 0.33 -0.94 0.00 5.85 -0.79 -2.17 115.31 118.58 1yis h LEU 347 Ca 0.22 -0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1yis h LEU 347 Cb 0.27 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1yis h LEU 347 CO -0.01 0.42 0.10 -0.07 -0.34 0.00 0.00 178.44 178.54 1yis h LEU 348 N 0.21 0.82 -0.84 2.25 3.38 -0.74 0.02 115.31 120.41 1yis h LEU 348 Ca 0.08 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1yis h LEU 348 Cb 0.21 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1yis h LEU 348 CO -0.00 0.83 0.43 0.74 0.09 0.00 0.00 178.44 180.52 1yis h THR 349 N 0.83 1.25 -0.14 0.22 2.02 -1.07 -0.67 112.91 115.35 1yis h THR 349 Ca 0.18 -0.68 -0.04 0.00 0.77 0.00 0.00 66.41 66.64 1yis h THR 349 Cb 0.35 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 66.92 1yis h THR 349 CO 0.01 0.30 -0.06 0.74 0.37 0.00 0.00 175.52 176.87 1yis h THR 350 N 1.18 1.31 -0.95 3.16 2.02 -0.89 -2.52 112.91 116.23 1yis h THR 350 Ca 0.29 -1.08 0.05 0.00 0.77 0.00 0.00 66.41 66.45 1yis h THR 350 Cb 0.08 1.73 -0.06 0.00 -1.74 0.00 0.00 68.15 68.16 1yis h THR 350 CO -0.04 0.31 0.61 -0.07 0.37 0.00 0.00 175.52 176.70 1yis h LEU 351 N -0.04 0.98 -0.42 2.58 3.38 -0.79 -1.33 115.31 119.68 1yis h LEU 351 Ca 0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1yis h LEU 351 Cb 0.52 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1yis h LEU 351 CO 0.02 0.64 0.28 -0.61 0.09 0.00 0.00 178.44 178.86 1yis h GLN 352 N 1.13 0.56 -0.29 1.13 4.15 -1.00 -0.13 115.11 120.65 1yis h GLN 352 Ca 0.40 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.80 1yis h GLN 352 Cb 0.11 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 1yis h GLN 352 CO -0.16 0.37 0.15 -0.91 -1.93 0.00 0.00 178.83 176.36 1yis h ASN 353 N 0.57 0.23 0.13 -0.69 4.21 -0.94 -1.71 115.58 117.39 1yis h ASN 353 Ca 0.15 0.01 0.01 0.00 1.21 0.00 0.00 56.30 57.68 1yis h ASN 353 Cb -0.06 -0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 37.08 1yis h ASN 353 CO -0.03 0.18 -0.18 0.40 -1.29 0.00 0.00 177.43 176.51 1yis h ILE 354 N 0.32 0.60 0.00 2.81 2.04 -0.83 -2.94 117.51 119.51 1yis h ILE 354 Ca 0.12 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 1yis h ILE 354 Cb 0.02 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 1yis h ILE 354 CO -0.07 0.00 -0.09 -0.26 0.00 0.00 0.00 178.15 177.73 1yis h PHE 355 N -0.36 0.00 -0.03 1.37 0.04 -0.90 -0.44 116.94 116.63 1yis h PHE 355 Ca 0.01 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.62 1yis h PHE 355 Cb 0.36 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 1yis h PHE 355 CO -0.16 0.09 -0.71 0.93 -0.60 0.00 0.00 178.31 177.85 1yis h GLU 356 N 0.00 0.16 -0.01 1.51 5.08 -1.13 -3.34 114.58 116.86 1yis h GLU 356 Ca -0.00 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1yis h GLU 356 Cb 0.51 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1yis h GLU 356 CO 0.01 0.81 0.00 0.41 -1.00 0.00 0.00 179.01 179.24 1yis n GLY 357 N 0.50 2.94 3.73 -3.84 0.00 -1.14 -5.03 105.19 102.36 1yis n GLY 357 Ca -0.02 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1yis n GLY 357 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1yis s LEU 358 N -0.99 4.37 0.12 0.99 2.96 -0.19 -3.84 118.68 122.10 1yis s LEU 358 Ca 0.00 2.75 0.01 0.00 -0.22 0.00 0.00 54.13 56.67 1yis s LEU 358 Cb 0.00 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 43.04 1yis s LEU 358 CO 0.00 -0.84 -0.03 -0.94 -1.32 0.00 0.00 176.35 173.23 1yis s SER 359 N 0.81 0.96 -0.15 3.68 1.04 -0.63 -5.00 113.70 114.41 1yis s SER 359 Ca 0.67 -1.08 -0.07 0.00 0.48 0.00 0.00 55.95 55.95 1yis s SER 359 Cb -0.45 0.14 -0.04 0.00 0.10 0.00 0.00 66.02 65.77 1yis s SER 359 CO 0.38 -0.55 0.11 -0.69 0.98 0.00 0.00 173.24 173.48 1yis s VAL 360 N -3.73 5.26 -1.23 5.02 1.01 -1.26 -1.51 120.40 123.97 1yis s VAL 360 Ca 0.16 0.13 -0.16 0.00 0.00 0.00 0.00 61.98 62.11 1yis s VAL 360 Cb 0.06 -3.33 0.13 0.00 0.00 0.00 0.00 36.38 33.25 1yis s VAL 360 CO -0.02 0.55 1.53 -1.10 0.00 0.00 0.00 175.10 176.05 1yis s GLN 361 N -0.44 4.03 0.47 2.72 -1.52 -0.37 -4.85 119.66 119.71 1yis s GLN 361 Ca 0.11 -2.33 0.23 0.00 -1.95 0.00 0.00 55.36 51.42 1yis s GLN 361 Cb -0.12 -5.23 1.26 0.00 -0.22 0.00 0.00 33.01 28.71 1yis s GLN 361 CO 0.02 -1.94 1.89 1.79 -0.25 0.00 0.00 175.29 176.80 1yis h THR 362 N 5.04 0.65 -0.17 -0.19 1.35 -1.92 -1.36 112.91 116.31 1yis h THR 362 Ca 0.35 -0.07 -0.04 0.00 -0.55 0.00 0.00 66.41 66.10 1yis h THR 362 Cb 0.88 0.42 -0.01 0.00 -1.73 0.00 0.00 68.15 67.71 1yis h THR 362 CO 1.32 0.04 -0.04 0.44 -0.25 0.00 0.00 175.52 177.03 1yis h ASP 363 N 0.21 0.32 -0.51 5.36 3.32 -1.96 -1.63 116.42 121.54 1yis h ASP 363 Ca 0.42 -0.36 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 1yis h ASP 363 Cb 1.30 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 1yis h ASP 363 CO -0.09 0.61 0.06 0.78 -1.72 0.00 0.00 179.24 178.87 1yis h ASN 364 N 0.03 0.84 -0.38 6.45 2.35 -1.61 -2.31 115.58 120.94 1yis h ASN 364 Ca 0.04 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 1yis h ASN 364 Cb 0.46 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1yis h ASN 364 CO 0.02 0.90 0.19 0.58 -1.65 0.00 0.00 177.43 177.47 1yis h VAL 365 N 0.74 1.16 -0.87 2.81 2.07 -1.28 -0.31 116.25 120.57 1yis h VAL 365 Ca 0.15 -0.46 0.03 0.00 0.82 0.00 0.00 66.70 67.24 1yis h VAL 365 Cb 0.44 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 1yis h VAL 365 CO 0.02 0.17 0.56 0.50 0.02 0.00 0.00 177.57 178.84 1yis h LYS 366 N 0.48 1.08 -0.39 1.57 3.64 -1.23 -0.44 116.57 121.29 1yis h LYS 366 Ca 0.13 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.32 1yis h LYS 366 Cb 0.10 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1yis h LYS 366 CO -0.02 0.71 -0.24 -0.22 -2.27 0.00 0.00 179.45 177.42 1yis h LYS 367 N 1.11 0.84 -0.83 1.90 3.64 -1.07 -0.76 116.57 121.40 1yis h LYS 367 Ca 0.34 -0.39 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1yis h LYS 367 Cb -0.03 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 1yis h LYS 367 CO -0.10 1.03 0.41 0.82 -2.27 0.00 0.00 179.45 179.33 1yis h ILE 368 N 0.65 1.25 -0.48 2.00 2.04 -0.64 -1.00 117.51 121.34 1yis h ILE 368 Ca 0.08 -0.70 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 1yis h ILE 368 Cb 0.80 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1yis h ILE 368 CO 0.07 0.30 0.15 0.58 0.00 0.00 0.00 178.15 179.25 1yis h VAL 369 N 1.17 1.23 -0.36 1.67 2.07 -0.92 -2.98 116.25 118.13 1yis h VAL 369 Ca 0.29 -0.75 -0.06 0.00 0.82 0.00 0.00 66.70 67.00 1yis h VAL 369 Cb 0.10 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1yis h VAL 369 CO -0.04 0.27 -0.01 -0.33 0.02 0.00 0.00 177.57 177.48 1yis h GLU 370 N 0.63 0.57 0.00 1.57 5.08 -0.61 0.13 114.58 121.96 1yis h GLU 370 Ca 0.15 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1yis h GLU 370 Cb 0.27 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1yis h GLU 370 CO -0.00 0.60 0.00 -0.44 -1.00 0.00 0.00 179.01 178.17 1yis h ASP 371 N 0.54 0.00 0.00 1.42 3.32 -1.06 -3.31 116.42 117.34 1yis h ASP 371 Ca 0.11 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 1yis h ASP 371 Cb 0.37 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1yis h ASP 371 CO 0.01 0.00 -1.41 -0.62 -1.72 0.00 0.00 179.24 175.50 1yis n GLU 372 N -2.43 1.12 0.29 3.56 -0.58 -0.93 -4.72 120.64 116.94 1yis n GLU 372 Ca 0.03 -0.05 0.14 0.00 -0.42 0.00 0.00 57.16 56.86 1yis n GLU 372 Cb 0.30 -1.19 0.89 0.00 -0.57 0.00 0.00 31.44 30.87 1yis n GLU 372 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1yis h ILE 373 N 0.00 0.56 -0.09 -3.67 2.10 -0.83 -2.33 117.51 113.25 1yis h ILE 373 Ca -0.07 -0.05 -0.01 0.00 1.08 0.00 0.00 64.86 65.81 1yis h ILE 373 Cb 0.74 1.03 -0.00 0.00 -1.09 0.00 0.00 36.82 37.49 1yis h ILE 373 CO 0.00 0.01 -0.00 0.00 -1.08 0.00 0.00 178.15 177.08 1yis h ALA 374 N 1.99 0.12 -0.55 0.18 0.00 -1.85 -1.27 119.26 117.87 1yis h ALA 374 Ca -0.00 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1yis h ALA 374 Cb 0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1yis h ALA 374 CO 0.00 -0.20 -0.04 0.74 0.00 0.00 0.00 179.25 179.76 1yis h PHE 375 N -0.13 1.10 -0.20 0.00 0.04 -1.80 -0.55 116.94 115.41 1yis h PHE 375 Ca 0.02 -0.21 -0.03 0.00 2.80 0.00 0.00 57.97 60.56 1yis h PHE 375 Cb 0.35 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 1yis h PHE 375 CO 0.03 1.01 -0.02 -0.07 -0.60 0.00 0.00 178.31 178.67 1yis h LEU 376 N 0.88 0.26 -0.33 1.54 3.38 -1.42 0.24 115.31 119.87 1yis h LEU 376 Ca 0.15 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 1yis h LEU 376 Cb 0.59 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1yis h LEU 376 CO 0.04 0.33 -0.17 1.23 0.09 0.00 0.00 178.44 179.96 1yis h GLY 377 N 0.60 0.75 1.00 0.83 0.00 -0.51 -1.15 103.07 104.59 1yis h GLY 377 Ca 0.07 -0.68 0.00 0.00 0.00 0.00 0.00 47.33 46.71 1yis h GLY 377 CO 0.01 0.62 0.37 1.41 0.00 0.00 0.00 176.54 178.95 1yis h LEU 378 N 0.46 0.70 -1.02 3.11 3.38 -0.11 -0.16 115.31 121.67 1yis h LEU 378 Ca 0.07 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1yis h LEU 378 Cb 0.71 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1yis h LEU 378 CO 0.05 0.53 0.25 -0.08 0.09 0.00 0.00 178.44 179.28 1yis h GLU 379 N 0.80 0.95 -0.35 1.13 4.57 -0.89 -2.85 114.58 117.94 1yis h GLU 379 Ca 0.21 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 58.20 1yis h GLU 379 Cb -0.05 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.37 1yis h GLU 379 CO -0.04 0.78 0.07 -0.22 -1.18 0.00 0.00 179.01 178.42 1yis h LYS 380 N 0.93 0.57 -6.27 1.92 1.63 -0.35 -3.50 116.57 111.51 1yis h LYS 380 Ca 0.22 -0.15 -0.55 0.00 -0.85 0.00 0.00 60.65 59.32 1yis h LYS 380 Cb 0.20 -0.07 0.01 0.00 -0.60 0.00 0.00 32.23 31.77 1yis h LYS 380 CO -0.02 0.63 1.27 0.00 -3.45 0.00 0.00 179.45 177.89 1yis s ALA 381 N -5.23 3.39 0.00 5.00 0.00 -0.15 -5.10 121.76 119.66 1yis s ALA 381 Ca -0.13 1.13 0.00 0.00 0.00 0.00 0.00 51.96 52.96 1yis s ALA 381 Cb 0.09 -3.89 0.00 0.00 0.00 0.00 0.00 23.12 19.33 1yis s ALA 381 CO 0.76 -1.84 0.00 1.28 0.00 0.00 0.00 175.76 175.96 1yis n LEU 385 N 8.43 0.00 0.00 0.00 4.77 -1.26 -5.05 117.00 123.90 1yis n LEU 385 Ca 0.22 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1yis n LEU 385 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1yis n LEU 385 CO 0.67 0.00 0.00 1.67 -1.33 0.00 0.00 177.39 178.40 1yis n GLN 419 N 0.00 0.00 -2.49 3.23 7.27 -1.26 -5.27 117.38 118.86 1yis n GLN 419 Ca 0.00 0.00 -0.37 0.00 0.07 0.00 0.00 57.00 56.70 1yis n GLN 419 Cb 0.00 0.00 0.01 0.00 2.41 0.00 0.00 30.24 32.66 1yis n GLN 419 CO 0.00 0.00 0.00 -2.37 0.07 0.00 0.00 177.06 174.76 1yis n THR 420 N 0.00 4.66 -1.80 1.69 5.66 -1.26 -5.07 114.28 118.16 1yis n THR 420 Ca 0.00 -5.40 -0.01 0.00 -3.05 0.00 0.00 64.05 55.59 1yis n THR 420 Cb 0.00 -1.42 0.00 0.00 -1.55 0.00 0.00 70.33 67.36 1yis n THR 420 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1yis n ALA 422 N -0.25 -3.04 -0.17 1.79 0.00 -1.26 -5.15 120.51 112.43 1yis n ALA 422 Ca 0.46 0.22 0.00 0.00 0.00 0.00 0.00 53.44 54.11 1yis n ALA 422 Cb 0.31 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.11 1yis n ALA 422 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1yis n ASP 423 N -0.25 0.00 -4.78 0.00 4.64 -1.26 -5.00 116.55 109.91 1yis n ASP 423 Ca 0.02 0.25 -0.35 0.00 -1.38 0.00 0.00 54.79 53.33 1yis n ASP 423 Cb 0.07 -0.41 -0.00 0.00 -1.04 0.00 0.00 41.12 39.73 1yis n ASP 423 CO 0.00 0.00 0.00 -2.84 -0.82 0.00 0.00 177.20 173.54 1yis s PRO 424 N -0.83 3.44 0.00 -0.67 0.02 -1.26 -5.08 135.00 130.62 1yis s PRO 424 Ca 0.00 1.61 0.00 0.00 0.02 0.00 0.00 61.00 62.63 1yis s PRO 424 Cb 0.00 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.46 1yis s PRO 424 CO 0.00 -0.78 0.00 0.34 -0.33 0.00 0.00 177.00 176.23 1yis n PHE 425 N -1.17 0.00 0.47 6.54 7.35 -1.26 -4.88 117.46 124.51 1yis n PHE 425 Ca 0.11 0.00 0.08 0.00 -0.76 0.00 0.00 57.45 56.88 1yis n PHE 425 Cb 0.51 0.00 0.10 0.00 0.35 0.00 0.00 39.48 40.44 1yis n PHE 425 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 1yis n PHE 426 N 0.00 0.14 -0.01 -5.13 3.01 -1.26 -4.59 117.46 109.63 1yis n PHE 426 Ca 0.00 -0.11 0.23 0.00 1.01 0.00 0.00 57.45 58.58 1yis n PHE 426 Cb 0.00 -0.00 0.66 0.00 -0.01 0.00 0.00 39.48 40.13 1yis n PHE 426 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1yis h ASP 427 N 3.12 0.00 -0.02 4.37 3.32 -1.99 1.37 116.42 126.58 1yis h ASP 427 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yis h ASP 427 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1yis h ASP 427 CO 0.00 0.00 -0.00 -1.54 -1.72 0.00 0.00 179.24 175.98 1yis n SER 428 N -3.57 2.14 0.00 6.45 3.41 -1.26 -4.34 113.62 116.45 1yis n SER 428 Ca 0.12 -1.71 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 1yis n SER 428 Cb 0.90 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.86 1yis n SER 428 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1yis n VAL 429 N 0.67 0.00 0.20 -3.33 0.24 0.22 -4.94 118.33 111.39 1yis n VAL 429 Ca 0.17 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.32 1yis n VAL 429 Cb 0.46 1.17 -0.08 0.00 -1.47 0.00 0.00 33.84 33.92 1yis n VAL 429 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1yis h ARG 430 N 0.00 -0.44 -0.84 7.34 2.43 0.13 -2.33 114.38 120.67 1yis h ARG 430 Ca 0.00 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1yis h ARG 430 Cb 0.72 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.32 1yis h ARG 430 CO 0.00 -0.23 0.55 -0.44 -1.51 0.00 0.00 179.97 178.34 1yis h ASP 431 N -0.55 0.95 -0.42 -3.80 3.32 -1.87 -0.17 116.42 113.87 1yis h ASP 431 Ca -0.05 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 1yis h ASP 431 Cb 0.41 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1yis h ASP 431 CO 0.08 0.68 0.22 -0.09 -1.72 0.00 0.00 179.24 178.40 1yis h ARG 432 N 1.12 0.60 -0.29 3.56 2.43 -1.91 -0.47 114.38 119.41 1yis h ARG 432 Ca 0.32 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.35 1yis h ARG 432 Cb -0.09 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.34 1yis h ARG 432 CO -0.08 0.49 -0.05 0.28 -1.51 0.00 0.00 179.97 179.10 1yis h VAL 433 N 0.54 1.27 -0.91 0.20 2.07 -1.15 -2.35 116.25 115.92 1yis h VAL 433 Ca 0.15 -1.05 0.08 0.00 0.82 0.00 0.00 66.70 66.70 1yis h VAL 433 Cb 0.08 1.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 1yis h VAL 433 CO -0.02 0.34 0.59 0.58 0.02 0.00 0.00 177.57 179.08 1yis h VAL 434 N 0.32 1.02 -0.48 2.57 2.07 -0.86 -0.10 116.25 120.79 1yis h VAL 434 Ca 0.08 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 1yis h VAL 434 Cb 0.51 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 1yis h VAL 434 CO 0.02 0.18 0.04 1.23 0.02 0.00 0.00 177.57 179.07 1yis h GLY 435 N 0.99 0.82 1.08 2.17 0.00 -0.80 -1.72 103.07 105.60 1yis h GLY 435 Ca 0.41 -0.51 -0.13 0.00 0.00 0.00 0.00 47.33 47.09 1yis h GLY 435 CO -0.17 0.48 -0.25 1.41 0.00 0.00 0.00 176.54 178.01 1yis h LEU 436 N 0.72 0.95 -1.31 3.11 3.38 -0.56 -1.96 115.31 119.64 1yis h LEU 436 Ca 0.15 -0.42 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 1yis h LEU 436 Cb 0.38 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1yis h LEU 436 CO 0.01 1.17 -0.33 0.58 0.09 0.00 0.00 178.44 179.95 1yis h VAL 437 N 0.75 1.11 0.00 1.22 2.07 -0.81 -1.69 116.25 118.91 1yis h VAL 437 Ca 0.09 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1yis h VAL 437 Cb 0.83 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 1yis h VAL 437 CO 0.07 0.33 -0.41 0.59 0.02 0.00 0.00 177.57 178.17 1yis n ASN 438 N -3.96 0.42 -3.15 0.57 5.03 -0.67 -4.35 115.26 109.14 1yis n ASN 438 Ca -0.02 -0.06 -0.22 0.00 0.87 0.00 0.00 54.58 55.16 1yis n ASN 438 Cb 0.39 0.08 -0.06 0.00 -1.02 0.00 0.00 39.78 39.18 1yis n ASN 438 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1yis n ASN 439 N -1.56 -0.47 -0.37 6.41 3.02 -0.75 -5.00 115.26 116.53 1yis n ASN 439 Ca 0.06 -2.73 0.29 0.00 -0.03 0.00 0.00 54.58 52.17 1yis n ASN 439 Cb 0.35 -0.22 0.56 0.00 -0.61 0.00 0.00 39.78 39.86 1yis n ASN 439 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1yis h PRO 440 N 4.30 0.21 -0.68 3.52 0.11 -1.53 0.02 132.00 137.96 1yis h PRO 440 Ca 0.07 -0.01 0.20 0.00 0.11 0.00 0.00 66.00 66.37 1yis h PRO 440 Cb 0.91 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.95 1yis h PRO 440 CO 0.41 0.14 0.50 0.97 -0.21 0.00 0.00 178.00 179.82 1yis h ILE 441 N 0.22 0.62 -0.00 4.15 6.09 -1.93 0.65 117.51 127.30 1yis h ILE 441 Ca 0.75 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 64.24 1yis h ILE 441 Cb 2.04 0.65 0.00 0.00 0.47 0.00 0.00 36.82 39.98 1yis h ILE 441 CO -0.49 0.00 -0.00 0.59 -3.07 0.00 0.00 178.15 175.17 1yis n ASN 442 N -4.26 0.14 -0.77 2.19 3.02 -0.01 -2.71 115.26 112.87 1yis n ASN 442 Ca 0.13 -0.91 0.12 0.00 -0.03 0.00 0.00 54.58 53.89 1yis n ASN 442 Cb 0.76 -0.04 0.13 0.00 -0.61 0.00 0.00 39.78 40.02 1yis n ASN 442 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1yis n PHE 443 N -0.94 0.00 -0.77 3.10 -0.00 0.22 -4.40 117.46 114.68 1yis n PHE 443 Ca 0.22 0.00 0.06 0.00 -0.00 0.00 0.00 57.45 57.73 1yis n PHE 443 Cb 0.15 -0.00 0.37 0.00 -0.00 0.00 0.00 39.48 40.00 1yis n PHE 443 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1yis n THR 444 N 0.81 2.58 -0.12 -2.13 -2.24 -1.10 -4.45 114.28 107.62 1yis n THR 444 Ca 0.13 -1.31 0.00 0.00 -2.27 0.00 0.00 64.05 60.60 1yis n THR 444 Cb 0.53 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 1yis n THR 444 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yis n GLY 445 N 0.54 3.08 1.81 3.38 0.00 -1.26 -1.89 105.19 110.86 1yis n GLY 445 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1yis n GLY 445 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yis n ARG 446 N 14.00 3.96 -0.22 1.61 1.74 -1.26 -4.65 116.66 131.84 1yis n ARG 446 Ca 0.00 -2.76 0.01 0.00 -0.77 0.00 0.00 57.85 54.33 1yis n ARG 446 Cb 0.00 -2.15 0.09 0.00 -1.02 0.00 0.00 32.46 29.38 1yis n ARG 446 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yis h VAL 448 N 0.04 0.55 -0.44 0.00 2.07 -1.82 -1.08 116.25 115.56 1yis h VAL 448 Ca 0.33 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.75 1yis h VAL 448 Cb 0.53 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1yis h VAL 448 CO -0.64 0.00 -0.03 0.77 0.02 0.00 0.00 177.57 177.70 1yis h SER 449 N -0.63 0.71 -0.43 0.57 4.64 -1.87 -2.15 113.55 114.39 1yis h SER 449 Ca -0.06 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1yis h SER 449 Cb 0.48 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.36 1yis h SER 449 CO 0.10 0.80 0.26 1.56 -0.87 0.00 0.00 176.83 178.68 1yis h GLN 450 N 0.69 0.59 -0.43 4.77 4.20 -1.08 -0.54 115.11 123.31 1yis h GLN 450 Ca 0.13 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.79 1yis h GLN 450 Cb 0.47 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 1yis h GLN 450 CO 0.02 0.45 0.28 1.15 -0.67 0.00 0.00 178.83 180.06 1yis h THR 451 N 0.57 1.10 -0.07 -0.54 2.02 -0.89 -1.47 112.91 113.63 1yis h THR 451 Ca 0.15 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 1yis h THR 451 Cb 0.01 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 66.90 1yis h THR 451 CO -0.03 0.10 -0.12 -0.33 0.37 0.00 0.00 175.52 175.52 1yis h GLU 452 N 0.57 0.20 -0.60 6.66 5.08 -1.23 -2.76 114.58 122.51 1yis h GLU 452 Ca 0.16 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 1yis h GLU 452 Cb -0.06 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1yis h GLU 452 CO -0.04 0.70 0.12 0.66 -1.00 0.00 0.00 179.01 179.45 1yis h SER 453 N -0.28 0.89 -0.05 1.42 4.64 -1.10 -0.45 113.55 118.62 1yis h SER 453 Ca 0.00 -0.18 -0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1yis h SER 453 Cb 0.68 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1yis h SER 453 CO 0.03 0.87 0.03 0.15 -0.87 0.00 0.00 176.83 177.04 1yis h PHE 454 N 0.89 0.06 -0.00 4.77 3.57 -1.32 0.12 116.94 125.04 1yis h PHE 454 Ca 0.19 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 1yis h PHE 454 Cb 0.35 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.07 1yis h PHE 454 CO 0.02 0.11 0.00 0.82 -2.23 0.00 0.00 178.31 177.03 1yis h ILE 455 N -0.00 1.08 -0.37 1.41 2.04 -1.27 0.11 117.51 120.51 1yis h ILE 455 Ca 0.02 -0.23 -0.10 0.00 1.00 0.00 0.00 64.86 65.54 1yis h ILE 455 Cb 0.06 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 1yis h ILE 455 CO -0.00 0.06 -0.18 0.00 0.00 0.00 0.00 178.15 178.03 1yis h ALA 456 N 0.90 0.52 0.00 1.87 0.00 -1.04 -0.40 119.26 121.11 1yis h ALA 456 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1yis h ALA 456 Cb 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1yis h ALA 456 CO -0.00 0.45 -1.15 1.63 0.00 0.00 0.00 179.25 180.18 1yis n LYS 457 N -4.29 0.19 0.02 0.00 5.02 0.40 -4.42 118.16 115.09 1yis n LYS 457 Ca -0.02 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.23 1yis n LYS 457 Cb 0.41 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1yis n LYS 457 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1yis n GLU 458 N -1.75 0.00 0.25 1.97 4.07 0.24 -4.75 120.64 120.67 1yis n GLU 458 Ca 0.02 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 56.98 1yis n GLU 458 Cb 0.40 -0.38 -0.08 0.00 -0.06 0.00 0.00 31.44 31.31 1yis n GLU 458 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1yis h LEU 459 N 0.00 -0.55 -0.02 4.31 6.46 -1.10 -2.98 115.31 121.44 1yis h LEU 459 Ca 0.00 -0.07 -0.00 0.00 -0.12 0.00 0.00 57.88 57.69 1yis h LEU 459 Cb 0.52 0.14 -0.00 0.00 -0.73 0.00 0.00 40.66 40.60 1yis h LEU 459 CO 0.00 -0.23 0.01 0.11 -0.62 0.00 0.00 178.44 177.71 1yis h LYS 460 N -0.89 0.02 -0.26 1.25 1.57 -1.31 -2.09 116.57 114.87 1yis h LYS 460 Ca -0.07 -0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.78 1yis h LYS 460 Cb 0.59 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 1yis h LYS 460 CO 0.11 0.12 0.22 -1.35 -0.57 0.00 0.00 179.45 177.98 1yis h PRO 461 N -0.08 0.00 0.10 3.15 0.11 -1.77 0.34 132.00 133.86 1yis h PRO 461 Ca 0.01 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.93 1yis h PRO 461 Cb 0.10 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.23 1yis h PRO 461 CO -0.00 0.00 -0.79 1.15 -0.21 0.00 0.00 178.00 178.15 1yis h THR 462 N 0.00 1.48 0.00 -1.15 2.02 -1.30 -3.39 112.91 110.56 1yis h THR 462 Ca 0.12 -2.41 0.00 0.00 0.77 0.00 0.00 66.41 64.89 1yis h THR 462 Cb 0.56 3.01 0.00 0.00 -1.74 0.00 0.00 68.15 69.98 1yis h THR 462 CO -0.00 0.69 -1.74 2.30 0.37 0.00 0.00 175.52 177.14 1yis n ILE 463 N -4.13 0.10 -0.33 3.11 -5.35 -0.82 -4.56 119.36 107.39 1yis n ILE 463 Ca -0.13 -0.46 0.22 0.00 -0.27 0.00 0.00 62.75 62.10 1yis n ILE 463 Cb 0.79 0.02 0.44 0.00 -1.74 0.00 0.00 39.64 39.15 1yis n ILE 463 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1yis h ASP 464 N 0.00 0.42 0.44 7.28 5.19 -0.52 0.20 116.42 129.43 1yis h ASP 464 Ca 0.00 0.19 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 1yis h ASP 464 Cb 0.96 0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.63 1yis h ASP 464 CO 0.00 -0.14 0.00 2.29 -3.12 0.00 0.00 179.24 178.27 1yis n LYS 465 N -5.08 0.01 -0.00 3.56 2.85 -1.26 -2.27 118.16 115.96 1yis n LYS 465 Ca 0.30 0.29 0.08 0.00 -1.05 0.00 0.00 58.31 57.93 1yis n LYS 465 Cb 0.92 -1.52 -0.11 0.00 -0.65 0.00 0.00 35.03 33.68 1yis n LYS 465 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1yis n TYR 466 N -1.53 0.00 -3.28 5.58 4.01 0.70 -4.86 117.16 117.77 1yis n TYR 466 Ca 0.03 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.36 1yis n TYR 466 Cb 0.15 -0.08 -0.08 0.00 -0.31 0.00 0.00 39.34 39.02 1yis n TYR 466 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1yis s LEU 467 N -3.09 4.31 0.00 7.72 1.43 -0.96 -4.75 118.68 123.34 1yis s LEU 467 Ca 0.04 0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.15 1yis s LEU 467 Cb 0.13 -2.53 0.00 0.00 0.03 0.00 0.00 46.19 43.81 1yis s LEU 467 CO 0.71 -0.41 0.00 0.47 0.23 0.00 0.00 176.35 177.35