#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jzq s PHE 2 N 0.00 2.99 0.59 1.12 0.08 -1.26 -4.93 117.98 116.57 1jzq s PHE 2 Ca 0.00 -0.06 -0.18 0.00 0.12 0.00 0.00 56.93 56.81 1jzq s PHE 2 Cb 0.00 -1.48 -0.03 0.00 -0.57 0.00 0.00 43.02 40.94 1jzq s PHE 2 CO 0.00 0.51 1.17 0.21 -0.10 0.00 0.00 175.22 177.00 1jzq s LYS 3 N -2.76 3.02 1.12 0.44 2.20 -1.26 -4.98 119.74 117.53 1jzq s LYS 3 Ca 0.28 1.68 -0.17 0.00 -0.36 0.00 0.00 55.97 57.40 1jzq s LYS 3 Cb -0.10 -1.95 0.14 0.00 -1.51 0.00 0.00 37.83 34.41 1jzq s LYS 3 CO 0.20 -1.13 0.26 -0.85 -0.36 0.00 0.00 175.35 173.47 1jzq n GLU 4 N -1.68 -1.72 0.00 4.03 0.00 -1.26 -5.00 120.64 115.01 1jzq n GLU 4 Ca 0.12 -0.48 0.00 0.00 0.00 0.00 0.00 57.16 56.80 1jzq n GLU 4 Cb 0.50 -1.82 0.00 0.00 0.00 0.00 0.00 31.44 30.13 1jzq n GLU 4 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 1jzq n VAL 5 N -4.51 0.00 0.00 3.84 0.24 -1.26 -5.12 118.33 111.52 1jzq n VAL 5 Ca 0.02 0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.60 1jzq n VAL 5 Cb 0.60 -0.99 0.00 0.00 -1.47 0.00 0.00 33.84 31.98 1jzq n VAL 5 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jzq n GLY 6 N 2.13 1.61 3.57 7.63 0.00 -1.26 -4.99 105.19 113.88 1jzq n GLY 6 Ca 0.00 -1.83 -0.37 0.00 0.00 0.00 0.00 46.02 43.82 1jzq n GLY 6 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jzq n GLU 7 N 1.49 0.62 -1.50 1.61 1.02 -1.26 -4.81 120.64 117.81 1jzq n GLU 7 Ca 0.00 0.26 -0.41 0.00 -0.02 0.00 0.00 57.16 56.98 1jzq n GLU 7 Cb 0.00 -2.06 -0.02 0.00 -0.02 0.00 0.00 31.44 29.34 1jzq n GLU 7 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1jzq n PRO 8 N -1.09 2.50 -2.76 3.49 -0.02 -1.26 -4.82 135.00 131.05 1jzq n PRO 8 Ca 0.13 -2.32 -0.43 0.00 -2.02 0.00 0.00 63.50 58.86 1jzq n PRO 8 Cb 0.49 -3.12 0.00 0.00 -0.02 0.00 0.00 33.50 30.85 1jzq n PRO 8 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1jzq n ASN 9 N 6.24 5.42 -0.14 2.55 2.85 -1.26 -4.88 115.26 126.04 1jzq n ASN 9 Ca 0.53 -3.12 -0.06 0.00 -0.11 0.00 0.00 54.58 51.83 1jzq n ASN 9 Cb 0.37 -1.46 0.01 0.00 1.24 0.00 0.00 39.78 39.94 1jzq n ASN 9 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1jzq h PHE 10 N 6.21 -0.70 -0.99 1.20 -1.00 -1.88 -1.85 116.94 117.93 1jzq h PHE 10 Ca 0.31 0.06 0.22 0.00 2.81 0.00 0.00 57.97 61.36 1jzq h PHE 10 Cb 0.73 0.38 -0.09 0.00 3.61 0.00 0.00 35.95 40.57 1jzq h PHE 10 CO 1.10 -0.34 0.62 -1.35 -1.61 0.00 0.00 178.31 176.74 1jzq h PRO 11 N -0.17 0.54 0.18 1.51 0.11 -1.85 -0.55 132.00 131.77 1jzq h PRO 11 Ca 0.21 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.28 1jzq h PRO 11 Cb 0.50 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.49 1jzq h PRO 11 CO -0.56 0.36 -0.09 0.87 -0.21 0.00 0.00 178.00 178.37 1jzq h LYS 12 N 0.56 -0.23 -0.78 1.05 6.56 -1.78 -3.01 116.57 118.93 1jzq h LYS 12 Ca 0.56 0.02 0.12 0.00 -1.06 0.00 0.00 60.65 60.28 1jzq h LYS 12 Cb 1.16 0.05 -0.13 0.00 -0.57 0.00 0.00 32.23 32.74 1jzq h LYS 12 CO -0.30 0.13 -0.40 -0.07 -2.06 0.00 0.00 179.45 176.74 1jzq h LEU 13 N -0.95 -1.43 -0.72 2.94 3.38 -0.92 0.47 115.31 118.08 1jzq h LEU 13 Ca -0.02 0.27 0.15 0.00 0.09 0.00 0.00 57.88 58.37 1jzq h LEU 13 Cb 0.46 0.70 -0.10 0.00 0.09 0.00 0.00 40.66 41.81 1jzq h LEU 13 CO 0.04 -0.30 0.20 -0.33 0.09 0.00 0.00 178.44 178.14 1jzq h GLU 14 N -0.10 0.30 -0.87 1.13 5.08 -1.21 0.11 114.58 119.02 1jzq h GLU 14 Ca 0.26 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.64 1jzq h GLU 14 Cb 0.56 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.69 1jzq h GLU 14 CO -0.83 0.20 0.55 0.93 -1.00 0.00 0.00 179.01 178.87 1jzq h GLU 15 N 0.31 1.02 0.18 2.33 5.08 0.03 0.28 114.58 123.81 1jzq h GLU 15 Ca 0.40 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.69 1jzq h GLU 15 Cb 0.65 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1jzq h GLU 15 CO -0.46 0.68 -0.09 0.93 -1.00 0.00 0.00 179.01 179.06 1jzq h GLU 16 N 1.05 -0.23 -0.80 2.33 5.08 0.54 -2.16 114.58 120.38 1jzq h GLU 16 Ca 0.36 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.77 1jzq h GLU 16 Cb 0.06 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.32 1jzq h GLU 16 CO -0.14 -0.15 0.51 0.28 -1.00 0.00 0.00 179.01 178.51 1jzq h VAL 17 N -0.25 1.12 -0.77 3.13 2.07 -0.57 -0.98 116.25 120.00 1jzq h VAL 17 Ca -0.02 -0.34 0.09 0.00 0.82 0.00 0.00 66.70 67.25 1jzq h VAL 17 Cb 0.19 0.04 -0.07 0.00 -1.52 0.00 0.00 31.29 29.93 1jzq h VAL 17 CO 0.04 0.18 0.41 0.25 0.02 0.00 0.00 177.57 178.48 1jzq h LEU 18 N 1.00 0.57 -0.26 2.57 5.85 -0.16 0.01 115.31 124.88 1jzq h LEU 18 Ca 0.32 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 59.07 1jzq h LEU 18 Cb 0.01 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1jzq h LEU 18 CO -0.11 0.32 0.07 0.00 -0.34 0.00 0.00 178.44 178.38 1jzq h ALA 19 N 1.44 0.35 -0.67 1.25 0.00 -0.64 -2.24 119.26 118.76 1jzq h ALA 19 Ca 0.37 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 55.25 1jzq h ALA 19 Cb 0.37 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1jzq h ALA 19 CO -0.26 -0.01 0.45 0.35 0.00 0.00 0.00 179.25 179.78 1jzq h PHE 20 N 0.26 0.45 -0.02 0.00 3.04 0.02 -1.02 116.94 119.68 1jzq h PHE 20 Ca 0.08 0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.97 1jzq h PHE 20 Cb 0.27 -0.14 0.01 0.00 2.56 0.00 0.00 35.95 38.64 1jzq h PHE 20 CO 0.01 0.20 -0.30 -1.49 -2.02 0.00 0.00 178.31 174.70 1jzq h TRP 21 N 0.41 0.34 -0.99 0.41 6.55 -0.71 -2.91 115.95 119.05 1jzq h TRP 21 Ca 0.32 -0.17 0.08 0.00 0.95 0.00 0.00 58.89 60.06 1jzq h TRP 21 Cb 0.68 -0.04 -0.07 0.00 -0.86 0.00 0.00 29.16 28.86 1jzq h TRP 21 CO -0.00 0.95 0.64 -0.22 -1.05 0.00 0.00 178.44 178.76 1jzq h LYS 22 N -0.37 1.08 0.00 0.49 3.64 -0.90 -1.58 116.57 118.92 1jzq h LYS 22 Ca -0.03 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1jzq h LYS 22 Cb 1.02 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1jzq h LYS 22 CO 0.06 0.71 0.00 -2.13 -2.27 0.00 0.00 179.45 175.83 1jzq n ARG 23 N -4.52 0.00 0.00 1.90 0.63 -0.43 -3.66 116.66 110.57 1jzq n ARG 23 Ca 0.16 0.27 0.00 0.00 -0.92 0.00 0.00 57.85 57.36 1jzq n ARG 23 Cb 0.23 -1.19 0.00 0.00 0.45 0.00 0.00 32.46 31.95 1jzq n ARG 23 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1jzq n GLU 24 N -1.32 0.96 -4.02 -0.14 1.02 -1.10 -4.89 120.64 111.15 1jzq n GLU 24 Ca 0.00 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.83 1jzq n GLU 24 Cb 0.00 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.00 1jzq n GLU 24 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1jzq n LYS 25 N -0.07 -1.92 -0.23 3.49 5.02 -0.61 -4.88 118.16 118.96 1jzq n LYS 25 Ca 0.00 0.28 -0.03 0.00 -2.02 0.00 0.00 58.31 56.54 1jzq n LYS 25 Cb 0.20 -3.92 0.08 0.00 -0.02 0.00 0.00 35.03 31.36 1jzq n LYS 25 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1jzq h ILE 26 N -1.96 1.05 -0.56 -0.18 5.03 -1.83 -1.83 117.51 117.23 1jzq h ILE 26 Ca -0.66 -0.27 0.02 0.00 -0.12 0.00 0.00 64.86 63.84 1jzq h ILE 26 Cb 1.38 0.21 -0.03 0.00 -3.03 0.00 0.00 36.82 35.35 1jzq h ILE 26 CO 0.61 0.14 0.35 0.15 -0.68 0.00 0.00 178.15 178.72 1jzq h PHE 27 N 0.78 0.65 -0.15 1.37 3.57 -1.91 -1.62 116.94 119.63 1jzq h PHE 27 Ca 0.28 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.70 1jzq h PHE 27 Cb 0.07 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 1jzq h PHE 27 CO -0.05 0.38 -0.34 0.37 -2.23 0.00 0.00 178.31 176.44 1jzq h GLN 28 N 0.69 0.30 0.30 1.11 4.15 -1.88 -3.08 115.11 116.70 1jzq h GLN 28 Ca 0.22 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 1jzq h GLN 28 Cb -0.01 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.67 1jzq h GLN 28 CO -0.08 0.61 -0.14 0.87 -1.93 0.00 0.00 178.83 178.15 1jzq h LYS 29 N 0.26 -0.39 -0.63 1.69 6.56 -0.78 -1.79 116.57 121.50 1jzq h LYS 29 Ca 0.03 0.03 0.25 0.00 -1.06 0.00 0.00 60.65 59.90 1jzq h LYS 29 Cb 0.72 0.09 -0.11 0.00 -0.57 0.00 0.00 32.23 32.36 1jzq h LYS 29 CO 0.06 -0.26 0.30 -1.13 -2.06 0.00 0.00 179.45 176.36 1jzq n SER 30 N -3.24 0.18 -0.03 0.86 3.41 -0.66 0.73 113.62 114.87 1jzq n SER 30 Ca -0.05 1.04 -0.19 0.00 -0.26 0.00 0.00 58.87 59.41 1jzq n SER 30 Cb 0.16 -0.49 -0.13 0.00 -0.26 0.00 0.00 64.21 63.48 1jzq n SER 30 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1jzq h VAL 31 N 0.00 1.32 0.00 -3.33 2.07 -1.53 -3.31 116.25 111.47 1jzq h VAL 31 Ca 0.51 -2.37 -0.00 0.00 0.82 0.00 0.00 66.70 65.66 1jzq h VAL 31 Cb 1.34 2.91 -0.00 0.00 -1.52 0.00 0.00 31.29 34.02 1jzq h VAL 31 CO -0.50 0.61 -0.02 -0.08 0.02 0.00 0.00 177.57 177.60 1jzq h GLU 32 N -0.64 0.00 0.00 1.57 4.81 0.71 -1.83 114.58 119.21 1jzq h GLU 32 Ca -0.20 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.97 1jzq h GLU 32 Cb 1.45 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.82 1jzq h GLU 32 CO 0.01 0.02 -0.28 -0.91 -0.73 0.00 0.00 179.01 177.12 1jzq h ASN 33 N 0.00 0.00 -0.38 1.04 4.21 0.22 -3.27 115.58 117.40 1jzq h ASN 33 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1jzq h ASN 33 Cb 0.10 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.30 1jzq h ASN 33 CO 0.00 0.28 0.00 0.54 -1.29 0.00 0.00 177.43 176.97 1jzq n ARG 34 N -3.34 3.42 -1.42 0.81 5.12 -0.69 -5.02 116.66 115.55 1jzq n ARG 34 Ca 0.01 -2.83 -0.35 0.00 -1.93 0.00 0.00 57.85 52.75 1jzq n ARG 34 Cb 0.51 -1.87 0.10 0.00 -1.16 0.00 0.00 32.46 30.04 1jzq n ARG 34 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1jzq n LYS 35 N 0.01 0.65 -0.16 5.56 3.00 -1.23 -1.74 118.16 124.24 1jzq n LYS 35 Ca 0.22 0.29 0.00 0.00 -0.00 0.00 0.00 58.31 58.82 1jzq n LYS 35 Cb 0.90 -2.45 0.00 0.00 0.00 0.00 0.00 35.03 33.49 1jzq n LYS 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1jzq n GLY 36 N 0.80 2.14 3.77 3.14 0.00 -1.26 -4.99 105.19 108.78 1jzq n GLY 36 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 1jzq n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jzq n GLY 37 N -2.00 0.34 3.68 -0.02 0.00 -0.71 -5.03 105.19 101.46 1jzq n GLY 37 Ca 0.00 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 1jzq n GLY 37 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jzq s PRO 38 N -5.14 4.21 0.51 1.61 0.04 -1.23 -4.46 135.00 130.53 1jzq s PRO 38 Ca 0.66 2.25 -0.22 0.00 0.04 0.00 0.00 61.00 63.73 1jzq s PRO 38 Cb -0.03 -3.67 -0.06 0.00 0.04 0.00 0.00 34.50 30.78 1jzq s PRO 38 CO 0.44 -0.73 1.31 0.50 0.04 0.00 0.00 177.00 178.55 1jzq s ARG 39 N 2.87 3.38 -0.36 4.56 6.06 -1.26 -0.80 118.95 133.39 1jzq s ARG 39 Ca 0.72 2.11 0.01 0.00 -2.50 0.00 0.00 55.73 56.08 1jzq s ARG 39 Cb -0.37 -2.34 0.15 0.00 0.06 0.00 0.00 34.95 32.44 1jzq s ARG 39 CO 0.31 -0.96 0.27 -0.47 -2.50 0.00 0.00 175.30 171.94 1jzq s TYR 40 N -1.36 0.48 -0.10 5.12 5.04 -0.88 -4.78 117.35 120.86 1jzq s TYR 40 Ca 0.68 -1.49 -0.19 0.00 -2.44 0.00 0.00 57.07 53.63 1jzq s TYR 40 Cb -0.37 -0.77 -0.04 0.00 0.35 0.00 0.00 41.96 41.12 1jzq s TYR 40 CO 0.45 -0.87 0.53 -0.08 -1.34 0.00 0.00 175.55 174.24 1jzq s THR 41 N 1.06 5.14 0.02 4.34 -1.32 -1.26 -4.42 115.64 119.21 1jzq s THR 41 Ca 0.19 1.07 0.08 0.00 -1.21 0.00 0.00 61.69 61.82 1jzq s THR 41 Cb -0.19 -3.87 -0.03 0.00 -1.51 0.00 0.00 72.50 66.91 1jzq s THR 41 CO -0.02 0.32 -0.24 -0.69 -2.21 0.00 0.00 174.62 171.78 1jzq s VAL 42 N 0.60 2.31 0.11 5.08 1.01 -1.26 -0.24 120.40 128.00 1jzq s VAL 42 Ca 0.29 -1.24 0.08 0.00 0.00 0.00 0.00 61.98 61.11 1jzq s VAL 42 Cb -0.16 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1jzq s VAL 42 CO 0.12 0.43 -0.15 -0.31 0.00 0.00 0.00 175.10 175.19 1jzq s TYR 43 N -0.78 2.62 -0.06 5.22 2.02 -1.09 -4.83 117.35 120.45 1jzq s TYR 43 Ca 0.12 -0.22 0.05 0.00 -0.37 0.00 0.00 57.07 56.66 1jzq s TYR 43 Cb -0.10 -1.39 -0.01 0.00 -0.40 0.00 0.00 41.96 40.06 1jzq s TYR 43 CO 0.02 0.39 -0.23 -2.00 -1.57 0.00 0.00 175.55 172.17 1jzq s GLU 44 N -2.11 2.34 -0.35 -0.62 2.12 -1.26 -4.58 118.70 114.24 1jzq s GLU 44 Ca 0.19 -0.81 -0.29 0.00 0.36 0.00 0.00 54.97 54.42 1jzq s GLU 44 Cb -0.11 -1.98 -0.01 0.00 0.26 0.00 0.00 34.13 32.29 1jzq s GLU 44 CO 0.11 0.33 1.65 0.20 -0.54 0.00 0.00 175.26 177.01 1jzq s GLY 45 N -0.07 0.93 -0.23 -1.50 0.00 -1.26 -4.90 107.32 100.28 1jzq s GLY 45 Ca -0.04 0.13 -0.30 0.00 0.00 0.00 0.00 44.72 44.50 1jzq s GLY 45 CO 0.03 3.08 2.19 -1.55 0.00 0.00 0.00 173.10 176.85 1jzq n PRO 46 N 8.26 1.78 -2.07 2.90 -0.04 -1.26 -4.97 135.00 139.60 1jzq n PRO 46 Ca 0.20 0.51 -0.28 0.00 -0.04 0.00 0.00 63.50 63.88 1jzq n PRO 46 Cb 0.47 -3.00 0.17 0.00 -0.04 0.00 0.00 33.50 31.10 1jzq n PRO 46 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1jzq s PRO 47 N 6.14 0.84 -0.08 0.54 0.04 -1.25 -3.39 135.00 137.84 1jzq s PRO 47 Ca 1.02 -0.57 0.02 0.00 0.04 0.00 0.00 61.00 61.52 1jzq s PRO 47 Cb -0.49 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.12 1jzq s PRO 47 CO 0.40 -2.22 -0.14 0.99 0.04 0.00 0.00 177.00 176.06 1jzq s THR 48 N -3.74 1.34 -0.16 1.26 2.01 -1.26 -0.35 115.64 114.74 1jzq s THR 48 Ca 0.73 -0.58 -0.00 0.00 0.31 0.00 0.00 61.69 62.15 1jzq s THR 48 Cb -0.04 -1.22 0.14 0.00 0.01 0.00 0.00 72.50 71.39 1jzq s THR 48 CO 0.51 0.40 1.76 0.00 -0.69 0.00 0.00 174.62 176.60 1jzq n ALA 49 N 3.95 4.20 1.01 7.40 0.00 -1.17 -3.37 120.51 132.54 1jzq n ALA 49 Ca -0.21 -0.88 0.11 0.00 0.00 0.00 0.00 53.44 52.47 1jzq n ALA 49 Cb 0.52 -1.18 0.01 0.00 0.00 0.00 0.00 19.45 18.80 1jzq n ALA 49 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1jzq n ASN 50 N 0.59 2.02 -3.78 0.00 2.04 -1.14 -1.92 115.26 113.08 1jzq n ASN 50 Ca 0.17 -1.51 -0.22 0.00 -0.44 0.00 0.00 54.58 52.58 1jzq n ASN 50 Cb 0.63 0.46 -0.08 0.00 -2.53 0.00 0.00 39.78 38.26 1jzq n ASN 50 CO 0.00 0.00 0.00 -0.83 -0.44 0.00 0.00 177.26 175.99 1jzq s GLY 51 N -2.47 2.39 0.15 4.83 0.00 -1.22 -4.96 107.32 106.04 1jzq s GLY 51 Ca 0.19 -1.67 0.05 0.00 0.00 0.00 0.00 44.72 43.29 1jzq s GLY 51 CO 0.57 -1.63 0.09 1.08 0.00 0.00 0.00 173.10 173.20 1jzq s LEU 52 N -3.46 3.68 1.06 0.66 1.43 -1.26 -4.87 118.68 115.91 1jzq s LEU 52 Ca 0.33 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 53.14 1jzq s LEU 52 Cb 0.03 -2.32 0.21 0.00 0.03 0.00 0.00 46.19 44.15 1jzq s LEU 52 CO 0.20 0.10 1.00 -2.65 0.23 0.00 0.00 176.35 175.23 1jzq n PRO 53 N -0.11 -1.53 -3.50 1.29 -0.02 -1.26 -5.07 135.00 124.81 1jzq n PRO 53 Ca -0.09 -0.40 -0.15 0.00 -2.02 0.00 0.00 63.50 60.84 1jzq n PRO 53 Cb 0.54 -2.22 -0.05 0.00 -0.02 0.00 0.00 33.50 31.75 1jzq n PRO 53 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1jzq s HIS 54 N -2.49 -0.58 0.40 6.00 -3.43 -1.26 -4.89 115.29 109.03 1jzq s HIS 54 Ca 0.67 0.80 -0.23 0.00 -0.80 0.00 0.00 55.06 55.50 1jzq s HIS 54 Cb -0.24 0.46 -0.12 0.00 -1.43 0.00 0.00 32.58 31.25 1jzq s HIS 54 CO 0.62 -0.65 0.66 1.33 -2.00 0.00 0.00 174.74 174.70 1jzq n VAL 55 N 0.46 1.93 0.00 -5.38 0.24 -1.26 0.10 118.33 114.42 1jzq n VAL 55 Ca -0.17 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.63 1jzq n VAL 55 Cb 0.60 -0.65 0.00 0.00 -1.47 0.00 0.00 33.84 32.31 1jzq n VAL 55 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jzq n GLY 56 N 1.65 2.68 0.12 7.63 0.00 -1.26 -4.62 105.19 111.40 1jzq n GLY 56 Ca 0.11 -0.22 -0.18 0.00 0.00 0.00 0.00 46.02 45.74 1jzq n GLY 56 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1jzq h HIS 57 N 0.00 0.47 -0.22 1.61 -0.00 0.29 -2.37 115.15 114.94 1jzq h HIS 57 Ca 0.00 -0.35 -0.20 0.00 -0.00 0.00 0.00 60.37 59.82 1jzq h HIS 57 Cb 0.00 -0.02 0.01 0.00 -0.00 0.00 0.00 27.41 27.40 1jzq h HIS 57 CO 0.00 1.47 -0.64 0.00 -0.00 0.00 0.00 177.93 178.76 1jzq h ALA 58 N 0.40 0.37 0.19 2.45 0.00 -1.80 -2.26 119.26 118.61 1jzq h ALA 58 Ca -0.29 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.06 1jzq h ALA 58 Cb 2.04 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.78 1jzq h ALA 58 CO 0.15 0.65 -0.13 0.37 0.00 0.00 0.00 179.25 180.28 1jzq h GLN 59 N 0.57 -0.32 -0.06 0.00 4.15 -1.86 0.43 115.11 118.03 1jzq h GLN 59 Ca -0.02 0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.46 1jzq h GLN 59 Cb 1.26 0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.98 1jzq h GLN 59 CO 0.14 -0.21 -0.18 0.00 -1.93 0.00 0.00 178.83 176.64 1jzq h ALA 60 N 0.46 -0.18 -0.88 3.38 0.00 -1.47 -2.71 119.26 117.87 1jzq h ALA 60 Ca -0.01 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1jzq h ALA 60 Cb 0.28 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 1jzq h ALA 60 CO 0.00 -0.66 0.57 0.00 0.00 0.00 0.00 179.25 179.16 1jzq h ARG 61 N -0.27 0.88 -0.37 0.00 -0.00 -0.97 -0.66 114.38 112.99 1jzq h ARG 61 Ca 0.07 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.98 59.48 1jzq h ARG 61 Cb 0.37 -0.20 -0.02 0.00 0.00 0.00 0.00 29.97 30.12 1jzq h ARG 61 CO -0.21 0.58 0.15 0.77 0.00 0.00 0.00 179.97 181.26 1jzq h SER 62 N 0.90 0.46 0.02 7.04 0.02 0.18 -1.25 113.55 120.93 1jzq h SER 62 Ca 0.40 -0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 61.23 1jzq h SER 62 Cb 0.35 -0.12 0.01 0.00 0.14 0.00 0.00 62.40 62.78 1jzq h SER 62 CO -0.16 0.42 -0.31 1.88 -1.14 0.00 0.00 176.83 177.52 1jzq h TYR 63 N 0.52 0.27 0.00 3.45 0.99 -1.12 -2.65 116.97 118.43 1jzq h TYR 63 Ca 0.13 -0.16 0.00 0.00 2.00 0.00 0.00 58.73 60.70 1jzq h TYR 63 Cb 0.10 -0.02 0.00 0.00 1.00 0.00 0.00 36.73 37.81 1jzq h TYR 63 CO 0.00 1.02 0.00 -0.22 -0.00 0.00 0.00 178.16 178.96 1jzq h LYS 64 N -0.56 0.00 0.00 4.88 3.11 -0.97 -3.18 116.57 119.85 1jzq h LYS 64 Ca -0.05 0.00 -0.23 0.00 -2.81 0.00 0.00 60.65 57.56 1jzq h LYS 64 Cb 1.12 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.32 1jzq h LYS 64 CO 0.06 0.00 -1.54 -3.47 -2.81 0.00 0.00 179.45 171.69 1jzq n ASP 65 N -2.60 1.90 -0.42 4.20 -0.08 -0.49 -4.46 116.55 114.60 1jzq n ASP 65 Ca -0.00 0.41 0.34 0.00 -1.51 0.00 0.00 54.79 54.03 1jzq n ASP 65 Cb 0.15 -0.86 0.62 0.00 2.34 0.00 0.00 41.12 43.38 1jzq n ASP 65 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1jzq h LEU 66 N -1.00 0.29 0.11 -2.67 5.85 -1.45 -2.63 115.31 113.81 1jzq h LEU 66 Ca -0.35 0.15 -0.16 0.00 0.84 0.00 0.00 57.88 58.36 1jzq h LEU 66 Cb 1.22 0.13 0.01 0.00 0.37 0.00 0.00 40.66 42.39 1jzq h LEU 66 CO -0.21 -0.18 -0.74 -0.26 -0.34 0.00 0.00 178.44 176.71 1jzq h PHE 67 N 0.12 0.41 -0.29 1.25 -1.00 -1.80 -3.03 116.94 112.60 1jzq h PHE 67 Ca 0.80 -0.30 0.04 0.00 2.81 0.00 0.00 57.97 61.31 1jzq h PHE 67 Cb 2.39 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 41.91 1jzq h PHE 67 CO -0.01 1.29 0.20 -1.35 -1.61 0.00 0.00 178.31 176.83 1jzq h PRO 68 N -0.50 0.23 0.14 1.51 0.11 -1.69 0.62 132.00 132.41 1jzq h PRO 68 Ca -0.14 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.95 1jzq h PRO 68 Cb 1.53 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.59 1jzq h PRO 68 CO 0.10 0.15 -0.07 0.00 -0.21 0.00 0.00 178.00 177.97 1jzq h ARG 69 N 0.23 -0.18 -1.00 1.05 3.08 -1.61 0.09 114.38 116.04 1jzq h ARG 69 Ca 0.13 0.01 0.32 0.00 0.07 0.00 0.00 59.98 60.51 1jzq h ARG 69 Cb 0.21 0.04 -0.18 0.00 0.08 0.00 0.00 29.97 30.12 1jzq h ARG 69 CO -0.02 -0.12 0.21 -0.92 -1.07 0.00 0.00 179.97 178.04 1jzq h TYR 70 N -0.22 0.26 -0.46 3.04 3.20 -1.25 0.41 116.97 121.94 1jzq h TYR 70 Ca -0.02 0.06 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 1jzq h TYR 70 Cb 0.15 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1jzq h TYR 70 CO 0.15 -0.45 -0.04 -0.22 -1.64 0.00 0.00 178.16 175.96 1jzq h LYS 71 N 0.01 0.78 0.00 1.82 1.63 0.36 -2.84 116.57 118.33 1jzq h LYS 71 Ca 0.69 -0.23 -0.19 0.00 -0.85 0.00 0.00 60.65 60.07 1jzq h LYS 71 Cb 1.59 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 33.13 1jzq h LYS 71 CO -0.87 0.81 -0.86 1.79 -3.45 0.00 0.00 179.45 176.87 1jzq h THR 72 N 0.72 1.50 0.00 1.00 1.35 0.18 -2.22 112.91 115.45 1jzq h THR 72 Ca 0.13 -2.62 0.00 0.00 -0.55 0.00 0.00 66.41 63.38 1jzq h THR 72 Cb 0.50 2.45 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 1jzq h THR 72 CO 0.03 0.76 0.00 0.23 -0.25 0.00 0.00 175.52 176.29 1jzq n MET 73 N -3.65 0.02 -0.62 4.72 2.81 -0.41 -0.97 117.12 119.02 1jzq n MET 73 Ca -0.03 0.34 0.03 0.00 -1.81 0.00 0.00 57.70 56.23 1jzq n MET 73 Cb 0.80 -1.50 0.20 0.00 -0.71 0.00 0.00 33.22 32.01 1jzq n MET 73 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1jzq n ARG 74 N -1.36 1.67 -1.30 0.03 1.74 -0.87 0.11 116.66 116.69 1jzq n ARG 74 Ca 0.01 -3.21 -0.06 0.00 -0.77 0.00 0.00 57.85 53.82 1jzq n ARG 74 Cb 0.02 -1.68 -0.02 0.00 -1.02 0.00 0.00 32.46 29.76 1jzq n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jzq n GLY 75 N -1.13 0.75 3.85 -0.13 0.00 -0.14 -5.01 105.19 103.38 1jzq n GLY 75 Ca 0.23 -0.76 -0.38 0.00 0.00 0.00 0.00 46.02 45.11 1jzq n GLY 75 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jzq s TYR 76 N -2.23 3.67 -0.81 1.61 1.51 -0.98 -3.53 117.35 116.58 1jzq s TYR 76 Ca 0.00 0.79 -0.25 0.00 -1.01 0.00 0.00 57.07 56.60 1jzq s TYR 76 Cb 0.00 -2.15 0.04 0.00 -0.11 0.00 0.00 41.96 39.75 1jzq s TYR 76 CO 0.00 0.67 1.29 -0.47 -1.11 0.00 0.00 175.55 175.93 1jzq s TYR 77 N -1.00 2.41 -1.02 2.71 5.04 0.02 -4.30 117.35 121.21 1jzq s TYR 77 Ca 0.20 -0.35 -0.04 0.00 -2.44 0.00 0.00 57.07 54.43 1jzq s TYR 77 Cb -0.15 -4.60 0.28 0.00 0.35 0.00 0.00 41.96 37.84 1jzq s TYR 77 CO 0.09 -1.98 1.19 0.00 -1.34 0.00 0.00 175.55 173.51 1jzq n ALA 78 N 8.99 4.56 -1.77 3.97 0.00 -1.26 -2.08 120.51 132.93 1jzq n ALA 78 Ca 0.11 -4.73 -0.40 0.00 0.00 0.00 0.00 53.44 48.42 1jzq n ALA 78 Cb 0.49 -2.13 -0.02 0.00 0.00 0.00 0.00 19.45 17.79 1jzq n ALA 78 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1jzq s PRO 79 N -2.09 4.30 -0.10 0.00 0.02 -1.26 -4.99 135.00 130.87 1jzq s PRO 79 Ca 0.31 2.10 0.01 0.00 0.02 0.00 0.00 61.00 63.44 1jzq s PRO 79 Cb -0.00 -2.99 0.02 0.00 0.02 0.00 0.00 34.50 31.55 1jzq s PRO 79 CO 0.00 -0.20 -0.11 1.03 -0.33 0.00 0.00 177.00 177.40 1jzq s ARG 80 N -1.88 1.78 0.28 5.54 3.00 -1.26 -4.59 118.95 121.83 1jzq s ARG 80 Ca 0.51 -0.39 0.10 0.00 0.00 0.00 0.00 55.73 55.95 1jzq s ARG 80 Cb -0.37 -1.64 -0.05 0.00 0.00 0.00 0.00 34.95 32.88 1jzq s ARG 80 CO 0.49 -0.14 -0.15 0.50 0.00 0.00 0.00 175.30 175.99 1jzq s ARG 81 N 1.25 1.65 0.42 3.54 3.52 -1.26 -1.91 118.95 126.15 1jzq s ARG 81 Ca -0.03 -1.79 0.04 0.00 -0.13 0.00 0.00 55.73 53.83 1jzq s ARG 81 Cb -0.14 -1.60 -0.05 0.00 -1.56 0.00 0.00 34.95 31.60 1jzq s ARG 81 CO -0.04 0.23 0.03 0.00 -0.81 0.00 0.00 175.30 174.72 1jzq s ALA 82 N -2.65 3.20 0.11 6.12 0.00 -1.19 -4.79 121.76 122.55 1jzq s ALA 82 Ca 0.29 -1.67 -0.26 0.00 0.00 0.00 0.00 51.96 50.33 1jzq s ALA 82 Cb -0.02 0.31 0.08 0.00 0.00 0.00 0.00 23.12 23.49 1jzq s ALA 82 CO 0.14 -0.16 1.01 0.20 0.00 0.00 0.00 175.76 176.95 1jzq s GLY 83 N -3.69 -0.28 0.10 0.00 0.00 -1.26 -0.39 107.32 101.79 1jzq s GLY 83 Ca 0.27 0.32 0.06 0.00 0.00 0.00 0.00 44.72 45.37 1jzq s GLY 83 CO 0.13 0.06 -0.15 -0.98 0.00 0.00 0.00 173.10 172.16 1jzq s TRP 84 N -3.11 1.38 -0.54 1.90 0.52 -0.46 -3.90 118.94 114.73 1jzq s TRP 84 Ca 0.12 -0.49 -0.17 0.00 0.02 0.00 0.00 56.10 55.58 1jzq s TRP 84 Cb -0.00 -0.75 0.10 0.00 -1.15 0.00 0.00 33.47 31.67 1jzq s TRP 84 CO 0.00 0.12 0.56 0.34 0.02 0.00 0.00 176.95 177.99 1jzq s ASP 85 N -2.04 6.18 0.00 2.95 -1.08 0.52 -2.45 116.67 120.76 1jzq s ASP 85 Ca 0.04 -1.46 0.19 0.00 -0.52 0.00 0.00 52.55 50.79 1jzq s ASP 85 Cb -0.08 -2.25 -0.02 0.00 -1.46 0.00 0.00 42.92 39.12 1jzq s ASP 85 CO 0.03 -0.91 0.95 0.35 0.52 0.00 0.00 175.17 176.11 1jzq n THR 86 N 5.39 0.00 -3.72 1.71 -2.24 -1.26 -4.45 114.28 109.72 1jzq n THR 86 Ca -0.11 -0.29 -0.23 0.00 -2.27 0.00 0.00 64.05 61.14 1jzq n THR 86 Cb 0.42 1.21 -0.02 0.00 -2.10 0.00 0.00 70.33 69.84 1jzq n THR 86 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1jzq s HIS 87 N -2.18 2.13 0.00 4.78 3.76 -1.26 -4.91 115.29 117.60 1jzq s HIS 87 Ca 0.15 -0.67 0.00 0.00 -0.15 0.00 0.00 55.06 54.39 1jzq s HIS 87 Cb 0.15 -2.04 0.00 0.00 1.11 0.00 0.00 32.58 31.80 1jzq s HIS 87 CO 0.49 -0.33 0.00 0.41 -0.85 0.00 0.00 174.74 174.46 1jzq n GLY 88 N -1.67 -1.60 0.32 -2.22 0.00 0.23 -4.43 105.19 95.82 1jzq n GLY 88 Ca 0.02 -1.55 0.17 0.00 0.00 0.00 0.00 46.02 44.66 1jzq n GLY 88 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1jzq h LEU 89 N 0.00 0.23 -1.81 0.99 3.38 -1.97 0.64 115.31 116.78 1jzq h LEU 89 Ca 0.00 0.19 0.18 0.00 0.09 0.00 0.00 57.88 58.34 1jzq h LEU 89 Cb 0.00 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1jzq h LEU 89 CO 0.00 -0.12 0.50 -0.65 0.09 0.00 0.00 178.44 178.26 1jzq h PRO 90 N 0.29 0.17 0.00 1.13 0.11 -1.98 -0.18 132.00 131.55 1jzq h PRO 90 Ca 0.61 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.66 1jzq h PRO 90 Cb 1.28 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1jzq h PRO 90 CO -0.62 0.11 -0.41 0.28 -0.21 0.00 0.00 178.00 177.16 1jzq h VAL 91 N 0.18 0.73 -1.03 3.15 2.07 -0.06 -3.36 116.25 117.93 1jzq h VAL 91 Ca 0.35 -1.66 0.28 0.00 0.82 0.00 0.00 66.70 66.49 1jzq h VAL 91 Cb 1.13 1.49 -0.13 0.00 -1.52 0.00 0.00 31.29 32.26 1jzq h VAL 91 CO -0.06 0.25 0.62 -0.33 0.02 0.00 0.00 177.57 178.06 1jzq h GLU 92 N -1.00 0.43 0.00 1.57 5.08 -0.28 -0.03 114.58 120.35 1jzq h GLU 92 Ca -0.08 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.20 1jzq h GLU 92 Cb 0.70 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1jzq h GLU 92 CO -0.05 0.28 -0.22 -0.07 -1.00 0.00 0.00 179.01 177.95 1jzq h LEU 93 N 0.44 0.00 0.04 1.33 4.07 -1.22 -0.35 115.31 119.63 1jzq h LEU 93 Ca 0.67 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 58.48 1jzq h LEU 93 Cb 1.49 0.00 0.01 0.00 1.08 0.00 0.00 40.66 43.24 1jzq h LEU 93 CO -0.48 0.22 -0.63 -0.33 -1.08 0.00 0.00 178.44 176.14 1jzq h GLU 94 N 0.00 0.36 -0.02 1.13 4.39 -1.15 -2.38 114.58 116.92 1jzq h GLU 94 Ca -0.00 -0.44 -0.08 0.00 0.34 0.00 0.00 59.36 59.18 1jzq h GLU 94 Cb 0.85 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.63 1jzq h GLU 94 CO 0.03 1.13 -0.36 0.28 -1.16 0.00 0.00 179.01 178.93 1jzq h VAL 95 N -0.20 1.27 -0.50 3.13 2.07 -1.45 -2.64 116.25 117.92 1jzq h VAL 95 Ca -0.09 -1.28 -0.05 0.00 0.82 0.00 0.00 66.70 66.11 1jzq h VAL 95 Cb 1.38 1.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 1jzq h VAL 95 CO 0.12 0.37 0.14 -0.08 0.02 0.00 0.00 177.57 178.14 1jzq h GLU 96 N 0.04 0.79 0.00 1.57 4.81 -1.01 -2.61 114.58 118.18 1jzq h GLU 96 Ca 0.00 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 1jzq h GLU 96 Cb 0.66 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1jzq h GLU 96 CO 0.05 0.75 0.00 1.63 -0.73 0.00 0.00 179.01 180.71 1jzq n LYS 97 N -4.47 0.00 -0.08 1.92 5.02 -0.90 -1.46 118.16 118.18 1jzq n LYS 97 Ca 0.01 0.14 -0.11 0.00 -2.02 0.00 0.00 58.31 56.33 1jzq n LYS 97 Cb 0.21 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.66 1jzq n LYS 97 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1jzq h LYS 98 N 0.00 0.00 0.00 1.97 1.57 -1.26 -3.35 116.57 115.50 1jzq h LYS 98 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1jzq h LYS 98 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1jzq h LYS 98 CO 0.00 0.43 0.00 1.28 -0.57 0.00 0.00 179.45 180.59 1jzq n LEU 99 N -4.56 0.00 -2.69 2.94 4.77 -1.01 -4.85 117.00 111.60 1jzq n LEU 99 Ca -0.17 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.60 1jzq n LEU 99 Cb 0.42 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.52 1jzq n LEU 99 CO 0.14 0.00 -0.11 0.61 -1.33 0.00 0.00 177.39 176.70 1jzq n GLY 100 N 0.14 -0.49 3.86 -0.72 0.00 -1.09 -5.00 105.19 101.90 1jzq n GLY 100 Ca 0.06 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1jzq n GLY 100 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzq s LEU 101 N -6.27 4.19 0.00 0.99 1.02 -0.54 -5.01 118.68 113.07 1jzq s LEU 101 Ca 0.17 1.06 0.00 0.00 0.02 0.00 0.00 54.13 55.37 1jzq s LEU 101 Cb -0.07 -3.68 0.00 0.00 0.02 0.00 0.00 46.19 42.46 1jzq s LEU 101 CO 0.21 -0.06 0.03 0.29 0.02 0.00 0.00 176.35 176.84 1jzq n LYS 102 N 0.05 3.95 -3.69 1.70 5.02 -1.26 -4.60 118.16 119.34 1jzq n LYS 102 Ca -0.00 -0.03 -0.12 0.00 -2.02 0.00 0.00 58.31 56.13 1jzq n LYS 102 Cb 0.52 -0.37 -0.07 0.00 -0.02 0.00 0.00 35.03 35.10 1jzq n LYS 102 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1jzq s SER 103 N -0.57 -0.24 0.42 4.39 1.04 -1.26 -4.99 113.70 112.49 1jzq s SER 103 Ca 0.00 -0.07 0.17 0.00 0.48 0.00 0.00 55.95 56.53 1jzq s SER 103 Cb 0.00 0.41 1.08 0.00 0.10 0.00 0.00 66.02 67.61 1jzq s SER 103 CO 0.00 -0.66 1.87 0.11 0.98 0.00 0.00 173.24 175.54 1jzq h LYS 104 N 3.04 0.39 0.00 4.02 1.57 -1.89 0.88 116.57 124.58 1jzq h LYS 104 Ca -0.31 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.36 1jzq h LYS 104 Cb 1.21 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 1jzq h LYS 104 CO 0.44 0.26 -0.37 0.07 -0.57 0.00 0.00 179.45 179.28 1jzq h ARG 105 N 0.41 0.00 0.11 3.15 0.11 -1.97 -1.53 114.38 114.65 1jzq h ARG 105 Ca 0.44 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.51 1jzq h ARG 105 Cb 1.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.16 1jzq h ARG 105 CO -0.16 0.37 -0.05 0.93 0.10 0.00 0.00 179.97 181.16 1jzq h GLU 106 N 0.00 -0.14 -0.67 0.08 5.08 -1.26 -1.25 114.58 116.42 1jzq h GLU 106 Ca -0.00 0.01 0.14 0.00 -1.00 0.00 0.00 59.36 58.51 1jzq h GLU 106 Cb 0.68 0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.84 1jzq h GLU 106 CO 0.05 0.32 -0.06 0.82 -1.00 0.00 0.00 179.01 179.14 1jzq h ILE 107 N -0.67 0.39 -0.77 3.13 5.03 -1.20 0.61 117.51 124.03 1jzq h ILE 107 Ca -0.01 -0.02 0.00 0.00 -0.12 0.00 0.00 64.86 64.71 1jzq h ILE 107 Cb 0.52 0.32 -0.04 0.00 -3.03 0.00 0.00 36.82 34.59 1jzq h ILE 107 CO 0.02 0.01 0.49 -0.33 -0.68 0.00 0.00 178.15 177.66 1jzq h GLU 108 N 0.06 1.03 0.63 2.37 5.08 -1.21 -0.97 114.58 121.56 1jzq h GLU 108 Ca 0.35 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.60 1jzq h GLU 108 Cb 0.57 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.60 1jzq h GLU 108 CO -0.63 0.70 -0.30 0.00 -1.00 0.00 0.00 179.01 177.78 1jzq h ALA 109 N 1.49 -0.84 -0.17 3.43 0.00 0.13 -1.43 119.26 121.87 1jzq h ALA 109 Ca 0.28 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1jzq h ALA 109 Cb -0.08 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1jzq h ALA 109 CO -0.06 -0.96 0.35 -0.92 0.00 0.00 0.00 179.25 177.66 1jzq h TYR 110 N -0.87 0.00 0.00 0.00 3.20 -0.01 -3.47 116.97 115.82 1jzq h TYR 110 Ca -0.09 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.78 1jzq h TYR 110 Cb 0.66 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.93 1jzq h TYR 110 CO -0.02 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.91 1jzq n GLY 111 N -1.33 2.22 0.19 1.82 0.00 -0.41 -4.73 105.19 102.94 1jzq n GLY 111 Ca 0.02 -1.52 -0.07 0.00 0.00 0.00 0.00 46.02 44.45 1jzq n GLY 111 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1jzq h ILE 112 N 0.00 0.00 -0.99 -0.61 2.04 -1.76 -2.16 117.51 114.02 1jzq h ILE 112 Ca 0.00 -0.31 0.24 0.00 1.00 0.00 0.00 64.86 65.79 1jzq h ILE 112 Cb 0.00 0.00 -0.19 0.00 -0.74 0.00 0.00 36.82 35.89 1jzq h ILE 112 CO 0.00 0.00 -0.11 1.21 0.00 0.00 0.00 178.15 179.25 1jzq n GLU 113 N -4.06 -0.08 0.22 2.37 2.13 -1.26 0.15 120.64 120.10 1jzq n GLU 113 Ca -0.06 1.52 -0.15 0.00 0.66 0.00 0.00 57.16 59.13 1jzq n GLU 113 Cb 0.18 -2.34 -0.08 0.00 0.27 0.00 0.00 31.44 29.46 1jzq n GLU 113 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1jzq h ARG 114 N 0.00 -0.47 -0.50 5.31 2.47 -1.86 -2.15 114.38 117.18 1jzq h ARG 114 Ca 0.54 0.03 0.10 0.00 -1.26 0.00 0.00 59.98 59.39 1jzq h ARG 114 Cb 0.99 0.11 -0.08 0.00 -1.65 0.00 0.00 29.97 29.34 1jzq h ARG 114 CO -0.98 -0.31 0.01 0.35 0.56 0.00 0.00 179.97 179.60 1jzq h PHE 115 N -0.50 -0.02 -0.75 3.04 3.57 0.39 -1.76 116.94 120.92 1jzq h PHE 115 Ca -0.05 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.49 1jzq h PHE 115 Cb 0.38 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 1jzq h PHE 115 CO -0.05 -0.11 0.49 -0.91 -2.23 0.00 0.00 178.31 175.51 1jzq h ASN 116 N 0.12 0.86 -0.90 0.41 2.35 -0.98 -2.09 115.58 115.35 1jzq h ASN 116 Ca 0.25 -0.02 0.10 0.00 -0.55 0.00 0.00 56.30 56.08 1jzq h ASN 116 Cb 0.38 -0.21 -0.07 0.00 0.05 0.00 0.00 38.32 38.47 1jzq h ASN 116 CO -0.41 0.62 0.58 1.56 -1.65 0.00 0.00 177.43 178.13 1jzq h GLN 117 N 1.01 0.86 -0.07 0.81 4.20 -0.65 0.80 115.11 122.08 1jzq h GLN 117 Ca 0.27 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.82 1jzq h GLN 117 Cb -0.12 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.46 1jzq h GLN 117 CO -0.06 0.57 -0.48 0.00 -0.67 0.00 0.00 178.83 178.19 1jzq h ALA 118 N 1.55 1.07 0.01 3.87 0.00 -0.93 -0.69 119.26 124.14 1jzq h ALA 118 Ca 0.42 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1jzq h ALA 118 Cb 0.43 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1jzq h ALA 118 CO -0.19 0.63 -0.00 0.00 0.00 0.00 0.00 179.25 179.69 1jzq h ARG 120 N -0.56 0.85 0.03 0.00 2.43 0.61 -2.48 114.38 115.26 1jzq h ARG 120 Ca -0.00 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1jzq h ARG 120 Cb 0.56 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1jzq h ARG 120 CO 0.00 0.56 -0.02 0.93 -1.51 0.00 0.00 179.97 179.94 1jzq h GLU 121 N 0.88 -0.04 -0.13 0.20 5.08 -1.04 -3.31 114.58 116.20 1jzq h GLU 121 Ca 0.51 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.91 1jzq h GLU 121 Cb 0.62 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 1jzq h GLU 121 CO -0.31 0.47 0.45 0.66 -1.00 0.00 0.00 179.01 179.28 1jzq h SER 122 N -0.58 0.00 0.36 1.42 4.64 -0.66 -2.48 113.55 116.25 1jzq h SER 122 Ca -0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 1jzq h SER 122 Cb 0.53 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.63 1jzq h SER 122 CO 0.01 0.00 -1.05 -0.37 -0.87 0.00 0.00 176.83 174.55 1jzq h VAL 123 N 0.00 1.40 -0.00 0.95 -1.51 -1.62 -3.31 116.25 112.16 1jzq h VAL 123 Ca 0.06 -2.57 0.00 0.00 -1.23 0.00 0.00 66.70 62.96 1jzq h VAL 123 Cb 0.97 2.57 0.00 0.00 -2.13 0.00 0.00 31.29 32.70 1jzq h VAL 123 CO -0.00 0.77 -0.64 0.49 -1.23 0.00 0.00 177.57 176.95 1jzq n PHE 124 N -3.71 0.00 0.00 5.19 0.99 -0.94 -2.89 117.46 116.10 1jzq n PHE 124 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 1jzq n PHE 124 Cb 0.90 -0.12 0.00 0.00 -1.00 0.00 0.00 39.48 39.26 1jzq n PHE 124 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1jzq n THR 125 N -1.22 0.00 -1.69 4.37 -2.24 -1.17 -0.68 114.28 111.65 1jzq n THR 125 Ca 0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 1jzq n THR 125 Cb 0.35 -0.72 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 1jzq n THR 125 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1jzq n TYR 126 N -0.61 0.00 -0.23 4.78 4.02 -0.81 -4.92 117.16 119.40 1jzq n TYR 126 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.84 1jzq n TYR 126 Cb 0.00 -0.03 0.01 0.00 -0.02 0.00 0.00 39.34 39.30 1jzq n TYR 126 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 1jzq h GLU 127 N 0.00 -0.14 0.00 -0.72 4.57 -1.10 -2.08 114.58 115.11 1jzq h GLU 127 Ca 0.00 0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 1jzq h GLU 127 Cb 1.27 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.89 1jzq h GLU 127 CO 0.00 -0.09 -0.17 0.87 -1.18 0.00 0.00 179.01 178.43 1jzq h LYS 128 N -0.14 0.00 0.08 1.92 6.56 -1.91 -2.44 116.57 120.63 1jzq h LYS 128 Ca 0.25 0.00 -0.26 0.00 -1.06 0.00 0.00 60.65 59.58 1jzq h LYS 128 Cb 0.56 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.23 1jzq h LYS 128 CO -0.73 0.17 -1.12 0.93 -2.06 0.00 0.00 179.45 176.65 1jzq h GLU 129 N 0.00 0.39 0.61 3.15 4.39 -1.77 -3.02 114.58 118.32 1jzq h GLU 129 Ca -0.00 -0.52 -0.03 0.00 0.34 0.00 0.00 59.36 59.15 1jzq h GLU 129 Cb 0.55 0.17 0.01 0.00 -0.10 0.00 0.00 28.75 29.38 1jzq h GLU 129 CO 0.02 1.20 -0.29 -1.49 -1.16 0.00 0.00 179.01 177.29 1jzq h TRP 130 N 0.17 -0.76 -0.68 4.33 4.06 -1.28 -2.44 115.95 119.36 1jzq h TRP 130 Ca -0.12 -0.02 0.12 0.00 2.06 0.00 0.00 58.89 60.93 1jzq h TRP 130 Cb 1.79 0.25 -0.12 0.00 -1.00 0.00 0.00 29.16 30.08 1jzq h TRP 130 CO 0.07 -0.42 -0.35 0.93 -3.56 0.00 0.00 178.44 175.11 1jzq h GLU 131 N -1.03 -0.12 -0.90 0.49 5.08 -1.54 0.91 114.58 117.47 1jzq h GLU 131 Ca -0.08 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 58.45 1jzq h GLU 131 Cb 0.68 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.86 1jzq h GLU 131 CO 0.14 -0.08 0.49 0.00 -1.00 0.00 0.00 179.01 178.55 1jzq h ALA 132 N 1.07 1.41 -0.01 3.43 0.00 -1.50 0.70 119.26 124.35 1jzq h ALA 132 Ca 0.26 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1jzq h ALA 132 Cb 0.56 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1jzq h ALA 132 CO -0.75 -0.09 -0.04 0.35 0.00 0.00 0.00 179.25 178.71 1jzq h PHE 133 N 0.65 0.07 -0.80 0.00 3.04 0.36 -0.87 116.94 119.38 1jzq h PHE 133 Ca 0.50 -0.03 0.13 0.00 3.98 0.00 0.00 57.97 62.56 1jzq h PHE 133 Cb 0.75 -0.01 -0.09 0.00 2.56 0.00 0.00 35.95 39.16 1jzq h PHE 133 CO -0.07 0.67 0.39 1.15 -2.02 0.00 0.00 178.31 178.43 1jzq h THR 134 N -0.55 0.75 0.03 4.41 2.02 0.12 -2.41 112.91 117.28 1jzq h THR 134 Ca -0.00 -0.20 -0.27 0.00 0.77 0.00 0.00 66.41 66.70 1jzq h THR 134 Cb 0.67 0.11 0.02 0.00 -1.74 0.00 0.00 68.15 67.21 1jzq h THR 134 CO 0.01 0.11 -1.09 -0.08 0.37 0.00 0.00 175.52 174.84 1jzq h GLU 135 N 0.59 0.66 -0.22 6.66 4.81 -0.93 -3.00 114.58 123.15 1jzq h GLU 135 Ca 0.43 -0.75 -0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1jzq h GLU 135 Cb 0.57 0.22 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 1jzq h GLU 135 CO -0.35 1.32 0.13 -0.09 -0.73 0.00 0.00 179.01 179.30 1jzq h ARG 136 N 0.35 0.30 -6.74 1.92 9.65 -0.67 -3.37 114.38 115.81 1jzq h ARG 136 Ca -0.14 -0.03 -0.50 0.00 -1.10 0.00 0.00 59.98 58.21 1jzq h ARG 136 Cb 1.75 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 30.26 1jzq h ARG 136 CO 0.21 0.25 0.39 0.96 2.80 0.00 0.00 179.97 184.58 1jzq s ILE 137 N -5.97 3.95 -0.15 1.20 -4.36 -1.00 -4.75 121.20 110.12 1jzq s ILE 137 Ca -0.13 1.91 -0.03 0.00 -0.26 0.00 0.00 60.65 62.14 1jzq s ILE 137 Cb 0.08 -4.21 -0.08 0.00 1.25 0.00 0.00 42.46 39.50 1jzq s ILE 137 CO 0.70 0.43 1.66 0.00 0.24 0.00 0.00 174.94 177.97 1jzq n ALA 138 N 1.59 3.06 -2.91 2.27 0.00 -1.26 -4.73 120.51 118.53 1jzq n ALA 138 Ca -0.01 -0.82 -0.44 0.00 0.00 0.00 0.00 53.44 52.17 1jzq n ALA 138 Cb 0.47 -2.41 -0.00 0.00 0.00 0.00 0.00 19.45 17.50 1jzq n ALA 138 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1jzq s TYR 139 N 2.70 3.43 0.05 0.00 5.04 -1.13 -4.98 117.35 122.46 1jzq s TYR 139 Ca 0.25 -2.07 -0.30 0.00 -2.44 0.00 0.00 57.07 52.50 1jzq s TYR 139 Cb 0.10 -4.35 -0.08 0.00 0.35 0.00 0.00 41.96 37.98 1jzq s TYR 139 CO -0.01 -1.44 1.67 -1.58 -1.34 0.00 0.00 175.55 172.86 1jzq s TRP 140 N 1.85 2.29 -0.28 4.97 0.51 -1.26 -4.67 118.94 122.35 1jzq s TRP 140 Ca 0.43 0.25 -0.27 0.00 -2.12 0.00 0.00 56.10 54.39 1jzq s TRP 140 Cb -0.02 -3.98 0.18 0.00 -0.81 0.00 0.00 33.47 28.84 1jzq s TRP 140 CO 0.00 -3.98 1.33 0.54 -0.51 0.00 0.00 176.95 174.34 1jzq s VAL 141 N 2.93 0.00 0.40 4.03 0.11 -1.26 -4.91 120.40 121.70 1jzq s VAL 141 Ca 0.75 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 59.53 1jzq s VAL 141 Cb -0.39 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.37 1jzq s VAL 141 CO 0.32 0.00 1.36 -1.81 -3.33 0.00 0.00 175.10 171.65 1jzq s ASP 142 N -0.52 6.27 0.00 3.54 1.01 -0.80 -4.90 116.67 121.26 1jzq s ASP 142 Ca 0.07 2.79 0.00 0.00 0.71 0.00 0.00 52.55 56.12 1jzq s ASP 142 Cb -0.03 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1jzq s ASP 142 CO -0.10 -0.89 0.00 0.18 0.21 0.00 0.00 175.17 174.57 1jzq n LEU 143 N 0.19 0.00 0.22 1.23 4.77 -1.26 -3.18 117.00 118.97 1jzq n LEU 143 Ca 0.03 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.17 1jzq n LEU 143 Cb 0.42 0.00 0.69 0.00 -2.33 0.00 0.00 43.42 42.20 1jzq n LEU 143 CO 0.58 0.00 0.95 1.05 -1.33 0.00 0.00 177.39 178.65 1jzq h GLU 144 N 0.00 0.00 -0.41 3.23 4.11 -2.00 -2.86 114.58 116.65 1jzq h GLU 144 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.13 1jzq h GLU 144 Cb 0.10 0.00 -0.37 0.00 0.50 0.00 0.00 28.75 28.98 1jzq h GLU 144 CO 0.00 0.00 -0.96 -0.40 0.07 0.00 0.00 179.01 177.72 1jzq n ASP 145 N -2.68 2.46 -4.77 3.06 5.75 -1.26 -5.08 116.55 114.02 1jzq n ASP 145 Ca 0.00 -2.70 -0.35 0.00 -0.01 0.00 0.00 54.79 51.73 1jzq n ASP 145 Cb 0.20 -0.42 0.01 0.00 -1.03 0.00 0.00 41.12 39.88 1jzq n ASP 145 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jzq s ALA 146 N -3.09 2.70 0.46 2.12 0.00 -1.08 -4.77 121.76 118.10 1jzq s ALA 146 Ca 0.36 0.86 -0.02 0.00 0.00 0.00 0.00 51.96 53.17 1jzq s ALA 146 Cb 0.36 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 20.09 1jzq s ALA 146 CO -0.04 -0.81 0.71 1.52 0.00 0.00 0.00 175.76 177.14 1jzq s TYR 147 N -1.72 3.34 -0.08 0.00 -0.85 0.47 -4.89 117.35 113.62 1jzq s TYR 147 Ca 0.73 0.43 -0.03 0.00 -0.52 0.00 0.00 57.07 57.68 1jzq s TYR 147 Cb -0.25 -2.31 0.04 0.00 0.38 0.00 0.00 41.96 39.82 1jzq s TYR 147 CO 0.28 -0.34 0.15 0.00 -1.52 0.00 0.00 175.55 174.13 1jzq s ALA 148 N -2.62 -0.15 -0.65 9.51 0.00 -1.26 -1.36 121.76 125.22 1jzq s ALA 148 Ca 0.48 0.56 0.00 0.00 0.00 0.00 0.00 51.96 52.99 1jzq s ALA 148 Cb -0.10 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.31 1jzq s ALA 148 CO 0.40 -0.46 0.80 0.25 0.00 0.00 0.00 175.76 176.75 1jzq n THR 149 N 5.06 1.21 0.29 0.00 -2.24 -1.02 -1.01 114.28 116.57 1jzq n THR 149 Ca -0.10 0.48 0.12 0.00 -2.27 0.00 0.00 64.05 62.28 1jzq n THR 149 Cb 0.50 -1.48 0.25 0.00 -2.10 0.00 0.00 70.33 67.50 1jzq n THR 149 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1jzq n LEU 150 N -1.30 3.38 -4.72 3.22 -0.00 -1.26 -4.55 117.00 111.77 1jzq n LEU 150 Ca 0.00 -1.50 -0.42 0.00 -0.00 0.00 0.00 56.01 54.09 1jzq n LEU 150 Cb 0.18 -0.28 -0.03 0.00 -0.00 0.00 0.00 43.42 43.29 1jzq n LEU 150 CO 0.00 0.75 0.73 -1.61 -0.00 0.00 0.00 177.39 177.26 1jzq s GLU 151 N -1.44 4.56 0.50 1.47 2.02 -0.18 -4.93 118.70 120.70 1jzq s GLU 151 Ca 0.40 1.52 0.41 0.00 0.02 0.00 0.00 54.97 57.31 1jzq s GLU 151 Cb 0.23 -3.41 1.61 0.00 0.10 0.00 0.00 34.13 32.65 1jzq s GLU 151 CO 0.31 -0.04 1.58 -1.35 0.02 0.00 0.00 175.26 175.78 1jzq h PRO 152 N 6.50 0.01 0.12 0.39 0.11 -1.92 0.21 132.00 137.42 1jzq h PRO 152 Ca -0.42 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 1jzq h PRO 152 Cb 1.22 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1jzq h PRO 152 CO 0.76 0.01 -0.06 1.79 -0.21 0.00 0.00 178.00 180.28 1jzq h THR 153 N 0.01 0.59 -0.93 -1.15 1.35 -1.95 -2.09 112.91 108.73 1jzq h THR 153 Ca 0.90 -1.21 0.27 0.00 -0.55 0.00 0.00 66.41 65.82 1jzq h THR 153 Cb 3.25 1.05 -0.14 0.00 -1.73 0.00 0.00 68.15 70.58 1jzq h THR 153 CO -0.25 0.18 0.35 0.22 -0.25 0.00 0.00 175.52 175.77 1jzq h TYR 154 N -0.98 0.55 -0.37 4.73 3.20 -1.18 0.56 116.97 123.49 1jzq h TYR 154 Ca -0.02 0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.81 1jzq h TYR 154 Cb 0.42 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 1jzq h TYR 154 CO 0.08 -0.20 -0.13 0.82 -1.64 0.00 0.00 178.16 177.09 1jzq h ILE 155 N 0.25 1.28 -0.54 1.81 2.04 -1.39 -2.41 117.51 118.55 1jzq h ILE 155 Ca 0.62 -1.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.22 1jzq h ILE 155 Cb 1.31 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 38.66 1jzq h ILE 155 CO -0.64 0.41 0.25 -0.08 0.00 0.00 0.00 178.15 178.08 1jzq h GLU 156 N 0.55 0.75 -0.09 2.37 4.81 0.72 0.58 114.58 124.27 1jzq h GLU 156 Ca 0.09 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1jzq h GLU 156 Cb 0.66 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 1jzq h GLU 156 CO 0.05 0.59 0.05 1.03 -0.73 0.00 0.00 179.01 180.00 1jzq h SER 157 N 0.75 0.11 -0.77 1.04 0.87 -0.64 -1.71 113.55 113.20 1jzq h SER 157 Ca 0.19 -0.05 0.06 0.00 -1.23 0.00 0.00 61.79 60.75 1jzq h SER 157 Cb 0.09 -0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 61.97 1jzq h SER 157 CO -0.02 0.13 0.47 0.40 -0.53 0.00 0.00 176.83 177.27 1jzq h ILE 158 N 0.08 1.02 0.00 2.23 2.04 -0.76 -0.20 117.51 121.92 1jzq h ILE 158 Ca 0.03 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 1jzq h ILE 158 Cb 0.04 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.20 1jzq h ILE 158 CO -0.01 0.16 -0.06 -0.50 0.00 0.00 0.00 178.15 177.74 1jzq h TRP 159 N 0.86 0.00 -0.20 1.37 4.06 -0.43 -1.35 115.95 120.26 1jzq h TRP 159 Ca 0.34 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.25 1jzq h TRP 159 Cb 0.15 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 1jzq h TRP 159 CO -0.05 0.06 -0.01 2.35 -3.56 0.00 0.00 178.44 177.24 1jzq h TRP 160 N 0.00 0.39 -0.42 0.49 7.01 -0.14 -1.85 115.95 121.42 1jzq h TRP 160 Ca -0.00 -0.07 -0.08 0.00 2.11 0.00 0.00 58.89 60.85 1jzq h TRP 160 Cb 0.11 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.06 1jzq h TRP 160 CO 0.00 0.56 -0.04 0.66 -2.79 0.00 0.00 178.44 176.82 1jzq h SER 161 N 0.11 0.77 -0.63 2.65 4.64 -1.07 -1.53 113.55 118.49 1jzq h SER 161 Ca 0.06 -0.33 -0.02 0.00 -0.47 0.00 0.00 61.79 61.02 1jzq h SER 161 Cb 0.41 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 1jzq h SER 161 CO 0.01 0.92 0.34 -0.07 -0.87 0.00 0.00 176.83 177.16 1jzq h LEU 162 N 0.61 0.82 -0.75 5.97 3.38 -1.20 0.06 115.31 124.19 1jzq h LEU 162 Ca 0.11 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1jzq h LEU 162 Cb 0.55 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1jzq h LEU 162 CO 0.03 0.68 -0.31 0.50 0.09 0.00 0.00 178.44 179.42 1jzq h LYS 163 N 0.92 0.60 0.33 1.13 3.64 -1.18 0.21 116.57 122.22 1jzq h LYS 163 Ca 0.23 -0.26 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1jzq h LYS 163 Cb 0.06 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1jzq h LYS 163 CO -0.03 0.84 -0.37 -0.97 -2.27 0.00 0.00 179.45 176.64 1jzq h ASN 164 N 0.51 -1.02 -0.40 4.20 -1.24 -0.13 0.48 115.58 117.98 1jzq h ASN 164 Ca 0.06 0.09 0.02 0.00 0.71 0.00 0.00 56.30 57.19 1jzq h ASN 164 Cb 0.79 0.35 -0.03 0.00 0.73 0.00 0.00 38.32 40.16 1jzq h ASN 164 CO 0.06 -0.51 0.21 -0.07 -1.29 0.00 0.00 177.43 175.84 1jzq h LEU 165 N -0.74 0.33 -0.10 0.34 3.38 -0.84 0.22 115.31 117.89 1jzq h LEU 165 Ca -0.02 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1jzq h LEU 165 Cb 0.68 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1jzq h LEU 165 CO -0.09 0.24 0.06 0.15 0.09 0.00 0.00 178.44 178.89 1jzq h PHE 166 N 0.43 0.13 -0.80 1.13 3.57 -0.72 0.44 116.94 121.13 1jzq h PHE 166 Ca 0.16 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.70 1jzq h PHE 166 Cb 0.05 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 1jzq h PHE 166 CO -0.09 0.12 0.53 -0.44 -2.23 0.00 0.00 178.31 176.19 1jzq h ASP 167 N 0.11 0.85 0.96 0.41 3.32 0.33 -1.03 116.42 121.36 1jzq h ASP 167 Ca 0.04 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1jzq h ASP 167 Cb 0.02 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.37 1jzq h ASP 167 CO -0.01 0.59 0.00 0.54 -1.72 0.00 0.00 179.24 178.64 1jzq n ARG 168 N -4.45 0.01 -1.33 3.56 1.74 0.03 -4.91 116.66 111.31 1jzq n ARG 168 Ca 0.10 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 1jzq n ARG 168 Cb 0.11 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 1jzq n ARG 168 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jzq n GLY 169 N 1.30 0.58 0.62 -0.13 0.00 -0.39 -4.95 105.19 102.22 1jzq n GLY 169 Ca 0.06 -0.81 0.07 0.00 0.00 0.00 0.00 46.02 45.35 1jzq n GLY 169 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jzq n LEU 170 N 0.00 2.46 -3.89 0.99 4.77 0.02 -4.84 117.00 116.51 1jzq n LEU 170 Ca 0.00 -1.34 -0.30 0.00 -0.03 0.00 0.00 56.01 54.34 1jzq n LEU 170 Cb 0.25 -0.09 -0.16 0.00 -2.33 0.00 0.00 43.42 41.09 1jzq n LEU 170 CO 0.00 0.52 -0.40 -0.22 -1.33 0.00 0.00 177.39 175.97 1jzq s LEU 171 N -1.08 2.48 0.23 2.23 2.96 -1.19 0.50 118.68 124.82 1jzq s LEU 171 Ca 0.20 -1.25 0.03 0.00 -0.22 0.00 0.00 54.13 52.89 1jzq s LEU 171 Cb 0.12 -1.09 -0.05 0.00 0.50 0.00 0.00 46.19 45.67 1jzq s LEU 171 CO 0.18 -0.28 0.02 -0.72 -1.32 0.00 0.00 176.35 174.23 1jzq s TYR 172 N 1.45 1.53 0.08 5.38 -0.85 -0.12 -4.66 117.35 120.17 1jzq s TYR 172 Ca -0.02 -0.99 0.06 0.00 -0.52 0.00 0.00 57.07 55.60 1jzq s TYR 172 Cb -0.18 -0.90 -0.04 0.00 0.38 0.00 0.00 41.96 41.22 1jzq s TYR 172 CO -0.09 -0.12 -0.09 0.50 -1.52 0.00 0.00 175.55 174.24 1jzq s ARG 173 N -3.90 2.25 0.01 -3.49 3.52 -1.26 0.69 118.95 116.76 1jzq s ARG 173 Ca 0.30 -0.94 -0.28 0.00 -0.13 0.00 0.00 55.73 54.68 1jzq s ARG 173 Cb 0.06 -2.36 0.10 0.00 -1.56 0.00 0.00 34.95 31.18 1jzq s ARG 173 CO 0.09 0.53 0.82 0.34 -0.81 0.00 0.00 175.30 176.27 1jzq s ASP 174 N -2.04 -0.44 -0.84 -2.12 2.15 -0.62 -4.98 116.67 107.77 1jzq s ASP 174 Ca 0.21 0.12 -0.08 0.00 0.43 0.00 0.00 52.55 53.23 1jzq s ASP 174 Cb -0.11 0.44 0.22 0.00 -0.30 0.00 0.00 42.92 43.16 1jzq s ASP 174 CO 0.13 -0.66 0.75 -2.28 -0.17 0.00 0.00 175.17 172.94 1jzq s HIS 175 N -2.82 3.79 0.29 -5.34 5.65 -1.26 -1.95 115.29 113.65 1jzq s HIS 175 Ca 0.02 -2.53 0.03 0.00 0.25 0.00 0.00 55.06 52.82 1jzq s HIS 175 Cb -0.01 -3.54 -0.06 0.00 -1.18 0.00 0.00 32.58 27.79 1jzq s HIS 175 CO -0.07 -0.89 0.06 -1.59 -0.65 0.00 0.00 174.74 171.61 1jzq s LYS 176 N -0.49 1.52 -0.10 2.88 -2.85 -1.16 -4.79 119.74 114.75 1jzq s LYS 176 Ca 0.22 -1.83 -0.30 0.00 -1.00 0.00 0.00 55.97 53.07 1jzq s LYS 176 Cb -0.12 -0.61 -0.03 0.00 -2.06 0.00 0.00 37.83 35.02 1jzq s LYS 176 CO -0.08 -0.22 1.27 0.08 0.10 0.00 0.00 175.35 176.51 1jzq s VAL 177 N -3.49 4.18 0.31 1.79 1.01 -1.26 -2.61 120.40 120.33 1jzq s VAL 177 Ca 0.36 1.47 0.04 0.00 0.00 0.00 0.00 61.98 63.85 1jzq s VAL 177 Cb 0.08 -3.95 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 1jzq s VAL 177 CO 0.14 -0.07 0.05 0.68 0.00 0.00 0.00 175.10 175.90 1jzq s VAL 178 N 2.93 1.14 0.19 2.92 -7.23 -0.05 -4.84 120.40 115.46 1jzq s VAL 178 Ca 0.57 -2.01 -0.30 0.00 -1.81 0.00 0.00 61.98 58.43 1jzq s VAL 178 Cb -0.24 -2.74 -0.08 0.00 0.56 0.00 0.00 36.38 33.88 1jzq s VAL 178 CO 0.19 -0.04 1.15 -2.84 -0.31 0.00 0.00 175.10 173.26 1jzq s PRO 179 N -3.90 4.54 -0.02 4.82 0.02 -1.26 -0.15 135.00 139.06 1jzq s PRO 179 Ca 0.36 1.81 0.02 0.00 0.02 0.00 0.00 61.00 63.20 1jzq s PRO 179 Cb 0.08 -3.25 0.01 0.00 0.02 0.00 0.00 34.50 31.36 1jzq s PRO 179 CO 0.15 -0.01 -0.06 -0.47 -0.33 0.00 0.00 177.00 176.28 1jzq s TYR 180 N -0.20 0.65 -0.30 6.54 5.04 -0.77 -0.65 117.35 127.65 1jzq s TYR 180 Ca 0.51 -0.14 -0.10 0.00 -2.44 0.00 0.00 57.07 54.89 1jzq s TYR 180 Cb -0.31 -0.49 -0.02 0.00 0.35 0.00 0.00 41.96 41.48 1jzq s TYR 180 CO 0.36 -0.08 0.16 0.00 -1.34 0.00 0.00 175.55 174.66 1jzq h PRO 182 N 8.36 0.00 0.02 0.00 0.13 -1.85 0.33 132.00 138.99 1jzq h PRO 182 Ca -0.34 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.58 1jzq h PRO 182 Cb 1.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 1jzq h PRO 182 CO 0.60 0.41 -0.95 -0.09 -0.23 0.00 0.00 178.00 177.73 1jzq h ARG 183 N 0.00 0.19 0.00 0.86 9.65 -1.89 -3.25 114.38 119.94 1jzq h ARG 183 Ca -0.00 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 58.65 1jzq h ARG 183 Cb 0.87 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.52 1jzq h ARG 183 CO 0.05 1.00 -1.51 0.00 2.80 0.00 0.00 179.97 182.32 1jzq n GLY 185 N 1.24 -0.88 3.51 0.00 0.00 0.11 -4.85 105.19 104.32 1jzq n GLY 185 Ca -0.02 0.43 -0.16 0.00 0.00 0.00 0.00 46.02 46.27 1jzq n GLY 185 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1jzq s THR 186 N -3.36 0.00 0.81 2.61 -1.32 -1.11 -4.46 115.64 108.81 1jzq s THR 186 Ca 0.33 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.70 1jzq s THR 186 Cb -0.04 -1.00 0.08 0.00 -1.51 0.00 0.00 72.50 70.02 1jzq s THR 186 CO 0.69 0.00 1.09 -2.84 -2.21 0.00 0.00 174.62 171.36 1jzq s PRO 187 N -1.74 2.01 0.42 7.08 0.02 -1.26 -2.23 135.00 139.30 1jzq s PRO 187 Ca -0.07 0.72 0.04 0.00 0.02 0.00 0.00 61.00 61.71 1jzq s PRO 187 Cb -0.00 -1.90 -0.02 0.00 0.02 0.00 0.00 34.50 32.59 1jzq s PRO 187 CO 0.04 -1.70 0.12 -0.51 -0.33 0.00 0.00 177.00 174.62 1jzq s LEU 188 N -5.85 2.03 0.27 -5.54 1.43 0.17 -4.85 118.68 106.35 1jzq s LEU 188 Ca 0.61 -1.67 0.11 0.00 -1.03 0.00 0.00 54.13 52.15 1jzq s LEU 188 Cb -0.15 -0.17 -0.05 0.00 0.03 0.00 0.00 46.19 45.85 1jzq s LEU 188 CO 0.55 -0.92 -0.10 -0.94 0.23 0.00 0.00 176.35 175.17 1jzq s SER 189 N -3.63 4.08 0.07 2.29 1.04 -1.26 -4.47 113.70 111.81 1jzq s SER 189 Ca 0.22 -0.83 -0.19 0.00 0.48 0.00 0.00 55.95 55.63 1jzq s SER 189 Cb 0.03 -0.58 -0.07 0.00 0.10 0.00 0.00 66.02 65.50 1jzq s SER 189 CO 0.13 0.02 1.31 0.28 0.98 0.00 0.00 173.24 175.97 1jzq h SER 190 N 2.09 -1.04 -0.93 7.02 0.02 -1.92 0.13 113.55 118.92 1jzq h SER 190 Ca -0.42 0.13 0.27 0.00 -0.84 0.00 0.00 61.79 60.93 1jzq h SER 190 Cb 1.25 0.42 -0.15 0.00 0.14 0.00 0.00 62.40 64.07 1jzq h SER 190 CO 0.60 -0.25 0.35 1.12 -1.14 0.00 0.00 176.83 177.51 1jzq h HIS 191 N -0.27 0.55 0.26 3.45 -0.00 -1.97 0.34 115.15 117.51 1jzq h HIS 191 Ca 0.03 0.05 -0.01 0.00 -0.00 0.00 0.00 60.37 60.44 1jzq h HIS 191 Cb 0.36 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.68 1jzq h HIS 191 CO -0.62 -0.21 -0.13 0.93 -0.00 0.00 0.00 177.93 177.91 1jzq h GLU 192 N 0.24 -0.34 -0.53 5.12 5.08 -1.48 -2.29 114.58 120.38 1jzq h GLU 192 Ca 0.62 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 59.10 1jzq h GLU 192 Cb 1.32 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 30.57 1jzq h GLU 192 CO -0.65 -0.09 0.09 0.28 -1.00 0.00 0.00 179.01 177.64 1jzq h VAL 193 N -0.55 0.68 -0.15 3.13 2.07 0.93 0.31 116.25 122.68 1jzq h VAL 193 Ca -0.04 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.45 1jzq h VAL 193 Cb 0.40 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1jzq h VAL 193 CO 0.06 0.04 0.28 0.00 0.02 0.00 0.00 177.57 177.97 1jzq h ALA 194 N 1.42 1.61 0.00 1.67 0.00 -0.18 0.11 119.26 123.88 1jzq h ALA 194 Ca 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1jzq h ALA 194 Cb 0.38 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1jzq h ALA 194 CO -0.36 -0.36 -0.70 1.25 0.00 0.00 0.00 179.25 179.08 1jzq h LEU 195 N 0.00 0.00 -4.11 0.00 5.85 0.19 -3.40 115.31 113.84 1jzq h LEU 195 Ca 0.07 -0.18 -0.50 0.00 0.84 0.00 0.00 57.88 58.11 1jzq h LEU 195 Cb 0.63 0.00 -0.42 0.00 0.37 0.00 0.00 40.66 41.24 1jzq h LEU 195 CO -0.00 0.09 -0.87 0.61 -0.34 0.00 0.00 178.44 177.93 1jzq n GLY 196 N 1.31 5.55 3.81 3.75 0.00 0.37 -4.90 105.19 115.09 1jzq n GLY 196 Ca 0.03 -2.40 -0.30 0.00 0.00 0.00 0.00 46.02 43.34 1jzq n GLY 196 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jzq s TYR 197 N -3.62 2.99 -0.30 1.61 2.02 -1.24 -1.03 117.35 117.78 1jzq s TYR 197 Ca 0.47 1.28 -0.18 0.00 -0.37 0.00 0.00 57.07 58.27 1jzq s TYR 197 Cb 0.40 -3.00 0.20 0.00 -0.40 0.00 0.00 41.96 39.16 1jzq s TYR 197 CO 0.01 -1.48 1.30 0.21 -1.57 0.00 0.00 175.55 174.01 1jzq s LYS 198 N -5.10 0.06 0.44 -0.62 2.20 -0.78 -4.80 119.74 111.14 1jzq s LYS 198 Ca 0.59 0.10 -0.25 0.00 -0.36 0.00 0.00 55.97 56.05 1jzq s LYS 198 Cb -0.14 0.02 -0.08 0.00 -1.51 0.00 0.00 37.83 36.11 1jzq s LYS 198 CO 0.55 -0.01 1.40 -1.83 -0.36 0.00 0.00 175.35 175.09 1jzq s GLU 199 N 0.79 3.76 0.19 4.03 -1.05 -1.26 -0.72 118.70 124.44 1jzq s GLU 199 Ca -0.04 2.36 -0.01 0.00 -0.15 0.00 0.00 54.97 57.13 1jzq s GLU 199 Cb -0.03 -2.69 -0.04 0.00 -0.44 0.00 0.00 34.13 30.93 1jzq s GLU 199 CO -0.11 -0.74 0.11 -1.50 0.95 0.00 0.00 175.26 173.97 1jzq s ILE 200 N -1.21 0.11 -0.26 1.83 2.07 0.18 -4.82 121.20 119.10 1jzq s ILE 200 Ca 0.60 -1.98 -0.07 0.00 -1.41 0.00 0.00 60.65 57.78 1jzq s ILE 200 Cb -0.42 -2.41 -0.02 0.00 0.13 0.00 0.00 42.46 39.73 1jzq s ILE 200 CO 0.55 -0.11 0.07 -1.58 -1.91 0.00 0.00 174.94 171.96 1jzq s GLN 201 N -4.11 3.53 0.18 3.50 2.00 -1.26 -2.98 119.66 120.52 1jzq s GLN 201 Ca 0.35 -0.56 0.08 0.00 -2.00 0.00 0.00 55.36 53.23 1jzq s GLN 201 Cb 0.07 -3.33 -0.04 0.00 0.80 0.00 0.00 33.01 30.51 1jzq s GLN 201 CO 0.10 -0.24 -0.16 -0.51 -0.50 0.00 0.00 175.29 173.97 1jzq s ASP 202 N 1.59 2.60 0.21 6.67 1.01 -0.52 -5.01 116.67 123.22 1jzq s ASP 202 Ca 0.06 -0.93 -0.24 0.00 0.71 0.00 0.00 52.55 52.15 1jzq s ASP 202 Cb -0.15 -0.14 -0.08 0.00 1.01 0.00 0.00 42.92 43.55 1jzq s ASP 202 CO 0.03 -0.10 0.79 -2.16 0.21 0.00 0.00 175.17 173.94 1jzq s PRO 203 N -3.16 4.48 -0.41 8.23 0.04 -1.26 -0.46 135.00 142.47 1jzq s PRO 203 Ca 0.18 1.10 -0.06 0.00 0.04 0.00 0.00 61.00 62.27 1jzq s PRO 203 Cb -0.04 -3.08 0.09 0.00 0.04 0.00 0.00 34.50 31.51 1jzq s PRO 203 CO 0.07 0.48 0.22 0.45 0.04 0.00 0.00 177.00 178.26 1jzq s SER 204 N -1.36 5.42 0.03 6.66 0.15 0.02 -4.09 113.70 120.53 1jzq s SER 204 Ca 0.40 -1.73 0.06 0.00 0.70 0.00 0.00 55.95 55.38 1jzq s SER 204 Cb -0.21 -1.90 -0.02 0.00 -1.71 0.00 0.00 66.02 62.18 1jzq s SER 204 CO 0.24 -0.53 -0.17 0.68 1.20 0.00 0.00 173.24 174.66 1jzq s VAL 205 N 1.29 1.35 -0.75 4.45 -7.23 -1.04 0.12 120.40 118.60 1jzq s VAL 205 Ca 0.04 -1.01 -0.03 0.00 -1.81 0.00 0.00 61.98 59.17 1jzq s VAL 205 Cb -0.23 -1.18 0.19 0.00 0.56 0.00 0.00 36.38 35.71 1jzq s VAL 205 CO -0.01 0.15 0.60 -0.31 -0.31 0.00 0.00 175.10 175.22 1jzq s TYR 206 N -0.74 3.62 0.29 2.82 1.51 -0.17 -2.29 117.35 122.40 1jzq s TYR 206 Ca 0.05 -2.81 -0.22 0.00 -1.01 0.00 0.00 57.07 53.08 1jzq s TYR 206 Cb -0.08 -3.25 -0.09 0.00 -0.11 0.00 0.00 41.96 38.43 1jzq s TYR 206 CO 0.01 -0.80 0.84 0.08 -1.11 0.00 0.00 175.55 174.57 1jzq s VAL 207 N -0.61 4.40 -0.17 0.71 1.01 -0.28 -1.81 120.40 123.66 1jzq s VAL 207 Ca 0.21 1.52 -0.08 0.00 0.00 0.00 0.00 61.98 63.63 1jzq s VAL 207 Cb -0.14 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 1jzq s VAL 207 CO -0.08 0.09 0.09 0.00 0.00 0.00 0.00 175.10 175.21 1jzq s ARG 208 N -2.21 3.87 -0.54 2.72 1.70 -1.06 0.29 118.95 123.73 1jzq s ARG 208 Ca 0.49 -0.28 -0.05 0.00 -0.47 0.00 0.00 55.73 55.42 1jzq s ARG 208 Cb -0.16 -3.23 0.14 0.00 -0.57 0.00 0.00 34.95 31.13 1jzq s ARG 208 CO 0.21 0.39 0.36 -0.06 -1.08 0.00 0.00 175.30 175.13 1jzq s PHE 209 N 0.04 3.49 0.71 5.89 0.40 0.37 -4.91 117.98 123.98 1jzq s PHE 209 Ca 0.07 -2.42 -0.16 0.00 -0.60 0.00 0.00 56.93 53.82 1jzq s PHE 209 Cb -0.12 -3.30 -0.02 0.00 0.51 0.00 0.00 43.02 40.09 1jzq s PHE 209 CO 0.00 -0.92 0.78 -2.30 0.70 0.00 0.00 175.22 173.48 1jzq n PRO 210 N 4.15 0.44 -3.73 0.24 -0.02 -1.26 -0.03 135.00 134.79 1jzq n PRO 210 Ca 0.02 0.20 -0.30 0.00 -2.02 0.00 0.00 63.50 61.40 1jzq n PRO 210 Cb 0.40 -2.04 -0.04 0.00 -0.02 0.00 0.00 33.50 31.80 1jzq n PRO 210 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1jzq s LEU 211 N -1.78 4.27 0.05 2.45 2.01 -0.80 -1.39 118.68 123.49 1jzq s LEU 211 Ca 0.70 0.46 0.23 0.00 0.01 0.00 0.00 54.13 55.53 1jzq s LEU 211 Cb -0.35 -3.19 0.07 0.00 0.01 0.00 0.00 46.19 42.73 1jzq s LEU 211 CO 0.53 0.04 1.05 0.29 1.01 0.00 0.00 176.35 179.28 1jzq n LYS 212 N -0.15 0.27 -3.18 1.70 5.02 -1.21 -4.48 118.16 116.13 1jzq n LYS 212 Ca -0.04 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.03 1jzq n LYS 212 Cb 0.52 -1.59 -0.06 0.00 -0.02 0.00 0.00 35.03 33.88 1jzq n LYS 212 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1jzq n GLU 213 N -1.94 0.59 0.26 1.97 -0.58 -1.26 -4.98 120.64 114.71 1jzq n GLU 213 Ca 0.02 -3.05 0.15 0.00 -0.42 0.00 0.00 57.16 53.86 1jzq n GLU 213 Cb 0.43 -1.34 0.67 0.00 -0.57 0.00 0.00 31.44 30.63 1jzq n GLU 213 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1jzq h PRO 214 N 4.39 0.00 -0.21 3.49 0.13 -1.82 -3.08 132.00 134.90 1jzq h PRO 214 Ca 0.09 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.10 1jzq h PRO 214 Cb 0.91 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1jzq h PRO 214 CO 0.42 0.09 -0.38 0.87 -0.23 0.00 0.00 178.00 178.76 1jzq h LYS 215 N 0.00 0.47 -0.46 0.86 6.56 -1.74 -0.92 116.57 121.33 1jzq h LYS 215 Ca -0.00 -0.22 0.13 0.00 -1.06 0.00 0.00 60.65 59.50 1jzq h LYS 215 Cb 0.51 -0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.15 1jzq h LYS 215 CO 0.01 0.78 0.67 -0.22 -2.06 0.00 0.00 179.45 178.63 1jzq h LYS 216 N 0.40 0.00 -0.50 3.15 1.63 -1.84 3.64 116.57 123.06 1jzq h LYS 216 Ca 0.04 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1jzq h LYS 216 Cb 0.84 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 1jzq h LYS 216 CO 0.07 0.00 0.00 1.28 -3.45 0.00 0.00 179.45 177.35 1jzq n LEU 217 N -3.34 3.61 -1.56 5.20 7.99 -1.00 -4.94 117.00 122.97 1jzq n LEU 217 Ca 0.09 -2.17 -0.13 0.00 -0.01 0.00 0.00 56.01 53.80 1jzq n LEU 217 Cb 0.84 -0.39 0.00 0.00 -0.11 0.00 0.00 43.42 43.77 1jzq n LEU 217 CO 0.22 0.81 -0.10 0.61 -1.51 0.00 0.00 177.39 177.41 1jzq n GLY 218 N 0.84 -0.10 3.44 -0.72 0.00 1.21 -5.02 105.19 104.83 1jzq n GLY 218 Ca 0.18 -0.33 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 1jzq n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzq s LEU 219 N -3.73 2.49 -0.08 0.99 1.43 -0.39 -4.96 118.68 114.43 1jzq s LEU 219 Ca 0.06 -0.75 -0.04 0.00 -1.03 0.00 0.00 54.13 52.37 1jzq s LEU 219 Cb -0.03 -1.29 -0.02 0.00 0.03 0.00 0.00 46.19 44.88 1jzq s LEU 219 CO 0.08 0.15 0.15 -0.08 0.23 0.00 0.00 176.35 176.88 1jzq h GLU 220 N 3.47 -0.13 -2.08 1.70 4.57 -1.95 -2.58 114.58 117.58 1jzq h GLU 220 Ca -0.48 0.01 -0.27 0.00 -1.18 0.00 0.00 59.36 57.44 1jzq h GLU 220 Cb 1.19 0.03 -0.32 0.00 -0.16 0.00 0.00 28.75 29.49 1jzq h GLU 220 CO 0.45 -0.08 -0.59 0.21 -1.18 0.00 0.00 179.01 177.82 1jzq s LYS 221 N -1.96 0.32 0.19 1.92 2.47 -1.26 -4.71 119.74 116.71 1jzq s LYS 221 Ca -0.02 0.09 0.07 0.00 -1.56 0.00 0.00 55.97 54.56 1jzq s LYS 221 Cb 0.00 -0.65 -0.05 0.00 -1.46 0.00 0.00 37.83 35.68 1jzq s LYS 221 CO 0.06 -0.89 -0.14 0.00 0.16 0.00 0.00 175.35 174.53 1jzq s ALA 222 N 2.42 1.88 -0.02 3.13 0.00 -1.26 -0.63 121.76 127.28 1jzq s ALA 222 Ca 0.10 -1.59 -0.05 0.00 0.00 0.00 0.00 51.96 50.42 1jzq s ALA 222 Cb -0.14 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.91 1jzq s ALA 222 CO -0.26 0.06 0.11 -1.12 0.00 0.00 0.00 175.76 174.55 1jzq s SER 223 N -3.16 -0.03 0.18 0.00 0.01 0.90 -1.90 113.70 109.69 1jzq s SER 223 Ca 0.20 0.01 -0.30 0.00 1.31 0.00 0.00 55.95 57.17 1jzq s SER 223 Cb -0.01 0.22 -0.07 0.00 0.21 0.00 0.00 66.02 66.36 1jzq s SER 223 CO 0.05 -0.18 1.01 -0.76 0.41 0.00 0.00 173.24 173.78 1jzq s LEU 224 N -0.58 4.54 -0.38 2.44 1.43 0.96 -0.82 118.68 126.26 1jzq s LEU 224 Ca -0.07 1.96 -0.13 0.00 -1.03 0.00 0.00 54.13 54.86 1jzq s LEU 224 Cb -0.04 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.59 1jzq s LEU 224 CO 0.00 -0.06 0.26 -0.22 0.23 0.00 0.00 176.35 176.56 1jzq s LEU 225 N -0.52 4.86 0.19 1.79 0.20 -0.88 0.14 118.68 124.46 1jzq s LEU 225 Ca 0.46 -0.82 0.02 0.00 0.69 0.00 0.00 54.13 54.48 1jzq s LEU 225 Cb -0.27 -2.12 -0.04 0.00 -0.43 0.00 0.00 46.19 43.34 1jzq s LEU 225 CO 0.33 -0.38 0.34 -0.63 -0.29 0.00 0.00 176.35 175.72 1jzq s ILE 226 N 1.65 5.26 0.11 6.68 -1.09 0.15 -4.50 121.20 129.46 1jzq s ILE 226 Ca 0.04 -0.59 0.05 0.00 -2.23 0.00 0.00 60.65 57.92 1jzq s ILE 226 Cb -0.19 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 1jzq s ILE 226 CO 0.09 -0.17 -0.13 0.86 -1.23 0.00 0.00 174.94 174.36 1jzq s TRP 227 N -1.84 1.31 -0.17 3.97 -0.11 -1.26 -1.13 118.94 119.71 1jzq s TRP 227 Ca 0.36 -0.56 -0.32 0.00 1.22 0.00 0.00 56.10 56.80 1jzq s TRP 227 Cb -0.11 -0.70 0.14 0.00 -1.50 0.00 0.00 33.47 31.30 1jzq s TRP 227 CO 0.29 0.11 1.15 -0.08 -4.62 0.00 0.00 176.95 173.80 1jzq s THR 228 N -2.07 0.00 -0.39 5.86 -1.32 -0.97 -4.59 115.64 112.16 1jzq s THR 228 Ca 0.07 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.59 1jzq s THR 228 Cb -0.05 -1.00 0.12 0.00 -1.51 0.00 0.00 72.50 70.06 1jzq s THR 228 CO 0.02 0.00 1.08 0.35 -2.21 0.00 0.00 174.62 173.86 1jzq n THR 229 N 0.13 0.95 -3.29 5.08 -2.24 -1.26 -2.49 114.28 111.16 1jzq n THR 229 Ca -0.03 -0.97 -0.25 0.00 -2.27 0.00 0.00 64.05 60.53 1jzq n THR 229 Cb 0.59 0.53 -0.08 0.00 -2.10 0.00 0.00 70.33 69.27 1jzq n THR 229 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1jzq n THR 230 N -0.06 0.45 -0.29 4.28 -2.24 -1.26 -4.16 114.28 111.00 1jzq n THR 230 Ca 0.05 -4.46 0.11 0.00 -2.27 0.00 0.00 64.05 57.48 1jzq n THR 230 Cb 0.31 -2.01 0.27 0.00 -2.10 0.00 0.00 70.33 66.80 1jzq n THR 230 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1jzq h PRO 231 N 4.12 0.23 0.00 -0.78 0.11 -1.90 -0.82 132.00 132.96 1jzq h PRO 231 Ca 0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1jzq h PRO 231 Cb 0.80 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1jzq h PRO 231 CO 0.60 0.15 0.12 -2.67 -0.21 0.00 0.00 178.00 175.99 1jzq n TRP 232 N -5.20 0.00 0.43 0.65 4.27 -1.26 0.19 117.44 116.52 1jzq n TRP 232 Ca 0.20 0.00 0.10 0.00 -3.89 0.00 0.00 57.50 53.91 1jzq n TRP 232 Cb 0.63 -0.22 -0.14 0.00 -1.36 0.00 0.00 31.31 30.23 1jzq n TRP 232 CO 0.00 0.00 0.00 0.25 -2.29 0.00 0.00 177.69 175.65 1jzq n THR 233 N -1.16 0.00 -0.26 -1.67 -2.24 -0.31 -4.50 114.28 104.14 1jzq n THR 233 Ca 0.00 -0.26 0.07 0.00 -2.27 0.00 0.00 64.05 61.58 1jzq n THR 233 Cb 0.12 0.48 0.20 0.00 -2.10 0.00 0.00 70.33 69.03 1jzq n THR 233 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1jzq h LEU 234 N 0.00 0.08 0.00 3.22 3.38 -0.41 1.08 115.31 122.66 1jzq h LEU 234 Ca 0.00 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1jzq h LEU 234 Cb 0.72 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1jzq h LEU 234 CO 0.00 -0.02 0.00 -2.65 0.09 0.00 0.00 178.44 175.86 1jzq n PRO 235 N -5.13 0.07 -0.02 1.13 -0.02 -1.26 -0.96 135.00 128.80 1jzq n PRO 235 Ca 0.15 0.15 0.08 0.00 -2.02 0.00 0.00 63.50 61.86 1jzq n PRO 235 Cb 0.48 -1.50 0.08 0.00 -0.02 0.00 0.00 33.50 32.54 1jzq n PRO 235 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jzq n GLY 236 N -0.92 0.31 3.52 -1.23 0.00 0.37 -4.89 105.19 102.35 1jzq n GLY 236 Ca 0.02 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.26 1jzq n GLY 236 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1jzq n ASN 237 N 0.85 -0.81 0.00 1.61 5.15 -0.14 -4.45 115.26 117.47 1jzq n ASN 237 Ca 0.09 0.49 0.00 0.00 -0.60 0.00 0.00 54.58 54.56 1jzq n ASN 237 Cb 0.39 -1.31 0.00 0.00 -0.53 0.00 0.00 39.78 38.33 1jzq n ASN 237 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1jzq n VAL 238 N -3.18 0.00 -3.63 3.44 0.24 -0.40 -4.93 118.33 109.87 1jzq n VAL 238 Ca 0.10 0.00 -0.06 0.00 -2.04 0.00 0.00 64.34 62.34 1jzq n VAL 238 Cb 0.51 0.24 -0.02 0.00 -1.47 0.00 0.00 33.84 33.10 1jzq n VAL 238 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jzq s ALA 239 N 0.00 -1.74 0.11 2.33 0.00 -1.22 -2.58 121.76 118.66 1jzq s ALA 239 Ca 0.00 0.56 0.09 0.00 0.00 0.00 0.00 51.96 52.62 1jzq s ALA 239 Cb 0.00 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1jzq s ALA 239 CO 0.00 -0.87 -0.21 0.00 0.00 0.00 0.00 175.76 174.68 1jzq s ALA 240 N -3.21 2.57 -0.01 0.00 0.00 -1.10 -0.70 121.76 119.31 1jzq s ALA 240 Ca 0.09 -1.36 0.03 0.00 0.00 0.00 0.00 51.96 50.72 1jzq s ALA 240 Cb -0.01 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.52 1jzq s ALA 240 CO -0.04 0.57 -0.11 0.00 0.00 0.00 0.00 175.76 176.19 1jzq s ALA 241 N -1.08 0.91 0.09 0.00 0.00 0.54 0.10 121.76 122.32 1jzq s ALA 241 Ca 0.16 -0.46 0.03 0.00 0.00 0.00 0.00 51.96 51.69 1jzq s ALA 241 Cb -0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 1jzq s ALA 241 CO 0.08 0.22 -0.08 0.14 0.00 0.00 0.00 175.76 176.12 1jzq s VAL 242 N -0.22 0.78 -0.27 0.00 -7.23 -0.59 -0.28 120.40 112.57 1jzq s VAL 242 Ca 0.04 -1.70 -0.24 0.00 -1.81 0.00 0.00 61.98 58.26 1jzq s VAL 242 Cb -0.05 -1.40 -0.00 0.00 0.56 0.00 0.00 36.38 35.49 1jzq s VAL 242 CO -0.00 -0.68 0.83 -2.28 -0.31 0.00 0.00 175.10 172.66 1jzq s HIS 243 N -2.84 3.26 0.19 2.82 2.46 -1.25 -2.08 115.29 117.85 1jzq s HIS 243 Ca 0.06 1.02 0.12 0.00 0.47 0.00 0.00 55.06 56.73 1jzq s HIS 243 Cb -0.00 -3.16 0.64 0.00 -0.13 0.00 0.00 32.58 29.92 1jzq s HIS 243 CO -0.02 -0.49 1.24 -1.00 -2.47 0.00 0.00 174.74 172.00 1jzq h PRO 244 N 7.87 0.00 -0.31 2.88 0.13 -1.85 -0.95 132.00 139.77 1jzq h PRO 244 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1jzq h PRO 244 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1jzq h PRO 244 CO 0.89 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 179.05 1jzq n GLU 245 N -2.11 3.11 -4.02 0.86 -0.58 -1.26 -1.47 120.64 115.17 1jzq n GLU 245 Ca -0.01 -2.75 -0.22 0.00 -0.42 0.00 0.00 57.16 53.76 1jzq n GLU 245 Cb 0.45 -1.80 -0.04 0.00 -0.57 0.00 0.00 31.44 29.49 1jzq n GLU 245 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1jzq s TYR 246 N -2.51 3.13 -0.31 -0.32 4.12 -0.36 -4.81 117.35 116.28 1jzq s TYR 246 Ca 0.41 -0.13 -0.07 0.00 0.02 0.00 0.00 57.07 57.29 1jzq s TYR 246 Cb 0.31 -1.51 0.01 0.00 -1.52 0.00 0.00 41.96 39.26 1jzq s TYR 246 CO 0.11 0.44 0.10 0.95 0.02 0.00 0.00 175.55 177.17 1jzq s THR 247 N -2.14 4.08 -0.38 -0.71 -4.23 -1.25 0.91 115.64 111.92 1jzq s THR 247 Ca 0.35 -0.74 -0.12 0.00 -1.18 0.00 0.00 61.69 59.99 1jzq s THR 247 Cb -0.08 -3.15 0.02 0.00 1.34 0.00 0.00 72.50 70.63 1jzq s THR 247 CO 0.26 0.01 0.24 -0.31 -0.54 0.00 0.00 174.62 174.28 1jzq s TYR 248 N 1.50 3.24 0.05 3.99 1.51 0.29 -1.07 117.35 126.86 1jzq s TYR 248 Ca 0.02 -0.73 -0.20 0.00 -1.01 0.00 0.00 57.07 55.15 1jzq s TYR 248 Cb -0.18 -2.49 -0.06 0.00 -0.11 0.00 0.00 41.96 39.12 1jzq s TYR 248 CO 0.03 -0.59 0.58 0.00 -1.11 0.00 0.00 175.55 174.46 1jzq s ALA 249 N 1.62 3.56 -0.62 3.71 0.00 -1.23 -1.08 121.76 127.72 1jzq s ALA 249 Ca 0.04 0.03 -0.22 0.00 0.00 0.00 0.00 51.96 51.81 1jzq s ALA 249 Cb -0.19 -2.67 0.07 0.00 0.00 0.00 0.00 23.12 20.33 1jzq s ALA 249 CO 0.08 0.32 0.90 0.00 0.00 0.00 0.00 175.76 177.07 1jzq s ALA 250 N -0.80 3.18 0.05 0.00 0.00 -0.89 -3.21 121.76 120.08 1jzq s ALA 250 Ca 0.30 -1.78 -0.27 0.00 0.00 0.00 0.00 51.96 50.21 1jzq s ALA 250 Cb -0.19 -3.76 -0.05 0.00 0.00 0.00 0.00 23.12 19.12 1jzq s ALA 250 CO 0.18 -2.60 0.84 -0.06 0.00 0.00 0.00 175.76 174.12 1jzq s PHE 251 N 3.77 3.73 -0.81 0.00 0.40 -0.80 -1.53 117.98 122.74 1jzq s PHE 251 Ca 0.22 1.57 -0.20 0.00 -0.60 0.00 0.00 56.93 57.91 1jzq s PHE 251 Cb -0.17 -2.92 0.11 0.00 0.51 0.00 0.00 43.02 40.55 1jzq s PHE 251 CO 0.11 0.20 1.03 -1.14 0.70 0.00 0.00 175.22 176.12 1jzq s GLN 252 N 0.18 3.38 -0.07 0.44 -0.44 -0.95 0.62 119.66 122.81 1jzq s GLN 252 Ca 0.42 -1.42 0.00 0.00 -2.50 0.00 0.00 55.36 51.87 1jzq s GLN 252 Cb -0.21 -4.62 -0.03 0.00 -1.64 0.00 0.00 33.01 26.51 1jzq s GLN 252 CO 0.25 -1.76 -0.06 0.14 0.50 0.00 0.00 175.29 174.36 1jzq s VAL 253 N 3.11 3.77 0.00 1.34 -7.23 -0.54 -4.67 120.40 116.18 1jzq s VAL 253 Ca 0.27 -0.45 0.00 0.00 -1.81 0.00 0.00 61.98 59.99 1jzq s VAL 253 Cb -0.11 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.28 1jzq s VAL 253 CO -0.01 0.60 0.00 0.61 -0.31 0.00 0.00 175.10 175.98 1jzq n GLY 254 N 2.27 2.87 0.75 2.32 0.00 -1.26 -1.46 105.19 110.68 1jzq n GLY 254 Ca -0.18 0.31 0.03 0.00 0.00 0.00 0.00 46.02 46.18 1jzq n GLY 254 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jzq n ASP 255 N 6.28 2.11 -3.64 1.61 9.92 -1.26 -5.03 116.55 126.54 1jzq n ASP 255 Ca 0.00 -3.76 -0.09 0.00 -0.53 0.00 0.00 54.79 50.41 1jzq n ASP 255 Cb 0.00 -0.56 -0.02 0.00 -0.64 0.00 0.00 41.12 39.90 1jzq n ASP 255 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 1jzq s GLU 256 N -3.19 1.48 -0.11 -1.24 -1.05 -0.53 -4.84 118.70 109.21 1jzq s GLU 256 Ca 0.40 -0.70 -0.09 0.00 -0.15 0.00 0.00 54.97 54.42 1jzq s GLU 256 Cb 0.37 0.58 -0.05 0.00 -0.44 0.00 0.00 34.13 34.60 1jzq s GLU 256 CO -0.03 -0.67 0.20 0.00 0.95 0.00 0.00 175.26 175.72 1jzq s ALA 257 N -3.77 3.79 -0.37 -0.84 0.00 0.20 -1.47 121.76 119.29 1jzq s ALA 257 Ca 0.06 -0.55 -0.07 0.00 0.00 0.00 0.00 51.96 51.40 1jzq s ALA 257 Cb -0.03 -2.11 0.06 0.00 0.00 0.00 0.00 23.12 21.03 1jzq s ALA 257 CO -0.03 0.49 0.17 -0.51 0.00 0.00 0.00 175.76 175.88 1jzq s LEU 258 N -0.72 4.70 -0.11 0.00 1.43 0.20 -0.07 118.68 124.11 1jzq s LEU 258 Ca 0.16 -1.32 -0.27 0.00 -1.03 0.00 0.00 54.13 51.66 1jzq s LEU 258 Cb -0.13 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.16 1jzq s LEU 258 CO 0.05 -0.42 0.90 -0.63 0.23 0.00 0.00 176.35 176.48 1jzq s ILE 259 N 1.40 4.86 -0.29 -0.59 1.01 -0.00 -1.91 121.20 125.67 1jzq s ILE 259 Ca 0.01 1.82 -0.23 0.00 0.00 0.00 0.00 60.65 62.25 1jzq s ILE 259 Cb -0.21 -4.22 0.16 0.00 0.01 0.00 0.00 42.46 38.20 1jzq s ILE 259 CO 0.02 0.06 1.22 -1.48 0.00 0.00 0.00 174.94 174.76 1jzq s LEU 260 N 1.80 -0.26 -0.25 2.97 2.34 -1.20 -2.07 118.68 122.02 1jzq s LEU 260 Ca 0.44 0.48 -0.23 0.00 0.06 0.00 0.00 54.13 54.88 1jzq s LEU 260 Cb -0.18 1.47 -0.10 0.00 -0.56 0.00 0.00 46.19 46.83 1jzq s LEU 260 CO 0.17 -0.08 0.85 1.21 -1.06 0.00 0.00 176.35 177.44 1jzq n GLU 261 N 2.21 0.00 -0.51 1.48 0.00 -1.10 -3.52 120.64 119.21 1jzq n GLU 261 Ca -0.13 0.00 -0.26 0.00 0.00 0.00 0.00 57.16 56.78 1jzq n GLU 261 Cb 0.56 -0.74 0.19 0.00 0.00 0.00 0.00 31.44 31.46 1jzq n GLU 261 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1jzq n GLU 262 N 2.36 -2.58 0.00 5.31 2.13 -0.23 -0.68 120.64 126.94 1jzq n GLU 262 Ca 0.18 -0.75 0.00 0.00 0.66 0.00 0.00 57.16 57.24 1jzq n GLU 262 Cb -0.03 -1.68 0.00 0.00 0.27 0.00 0.00 31.44 30.01 1jzq n GLU 262 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jzq n GLY 263 N 2.11 0.36 0.10 8.31 0.00 -1.26 -3.43 105.19 111.39 1jzq n GLY 263 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1jzq n GLY 263 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jzq h LEU 264 N 0.00 0.32 -0.53 0.99 5.85 -1.86 -2.96 115.31 117.13 1jzq h LEU 264 Ca 0.00 -0.33 -0.16 0.00 0.84 0.00 0.00 57.88 58.22 1jzq h LEU 264 Cb 0.00 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1jzq h LEU 264 CO 0.00 1.24 -0.66 1.23 -0.34 0.00 0.00 178.44 179.91 1jzq h GLY 265 N 1.90 0.36 0.31 3.75 0.00 -0.92 -2.70 103.07 105.77 1jzq h GLY 265 Ca -0.10 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.75 1jzq h GLY 265 CO 0.18 0.43 0.00 -0.96 0.00 0.00 0.00 176.54 176.19 1jzq n ARG 266 N -3.86 1.21 -0.08 4.80 1.85 -1.21 -1.95 116.66 117.42 1jzq n ARG 266 Ca -0.03 -0.31 -0.10 0.00 -1.00 0.00 0.00 57.85 56.41 1jzq n ARG 266 Cb 0.66 -1.38 -0.15 0.00 -1.05 0.00 0.00 32.46 30.53 1jzq n ARG 266 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79 1jzq n LYS 267 N -0.53 0.67 -0.02 2.89 4.81 -1.04 -2.44 118.16 122.51 1jzq n LYS 267 Ca 0.17 0.08 -0.01 0.00 -0.87 0.00 0.00 58.31 57.69 1jzq n LYS 267 Cb 0.16 -1.59 -0.00 0.00 0.02 0.00 0.00 35.03 33.61 1jzq n LYS 267 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1jzq h LEU 268 N 0.00 -0.04 -0.06 3.14 -0.00 -1.35 -3.40 115.31 113.61 1jzq h LEU 268 Ca -0.48 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.36 1jzq h LEU 268 Cb 2.17 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 42.84 1jzq h LEU 268 CO 0.04 0.34 -0.13 -0.07 -0.00 0.00 0.00 178.44 178.63 1jzq h LEU 269 N -0.78 0.21 0.00 1.67 3.38 -1.62 -3.50 115.31 114.67 1jzq h LEU 269 Ca -0.00 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.39 1jzq h LEU 269 Cb 0.03 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1jzq h LEU 269 CO 0.01 0.75 0.00 0.61 0.09 0.00 0.00 178.44 179.90 1jzq n GLY 270 N 0.48 4.04 3.57 0.83 0.00 -1.02 -4.94 105.19 108.14 1jzq n GLY 270 Ca -0.08 -1.48 -0.27 0.00 0.00 0.00 0.00 46.02 44.19 1jzq n GLY 270 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jzq s GLU 271 N -4.08 2.51 0.00 1.61 0.41 -1.13 -3.11 118.70 114.92 1jzq s GLU 271 Ca 0.00 -0.69 0.00 0.00 -0.41 0.00 0.00 54.97 53.87 1jzq s GLU 271 Cb 0.00 -5.14 0.00 0.00 -1.78 0.00 0.00 34.13 27.21 1jzq s GLU 271 CO 0.00 -3.68 0.00 0.41 -0.49 0.00 0.00 175.26 171.50 1jzq n GLY 272 N 6.37 0.00 3.17 -1.39 0.00 -1.26 -5.13 105.19 106.95 1jzq n GLY 272 Ca 0.42 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.11 1jzq n GLY 272 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jzq s THR 273 N 0.00 2.39 -0.25 2.61 2.01 -1.18 -5.06 115.64 116.16 1jzq s THR 273 Ca 0.00 -0.83 -0.38 0.00 0.31 0.00 0.00 61.69 60.79 1jzq s THR 273 Cb 0.00 -2.02 -0.14 0.00 0.01 0.00 0.00 72.50 70.34 1jzq s THR 273 CO 0.00 0.51 1.83 0.00 -0.69 0.00 0.00 174.62 176.27 1jzq n GLN 274 N 4.64 1.37 -3.33 4.92 0.00 -1.26 -4.85 117.38 118.87 1jzq n GLN 274 Ca -0.20 0.49 -0.42 0.00 0.00 0.00 0.00 57.00 56.87 1jzq n GLN 274 Cb 0.50 -2.26 -0.09 0.00 0.00 0.00 0.00 30.24 28.39 1jzq n GLN 274 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1jzq s VAL 275 N 4.11 5.10 -0.01 -0.39 1.01 -1.26 -2.25 120.40 126.71 1jzq s VAL 275 Ca 0.99 -0.18 -0.25 0.00 0.00 0.00 0.00 61.98 62.55 1jzq s VAL 275 Cb -0.97 -3.98 -0.18 0.00 0.00 0.00 0.00 36.38 31.26 1jzq s VAL 275 CO 0.61 -0.32 1.22 -0.07 0.00 0.00 0.00 175.10 176.53 1jzq h LEU 276 N 8.99 -0.19 0.00 3.92 3.38 -1.62 -3.48 115.31 126.31 1jzq h LEU 276 Ca -0.27 -0.30 -0.12 0.00 0.09 0.00 0.00 57.88 57.29 1jzq h LEU 276 Cb 1.12 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 1jzq h LEU 276 CO 0.77 0.23 -0.10 0.29 0.09 0.00 0.00 178.44 179.71 1jzq n LYS 277 N -5.00 0.14 -3.70 1.13 5.02 -1.25 -4.99 118.16 109.51 1jzq n LYS 277 Ca -0.09 -0.88 -0.12 0.00 -2.02 0.00 0.00 58.31 55.20 1jzq n LYS 277 Cb 0.25 0.76 -0.10 0.00 -0.02 0.00 0.00 35.03 35.92 1jzq n LYS 277 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1jzq s THR 278 N -2.43 -0.01 0.04 -0.18 2.01 -1.26 -2.09 115.64 111.73 1jzq s THR 278 Ca 0.10 0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.16 1jzq s THR 278 Cb 0.00 -0.68 -0.02 0.00 0.01 0.00 0.00 72.50 71.81 1jzq s THR 278 CO 0.07 0.01 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.56 1jzq s PHE 279 N 0.70 0.80 0.05 4.92 0.08 -0.24 -4.92 117.98 119.36 1jzq s PHE 279 Ca -0.04 -0.43 -0.20 0.00 0.12 0.00 0.00 56.93 56.38 1jzq s PHE 279 Cb -0.05 -0.47 -0.06 0.00 -0.57 0.00 0.00 43.02 41.87 1jzq s PHE 279 CO -0.05 -0.04 0.59 -1.25 -0.10 0.00 0.00 175.22 174.37 1jzq s PRO 280 N -1.41 4.26 0.03 0.24 0.04 -1.25 0.11 135.00 137.02 1jzq s PRO 280 Ca -0.06 0.75 -0.07 0.00 0.04 0.00 0.00 61.00 61.67 1jzq s PRO 280 Cb -0.09 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.15 1jzq s PRO 280 CO 0.01 0.53 0.67 0.41 0.04 0.00 0.00 177.00 178.65 1jzq n GLY 281 N 2.01 -1.62 0.52 0.56 0.00 0.26 0.17 105.19 107.10 1jzq n GLY 281 Ca -0.09 0.46 0.28 0.00 0.00 0.00 0.00 46.02 46.67 1jzq n GLY 281 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1jzq h LYS 282 N 0.00 0.00 -0.27 1.61 1.63 -1.47 0.12 116.57 118.19 1jzq h LYS 282 Ca 0.03 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.74 1jzq h LYS 282 Cb 0.09 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 1jzq h LYS 282 CO -0.20 0.00 -0.25 0.00 -3.45 0.00 0.00 179.45 175.55 1jzq h ALA 283 N 0.61 1.07 -0.08 5.00 0.00 0.14 -3.23 119.26 122.77 1jzq h ALA 283 Ca 0.48 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1jzq h ALA 283 Cb 2.80 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 20.46 1jzq h ALA 283 CO -0.01 0.57 0.00 1.28 0.00 0.00 0.00 179.25 181.09 1jzq n LEU 284 N -4.12 1.38 -4.58 0.00 4.32 0.43 -4.96 117.00 109.46 1jzq n LEU 284 Ca -0.00 -0.52 -0.34 0.00 -0.02 0.00 0.00 56.01 55.12 1jzq n LEU 284 Cb 0.41 -0.05 0.11 0.00 -1.62 0.00 0.00 43.42 42.27 1jzq n LEU 284 CO 0.42 0.26 0.42 1.21 -1.22 0.00 0.00 177.39 178.49 1jzq n GLU 285 N 0.10 0.17 -0.33 3.23 2.13 -1.22 -2.22 120.64 122.50 1jzq n GLU 285 Ca 0.18 0.12 0.00 0.00 0.66 0.00 0.00 57.16 58.12 1jzq n GLU 285 Cb 0.31 -2.17 0.00 0.00 0.27 0.00 0.00 31.44 29.85 1jzq n GLU 285 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jzq n GLY 286 N 1.04 0.00 3.62 8.31 0.00 -0.29 -4.88 105.19 112.99 1jzq n GLY 286 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1jzq n GLY 286 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1jzq s LEU 287 N 0.00 3.75 0.62 0.99 1.98 -0.94 -4.62 118.68 120.46 1jzq s LEU 287 Ca 0.00 1.38 -0.18 0.00 -2.89 0.00 0.00 54.13 52.44 1jzq s LEU 287 Cb 0.00 -3.53 -0.02 0.00 0.66 0.00 0.00 46.19 43.30 1jzq s LEU 287 CO 0.00 -1.37 1.22 -2.16 -1.89 0.00 0.00 176.35 172.15 1jzq s PRO 288 N 4.89 2.78 0.37 0.98 0.04 -1.26 -0.31 135.00 142.49 1jzq s PRO 288 Ca 0.70 1.85 -0.05 0.00 0.04 0.00 0.00 61.00 63.54 1jzq s PRO 288 Cb -0.22 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.44 1jzq s PRO 288 CO 0.30 -1.36 0.57 1.52 0.04 0.00 0.00 177.00 178.07 1jzq s TYR 289 N -1.63 0.90 -0.14 0.56 -0.85 -1.10 -3.29 117.35 111.79 1jzq s TYR 289 Ca 0.78 -1.23 0.02 0.00 -0.52 0.00 0.00 57.07 56.12 1jzq s TYR 289 Cb -0.31 0.14 0.01 0.00 0.38 0.00 0.00 41.96 42.18 1jzq s TYR 289 CO 0.36 -1.28 -0.21 0.99 -1.52 0.00 0.00 175.55 173.88 1jzq s THR 290 N -2.70 2.00 0.35 -3.49 2.01 -0.49 -4.78 115.64 108.55 1jzq s THR 290 Ca 0.27 -0.94 -0.21 0.00 0.31 0.00 0.00 61.69 61.12 1jzq s THR 290 Cb -0.02 -1.78 -0.10 0.00 0.01 0.00 0.00 72.50 70.61 1jzq s THR 290 CO 0.19 0.54 0.88 -2.16 -0.69 0.00 0.00 174.62 173.38 1jzq s PRO 291 N 0.87 4.31 0.42 4.92 0.04 -1.26 -4.21 135.00 140.08 1jzq s PRO 291 Ca -0.06 1.07 0.12 0.00 0.04 0.00 0.00 61.00 62.17 1jzq s PRO 291 Cb -0.15 -2.52 0.89 0.00 0.04 0.00 0.00 34.50 32.76 1jzq s PRO 291 CO -0.03 0.16 1.95 -1.00 0.04 0.00 0.00 177.00 178.12 1jzq h PRO 292 N 2.59 0.10 -2.15 0.56 0.13 -1.93 -3.28 132.00 128.02 1jzq h PRO 292 Ca -0.48 -0.02 -0.54 0.00 -0.87 0.00 0.00 66.00 64.09 1jzq h PRO 292 Cb 1.18 -0.01 -0.41 0.00 0.13 0.00 0.00 31.00 31.89 1jzq h PRO 292 CO 0.64 0.28 -0.90 0.66 -0.23 0.00 0.00 178.00 178.45 1jzq n TYR 293 N -4.29 2.23 -1.56 1.56 4.02 -1.26 -5.10 117.16 112.76 1jzq n TYR 293 Ca -0.02 -3.91 -0.53 0.00 -0.01 0.00 0.00 57.90 53.43 1jzq n TYR 293 Cb 0.26 -0.46 -0.06 0.00 -0.02 0.00 0.00 39.34 39.07 1jzq n TYR 293 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1jzq n PRO 294 N 0.06 0.82 -3.60 -0.72 -0.04 -1.24 -4.88 135.00 125.41 1jzq n PRO 294 Ca 0.28 0.30 -0.24 0.00 -0.04 0.00 0.00 63.50 63.80 1jzq n PRO 294 Cb 0.51 -1.84 0.01 0.00 -0.04 0.00 0.00 33.50 32.14 1jzq n PRO 294 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1jzq n GLN 295 N 2.04 0.71 -0.60 0.54 1.13 -1.26 -4.99 117.38 114.94 1jzq n GLN 295 Ca 0.18 -3.21 -0.05 0.00 -1.94 0.00 0.00 57.00 51.98 1jzq n GLN 295 Cb 0.18 0.28 0.01 0.00 0.11 0.00 0.00 30.24 30.82 1jzq n GLN 295 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1jzq n ALA 296 N -1.98 4.28 -1.67 -1.58 0.00 -1.26 -4.94 120.51 113.35 1jzq n ALA 296 Ca -0.16 -0.50 -0.45 0.00 0.00 0.00 0.00 53.44 52.34 1jzq n ALA 296 Cb 0.59 -1.11 -0.02 0.00 0.00 0.00 0.00 19.45 18.90 1jzq n ALA 296 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1jzq n LEU 297 N 1.11 3.14 -0.25 0.00 4.77 -1.26 -4.87 117.00 119.64 1jzq n LEU 297 Ca 0.09 1.15 0.15 0.00 -0.03 0.00 0.00 56.01 57.36 1jzq n LEU 297 Cb 0.53 -1.43 0.66 0.00 -2.33 0.00 0.00 43.42 40.84 1jzq n LEU 297 CO 0.11 -0.48 0.92 -1.84 -1.33 0.00 0.00 177.39 174.77 1jzq n GLU 298 N 1.93 1.22 0.00 3.23 0.00 -1.26 -4.86 120.64 120.90 1jzq n GLU 298 Ca 0.11 -0.50 0.00 0.00 0.00 0.00 0.00 57.16 56.77 1jzq n GLU 298 Cb 0.32 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.27 1jzq n GLU 298 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 1jzq n LYS 299 N -0.45 0.00 0.00 3.44 0.00 -1.26 -5.14 118.16 114.75 1jzq n LYS 299 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.50 1jzq n LYS 299 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.30 1jzq n LYS 299 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1jzq n GLY 300 N 0.00 2.18 0.00 3.14 0.00 -1.26 -4.36 105.19 104.89 1jzq n GLY 300 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.75 1jzq n GLY 300 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1jzq n TYR 301 N 2.13 0.00 -3.40 1.61 0.53 -1.07 -4.82 117.16 112.14 1jzq n TYR 301 Ca 0.00 0.00 -0.21 0.00 -1.02 0.00 0.00 57.90 56.67 1jzq n TYR 301 Cb 0.00 0.00 0.01 0.00 -1.03 0.00 0.00 39.34 38.32 1jzq n TYR 301 CO 0.00 0.00 0.00 -0.59 -1.02 0.00 0.00 176.86 175.25 1jzq s PHE 302 N 0.00 2.09 0.31 -0.72 -0.71 -1.26 -2.72 117.98 114.98 1jzq s PHE 302 Ca 0.00 -0.63 -0.27 0.00 -1.04 0.00 0.00 56.93 54.99 1jzq s PHE 302 Cb 0.00 -2.15 -0.10 0.00 -1.21 0.00 0.00 43.02 39.56 1jzq s PHE 302 CO 0.00 -0.55 0.96 0.08 -1.34 0.00 0.00 175.22 174.37 1jzq s VAL 303 N -2.58 4.12 0.25 -2.49 1.01 0.58 -2.72 120.40 118.57 1jzq s VAL 303 Ca 0.50 1.83 0.06 0.00 0.00 0.00 0.00 61.98 64.36 1jzq s VAL 303 Cb -0.05 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 1jzq s VAL 303 CO 0.30 0.20 -0.06 -0.69 0.00 0.00 0.00 175.10 174.85 1jzq s VAL 304 N -1.53 1.48 -0.10 2.92 1.01 0.28 -1.14 120.40 123.33 1jzq s VAL 304 Ca 0.49 -2.11 -0.01 0.00 0.00 0.00 0.00 61.98 60.34 1jzq s VAL 304 Cb -0.21 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.83 1jzq s VAL 304 CO 0.26 -0.39 -0.03 -0.76 0.00 0.00 0.00 175.10 174.18 1jzq s LEU 305 N -3.37 3.35 -0.29 3.92 1.43 -1.26 -1.55 118.68 120.90 1jzq s LEU 305 Ca 0.27 0.01 -0.13 0.00 -1.03 0.00 0.00 54.13 53.25 1jzq s LEU 305 Cb 0.03 -1.76 0.12 0.00 0.03 0.00 0.00 46.19 44.62 1jzq s LEU 305 CO 0.09 0.32 0.76 0.00 0.23 0.00 0.00 176.35 177.75 1jzq s ALA 306 N -0.53 -2.15 -0.06 4.21 0.00 -0.88 -4.92 121.76 117.43 1jzq s ALA 306 Ca 0.08 2.30 0.00 0.00 0.00 0.00 0.00 51.96 54.35 1jzq s ALA 306 Cb -0.12 -1.72 0.09 0.00 0.00 0.00 0.00 23.12 21.36 1jzq s ALA 306 CO 0.02 -0.71 1.19 -0.40 0.00 0.00 0.00 175.76 175.87 1jzq n ASP 307 N 4.83 3.31 -0.05 0.00 5.75 -1.26 -3.67 116.55 125.46 1jzq n ASP 307 Ca -0.15 -2.24 0.01 0.00 -0.01 0.00 0.00 54.79 52.41 1jzq n ASP 307 Cb 0.53 -0.59 -0.00 0.00 -1.03 0.00 0.00 41.12 40.03 1jzq n ASP 307 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jzq n TYR 308 N 0.36 0.00 -1.76 2.11 4.11 -1.26 -5.00 117.16 115.71 1jzq n TYR 308 Ca 0.08 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.56 1jzq n TYR 308 Cb 0.64 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.95 1jzq n TYR 308 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.86 177.00 1jzq s VAL 309 N -0.85 2.24 0.00 -3.48 -7.23 -1.24 -4.96 120.40 104.88 1jzq s VAL 309 Ca 0.02 0.10 0.00 0.00 -1.81 0.00 0.00 61.98 60.29 1jzq s VAL 309 Cb 0.02 -3.06 0.00 0.00 0.56 0.00 0.00 36.38 33.90 1jzq s VAL 309 CO 0.08 0.01 0.00 -0.24 -0.31 0.00 0.00 175.10 174.64 1jzq n SER 310 N 4.35 0.00 0.00 4.85 2.88 -1.26 -4.87 113.62 119.56 1jzq n SER 310 Ca 0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1jzq n SER 310 Cb 0.36 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 1jzq n SER 310 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1jzq n GLN 311 N 0.00 0.00 0.00 -1.46 7.27 -1.26 -4.88 117.38 117.05 1jzq n GLN 311 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1jzq n GLN 311 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1jzq n GLN 311 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1jzq n GLU 312 N 0.00 4.40 -4.21 3.69 0.00 -1.26 -4.87 120.64 118.39 1jzq n GLU 312 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 57.16 56.96 1jzq n GLU 312 Cb 0.21 -0.67 -0.12 0.00 0.00 0.00 0.00 31.44 30.85 1jzq n GLU 312 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1jzq s ASP 313 N -1.34 1.97 1.15 4.31 1.11 -1.26 -5.07 116.67 117.54 1jzq s ASP 313 Ca 0.00 -0.64 0.00 0.00 0.18 0.00 0.00 52.55 52.09 1jzq s ASP 313 Cb 0.00 -0.08 0.00 0.00 1.07 0.00 0.00 42.92 43.91 1jzq s ASP 313 CO 0.00 -0.03 0.00 0.61 1.18 0.00 0.00 175.17 176.93 1jzq n GLY 314 N 1.22 1.04 0.15 0.21 0.00 -1.26 -4.38 105.19 102.18 1jzq n GLY 314 Ca -0.21 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.23 1jzq n GLY 314 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jzq n THR 315 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -4.93 114.28 108.46 1jzq n THR 315 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1jzq n THR 315 Cb 0.00 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 1jzq n THR 315 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jzq n GLY 316 N 3.22 1.24 3.78 3.38 0.00 -1.26 -2.69 105.19 112.85 1jzq n GLY 316 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1jzq n GLY 316 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jzq s ILE 317 N -0.33 5.39 -0.06 -0.61 1.01 -1.26 -4.52 121.20 120.82 1jzq s ILE 317 Ca 0.00 0.18 0.05 0.00 0.00 0.00 0.00 60.65 60.87 1jzq s ILE 317 Cb 0.00 -3.41 -0.02 0.00 0.01 0.00 0.00 42.46 39.04 1jzq s ILE 317 CO 0.00 0.51 -0.20 -0.69 0.00 0.00 0.00 174.94 174.56 1jzq s VAL 318 N -0.16 2.48 0.02 2.92 1.01 0.61 -4.21 120.40 123.07 1jzq s VAL 318 Ca 0.10 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 1jzq s VAL 318 Cb -0.11 -1.94 -0.06 0.00 0.00 0.00 0.00 36.38 34.27 1jzq s VAL 318 CO 0.00 0.57 1.33 -2.28 0.00 0.00 0.00 175.10 174.72 1jzq s HIS 319 N -0.28 3.08 -0.45 5.22 2.46 -1.26 -0.34 115.29 123.72 1jzq s HIS 319 Ca 0.01 1.00 -0.08 0.00 0.47 0.00 0.00 55.06 56.45 1jzq s HIS 319 Cb -0.13 -3.58 0.11 0.00 -0.13 0.00 0.00 32.58 28.85 1jzq s HIS 319 CO 0.03 -2.03 0.30 -1.14 -2.47 0.00 0.00 174.74 169.43 1jzq s GLN 320 N 1.92 2.47 -0.47 2.88 2.00 0.12 -4.95 119.66 123.62 1jzq s GLN 320 Ca 0.62 -1.68 -0.03 0.00 -2.00 0.00 0.00 55.36 52.27 1jzq s GLN 320 Cb -0.31 -3.84 0.13 0.00 0.80 0.00 0.00 33.01 29.78 1jzq s GLN 320 CO 0.27 -1.11 0.27 0.00 -0.50 0.00 0.00 175.29 174.22 1jzq s ALA 321 N 1.36 3.28 -2.00 1.58 0.00 -1.26 -1.27 121.76 123.45 1jzq s ALA 321 Ca 0.05 -2.76 0.00 0.00 0.00 0.00 0.00 51.96 49.26 1jzq s ALA 321 Cb -0.25 -2.49 0.02 0.00 0.00 0.00 0.00 23.12 20.40 1jzq s ALA 321 CO -0.00 -1.89 0.38 -0.35 0.00 0.00 0.00 175.76 173.90 1jzq n PRO 322 N 4.26 0.01 -0.03 0.00 -0.04 -1.26 -2.10 135.00 135.84 1jzq n PRO 322 Ca 0.01 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.50 1jzq n PRO 322 Cb 0.40 -1.36 0.04 0.00 -0.04 0.00 0.00 33.50 32.54 1jzq n PRO 322 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1jzq n ALA 323 N -0.86 2.02 -2.18 0.55 0.00 -1.26 -4.35 120.51 114.42 1jzq n ALA 323 Ca 0.00 -1.43 0.01 0.00 0.00 0.00 0.00 53.44 52.02 1jzq n ALA 323 Cb 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 19.45 19.33 1jzq n ALA 323 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1jzq n PHE 324 N -0.72 0.00 -3.64 0.00 3.01 -0.89 -2.60 117.46 112.62 1jzq n PHE 324 Ca 0.05 -0.24 -0.09 0.00 1.01 0.00 0.00 57.45 58.18 1jzq n PHE 324 Cb 0.39 0.01 -0.07 0.00 -0.01 0.00 0.00 39.48 39.80 1jzq n PHE 324 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1jzq s GLY 325 N -1.25 -0.32 0.02 1.37 0.00 -1.22 -4.72 107.32 101.20 1jzq s GLY 325 Ca 0.12 2.55 -0.24 0.00 0.00 0.00 0.00 44.72 47.16 1jzq s GLY 325 CO -0.06 2.07 1.40 0.00 0.00 0.00 0.00 173.10 176.51 1jzq h ALA 326 N 5.31 0.08 -0.20 3.20 0.00 -1.92 -2.72 119.26 123.01 1jzq h ALA 326 Ca -0.29 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1jzq h ALA 326 Cb 1.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1jzq h ALA 326 CO 0.12 -0.21 0.13 0.93 0.00 0.00 0.00 179.25 180.21 1jzq h GLU 327 N -0.24 0.25 -0.89 0.00 3.07 -1.97 -2.05 114.58 112.74 1jzq h GLU 327 Ca 0.01 -0.02 0.21 0.00 -0.50 0.00 0.00 59.36 59.07 1jzq h GLU 327 Cb 0.40 -0.06 -0.06 0.00 -0.84 0.00 0.00 28.75 28.20 1jzq h GLU 327 CO 0.01 0.17 0.60 -0.44 -1.40 0.00 0.00 179.01 177.94 1jzq h ASP 328 N 0.26 0.34 0.43 1.42 5.19 -1.86 0.22 116.42 122.43 1jzq h ASP 328 Ca 0.07 0.04 -0.23 0.00 -0.62 0.00 0.00 57.03 56.29 1jzq h ASP 328 Cb -0.02 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.46 1jzq h ASP 328 CO -0.02 0.13 -0.99 0.25 -3.12 0.00 0.00 179.24 175.49 1jzq h LEU 329 N 0.34 0.47 0.38 1.55 6.46 -1.06 -0.80 115.31 122.65 1jzq h LEU 329 Ca 0.46 -0.40 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1jzq h LEU 329 Cb 1.24 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 41.03 1jzq h LEU 329 CO -0.15 1.22 -0.18 -0.08 -0.62 0.00 0.00 178.44 178.62 1jzq h GLU 330 N 0.18 -0.49 -0.73 1.25 4.81 -0.45 -1.92 114.58 117.23 1jzq h GLU 330 Ca -0.08 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.28 1jzq h GLU 330 Cb 1.64 0.11 -0.08 0.00 0.63 0.00 0.00 28.75 31.06 1jzq h GLU 330 CO 0.17 -0.27 0.36 1.15 -0.73 0.00 0.00 179.01 179.68 1jzq h THR 331 N -0.60 0.81 -0.25 0.32 2.02 -1.30 0.35 112.91 114.26 1jzq h THR 331 Ca -0.05 -0.20 0.07 0.00 0.77 0.00 0.00 66.41 67.00 1jzq h THR 331 Cb 0.44 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 1jzq h THR 331 CO 0.09 0.11 0.19 0.00 0.37 0.00 0.00 175.52 176.27 1jzq h ALA 332 N 1.46 2.17 0.11 6.16 0.00 -0.72 -1.70 119.26 126.74 1jzq h ALA 332 Ca 0.37 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 55.01 1jzq h ALA 332 Cb 0.43 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1jzq h ALA 332 CO -0.30 -0.31 -1.21 -0.09 0.00 0.00 0.00 179.25 177.33 1jzq h ARG 333 N 0.00 0.23 0.00 0.00 9.65 -0.16 0.12 114.38 124.21 1jzq h ARG 333 Ca 0.12 -0.39 0.00 0.00 -1.10 0.00 0.00 59.98 58.61 1jzq h ARG 333 Cb 0.49 0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.21 1jzq h ARG 333 CO -0.00 1.18 0.00 0.28 2.80 0.00 0.00 179.97 184.23 1jzq n VAL 334 N -3.50 0.00 0.89 0.20 0.31 -0.65 -2.81 118.33 112.78 1jzq n VAL 334 Ca -0.07 1.41 0.05 0.00 -0.01 0.00 0.00 64.34 65.72 1jzq n VAL 334 Cb 1.01 -2.37 0.30 0.00 -0.91 0.00 0.00 33.84 31.87 1jzq n VAL 334 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1jzq n TYR 335 N -1.81 0.00 -3.20 3.52 4.02 -1.14 -4.85 117.16 113.70 1jzq n TYR 335 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.70 1jzq n TYR 335 Cb 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.37 1jzq n TYR 335 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1jzq n GLY 336 N -0.09 -0.31 3.87 2.72 0.00 -1.06 -5.01 105.19 105.31 1jzq n GLY 336 Ca 0.08 0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1jzq n GLY 336 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzq s LEU 337 N -6.02 3.10 0.54 0.99 1.43 0.39 -5.02 118.68 114.10 1jzq s LEU 337 Ca 0.39 1.31 -0.16 0.00 -1.03 0.00 0.00 54.13 54.65 1jzq s LEU 337 Cb -0.17 -4.26 -0.06 0.00 0.03 0.00 0.00 46.19 41.72 1jzq s LEU 337 CO 0.49 -1.07 1.01 -2.84 0.23 0.00 0.00 176.35 174.17 1jzq s PRO 338 N -5.24 3.73 -0.47 1.29 0.02 -1.26 -4.78 135.00 128.28 1jzq s PRO 338 Ca 0.56 1.03 -0.13 0.00 0.02 0.00 0.00 61.00 62.48 1jzq s PRO 338 Cb -0.11 -2.10 0.09 0.00 0.02 0.00 0.00 34.50 32.40 1jzq s PRO 338 CO 0.53 -0.46 0.38 -1.17 -0.33 0.00 0.00 177.00 175.95 1jzq s LEU 339 N -4.25 5.63 -0.49 -5.54 2.96 -1.26 -4.83 118.68 110.89 1jzq s LEU 339 Ca 0.60 -1.53 -0.23 0.00 -0.22 0.00 0.00 54.13 52.75 1jzq s LEU 339 Cb -0.12 -2.12 0.04 0.00 0.50 0.00 0.00 46.19 44.49 1jzq s LEU 339 CO 0.34 -0.67 0.79 -0.76 -1.32 0.00 0.00 176.35 174.73 1jzq s LEU 340 N 1.55 4.35 -1.07 -0.68 1.43 -1.26 -4.97 118.68 118.02 1jzq s LEU 340 Ca 0.04 -0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 52.69 1jzq s LEU 340 Cb -0.25 -2.82 0.23 0.00 0.03 0.00 0.00 46.19 43.38 1jzq s LEU 340 CO 0.04 -0.99 1.13 -0.54 0.23 0.00 0.00 176.35 176.22 1jzq s LYS 341 N 3.33 4.03 -0.18 1.70 -0.14 -1.26 -4.57 119.74 122.64 1jzq s LYS 341 Ca 0.27 -2.84 0.09 0.00 -1.36 0.00 0.00 55.97 52.14 1jzq s LYS 341 Cb -0.14 -4.68 0.57 0.00 -1.68 0.00 0.00 37.83 31.91 1jzq s LYS 341 CO 0.20 -1.41 1.41 0.25 -0.76 0.00 0.00 175.35 175.04 1jzq n THR 342 N 3.57 2.03 -3.71 2.17 -2.24 -1.26 -4.84 114.28 109.99 1jzq n THR 342 Ca 0.25 -1.03 -0.12 0.00 -2.27 0.00 0.00 64.05 60.88 1jzq n THR 342 Cb 0.42 -0.37 -0.13 0.00 -2.10 0.00 0.00 70.33 68.15 1jzq n THR 342 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1jzq s VAL 343 N -2.26 -0.11 0.86 2.28 1.01 -1.26 -2.38 120.40 118.54 1jzq s VAL 343 Ca 0.39 0.16 -0.12 0.00 0.00 0.00 0.00 61.98 62.41 1jzq s VAL 343 Cb 0.30 -0.43 0.11 0.00 0.00 0.00 0.00 36.38 36.36 1jzq s VAL 343 CO 0.11 0.07 1.13 1.51 0.00 0.00 0.00 175.10 177.92 1jzq s ASP 344 N 1.50 3.94 0.00 3.32 3.84 -0.19 -4.90 116.67 124.18 1jzq s ASP 344 Ca -0.07 1.03 0.00 0.00 -0.00 0.00 0.00 52.55 53.51 1jzq s ASP 344 Cb -0.10 -1.65 0.00 0.00 -1.38 0.00 0.00 42.92 39.79 1jzq s ASP 344 CO -0.09 -2.29 0.53 -0.62 -0.00 0.00 0.00 175.17 172.70 1jzq n GLU 345 N -3.60 0.00 -0.00 2.11 1.02 -1.26 -1.13 120.64 117.77 1jzq n GLU 345 Ca 0.07 0.06 0.07 0.00 -0.02 0.00 0.00 57.16 57.34 1jzq n GLU 345 Cb 0.59 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.41 1jzq n GLU 345 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1jzq n GLU 346 N -1.03 1.92 -0.09 3.49 1.02 -1.26 -4.68 120.64 120.00 1jzq n GLU 346 Ca 0.00 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1jzq n GLU 346 Cb 0.00 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1jzq n GLU 346 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1jzq n GLY 347 N 1.38 0.95 3.72 0.62 0.00 -0.29 -4.57 105.19 107.00 1jzq n GLY 347 Ca 0.02 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 1jzq n GLY 347 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jzq s LYS 348 N -0.36 3.29 0.25 1.61 1.02 -1.26 0.21 119.74 124.51 1jzq s LYS 348 Ca 0.00 -0.32 -0.30 0.00 0.02 0.00 0.00 55.97 55.37 1jzq s LYS 348 Cb 0.00 -2.98 -0.09 0.00 -0.52 0.00 0.00 37.83 34.24 1jzq s LYS 348 CO 0.00 0.64 0.95 -0.51 -0.92 0.00 0.00 175.35 175.51 1jzq s LEU 349 N -0.68 4.62 -0.31 3.17 1.43 -0.23 -1.02 118.68 125.65 1jzq s LEU 349 Ca 0.12 1.95 0.08 0.00 -1.03 0.00 0.00 54.13 55.25 1jzq s LEU 349 Cb -0.12 -3.65 0.50 0.00 0.03 0.00 0.00 46.19 42.95 1jzq s LEU 349 CO 0.02 0.13 1.46 0.00 0.23 0.00 0.00 176.35 178.19 1jzq n LEU 350 N 1.39 4.35 -4.39 1.79 -0.00 -1.00 0.11 117.00 119.24 1jzq n LEU 350 Ca -0.02 -3.94 -0.42 0.00 -0.00 0.00 0.00 56.01 51.63 1jzq n LEU 350 Cb 0.47 -0.62 -0.10 0.00 -0.00 0.00 0.00 43.42 43.18 1jzq n LEU 350 CO 0.50 1.39 -0.07 -0.69 -0.00 0.00 0.00 177.39 178.51 1jzq s VAL 351 N -3.49 4.91 0.00 1.47 1.01 -1.26 -4.84 120.40 118.20 1jzq s VAL 351 Ca 0.46 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1jzq s VAL 351 Cb 0.41 -3.83 0.00 0.00 0.00 0.00 0.00 36.38 32.96 1jzq s VAL 351 CO -0.00 -0.40 0.00 1.21 0.00 0.00 0.00 175.10 175.91 1jzq n GLU 352 N 5.09 0.00 0.30 2.72 4.07 -1.26 -0.01 120.64 131.55 1jzq n GLU 352 Ca -0.11 0.00 0.18 0.00 -0.06 0.00 0.00 57.16 57.16 1jzq n GLU 352 Cb 0.45 0.00 0.92 0.00 -0.06 0.00 0.00 31.44 32.75 1jzq n GLU 352 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1jzq h PRO 353 N 0.00 0.00 0.00 5.31 0.13 -2.00 -2.97 132.00 132.47 1jzq h PRO 353 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1jzq h PRO 353 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1jzq h PRO 353 CO 0.00 0.04 -0.12 1.19 -0.23 0.00 0.00 178.00 178.88 1jzq n PHE 354 N -3.33 0.00 -1.50 1.56 3.01 0.99 -5.05 117.46 113.13 1jzq n PHE 354 Ca -0.02 -0.57 -0.44 0.00 1.01 0.00 0.00 57.45 57.43 1jzq n PHE 354 Cb 0.18 -0.09 -0.07 0.00 -0.01 0.00 0.00 39.48 39.49 1jzq n PHE 354 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1jzq n LYS 355 N -0.79 0.99 0.00 -1.08 4.81 -0.29 -2.06 118.16 119.75 1jzq n LYS 355 Ca 0.08 0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 1jzq n LYS 355 Cb 0.57 -2.68 0.00 0.00 0.02 0.00 0.00 35.03 32.94 1jzq n LYS 355 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jzq n GLY 356 N 6.30 2.13 3.76 3.14 0.00 0.29 -4.95 105.19 115.87 1jzq n GLY 356 Ca 0.43 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.06 1jzq n GLY 356 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jzq s LEU 357 N 0.00 4.48 0.14 0.99 2.01 -0.87 -4.70 118.68 120.73 1jzq s LEU 357 Ca 0.00 2.05 -0.31 0.00 0.01 0.00 0.00 54.13 55.88 1jzq s LEU 357 Cb 0.00 -3.78 -0.09 0.00 0.01 0.00 0.00 46.19 42.33 1jzq s LEU 357 CO 0.00 -0.08 1.44 -0.47 1.01 0.00 0.00 176.35 178.25 1jzq s TYR 358 N -1.33 3.18 0.47 0.29 5.04 -1.26 -1.07 117.35 122.67 1jzq s TYR 358 Ca 0.46 0.87 0.36 0.00 -2.44 0.00 0.00 57.07 56.33 1jzq s TYR 358 Cb -0.26 -3.76 1.53 0.00 0.35 0.00 0.00 41.96 39.82 1jzq s TYR 358 CO 0.33 -2.69 1.60 0.27 -1.34 0.00 0.00 175.55 173.71 1jzq h PHE 359 N 6.63 0.38 -0.62 4.97 -5.15 0.22 0.57 116.94 123.93 1jzq h PHE 359 Ca -0.43 0.02 -0.00 0.00 -0.20 0.00 0.00 57.97 57.36 1jzq h PHE 359 Cb 1.21 -0.09 -0.03 0.00 0.22 0.00 0.00 35.95 37.26 1jzq h PHE 359 CO 0.65 -0.18 0.37 0.00 -2.00 0.00 0.00 178.31 177.15 1jzq h ARG 360 N 0.03 0.84 0.00 6.09 2.47 -1.89 -3.18 114.38 118.73 1jzq h ARG 360 Ca 0.87 -0.07 -0.30 0.00 -1.26 0.00 0.00 59.98 59.22 1jzq h ARG 360 Cb 2.96 -0.18 -0.05 0.00 -1.65 0.00 0.00 29.97 31.05 1jzq h ARG 360 CO -0.33 0.59 -1.92 0.39 0.56 0.00 0.00 179.97 179.26 1jzq n GLU 361 N -4.41 0.65 -0.04 0.04 1.02 0.17 -3.90 120.64 114.18 1jzq n GLU 361 Ca 0.06 0.18 0.24 0.00 -0.02 0.00 0.00 57.16 57.62 1jzq n GLU 361 Cb 0.07 -1.70 0.61 0.00 -0.02 0.00 0.00 31.44 30.40 1jzq n GLU 361 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1jzq h ALA 362 N 1.05 2.47 -0.06 0.62 0.00 -1.47 0.43 119.26 122.29 1jzq h ALA 362 Ca -0.36 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.54 1jzq h ALA 362 Cb 2.05 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.85 1jzq h ALA 362 CO 0.06 -1.13 -0.33 -0.91 0.00 0.00 0.00 179.25 176.94 1jzq h ASN 363 N 0.00 -1.04 -0.90 0.00 2.35 -1.67 0.96 115.58 115.27 1jzq h ASN 363 Ca 0.32 0.12 0.09 0.00 -0.55 0.00 0.00 56.30 56.28 1jzq h ASN 363 Cb 1.88 0.40 -0.06 0.00 0.05 0.00 0.00 38.32 40.59 1jzq h ASN 363 CO -0.00 -0.30 0.58 0.08 -1.65 0.00 0.00 177.43 176.14 1jzq h ARG 364 N -0.37 0.91 -0.48 0.81 0.11 -1.18 0.78 114.38 114.95 1jzq h ARG 364 Ca 0.02 -0.05 -0.09 0.00 0.10 0.00 0.00 59.98 59.95 1jzq h ARG 364 Cb 0.42 -0.20 -0.02 0.00 1.11 0.00 0.00 29.97 31.28 1jzq h ARG 364 CO -0.25 0.60 -0.06 0.00 0.10 0.00 0.00 179.97 180.36 1jzq h ALA 365 N 1.54 0.98 0.12 0.08 0.00 -0.85 -2.16 119.26 118.97 1jzq h ALA 365 Ca 0.41 -0.31 -0.27 0.00 0.00 0.00 0.00 54.91 54.74 1jzq h ALA 365 Cb 0.36 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.97 1jzq h ALA 365 CO -0.17 0.61 -1.21 0.82 0.00 0.00 0.00 179.25 179.30 1jzq h ILE 366 N 0.78 1.43 -0.31 0.00 2.04 0.17 -2.79 117.51 118.82 1jzq h ILE 366 Ca 0.14 -2.81 -0.02 0.00 1.00 0.00 0.00 64.86 63.16 1jzq h ILE 366 Cb 0.56 2.81 -0.02 0.00 -0.74 0.00 0.00 36.82 39.43 1jzq h ILE 366 CO 0.03 0.83 0.09 -0.07 0.00 0.00 0.00 178.15 179.03 1jzq h LEU 367 N 0.14 0.40 0.19 1.44 4.07 -0.80 -0.71 115.31 120.05 1jzq h LEU 367 Ca -0.14 -0.04 -0.01 0.00 0.08 0.00 0.00 57.88 57.76 1jzq h LEU 367 Cb 1.90 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 43.54 1jzq h LEU 367 CO 0.21 0.40 -0.09 -0.09 -1.08 0.00 0.00 178.44 177.78 1jzq h ARG 368 N 0.44 -0.25 -0.64 1.13 2.43 -1.32 -0.25 114.38 115.92 1jzq h ARG 368 Ca 0.11 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 1jzq h ARG 368 Cb 0.15 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.72 1jzq h ARG 368 CO -0.01 0.04 0.40 0.22 -1.51 0.00 0.00 179.97 179.12 1jzq h ASP 369 N -0.54 0.67 -0.06 -3.80 1.82 -1.19 0.80 116.42 114.11 1jzq h ASP 369 Ca -0.03 -0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.60 1jzq h ASP 369 Cb 0.41 -0.15 -0.00 0.00 0.68 0.00 0.00 39.33 40.27 1jzq h ASP 369 CO 0.04 0.47 0.02 -0.07 -1.61 0.00 0.00 179.24 178.09 1jzq h LEU 370 N 0.80 0.09 -0.48 2.28 3.38 -1.11 -0.77 115.31 119.50 1jzq h LEU 370 Ca 0.25 -0.20 0.07 0.00 0.09 0.00 0.00 57.88 58.09 1jzq h LEU 370 Cb -0.01 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 1jzq h LEU 370 CO -0.09 0.26 0.14 -0.09 0.09 0.00 0.00 178.44 178.76 1jzq h ARG 371 N -0.10 0.30 0.00 1.13 9.65 -0.71 -0.25 114.38 124.40 1jzq h ARG 371 Ca 0.02 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1jzq h ARG 371 Cb 0.21 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.72 1jzq h ARG 371 CO -0.00 0.20 0.00 0.78 2.80 0.00 0.00 179.97 183.74 1jzq h GLY 372 N 0.30 0.00 -2.99 2.80 0.00 -0.60 -0.63 103.07 101.95 1jzq h GLY 372 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1jzq h GLY 372 CO -0.26 0.00 0.00 0.54 0.00 0.00 0.00 176.54 176.82 1jzq n ARG 373 N -3.05 4.08 -1.89 4.80 1.74 -0.18 -4.94 116.66 117.22 1jzq n ARG 373 Ca -0.01 -2.97 -0.08 0.00 -0.77 0.00 0.00 57.85 54.03 1jzq n ARG 373 Cb 0.22 -2.02 -0.02 0.00 -1.02 0.00 0.00 32.46 29.63 1jzq n ARG 373 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jzq n GLY 374 N 0.67 0.07 1.39 -0.13 0.00 -0.24 -4.79 105.19 102.15 1jzq n GLY 374 Ca 0.26 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.17 1jzq n GLY 374 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1jzq n LEU 375 N -2.14 4.47 -3.89 0.99 -0.00 -0.94 -4.84 117.00 110.65 1jzq n LEU 375 Ca -0.08 -4.04 -0.30 0.00 -0.00 0.00 0.00 56.01 51.59 1jzq n LEU 375 Cb 0.42 -0.60 -0.14 0.00 -0.00 0.00 0.00 43.42 43.10 1jzq n LEU 375 CO 0.11 1.47 -0.23 -0.22 -0.00 0.00 0.00 177.39 178.52 1jzq s LEU 376 N -3.37 3.88 0.06 1.47 1.98 -1.25 -2.55 118.68 118.90 1jzq s LEU 376 Ca 0.47 -2.69 -0.35 0.00 -2.89 0.00 0.00 54.13 48.67 1jzq s LEU 376 Cb 0.41 -1.45 -0.18 0.00 0.66 0.00 0.00 46.19 45.63 1jzq s LEU 376 CO -0.00 -0.28 1.53 0.15 -1.89 0.00 0.00 176.35 175.86 1jzq h PHE 377 N 6.85 -1.24 -3.97 5.38 3.04 -1.68 -3.47 116.94 121.85 1jzq h PHE 377 Ca -0.06 -0.01 -0.23 0.00 3.98 0.00 0.00 57.97 61.65 1jzq h PHE 377 Cb 0.93 0.44 -0.20 0.00 2.56 0.00 0.00 35.95 39.68 1jzq h PHE 377 CO 0.49 -0.70 -0.72 0.21 -2.02 0.00 0.00 178.31 175.57 1jzq s LYS 378 N -5.75 0.49 -0.10 1.11 2.20 -1.21 -4.98 119.74 111.50 1jzq s LYS 378 Ca -0.18 -0.79 -0.03 0.00 -0.36 0.00 0.00 55.97 54.61 1jzq s LYS 378 Cb 0.03 -0.13 0.04 0.00 -1.51 0.00 0.00 37.83 36.25 1jzq s LYS 378 CO 0.56 0.00 0.06 -2.00 -0.36 0.00 0.00 175.35 173.61 1jzq s GLU 379 N -1.88 0.16 0.06 4.03 2.12 -1.26 -1.00 118.70 120.93 1jzq s GLU 379 Ca -0.09 0.11 0.00 0.00 0.36 0.00 0.00 54.97 55.36 1jzq s GLU 379 Cb -0.08 -1.15 -0.00 0.00 0.26 0.00 0.00 34.13 33.16 1jzq s GLU 379 CO -0.01 -0.46 0.01 0.39 -0.54 0.00 0.00 175.26 174.65 1jzq n GLU 380 N 5.24 1.35 -3.93 4.30 1.02 0.33 -4.98 120.64 123.98 1jzq n GLU 380 Ca -0.06 -0.44 -0.28 0.00 -0.02 0.00 0.00 57.16 56.36 1jzq n GLU 380 Cb 0.49 0.18 -0.17 0.00 -0.02 0.00 0.00 31.44 31.93 1jzq n GLU 380 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1jzq s SER 381 N -1.33 2.51 0.06 1.62 0.15 -1.26 -0.80 113.70 114.66 1jzq s SER 381 Ca 0.01 -0.46 -0.21 0.00 0.70 0.00 0.00 55.95 55.99 1jzq s SER 381 Cb 0.00 -0.96 -0.06 0.00 -1.71 0.00 0.00 66.02 63.29 1jzq s SER 381 CO 0.01 -0.12 0.63 -0.47 1.20 0.00 0.00 173.24 174.49 1jzq s TYR 382 N 1.62 3.78 -0.24 3.44 6.04 0.39 -4.84 117.35 127.54 1jzq s TYR 382 Ca 0.04 1.34 -0.00 0.00 0.04 0.00 0.00 57.07 58.48 1jzq s TYR 382 Cb -0.13 -2.61 0.07 0.00 -1.04 0.00 0.00 41.96 38.25 1jzq s TYR 382 CO -0.09 0.48 0.00 -1.17 -1.54 0.00 0.00 175.55 173.23 1jzq s LEU 383 N -0.75 2.29 0.24 6.97 1.98 -1.26 -1.44 118.68 126.71 1jzq s LEU 383 Ca 0.32 -1.23 -0.15 0.00 -2.89 0.00 0.00 54.13 50.18 1jzq s LEU 383 Cb -0.20 -1.00 0.01 0.00 0.66 0.00 0.00 46.19 45.66 1jzq s LEU 383 CO 0.20 -0.30 0.52 -1.38 -1.89 0.00 0.00 176.35 173.51 1jzq s HIS 384 N 1.52 0.15 -0.08 5.38 -3.43 -1.16 -4.97 115.29 112.70 1jzq s HIS 384 Ca -0.01 -0.52 -0.26 0.00 -0.80 0.00 0.00 55.06 53.47 1jzq s HIS 384 Cb -0.18 0.32 -0.03 0.00 -1.43 0.00 0.00 32.58 31.26 1jzq s HIS 384 CO -0.10 -1.01 0.80 -1.54 -2.00 0.00 0.00 174.74 170.90 1jzq s SER 385 N -2.96 7.08 0.14 7.38 1.04 -1.26 0.48 113.70 125.59 1jzq s SER 385 Ca 0.17 1.30 0.07 0.00 0.48 0.00 0.00 55.95 57.97 1jzq s SER 385 Cb -0.02 -2.46 -0.04 0.00 0.10 0.00 0.00 66.02 63.60 1jzq s SER 385 CO 0.05 -0.22 -0.16 -0.47 0.98 0.00 0.00 173.24 173.42 1jzq s TYR 386 N 1.19 1.61 -0.30 5.02 5.04 0.10 -4.82 117.35 125.18 1jzq s TYR 386 Ca 0.41 -0.51 -0.29 0.00 -2.44 0.00 0.00 57.07 54.24 1jzq s TYR 386 Cb -0.18 -0.82 -0.00 0.00 0.35 0.00 0.00 41.96 41.30 1jzq s TYR 386 CO 0.19 0.23 1.43 -1.25 -1.34 0.00 0.00 175.55 174.81 1jzq s PRO 387 N -2.68 3.78 0.28 4.97 0.04 -1.26 -1.87 135.00 138.26 1jzq s PRO 387 Ca 0.12 1.30 0.07 0.00 0.04 0.00 0.00 61.00 62.52 1jzq s PRO 387 Cb -0.06 -3.97 -0.03 0.00 0.04 0.00 0.00 34.50 30.49 1jzq s PRO 387 CO 0.05 -1.30 0.25 -1.01 0.04 0.00 0.00 177.00 175.03 1jzq s HIS 388 N 4.93 3.08 0.33 0.56 3.76 -0.19 -0.72 115.29 127.03 1jzq s HIS 388 Ca 0.62 -0.17 -0.29 0.00 -0.15 0.00 0.00 55.06 55.08 1jzq s HIS 388 Cb -0.18 -1.56 -0.10 0.00 1.11 0.00 0.00 32.58 31.84 1jzq s HIS 388 CO 0.27 0.39 1.30 0.00 -0.85 0.00 0.00 174.74 175.85 1jzq h TRP 390 N 3.42 0.00 0.00 0.00 5.08 -1.86 -3.34 115.95 119.25 1jzq h TRP 390 Ca -0.49 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.48 1jzq h TRP 390 Cb 1.23 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.39 1jzq h TRP 390 CO 0.56 0.18 0.00 0.54 -1.28 0.00 0.00 178.44 178.44 1jzq n ARG 391 N -3.37 0.00 -2.91 0.12 5.12 -1.26 -4.86 116.66 109.50 1jzq n ARG 391 Ca -0.00 0.00 -0.40 0.00 -1.93 0.00 0.00 57.85 55.52 1jzq n ARG 391 Cb 0.39 -0.21 -0.06 0.00 -1.16 0.00 0.00 32.46 31.42 1jzq n ARG 391 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1jzq n SER 393 N 2.05 0.36 -4.65 0.00 7.64 -1.25 -3.71 113.62 114.06 1jzq n SER 393 Ca -0.03 -1.08 -0.51 0.00 1.01 0.00 0.00 58.87 58.27 1jzq n SER 393 Cb 0.49 -0.18 -0.05 0.00 -1.01 0.00 0.00 64.21 63.45 1jzq n SER 393 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1jzq n THR 394 N -0.01 0.14 -2.22 0.44 -1.04 -1.26 -4.39 114.28 105.93 1jzq n THR 394 Ca 0.00 -0.02 -0.41 0.00 -2.04 0.00 0.00 64.05 61.57 1jzq n THR 394 Cb 0.09 -1.26 -0.03 0.00 -1.82 0.00 0.00 70.33 67.31 1jzq n THR 394 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1jzq s PRO 395 N 1.66 4.39 0.88 -2.82 0.04 -1.26 -0.59 135.00 137.30 1jzq s PRO 395 Ca 0.86 2.05 -0.13 0.00 0.04 0.00 0.00 61.00 63.82 1jzq s PRO 395 Cb -0.85 -3.20 0.13 0.00 0.04 0.00 0.00 34.50 30.62 1jzq s PRO 395 CO 0.48 -0.26 1.18 -0.51 0.04 0.00 0.00 177.00 177.94 1jzq s LEU 396 N -0.05 2.29 -0.08 -3.56 1.02 0.10 -4.78 118.68 113.63 1jzq s LEU 396 Ca 0.57 0.76 -0.03 0.00 0.02 0.00 0.00 54.13 55.44 1jzq s LEU 396 Cb -0.36 -3.09 0.04 0.00 0.02 0.00 0.00 46.19 42.80 1jzq s LEU 396 CO 0.38 -2.35 0.16 0.00 0.02 0.00 0.00 176.35 174.56 1jzq s MET 397 N -5.52 0.09 0.12 1.70 0.23 -0.69 -4.93 119.30 110.31 1jzq s MET 397 Ca 0.65 0.45 -0.31 0.00 -1.03 0.00 0.00 55.69 55.44 1jzq s MET 397 Cb -0.11 -0.19 -0.09 0.00 -1.53 0.00 0.00 34.83 32.91 1jzq s MET 397 CO 0.51 -0.20 1.54 0.71 -2.03 0.00 0.00 175.02 175.55 1jzq s TYR 398 N 1.50 2.94 -0.01 3.16 2.02 -1.26 -1.85 117.35 123.85 1jzq s TYR 398 Ca -0.06 0.63 0.01 0.00 -0.37 0.00 0.00 57.07 57.28 1jzq s TYR 398 Cb -0.12 -3.87 0.00 0.00 -0.40 0.00 0.00 41.96 37.58 1jzq s TYR 398 CO -0.06 -3.26 -0.01 -0.47 -1.57 0.00 0.00 175.55 170.17 1jzq s TYR 399 N 1.54 0.19 -0.21 2.71 5.04 0.79 -4.39 117.35 123.03 1jzq s TYR 399 Ca 0.69 -0.02 -0.26 0.00 -2.44 0.00 0.00 57.07 55.04 1jzq s TYR 399 Cb -0.41 -0.16 -0.00 0.00 0.35 0.00 0.00 41.96 41.73 1jzq s TYR 399 CO 0.31 -0.02 0.90 0.00 -1.34 0.00 0.00 175.55 175.40 1jzq s ALA 400 N 0.16 3.60 0.33 3.97 0.00 -1.07 -0.87 121.76 127.88 1jzq s ALA 400 Ca -0.01 0.05 -0.18 0.00 0.00 0.00 0.00 51.96 51.82 1jzq s ALA 400 Cb -0.03 -3.36 0.03 0.00 0.00 0.00 0.00 23.12 19.77 1jzq s ALA 400 CO -0.00 -0.86 0.73 -0.08 0.00 0.00 0.00 175.76 175.55 1jzq s THR 401 N 2.68 0.00 0.09 0.00 -1.32 -1.07 -4.94 115.64 111.07 1jzq s THR 401 Ca 0.40 -1.04 -0.30 0.00 -1.21 0.00 0.00 61.69 59.54 1jzq s THR 401 Cb -0.16 -2.43 -0.05 0.00 -1.51 0.00 0.00 72.50 68.35 1jzq s THR 401 CO 0.09 0.00 1.02 -0.70 -2.21 0.00 0.00 174.62 172.82 1jzq s GLU 402 N -3.16 4.61 0.17 7.08 2.12 -1.26 -2.99 118.70 125.26 1jzq s GLU 402 Ca 0.14 1.52 -0.09 0.00 0.36 0.00 0.00 54.97 56.91 1jzq s GLU 402 Cb -0.05 -3.38 -0.01 0.00 0.26 0.00 0.00 34.13 30.95 1jzq s GLU 402 CO 0.10 0.07 0.28 0.45 -0.54 0.00 0.00 175.26 175.62 1jzq s SER 403 N 0.36 0.04 -0.07 -1.70 0.15 -0.82 -4.98 113.70 106.68 1jzq s SER 403 Ca 0.50 -0.88 0.05 0.00 0.70 0.00 0.00 55.95 56.31 1jzq s SER 403 Cb -0.24 0.44 -0.00 0.00 -1.71 0.00 0.00 66.02 64.50 1jzq s SER 403 CO 0.30 -0.90 -0.22 0.26 1.20 0.00 0.00 173.24 173.89 1jzq s TRP 404 N -3.97 2.24 0.23 3.44 0.52 -1.26 -1.59 118.94 118.54 1jzq s TRP 404 Ca 0.18 -0.77 0.07 0.00 0.02 0.00 0.00 56.10 55.60 1jzq s TRP 404 Cb 0.03 -1.50 -0.05 0.00 -1.15 0.00 0.00 33.47 30.81 1jzq s TRP 404 CO 0.00 -0.28 -0.10 -0.06 0.02 0.00 0.00 176.95 176.53 1jzq s PHE 405 N 0.13 1.76 -0.29 -1.98 0.40 0.22 -0.32 117.98 117.89 1jzq s PHE 405 Ca -0.10 -0.65 -0.08 0.00 -0.60 0.00 0.00 56.93 55.49 1jzq s PHE 405 Cb -0.15 -0.91 -0.01 0.00 0.51 0.00 0.00 43.02 42.46 1jzq s PHE 405 CO 0.05 0.28 0.11 0.42 0.70 0.00 0.00 175.22 176.78 1jzq s ILE 406 N -3.04 4.34 -0.28 0.64 1.01 -0.18 -0.94 121.20 122.75 1jzq s ILE 406 Ca 0.25 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.47 1jzq s ILE 406 Cb 0.02 -3.16 -0.02 0.00 0.01 0.00 0.00 42.46 39.30 1jzq s ILE 406 CO 0.08 0.16 1.35 0.29 0.00 0.00 0.00 174.94 176.82 1jzq n LYS 407 N 4.93 0.68 0.00 2.79 5.02 0.18 -2.59 118.16 129.18 1jzq n LYS 407 Ca -0.15 -0.76 0.08 0.00 -2.02 0.00 0.00 58.31 55.46 1jzq n LYS 407 Cb 0.50 -2.10 0.49 0.00 -0.02 0.00 0.00 35.03 33.90 1jzq n LYS 407 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1jzq n ASN 408 N 4.53 0.00 0.06 4.39 2.04 -1.26 -2.60 115.26 122.41 1jzq n ASN 408 Ca 0.15 -0.60 -0.07 0.00 -0.44 0.00 0.00 54.58 53.62 1jzq n ASN 408 Cb 0.06 0.00 -0.12 0.00 -2.53 0.00 0.00 39.78 37.19 1jzq n ASN 408 CO 0.00 0.00 0.00 0.71 -0.44 0.00 0.00 177.26 177.53 1jzq h THR 409 N 0.00 1.69 0.00 5.53 1.35 -1.89 -3.02 112.91 116.57 1jzq h THR 409 Ca 0.00 -3.39 0.00 0.00 -0.55 0.00 0.00 66.41 62.47 1jzq h THR 409 Cb 0.00 2.83 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 1jzq h THR 409 CO 0.00 0.96 0.00 0.18 -0.25 0.00 0.00 175.52 176.41 1jzq n LEU 410 N -3.34 0.00 -0.28 3.87 4.77 -1.07 -1.14 117.00 119.81 1jzq n LEU 410 Ca -0.00 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 1jzq n LEU 410 Cb 0.94 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 42.07 1jzq n LEU 410 CO 0.47 0.00 0.36 0.49 -1.33 0.00 0.00 177.39 177.38 1jzq n PHE 411 N -0.72 0.00 -0.21 -1.77 3.01 -1.14 -4.92 117.46 111.70 1jzq n PHE 411 Ca 0.02 -0.33 0.01 0.00 1.01 0.00 0.00 57.45 58.17 1jzq n PHE 411 Cb 0.01 -0.07 0.13 0.00 -0.01 0.00 0.00 39.48 39.53 1jzq n PHE 411 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1jzq h LYS 412 N 0.00 0.35 -0.05 -1.08 3.64 -1.21 0.27 116.57 118.48 1jzq h LYS 412 Ca 0.00 -0.02 -0.22 0.00 -1.27 0.00 0.00 60.65 59.14 1jzq h LYS 412 Cb 1.17 -0.08 0.02 0.00 -0.41 0.00 0.00 32.23 32.93 1jzq h LYS 412 CO 0.00 0.23 -0.83 -0.44 -2.27 0.00 0.00 179.45 176.14 1jzq h ASP 413 N 0.36 0.82 -0.07 4.20 3.32 -1.91 -2.50 116.42 120.63 1jzq h ASP 413 Ca 0.33 -0.70 0.02 0.00 0.02 0.00 0.00 57.03 56.70 1jzq h ASP 413 Cb 0.47 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1jzq h ASP 413 CO -0.36 1.41 -0.05 -0.08 -1.72 0.00 0.00 179.24 178.43 1jzq h GLU 414 N 0.31 -0.05 -0.56 3.56 4.57 -1.86 0.62 114.58 121.17 1jzq h GLU 414 Ca -0.09 0.00 0.10 0.00 -1.18 0.00 0.00 59.36 58.20 1jzq h GLU 414 Cb 1.49 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 30.06 1jzq h GLU 414 CO 0.17 -0.03 0.38 -0.07 -1.18 0.00 0.00 179.01 178.27 1jzq h LEU 415 N -0.05 0.30 0.00 1.64 3.38 -0.50 -0.03 115.31 120.04 1jzq h LEU 415 Ca 0.05 0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.81 1jzq h LEU 415 Cb 0.12 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1jzq h LEU 415 CO -0.11 0.18 -1.08 0.40 0.09 0.00 0.00 178.44 177.92 1jzq h ILE 416 N 0.33 1.54 0.75 1.22 2.04 -0.71 -3.03 117.51 119.65 1jzq h ILE 416 Ca 0.26 -3.25 -0.04 0.00 1.00 0.00 0.00 64.86 62.83 1jzq h ILE 416 Cb 0.59 2.76 0.01 0.00 -0.74 0.00 0.00 36.82 39.43 1jzq h ILE 416 CO -0.06 0.88 -0.36 0.03 0.00 0.00 0.00 178.15 178.63 1jzq h ARG 417 N 0.00 -0.97 -0.28 2.37 3.08 0.20 -3.08 114.38 115.70 1jzq h ARG 417 Ca -0.05 0.07 0.08 0.00 0.07 0.00 0.00 59.98 60.15 1jzq h ARG 417 Cb 1.78 0.22 -0.01 0.00 0.08 0.00 0.00 29.97 32.04 1jzq h ARG 417 CO 0.12 -0.65 0.21 -0.91 -1.07 0.00 0.00 179.97 177.67 1jzq h ASN 418 N -1.21 0.00 0.28 7.04 2.35 -1.29 0.26 115.58 123.01 1jzq h ASN 418 Ca -0.10 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 1jzq h ASN 418 Cb 0.77 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.14 1jzq h ASN 418 CO 0.17 0.00 -0.13 -1.13 -1.65 0.00 0.00 177.43 174.68 1jzq h ASN 419 N 0.00 0.00 -0.38 5.81 -0.00 -1.47 -2.03 115.58 117.51 1jzq h ASN 419 Ca 0.13 0.00 -0.08 0.00 -0.00 0.00 0.00 56.30 56.35 1jzq h ASN 419 Cb 0.55 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.86 1jzq h ASN 419 CO -0.00 0.13 -0.07 1.56 -0.00 0.00 0.00 177.43 179.06 1jzq h GLN 420 N 0.00 0.72 -0.70 6.67 1.08 -0.38 -3.00 115.11 119.49 1jzq h GLN 420 Ca -0.00 -0.26 0.06 0.00 -1.45 0.00 0.00 58.65 56.99 1jzq h GLN 420 Cb 0.31 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.65 1jzq h GLN 420 CO 0.02 0.85 0.46 0.93 -0.95 0.00 0.00 178.83 180.14 1jzq h GLU 421 N 0.53 0.71 -7.05 1.46 5.08 -1.38 -3.44 114.58 110.49 1jzq h GLU 421 Ca 0.10 -0.04 -0.54 0.00 -1.00 0.00 0.00 59.36 57.87 1jzq h GLU 421 Cb 0.57 -0.16 0.13 0.00 0.50 0.00 0.00 28.75 29.79 1jzq h GLU 421 CO 0.03 0.47 0.57 0.42 -1.00 0.00 0.00 179.01 179.50 1jzq s ILE 422 N -5.65 2.26 -0.55 3.13 1.01 -1.14 -4.97 121.20 115.29 1jzq s ILE 422 Ca -0.10 0.19 -0.10 0.00 0.00 0.00 0.00 60.65 60.64 1jzq s ILE 422 Cb 0.19 -3.09 0.14 0.00 0.01 0.00 0.00 42.46 39.71 1jzq s ILE 422 CO 0.77 -0.01 0.44 -2.28 0.00 0.00 0.00 174.94 173.86 1jzq s HIS 423 N -1.37 3.44 -0.12 3.97 5.65 -0.53 -5.03 115.29 121.30 1jzq s HIS 423 Ca 0.72 -1.86 -0.24 0.00 0.25 0.00 0.00 55.06 53.93 1jzq s HIS 423 Cb -0.38 -3.57 -0.03 0.00 -1.18 0.00 0.00 32.58 27.43 1jzq s HIS 423 CO 0.44 -0.98 0.74 -1.58 -0.65 0.00 0.00 174.74 172.70 1jzq s TRP 424 N 1.11 3.50 0.00 3.88 0.52 -1.26 -1.10 118.94 125.59 1jzq s TRP 424 Ca 0.08 1.22 0.00 0.00 0.02 0.00 0.00 56.10 57.42 1jzq s TRP 424 Cb -0.24 -2.88 0.00 0.00 -1.15 0.00 0.00 33.47 29.20 1jzq s TRP 424 CO -0.01 -0.06 0.41 0.28 0.02 0.00 0.00 176.95 177.59 1jzq n VAL 425 N 4.22 0.00 -1.74 4.03 0.31 0.14 -2.94 118.33 122.36 1jzq n VAL 425 Ca 0.01 0.91 -0.43 0.00 -0.01 0.00 0.00 64.34 64.82 1jzq n VAL 425 Cb 0.50 -1.77 -0.03 0.00 -0.91 0.00 0.00 33.84 31.63 1jzq n VAL 425 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1jzq s PRO 426 N -0.83 3.36 0.23 5.55 0.04 -1.26 -4.75 135.00 137.34 1jzq s PRO 426 Ca 0.00 1.96 -0.07 0.00 0.04 0.00 0.00 61.00 62.92 1jzq s PRO 426 Cb 0.00 -4.28 0.38 0.00 0.04 0.00 0.00 34.50 30.64 1jzq s PRO 426 CO 0.00 -1.83 1.69 -1.35 0.04 0.00 0.00 177.00 175.55 1jzq h PRO 427 N 13.65 0.25 0.00 0.56 0.11 -1.95 -2.52 132.00 142.10 1jzq h PRO 427 Ca -0.40 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1jzq h PRO 427 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1jzq h PRO 427 CO 0.98 0.17 0.02 -2.39 -0.21 0.00 0.00 178.00 176.56 1jzq n HIS 428 N -5.15 0.00 0.31 0.65 1.44 -1.26 -1.11 115.22 110.10 1jzq n HIS 428 Ca 0.12 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.94 1jzq n HIS 428 Cb 0.39 -0.07 0.10 0.00 0.12 0.00 0.00 29.99 30.53 1jzq n HIS 428 CO 0.00 0.00 0.00 0.82 -2.81 0.00 0.00 176.34 174.35 1jzq h ILE 429 N 0.00 0.00 -0.40 0.61 1.08 -1.81 0.75 117.51 117.74 1jzq h ILE 429 Ca 0.00 -0.79 -0.08 0.00 -0.39 0.00 0.00 64.86 63.60 1jzq h ILE 429 Cb 0.05 1.41 -0.01 0.00 -3.07 0.00 0.00 36.82 35.19 1jzq h ILE 429 CO 0.00 0.00 -0.07 0.50 -0.69 0.00 0.00 178.15 177.89 1jzq h LYS 430 N 0.00 0.76 0.00 2.37 3.64 -1.34 -1.27 116.57 120.73 1jzq h LYS 430 Ca 0.00 -0.28 -0.29 0.00 -1.27 0.00 0.00 60.65 58.81 1jzq h LYS 430 Cb 0.90 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.61 1jzq h LYS 430 CO 0.00 0.88 -2.08 0.39 -2.27 0.00 0.00 179.45 176.38 1jzq n GLU 431 N -4.36 1.20 0.00 1.90 4.71 -1.26 -2.01 120.64 120.82 1jzq n GLU 431 Ca -0.01 0.03 0.00 0.00 -0.01 0.00 0.00 57.16 57.17 1jzq n GLU 431 Cb 0.34 -1.40 0.00 0.00 -1.01 0.00 0.00 31.44 29.38 1jzq n GLU 431 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1jzq n GLY 432 N 2.19 -1.19 0.36 0.62 0.00 0.26 -1.49 105.19 105.94 1jzq n GLY 432 Ca -0.28 -0.10 -0.01 0.00 0.00 0.00 0.00 46.02 45.63 1jzq n GLY 432 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jzq n ARG 433 N 0.00 -0.22 -0.03 1.61 5.12 -1.24 -0.74 116.66 121.14 1jzq n ARG 433 Ca 0.00 1.44 -0.09 0.00 -1.93 0.00 0.00 57.85 57.27 1jzq n ARG 433 Cb 0.00 -2.14 -0.14 0.00 -1.16 0.00 0.00 32.46 29.01 1jzq n ARG 433 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 1jzq n TYR 434 N -5.38 0.83 -0.11 -1.55 9.36 -0.49 -3.68 117.16 116.14 1jzq n TYR 434 Ca 0.09 0.30 -0.10 0.00 3.32 0.00 0.00 57.90 61.52 1jzq n TYR 434 Cb 0.37 -1.15 -0.02 0.00 -0.63 0.00 0.00 39.34 37.91 1jzq n TYR 434 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1jzq h GLY 435 N 3.57 0.55 0.72 2.98 0.00 -1.07 -3.07 103.07 106.76 1jzq h GLY 435 Ca -0.33 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 46.68 1jzq h GLY 435 CO 0.07 0.30 -0.26 -2.09 0.00 0.00 0.00 176.54 174.56 1jzq h GLU 436 N 0.39 -0.55 -1.14 4.80 4.57 0.19 -2.35 114.58 120.49 1jzq h GLU 436 Ca 0.11 0.04 0.32 0.00 -1.18 0.00 0.00 59.36 58.65 1jzq h GLU 436 Cb 0.24 0.13 -0.10 0.00 -0.16 0.00 0.00 28.75 28.85 1jzq h GLU 436 CO -0.00 -0.37 0.73 2.35 -1.18 0.00 0.00 179.01 180.54 1jzq h TRP 437 N -0.57 0.59 -0.17 0.92 7.01 -1.62 -0.12 115.95 121.99 1jzq h TRP 437 Ca -0.01 0.02 -0.17 0.00 2.11 0.00 0.00 58.89 60.84 1jzq h TRP 437 Cb 0.52 -0.16 -0.00 0.00 -2.10 0.00 0.00 29.16 27.41 1jzq h TRP 437 CO -0.16 -0.03 -0.58 -0.07 -2.79 0.00 0.00 178.44 174.80 1jzq h LEU 438 N 0.27 0.62 -1.69 0.65 3.38 -1.33 -2.32 115.31 114.90 1jzq h LEU 438 Ca 0.67 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 58.29 1jzq h LEU 438 Cb 1.89 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.46 1jzq h LEU 438 CO -0.33 1.07 0.00 0.11 0.09 0.00 0.00 178.44 179.38 1jzq h LYS 439 N 0.42 0.00 -0.09 1.13 1.57 -0.84 -1.80 116.57 116.97 1jzq h LYS 439 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1jzq h LYS 439 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1jzq h LYS 439 CO 0.11 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.08 1jzq n ASN 440 N -2.64 2.50 -4.35 0.86 4.13 -1.12 -5.07 115.26 109.56 1jzq n ASN 440 Ca -0.01 -2.47 -0.42 0.00 1.68 0.00 0.00 54.58 53.37 1jzq n ASN 440 Cb 0.15 -0.24 0.00 0.00 -1.54 0.00 0.00 39.78 38.15 1jzq n ASN 440 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1jzq n LEU 441 N -0.63 -1.85 -4.02 3.41 0.00 -0.68 -4.99 117.00 108.24 1jzq n LEU 441 Ca 0.10 0.85 -0.12 0.00 0.00 0.00 0.00 56.01 56.84 1jzq n LEU 441 Cb 0.48 -0.96 -0.12 0.00 0.00 0.00 0.00 43.42 42.82 1jzq n LEU 441 CO 0.04 -3.73 -0.39 -0.69 0.00 0.00 0.00 177.39 172.62 1jzq s VAL 442 N -1.59 0.36 0.30 1.96 1.01 -1.26 -4.97 120.40 116.21 1jzq s VAL 442 Ca 0.61 -0.89 -0.27 0.00 0.00 0.00 0.00 61.98 61.44 1jzq s VAL 442 Cb -0.63 -0.44 -0.14 0.00 0.00 0.00 0.00 36.38 35.17 1jzq s VAL 442 CO 0.61 -0.35 0.78 0.47 0.00 0.00 0.00 175.10 176.60 1jzq n ASP 443 N 1.73 0.16 -4.64 3.32 10.43 -1.26 -4.85 116.55 121.44 1jzq n ASP 443 Ca -0.22 1.10 -0.43 0.00 2.57 0.00 0.00 54.79 57.81 1jzq n ASP 443 Cb 0.55 -1.17 -0.02 0.00 1.84 0.00 0.00 41.12 42.33 1jzq n ASP 443 CO 0.00 0.00 0.00 0.86 -1.07 0.00 0.00 177.20 176.99 1jzq s TRP 444 N -1.15 3.16 -0.56 1.24 -0.11 -1.07 -4.80 118.94 115.65 1jzq s TRP 444 Ca 0.61 1.21 -0.25 0.00 1.22 0.00 0.00 56.10 58.89 1jzq s TRP 444 Cb -0.73 -3.67 0.04 0.00 -1.50 0.00 0.00 33.47 27.61 1jzq s TRP 444 CO 0.58 -0.75 1.02 0.00 -4.62 0.00 0.00 176.95 173.19 1jzq s ALA 445 N 3.62 3.10 -0.16 5.86 0.00 -1.26 -1.01 121.76 131.92 1jzq s ALA 445 Ca 0.45 -1.13 -0.13 0.00 0.00 0.00 0.00 51.96 51.15 1jzq s ALA 445 Cb -0.12 -3.84 -0.08 0.00 0.00 0.00 0.00 23.12 19.08 1jzq s ALA 445 CO 0.15 -2.49 -0.04 1.25 0.00 0.00 0.00 175.76 174.62 1jzq h LEU 446 N 11.30 0.00 -9.43 0.00 5.85 -1.03 -3.39 115.31 118.61 1jzq h LEU 446 Ca -0.26 -0.17 -0.62 0.00 0.84 0.00 0.00 57.88 57.67 1jzq h LEU 446 Cb 1.07 0.00 0.08 0.00 0.37 0.00 0.00 40.66 42.18 1jzq h LEU 446 CO 1.12 0.98 0.35 -1.54 -0.34 0.00 0.00 178.44 179.02 1jzq n SER 447 N -4.56 1.75 -3.95 1.25 3.41 -1.10 -2.81 113.62 107.61 1jzq n SER 447 Ca -0.15 1.15 -0.24 0.00 -0.26 0.00 0.00 58.87 59.37 1jzq n SER 447 Cb 0.39 -1.29 -0.17 0.00 -0.26 0.00 0.00 64.21 62.89 1jzq n SER 447 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1jzq s ARG 448 N -0.54 1.36 -1.44 4.33 1.81 -0.47 -4.54 118.95 119.46 1jzq s ARG 448 Ca 0.70 -0.27 -0.12 0.00 -1.72 0.00 0.00 55.73 54.32 1jzq s ARG 448 Cb -0.77 -1.26 0.05 0.00 -0.45 0.00 0.00 34.95 32.52 1jzq s ARG 448 CO 0.52 -0.08 2.30 0.09 -0.68 0.00 0.00 175.30 177.46 1jzq n ASN 449 N 4.17 5.36 -0.36 0.23 4.13 -1.26 -0.88 115.26 126.64 1jzq n ASN 449 Ca -0.21 -2.87 0.00 0.00 1.68 0.00 0.00 54.58 53.18 1jzq n ASN 449 Cb 0.51 -1.58 0.00 0.00 -1.54 0.00 0.00 39.78 37.17 1jzq n ASN 449 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1jzq n ARG 450 N 4.81 1.45 0.00 3.52 5.12 -1.26 -4.72 116.66 125.57 1jzq n ARG 450 Ca 0.55 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.47 1jzq n ARG 450 Cb 0.34 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.64 1jzq n ARG 450 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1jzq n TYR 451 N 0.00 0.00 -3.18 -1.55 4.02 -1.26 -4.72 117.16 110.46 1jzq n TYR 451 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.44 1jzq n TYR 451 Cb 0.00 0.02 -0.01 0.00 -0.02 0.00 0.00 39.34 39.32 1jzq n TYR 451 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 176.86 175.39 1jzq s TRP 452 N -1.85 3.69 0.13 -0.72 -0.00 -1.26 -4.34 118.94 114.59 1jzq s TRP 452 Ca 0.00 -2.03 -0.23 0.00 -0.00 0.00 0.00 56.10 53.84 1jzq s TRP 452 Cb 0.00 -4.00 0.08 0.00 -0.00 0.00 0.00 33.47 29.55 1jzq s TRP 452 CO 0.00 -1.16 1.09 0.41 -0.00 0.00 0.00 176.95 177.30 1jzq n GLY 453 N 4.06 0.50 3.63 5.86 0.00 -1.26 0.75 105.19 118.74 1jzq n GLY 453 Ca 0.22 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 1jzq n GLY 453 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jzq s THR 454 N -2.05 4.00 0.65 2.61 2.01 -1.26 -4.53 115.64 117.07 1jzq s THR 454 Ca 0.25 1.14 -0.17 0.00 0.31 0.00 0.00 61.69 63.22 1jzq s THR 454 Cb -0.02 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 1jzq s THR 454 CO 0.04 -0.37 0.86 -2.65 -0.69 0.00 0.00 174.62 171.81 1jzq n PRO 455 N 7.33 0.66 -3.09 4.92 -0.02 -1.26 -1.35 135.00 142.19 1jzq n PRO 455 Ca 0.16 0.27 -0.43 0.00 -2.02 0.00 0.00 63.50 61.48 1jzq n PRO 455 Cb 0.46 -2.09 -0.06 0.00 -0.02 0.00 0.00 33.50 31.79 1jzq n PRO 455 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1jzq s LEU 456 N -1.80 4.63 0.00 2.45 2.96 -1.08 -4.64 118.68 121.20 1jzq s LEU 456 Ca 0.74 -0.56 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 1jzq s LEU 456 Cb -0.39 -2.63 0.00 0.00 0.50 0.00 0.00 46.19 43.67 1jzq s LEU 456 CO 0.50 -0.88 0.00 -0.81 -1.32 0.00 0.00 176.35 173.84 1jzq n PRO 457 N 6.38 0.00 -4.27 0.98 -0.04 -1.26 -4.66 135.00 132.14 1jzq n PRO 457 Ca -0.03 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.09 1jzq n PRO 457 Cb 0.47 -1.43 -0.10 0.00 -0.04 0.00 0.00 33.50 32.39 1jzq n PRO 457 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1jzq s ILE 458 N 1.33 4.34 -0.22 0.52 1.09 -1.26 -1.82 121.20 125.16 1jzq s ILE 458 Ca 0.00 -0.21 -0.04 0.00 -1.10 0.00 0.00 60.65 59.30 1jzq s ILE 458 Cb 0.00 -2.89 -0.01 0.00 -1.06 0.00 0.00 42.46 38.50 1jzq s ILE 458 CO 0.00 0.53 -0.04 0.26 -0.10 0.00 0.00 174.94 175.59 1jzq s TRP 459 N -0.10 2.96 0.12 3.97 0.51 0.79 -1.40 118.94 125.80 1jzq s TRP 459 Ca 0.04 -0.91 -0.03 0.00 -2.12 0.00 0.00 56.10 53.09 1jzq s TRP 459 Cb -0.13 -2.11 -0.05 0.00 -0.81 0.00 0.00 33.47 30.37 1jzq s TRP 459 CO 0.02 -0.54 0.33 0.08 -0.51 0.00 0.00 176.95 176.33 1jzq s VAL 460 N 1.49 5.23 -0.10 4.03 1.01 -0.17 -2.11 120.40 129.77 1jzq s VAL 460 Ca 0.06 -0.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.80 1jzq s VAL 460 Cb -0.14 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.56 1jzq s VAL 460 CO -0.03 0.05 0.29 0.00 0.00 0.00 0.00 175.10 175.42 1jzq n GLN 462 N 2.66 0.73 0.00 0.00 6.02 -1.17 -4.58 117.38 121.04 1jzq n GLN 462 Ca -0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.85 1jzq n GLN 462 Cb 0.53 -1.32 0.00 0.00 1.02 0.00 0.00 30.24 30.47 1jzq n GLN 462 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1jzq n ALA 463 N -0.82 1.44 -1.00 -1.58 0.00 -1.26 -5.08 120.51 112.21 1jzq n ALA 463 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1jzq n ALA 463 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 1jzq n ALA 463 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jzq n GLY 465 N 2.26 0.67 0.00 0.00 0.00 -1.26 -4.73 105.19 102.13 1jzq n GLY 465 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 46.02 46.86 1jzq n GLY 465 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1jzq n LYS 466 N 8.57 1.49 0.00 1.61 5.02 -1.26 -4.31 118.16 129.28 1jzq n LYS 466 Ca 0.36 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1jzq n LYS 466 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.37 1jzq n LYS 466 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1jzq n GLU 467 N 0.00 0.00 -3.69 1.97 4.71 -1.25 -4.65 120.64 117.73 1jzq n GLU 467 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.16 57.02 1jzq n GLU 467 Cb 0.00 0.00 -0.09 0.00 -1.01 0.00 0.00 31.44 30.34 1jzq n GLU 467 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1jzq s GLU 468 N 0.00 0.61 -0.08 3.49 2.12 -0.90 -4.97 118.70 118.96 1jzq s GLU 468 Ca 0.00 0.77 0.04 0.00 0.36 0.00 0.00 54.97 56.14 1jzq s GLU 468 Cb 0.00 0.27 -0.01 0.00 0.26 0.00 0.00 34.13 34.65 1jzq s GLU 468 CO 0.00 -0.09 -0.21 0.00 -0.54 0.00 0.00 175.26 174.42 1jzq s ALA 469 N 0.45 2.31 -0.03 6.30 0.00 -1.26 -0.15 121.76 129.38 1jzq s ALA 469 Ca -0.01 -0.99 -0.20 0.00 0.00 0.00 0.00 51.96 50.76 1jzq s ALA 469 Cb -0.04 -0.86 -0.05 0.00 0.00 0.00 0.00 23.12 22.17 1jzq s ALA 469 CO -0.02 0.36 0.58 0.42 0.00 0.00 0.00 175.76 177.11 1jzq s ILE 470 N 0.03 4.98 -1.05 0.00 1.09 -0.76 -4.91 121.20 120.59 1jzq s ILE 470 Ca -0.08 1.21 0.13 0.00 -1.10 0.00 0.00 60.65 60.81 1jzq s ILE 470 Cb -0.15 -3.92 -0.05 0.00 -1.06 0.00 0.00 42.46 37.28 1jzq s ILE 470 CO 0.05 0.38 0.70 0.61 -0.10 0.00 0.00 174.94 176.58 1jzq n GLY 471 N 2.67 -0.13 3.58 6.18 0.00 -1.26 -4.65 105.19 111.57 1jzq n GLY 471 Ca -0.06 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.48 1jzq n GLY 471 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jzq s SER 472 N -1.85 -0.37 0.25 1.61 1.04 -1.26 -3.12 113.70 110.00 1jzq s SER 472 Ca 0.09 -0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.20 1jzq s SER 472 Cb 0.11 0.63 0.29 0.00 0.10 0.00 0.00 66.02 67.15 1jzq s SER 472 CO 0.40 -1.10 1.62 -0.26 0.98 0.00 0.00 173.24 174.88 1jzq h PHE 473 N 2.07 0.49 -0.36 5.02 0.04 -1.96 -2.95 116.94 119.30 1jzq h PHE 473 Ca -0.28 -0.15 0.08 0.00 2.80 0.00 0.00 57.97 60.42 1jzq h PHE 473 Cb 1.28 -0.10 -0.08 0.00 2.20 0.00 0.00 35.95 39.25 1jzq h PHE 473 CO 0.33 0.78 -0.14 0.37 -0.60 0.00 0.00 178.31 179.06 1jzq h GLN 474 N 0.34 -0.06 0.11 1.51 5.75 -2.00 -1.39 115.11 119.36 1jzq h GLN 474 Ca 0.02 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1jzq h GLN 474 Cb 0.91 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.47 1jzq h GLN 474 CO 0.08 -0.04 -0.09 0.93 -2.65 0.00 0.00 178.83 177.05 1jzq h GLU 475 N -0.06 -0.21 -0.84 1.69 5.08 -1.94 -2.66 114.58 115.64 1jzq h GLU 475 Ca 0.18 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 58.72 1jzq h GLU 475 Cb 0.34 0.05 -0.16 0.00 0.50 0.00 0.00 28.75 29.48 1jzq h GLU 475 CO -0.41 -0.14 -0.23 1.25 -1.00 0.00 0.00 179.01 178.48 1jzq h LEU 476 N -0.22 -0.87 -0.82 1.33 6.46 -1.17 0.30 115.31 120.32 1jzq h LEU 476 Ca -0.00 0.26 -0.04 0.00 -0.12 0.00 0.00 57.88 57.97 1jzq h LEU 476 Cb 0.20 0.55 -0.04 0.00 -0.73 0.00 0.00 40.66 40.64 1jzq h LEU 476 CO -0.01 -0.28 0.35 0.50 -0.62 0.00 0.00 178.44 178.37 1jzq h LYS 477 N -0.01 1.21 0.00 1.25 3.11 -1.05 0.58 116.57 121.66 1jzq h LYS 477 Ca 0.39 -0.21 0.00 0.00 -2.81 0.00 0.00 60.65 58.02 1jzq h LYS 477 Cb 0.61 -0.20 0.00 0.00 -1.00 0.00 0.00 32.23 31.64 1jzq h LYS 477 CO -0.87 0.96 0.00 0.00 -2.81 0.00 0.00 179.45 176.73 1jzq h ALA 478 N 1.19 1.00 0.00 5.00 0.00 -0.17 -3.23 119.26 123.05 1jzq h ALA 478 Ca 0.28 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.78 1jzq h ALA 478 Cb 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 1jzq h ALA 478 CO -0.03 0.00 -2.48 0.54 0.00 0.00 0.00 179.25 177.28 1jzq n ARG 479 N -2.82 0.63 -1.47 0.00 5.12 0.07 -4.99 116.66 113.19 1jzq n ARG 479 Ca 0.01 0.18 -0.46 0.00 -1.93 0.00 0.00 57.85 55.65 1jzq n ARG 479 Cb 0.28 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 30.06 1jzq n ARG 479 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1jzq n ALA 480 N -3.50 -1.86 0.18 7.54 0.00 0.20 -3.01 120.51 120.06 1jzq n ALA 480 Ca -0.48 0.39 0.12 0.00 0.00 0.00 0.00 53.44 53.48 1jzq n ALA 480 Cb 0.96 -1.76 0.07 0.00 0.00 0.00 0.00 19.45 18.72 1jzq n ALA 480 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1jzq h THR 481 N 1.31 0.00 -4.34 0.00 1.35 -1.55 -3.46 112.91 106.22 1jzq h THR 481 Ca -0.33 -0.95 -0.57 0.00 -0.55 0.00 0.00 66.41 64.00 1jzq h THR 481 Cb 1.40 1.61 -0.29 0.00 -1.73 0.00 0.00 68.15 69.15 1jzq h THR 481 CO 0.58 0.00 -0.84 -0.54 -0.25 0.00 0.00 175.52 174.46 1jzq s LYS 482 N -3.30 1.51 0.31 4.72 3.01 -1.26 -5.10 119.74 119.62 1jzq s LYS 482 Ca 0.02 -0.73 -0.30 0.00 -1.01 0.00 0.00 55.97 53.96 1jzq s LYS 482 Cb 0.09 -1.49 -0.11 0.00 -1.01 0.00 0.00 37.83 35.30 1jzq s LYS 482 CO 0.75 0.40 1.59 -1.25 0.51 0.00 0.00 175.35 177.35 1jzq s PRO 483 N -0.57 4.11 0.70 -1.68 0.04 -1.26 -4.94 135.00 131.39 1jzq s PRO 483 Ca 0.07 2.59 -0.15 0.00 0.04 0.00 0.00 61.00 63.56 1jzq s PRO 483 Cb -0.08 -3.01 0.02 0.00 0.04 0.00 0.00 34.50 31.47 1jzq s PRO 483 CO -0.00 -0.63 1.14 -0.51 0.04 0.00 0.00 177.00 177.04 1jzq s LEU 484 N -0.73 3.33 0.22 -3.56 1.43 -1.26 -4.94 118.68 113.18 1jzq s LEU 484 Ca 0.62 2.12 -0.31 0.00 -1.03 0.00 0.00 54.13 55.52 1jzq s LEU 484 Cb -0.48 -4.56 -0.11 0.00 0.03 0.00 0.00 46.19 41.06 1jzq s LEU 484 CO 0.50 -1.91 1.66 -2.16 0.23 0.00 0.00 176.35 174.67 1jzq s PRO 485 N -4.09 4.14 0.18 1.29 0.04 -1.26 -4.90 135.00 130.41 1jzq s PRO 485 Ca 0.69 2.56 -0.21 0.00 0.04 0.00 0.00 61.00 64.07 1jzq s PRO 485 Cb -0.23 -3.07 0.10 0.00 0.04 0.00 0.00 34.50 31.34 1jzq s PRO 485 CO 0.44 -0.69 1.42 0.39 0.04 0.00 0.00 177.00 178.60 1jzq n GLU 486 N 3.47 -0.29 -2.94 4.56 1.02 -1.26 -1.62 120.64 123.58 1jzq n GLU 486 Ca 0.13 1.40 -0.44 0.00 -0.02 0.00 0.00 57.16 58.23 1jzq n GLU 486 Cb 0.36 -2.07 -0.00 0.00 -0.02 0.00 0.00 31.44 29.71 1jzq n GLU 486 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1jzq s PRO 487 N -5.70 4.03 -0.39 3.49 0.04 -1.26 -4.97 135.00 130.24 1jzq s PRO 487 Ca -0.12 -2.48 -0.29 0.00 0.04 0.00 0.00 61.00 58.16 1jzq s PRO 487 Cb 0.15 -5.06 0.00 0.00 0.04 0.00 0.00 34.50 29.63 1jzq s PRO 487 CO 0.62 -1.78 1.53 0.12 0.04 0.00 0.00 177.00 177.53 1jzq s PHE 488 N 1.76 2.22 -0.30 0.56 5.36 -0.64 -4.99 117.98 121.95 1jzq s PHE 488 Ca 0.42 0.65 -0.06 0.00 -0.96 0.00 0.00 56.93 56.98 1jzq s PHE 488 Cb -0.03 -4.26 0.02 0.00 -0.34 0.00 0.00 43.02 38.41 1jzq s PHE 488 CO -0.01 -2.28 0.06 0.34 -1.46 0.00 0.00 175.22 171.87 1jzq s ASP 489 N 4.60 5.03 -0.46 6.13 2.15 -1.26 -4.95 116.67 127.90 1jzq s ASP 489 Ca 0.67 -0.84 -0.06 0.00 0.43 0.00 0.00 52.55 52.75 1jzq s ASP 489 Cb -0.16 -1.84 -0.15 0.00 -0.30 0.00 0.00 42.92 40.47 1jzq s ASP 489 CO 0.33 -0.21 2.72 -0.81 -0.17 0.00 0.00 175.17 177.03 1jzq n PRO 490 N 4.82 1.99 -4.46 4.34 -0.04 -1.26 -4.48 135.00 135.91 1jzq n PRO 490 Ca -0.14 -1.14 -0.24 0.00 -0.04 0.00 0.00 63.50 61.94 1jzq n PRO 490 Cb 0.47 -2.15 -0.10 0.00 -0.04 0.00 0.00 33.50 31.68 1jzq n PRO 490 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1jzq s HIS 491 N 2.01 2.31 0.00 0.54 3.76 -1.26 -4.44 115.29 118.20 1jzq s HIS 491 Ca 0.51 -0.33 0.00 0.00 -0.15 0.00 0.00 55.06 55.10 1jzq s HIS 491 Cb 0.20 -1.01 0.00 0.00 1.11 0.00 0.00 32.58 32.88 1jzq s HIS 491 CO -0.02 0.70 0.00 -2.13 -0.85 0.00 0.00 174.74 172.44 1jzq n ARG 492 N -0.56 0.00 -0.20 1.40 0.00 -1.26 -1.60 116.66 114.44 1jzq n ARG 492 Ca -0.06 0.00 -0.03 0.00 -0.00 0.00 0.00 57.85 57.77 1jzq n ARG 492 Cb 0.60 0.00 0.08 0.00 0.00 0.00 0.00 32.46 33.13 1jzq n ARG 492 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 1jzq h PRO 493 N 0.00 0.53 -0.12 -0.14 0.13 -1.94 -2.99 132.00 127.48 1jzq h PRO 493 Ca 0.00 -0.03 -0.20 0.00 -0.87 0.00 0.00 66.00 64.90 1jzq h PRO 493 Cb 0.00 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.01 1jzq h PRO 493 CO 0.00 0.35 -0.74 1.88 -0.23 0.00 0.00 178.00 179.27 1jzq h TYR 494 N 0.55 0.77 0.00 1.56 -1.99 -1.58 -3.19 116.97 113.08 1jzq h TYR 494 Ca 0.26 -0.34 -0.00 0.00 2.00 0.00 0.00 58.73 60.66 1jzq h TYR 494 Cb 0.20 -0.12 -0.00 0.00 2.00 0.00 0.00 36.73 38.81 1jzq h TYR 494 CO -0.11 1.12 -0.01 -0.39 -0.00 0.00 0.00 178.16 178.78 1jzq h VAL 495 N 0.40 0.02 0.00 -2.88 -1.51 -1.38 -2.92 116.25 107.97 1jzq h VAL 495 Ca -0.04 -0.71 0.00 0.00 -1.23 0.00 0.00 66.70 64.73 1jzq h VAL 495 Cb 1.33 1.69 0.00 0.00 -2.13 0.00 0.00 31.29 32.18 1jzq h VAL 495 CO 0.14 0.01 0.00 0.47 -1.23 0.00 0.00 177.57 176.96 1jzq n ASP 496 N -3.10 0.00 0.01 4.19 8.00 -1.13 -3.06 116.55 121.46 1jzq n ASP 496 Ca 0.02 0.49 0.11 0.00 0.71 0.00 0.00 54.79 56.12 1jzq n ASP 496 Cb 0.39 -0.50 -0.11 0.00 -0.02 0.00 0.00 41.12 40.88 1jzq n ASP 496 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jzq n GLN 497 N -1.50 0.44 -2.50 -1.24 1.13 -1.10 -4.82 117.38 107.79 1jzq n GLN 497 Ca 0.04 -0.09 -0.42 0.00 -1.94 0.00 0.00 57.00 54.59 1jzq n GLN 497 Cb 0.20 -1.55 -0.03 0.00 0.11 0.00 0.00 30.24 28.97 1jzq n GLN 497 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1jzq s VAL 498 N -3.33 4.30 -0.13 5.09 1.01 -1.17 -5.02 120.40 121.15 1jzq s VAL 498 Ca -0.02 1.64 0.02 0.00 0.00 0.00 0.00 61.98 63.62 1jzq s VAL 498 Cb 0.14 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.48 1jzq s VAL 498 CO 0.87 0.07 -0.19 -1.61 0.00 0.00 0.00 175.10 174.24 1jzq s GLU 499 N 1.55 2.67 0.37 2.72 2.02 -1.26 -4.51 118.70 122.25 1jzq s GLU 499 Ca 0.56 -0.72 0.01 0.00 0.02 0.00 0.00 54.97 54.83 1jzq s GLU 499 Cb -0.26 -2.22 -0.03 0.00 0.10 0.00 0.00 34.13 31.73 1jzq s GLU 499 CO 0.26 -0.06 0.57 -0.51 0.02 0.00 0.00 175.26 175.53 1jzq s LEU 500 N 0.96 3.94 -0.05 1.80 1.43 -1.13 -1.37 118.68 124.26 1jzq s LEU 500 Ca -0.05 0.39 -0.20 0.00 -1.03 0.00 0.00 54.13 53.24 1jzq s LEU 500 Cb -0.15 -3.26 -0.05 0.00 0.03 0.00 0.00 46.19 42.76 1jzq s LEU 500 CO -0.03 -0.38 0.57 0.00 0.23 0.00 0.00 176.35 176.74 1jzq s ALA 501 N -2.36 3.47 0.29 4.21 0.00 -1.16 -0.84 121.76 125.36 1jzq s ALA 501 Ca 0.42 -0.03 -0.10 0.00 0.00 0.00 0.00 51.96 52.25 1jzq s ALA 501 Cb -0.10 -2.73 -0.07 0.00 0.00 0.00 0.00 23.12 20.22 1jzq s ALA 501 CO 0.36 0.09 0.62 0.00 0.00 0.00 0.00 175.76 176.83 1jzq h ALA 503 N 2.07 1.78 0.00 0.00 0.00 -1.96 0.45 119.26 121.60 1jzq h ALA 503 Ca -0.47 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1jzq h ALA 503 Cb 1.18 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1jzq h ALA 503 CO 0.67 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.86 1jzq n GLY 505 N 0.71 0.55 3.90 0.00 0.00 0.16 -5.08 105.19 105.43 1jzq n GLY 505 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1jzq n GLY 505 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jzq s GLY 506 N -0.93 1.54 0.20 -0.02 0.00 -1.25 -4.71 107.32 102.15 1jzq s GLY 506 Ca 0.00 -0.50 -0.18 0.00 0.00 0.00 0.00 44.72 44.04 1jzq s GLY 506 CO 0.00 -0.34 0.68 -1.08 0.00 0.00 0.00 173.10 172.36 1jzq s THR 507 N -2.67 4.65 -0.05 0.90 -1.32 -1.26 0.12 115.64 116.01 1jzq s THR 507 Ca 0.47 1.17 0.05 0.00 -1.21 0.00 0.00 61.69 62.17 1jzq s THR 507 Cb -0.10 -3.83 -0.02 0.00 -1.51 0.00 0.00 72.50 67.04 1jzq s THR 507 CO 0.43 0.22 -0.18 -0.04 -2.21 0.00 0.00 174.62 172.84 1jzq s MET 508 N -1.95 2.47 0.05 7.08 1.00 -0.02 -3.06 119.30 124.87 1jzq s MET 508 Ca 0.41 -0.77 0.09 0.00 0.00 0.00 0.00 55.69 55.42 1jzq s MET 508 Cb -0.16 -2.29 -0.03 0.00 0.00 0.00 0.00 34.83 32.35 1jzq s MET 508 CO 0.20 0.56 -0.24 1.03 0.00 0.00 0.00 175.02 176.57 1jzq s ARG 509 N -0.57 1.85 0.50 2.03 1.81 -0.54 -2.86 118.95 121.17 1jzq s ARG 509 Ca 0.08 -1.09 -0.10 0.00 -1.72 0.00 0.00 55.73 52.90 1jzq s ARG 509 Cb -0.11 -2.03 -0.05 0.00 -0.45 0.00 0.00 34.95 32.31 1jzq s ARG 509 CO 0.01 0.52 0.87 -0.98 -0.68 0.00 0.00 175.30 175.03 1jzq s ARG 510 N -1.34 3.68 0.99 3.54 1.70 -1.26 -1.00 118.95 125.26 1jzq s ARG 510 Ca 0.13 0.52 -0.11 0.00 -0.47 0.00 0.00 55.73 55.80 1jzq s ARG 510 Cb -0.10 -2.27 0.19 0.00 -0.57 0.00 0.00 34.95 32.19 1jzq s ARG 510 CO 0.03 -0.25 1.11 0.14 -1.08 0.00 0.00 175.30 175.24 1jzq s VAL 511 N -2.72 2.08 -1.98 4.99 -7.23 -0.49 -4.86 120.40 110.19 1jzq s VAL 511 Ca 0.52 0.03 0.22 0.00 -1.81 0.00 0.00 61.98 60.94 1jzq s VAL 511 Cb -0.10 -2.07 0.63 0.00 0.56 0.00 0.00 36.38 35.39 1jzq s VAL 511 CO 0.41 -0.04 1.53 -0.81 -0.31 0.00 0.00 175.10 175.88 1jzq n PRO 512 N -4.45 2.67 -1.62 4.82 -0.04 -1.26 -4.89 135.00 130.23 1jzq n PRO 512 Ca 0.09 -2.57 -0.29 0.00 -0.04 0.00 0.00 63.50 60.69 1jzq n PRO 512 Cb 0.53 -1.56 0.14 0.00 -0.04 0.00 0.00 33.50 32.57 1jzq n PRO 512 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1jzq s TYR 513 N -1.06 2.27 -0.03 0.54 1.51 -1.26 -4.75 117.35 114.56 1jzq s TYR 513 Ca 0.48 0.72 -0.01 0.00 -1.01 0.00 0.00 57.07 57.25 1jzq s TYR 513 Cb 0.25 -3.52 0.03 0.00 -0.11 0.00 0.00 41.96 38.61 1jzq s TYR 513 CO 0.32 -2.44 0.06 0.08 -1.11 0.00 0.00 175.55 172.46 1jzq s VAL 514 N -3.40 -0.09 0.72 0.71 1.01 -0.06 -2.63 120.40 116.66 1jzq s VAL 514 Ca 0.66 0.33 -0.17 0.00 0.00 0.00 0.00 61.98 62.79 1jzq s VAL 514 Cb -0.12 -0.13 -0.09 0.00 0.00 0.00 0.00 36.38 36.04 1jzq s VAL 514 CO 0.53 0.14 0.09 -0.38 0.00 0.00 0.00 175.10 175.48 1jzq n ILE 515 N 4.78 0.90 -2.57 2.22 -0.00 -0.46 -1.37 119.36 122.85 1jzq n ILE 515 Ca -0.15 -0.44 -0.41 0.00 -0.00 0.00 0.00 62.75 61.75 1jzq n ILE 515 Cb 0.50 -0.39 -0.04 0.00 -0.00 0.00 0.00 39.64 39.71 1jzq n ILE 515 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1jzq s ASP 516 N -1.27 7.32 0.64 4.38 2.15 -1.12 -4.58 116.67 124.19 1jzq s ASP 516 Ca 0.58 1.98 0.32 0.00 0.43 0.00 0.00 52.55 55.86 1jzq s ASP 516 Cb -0.36 -2.60 1.73 0.00 -0.30 0.00 0.00 42.92 41.40 1jzq s ASP 516 CO 0.65 -0.20 2.01 -0.37 -0.17 0.00 0.00 175.17 177.09 1jzq h VAL 517 N 3.94 0.13 0.00 1.11 -1.51 -1.92 0.15 116.25 118.15 1jzq h VAL 517 Ca -0.43 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.01 1jzq h VAL 517 Cb 1.21 0.74 -0.00 0.00 -2.13 0.00 0.00 31.29 31.11 1jzq h VAL 517 CO 0.73 0.00 -0.11 -0.50 -1.23 0.00 0.00 177.57 176.46 1jzq h TRP 518 N 0.00 0.00 -0.10 5.19 4.06 -1.95 -0.82 115.95 122.32 1jzq h TRP 518 Ca 0.05 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 60.82 1jzq h TRP 518 Cb 0.61 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.77 1jzq h TRP 518 CO 0.00 0.11 -0.68 -0.92 -3.56 0.00 0.00 178.44 173.39 1jzq h TYR 519 N 0.00 0.56 0.66 0.49 3.20 -1.08 -0.96 116.97 119.85 1jzq h TYR 519 Ca -0.00 -0.23 -0.03 0.00 3.14 0.00 0.00 58.73 61.60 1jzq h TYR 519 Cb 0.77 -0.09 0.01 0.00 1.54 0.00 0.00 36.73 38.95 1jzq h TYR 519 CO 0.00 0.98 -0.32 -0.44 -1.64 0.00 0.00 178.16 176.74 1jzq h ASP 520 N 0.30 -0.75 0.00 -2.11 3.32 -1.37 -1.53 116.42 114.29 1jzq h ASP 520 Ca -0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1jzq h ASP 520 Cb 1.24 0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.98 1jzq h ASP 520 CO 0.12 -0.37 0.10 0.28 -1.72 0.00 0.00 179.24 177.65 1jzq h SER 521 N -1.18 0.00 0.10 6.45 0.02 -1.24 -2.67 113.55 115.03 1jzq h SER 521 Ca -0.09 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.71 1jzq h SER 521 Cb 0.70 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.25 1jzq h SER 521 CO 0.15 0.00 -0.71 1.23 -1.14 0.00 0.00 176.83 176.36 1jzq h GLY 522 N 0.00 0.24 2.00 -3.77 0.00 -0.72 -3.33 103.07 97.48 1jzq h GLY 522 Ca 0.00 -0.61 -0.00 0.00 0.00 0.00 0.00 47.33 46.72 1jzq h GLY 522 CO 0.00 0.53 -0.01 0.00 0.00 0.00 0.00 176.54 177.06 1jzq h ALA 523 N 0.02 1.05 -0.15 3.60 0.00 -0.93 -3.37 119.26 119.48 1jzq h ALA 523 Ca -0.14 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.78 1jzq h ALA 523 Cb 1.49 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.26 1jzq h ALA 523 CO 0.09 0.02 -0.09 -0.12 0.00 0.00 0.00 179.25 179.14 1jzq n MET 524 N -3.17 -0.07 -0.35 0.00 1.56 -1.20 0.24 117.12 114.14 1jzq n MET 524 Ca -0.02 0.24 0.36 0.00 -0.27 0.00 0.00 57.70 58.01 1jzq n MET 524 Cb 0.16 -0.35 0.67 0.00 2.15 0.00 0.00 33.22 35.85 1jzq n MET 524 CO 0.00 0.00 0.00 -1.35 -0.73 0.00 0.00 175.97 173.89 1jzq h PRO 525 N 0.00 0.00 0.00 2.12 0.11 -1.88 0.91 132.00 133.26 1jzq h PRO 525 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1jzq h PRO 525 Cb 0.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.17 1jzq h PRO 525 CO -0.14 0.00 -0.93 1.97 -0.21 0.00 0.00 178.00 178.69 1jzq n PHE 526 N -3.72 0.00 0.11 0.65 1.16 0.14 -4.67 117.46 111.14 1jzq n PHE 526 Ca 0.28 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.90 1jzq n PHE 526 Cb 1.50 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 39.37 1jzq n PHE 526 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1jzq h ALA 527 N 0.00 0.68 0.00 1.98 0.00 -0.62 -2.66 119.26 118.64 1jzq h ALA 527 Ca 0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 1jzq h ALA 527 Cb 0.13 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1jzq h ALA 527 CO 0.00 0.60 -0.12 0.66 0.00 0.00 0.00 179.25 180.39 1jzq h SER 528 N 0.00 0.00 -0.82 0.00 4.64 -1.05 -3.39 113.55 112.93 1jzq h SER 528 Ca -0.05 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.74 1jzq h SER 528 Cb 1.37 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.44 1jzq h SER 528 CO 0.05 0.12 -0.25 -0.76 -0.87 0.00 0.00 176.83 175.12 1jzq s LEU 529 N -7.13 2.97 -0.23 5.97 1.43 -1.19 -4.93 118.68 115.58 1jzq s LEU 529 Ca -0.02 -1.01 0.12 0.00 -1.03 0.00 0.00 54.13 52.19 1jzq s LEU 529 Cb 0.13 -1.52 0.75 0.00 0.03 0.00 0.00 46.19 45.58 1jzq s LEU 529 CO 0.58 -1.09 1.67 1.57 0.23 0.00 0.00 176.35 179.30 1jzq n HIS 530 N -1.88 1.99 0.00 0.29 -0.00 -1.26 -4.84 115.22 109.53 1jzq n HIS 530 Ca 0.05 -0.73 0.00 0.00 0.46 0.00 0.00 57.72 57.50 1jzq n HIS 530 Cb 0.63 -0.51 0.00 0.00 -0.12 0.00 0.00 29.99 29.99 1jzq n HIS 530 CO 0.00 0.00 0.00 0.98 0.46 0.00 0.00 176.34 177.78 1jzq n TYR 531 N 0.49 0.00 0.02 1.57 9.36 -1.01 0.38 117.16 127.98 1jzq n TYR 531 Ca 0.27 0.00 0.10 0.00 3.32 0.00 0.00 57.90 61.60 1jzq n TYR 531 Cb 1.16 0.00 0.54 0.00 -0.63 0.00 0.00 39.34 40.41 1jzq n TYR 531 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1jzq h PRO 532 N 0.00 0.29 0.00 2.98 0.13 -1.92 -2.69 132.00 130.79 1jzq h PRO 532 Ca 0.00 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 1jzq h PRO 532 Cb 0.00 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.06 1jzq h PRO 532 CO 0.00 0.19 -0.86 1.19 -0.23 0.00 0.00 178.00 178.29 1jzq n PHE 533 N -4.47 0.25 -3.59 1.56 3.01 0.16 -4.91 117.46 109.47 1jzq n PHE 533 Ca 0.05 0.07 -0.10 0.00 1.01 0.00 0.00 57.45 58.48 1jzq n PHE 533 Cb 0.27 -0.41 -0.03 0.00 -0.01 0.00 0.00 39.48 39.30 1jzq n PHE 533 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1jzq s GLU 534 N -3.14 1.39 -1.32 -1.08 2.02 -1.01 -4.95 118.70 110.61 1jzq s GLU 534 Ca 0.06 -0.67 -0.01 0.00 0.02 0.00 0.00 54.97 54.37 1jzq s GLU 534 Cb 0.15 0.57 0.01 0.00 0.10 0.00 0.00 34.13 34.96 1jzq s GLU 534 CO 0.77 -0.61 0.07 0.72 0.02 0.00 0.00 175.26 176.24 1jzq n HIS 535 N -0.38 -1.36 -0.34 1.61 8.25 -1.26 -2.59 115.22 119.15 1jzq n HIS 535 Ca -0.13 0.07 0.25 0.00 -0.26 0.00 0.00 57.72 57.65 1jzq n HIS 535 Cb 0.63 -3.24 0.54 0.00 1.12 0.00 0.00 29.99 29.04 1jzq n HIS 535 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 1jzq h GLU 536 N -0.16 0.32 0.00 -0.41 4.22 -1.92 0.29 114.58 116.92 1jzq h GLU 536 Ca -0.38 -0.02 -0.21 0.00 0.08 0.00 0.00 59.36 58.83 1jzq h GLU 536 Cb 1.28 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1jzq h GLU 536 CO 0.44 0.21 -1.06 1.05 -2.18 0.00 0.00 179.01 177.48 1jzq h GLU 537 N 0.33 0.00 -0.01 1.92 9.09 -1.94 -3.10 114.58 120.88 1jzq h GLU 537 Ca 0.63 0.00 -0.21 0.00 0.05 0.00 0.00 59.36 59.83 1jzq h GLU 537 Cb 1.70 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.80 1jzq h GLU 537 CO -0.31 0.92 -0.88 0.28 0.05 0.00 0.00 179.01 179.07 1jzq h VAL 538 N 0.00 1.43 -0.26 -1.06 2.07 -0.89 -2.82 116.25 114.73 1jzq h VAL 538 Ca -0.04 -2.47 -0.02 0.00 0.82 0.00 0.00 66.70 64.99 1jzq h VAL 538 Cb 1.78 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 33.93 1jzq h VAL 538 CO 0.12 0.73 0.09 0.15 0.02 0.00 0.00 177.57 178.68 1jzq h PHE 539 N 0.19 0.42 -0.54 1.57 3.57 -1.05 -1.29 116.94 119.81 1jzq h PHE 539 Ca -0.06 -0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.35 1jzq h PHE 539 Cb 1.50 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 40.10 1jzq h PHE 539 CO 0.04 0.45 0.13 0.00 -2.23 0.00 0.00 178.31 176.71 1jzq h ARG 540 N 0.26 0.82 0.00 1.11 3.08 -1.57 0.52 114.38 118.60 1jzq h ARG 540 Ca 0.09 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 1jzq h ARG 540 Cb 0.23 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1jzq h ARG 540 CO -0.00 0.74 -0.27 0.93 -1.07 0.00 0.00 179.97 180.29 1jzq h GLU 541 N 0.80 0.00 0.00 0.04 5.08 -1.35 -3.32 114.58 115.83 1jzq h GLU 541 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1jzq h GLU 541 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1jzq h GLU 541 CO -0.00 0.27 -0.05 -1.13 -1.00 0.00 0.00 179.01 177.11 1jzq n SER 542 N -3.29 1.87 0.00 1.42 3.41 -0.50 -4.92 113.62 111.62 1jzq n SER 542 Ca 0.01 -2.50 0.00 0.00 -0.26 0.00 0.00 58.87 56.12 1jzq n SER 542 Cb 0.54 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 1jzq n SER 542 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1jzq n PHE 543 N -0.91 0.00 -1.48 7.33 7.35 0.18 -4.22 117.46 125.70 1jzq n PHE 543 Ca 0.08 0.00 -0.54 0.00 -0.76 0.00 0.00 57.45 56.23 1jzq n PHE 543 Cb 0.51 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.26 1jzq n PHE 543 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 1jzq n PRO 544 N 0.00 0.93 -1.71 -7.13 -0.02 -1.26 -4.79 135.00 121.01 1jzq n PRO 544 Ca 0.00 0.28 -0.33 0.00 -2.02 0.00 0.00 63.50 61.43 1jzq n PRO 544 Cb 0.00 -2.21 0.05 0.00 -0.02 0.00 0.00 33.50 31.33 1jzq n PRO 544 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jzq s ALA 545 N 6.10 2.41 -0.98 3.55 0.00 -1.04 -4.84 121.76 126.95 1jzq s ALA 545 Ca 1.08 0.62 0.25 0.00 0.00 0.00 0.00 51.96 53.91 1jzq s ALA 545 Cb -1.02 -3.35 0.50 0.00 0.00 0.00 0.00 23.12 19.25 1jzq s ALA 545 CO 0.56 -1.37 1.41 -0.25 0.00 0.00 0.00 175.76 176.11 1jzq n ASP 546 N -2.44 0.50 -3.62 0.00 9.92 0.66 -1.43 116.55 120.15 1jzq n ASP 546 Ca 0.11 -0.23 -0.07 0.00 -0.53 0.00 0.00 54.79 54.07 1jzq n ASP 546 Cb 0.52 0.25 -0.06 0.00 -0.64 0.00 0.00 41.12 41.18 1jzq n ASP 546 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1jzq s PHE 547 N -3.01 -0.30 0.11 1.24 2.19 -1.22 -3.06 117.98 113.93 1jzq s PHE 547 Ca 0.11 0.64 -0.05 0.00 0.33 0.00 0.00 56.93 57.96 1jzq s PHE 547 Cb 0.17 0.43 -0.02 0.00 -1.31 0.00 0.00 43.02 42.29 1jzq s PHE 547 CO 0.70 -0.20 0.13 0.96 1.83 0.00 0.00 175.22 178.64 1jzq s ILE 548 N -0.41 0.13 -0.28 3.12 -4.36 -1.03 -2.68 121.20 115.68 1jzq s ILE 548 Ca 0.03 -1.57 0.02 0.00 -0.26 0.00 0.00 60.65 58.88 1jzq s ILE 548 Cb -0.03 -1.69 0.17 0.00 1.25 0.00 0.00 42.46 42.16 1jzq s ILE 548 CO -0.06 -0.59 0.45 0.00 0.24 0.00 0.00 174.94 174.99 1jzq s ALA 549 N -3.95 -1.51 0.00 2.27 0.00 -1.26 -2.89 121.76 114.42 1jzq s ALA 549 Ca 0.13 0.61 0.00 0.00 0.00 0.00 0.00 51.96 52.71 1jzq s ALA 549 Cb 0.06 -2.12 0.00 0.00 0.00 0.00 0.00 23.12 21.06 1jzq s ALA 549 CO -0.05 -1.67 0.00 0.39 0.00 0.00 0.00 175.76 174.44 1jzq n GLU 550 N 5.37 1.13 -3.25 0.00 -0.58 -0.86 -4.82 120.64 117.63 1jzq n GLU 550 Ca 0.01 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.39 1jzq n GLU 550 Cb 0.50 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.32 1jzq n GLU 550 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1jzq s GLY 551 N -0.87 2.53 0.37 0.62 0.00 -1.26 -1.23 107.32 107.47 1jzq s GLY 551 Ca 0.00 -0.01 0.19 0.00 0.00 0.00 0.00 44.72 44.91 1jzq s GLY 551 CO 0.00 0.31 1.63 1.19 0.00 0.00 0.00 173.10 176.23 1jzq h ILE 552 N 2.79 0.17 0.00 0.90 6.09 -1.78 1.42 117.51 127.10 1jzq h ILE 552 Ca -0.48 -0.06 0.00 0.00 -1.37 0.00 0.00 64.86 62.95 1jzq h ILE 552 Cb 1.19 -0.02 0.00 0.00 0.47 0.00 0.00 36.82 38.46 1jzq h ILE 552 CO 0.65 0.03 0.01 -0.90 -3.07 0.00 0.00 178.15 174.87 1jzq n ASP 553 N -5.06 0.00 -0.01 2.19 5.68 -1.26 -0.96 116.55 117.13 1jzq n ASP 553 Ca 0.35 0.48 0.15 0.00 -0.50 0.00 0.00 54.79 55.27 1jzq n ASP 553 Cb 1.17 -0.48 0.72 0.00 -1.14 0.00 0.00 41.12 41.39 1jzq n ASP 553 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1jzq n GLN 554 N -1.48 0.39 0.03 0.11 1.13 0.49 -2.98 117.38 115.06 1jzq n GLN 554 Ca 0.00 -0.02 0.05 0.00 -1.94 0.00 0.00 57.00 55.09 1jzq n GLN 554 Cb 0.01 -1.50 0.24 0.00 0.11 0.00 0.00 30.24 29.09 1jzq n GLN 554 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1jzq n THR 555 N -1.29 1.36 0.15 5.09 -2.24 -0.13 -0.30 114.28 116.92 1jzq n THR 555 Ca 0.13 0.39 0.03 0.00 -2.27 0.00 0.00 64.05 62.32 1jzq n THR 555 Cb 0.26 -1.27 0.03 0.00 -2.10 0.00 0.00 70.33 67.25 1jzq n THR 555 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1jzq n ARG 556 N -1.64 0.51 0.00 -0.78 5.12 -1.16 -4.47 116.66 114.23 1jzq n ARG 556 Ca 0.02 -1.04 0.00 0.00 -1.93 0.00 0.00 57.85 54.89 1jzq n ARG 556 Cb 0.10 -1.11 0.00 0.00 -1.16 0.00 0.00 32.46 30.29 1jzq n ARG 556 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1jzq n GLY 557 N 0.22 1.24 0.21 -0.13 0.00 0.58 -4.65 105.19 102.67 1jzq n GLY 557 Ca 0.04 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 1jzq n GLY 557 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1jzq h TRP 558 N 0.00 -0.41 -0.70 1.61 7.01 -1.90 -2.61 115.95 118.96 1jzq h TRP 558 Ca 0.00 -0.01 0.15 0.00 2.11 0.00 0.00 58.89 61.14 1jzq h TRP 558 Cb 0.00 0.13 -0.12 0.00 -2.10 0.00 0.00 29.16 27.07 1jzq h TRP 558 CO 0.00 -0.12 -0.04 0.74 -2.79 0.00 0.00 178.44 176.23 1jzq h PHE 559 N -0.67 -0.12 -0.67 2.65 0.05 -1.88 0.26 116.94 116.56 1jzq h PHE 559 Ca -0.04 0.05 -0.04 0.00 3.82 0.00 0.00 57.97 61.76 1jzq h PHE 559 Cb 0.47 0.16 -0.03 0.00 2.00 0.00 0.00 35.95 38.55 1jzq h PHE 559 CO 0.00 -0.23 0.25 -0.97 -0.18 0.00 0.00 178.31 177.18 1jzq h ASN 560 N 0.08 0.94 0.73 2.17 -0.73 -1.65 -1.67 115.58 115.45 1jzq h ASN 560 Ca 0.37 -0.18 -0.20 0.00 1.87 0.00 0.00 56.30 58.16 1jzq h ASN 560 Cb 0.62 -0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.95 1jzq h ASN 560 CO -0.64 0.86 -0.92 0.77 -0.37 0.00 0.00 177.43 177.14 1jzq h SER 561 N 0.96 0.15 0.71 1.15 4.64 -0.99 -1.30 113.55 118.87 1jzq h SER 561 Ca 0.22 -0.14 -0.04 0.00 -0.47 0.00 0.00 61.79 61.37 1jzq h SER 561 Cb 0.23 -0.05 0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1jzq h SER 561 CO -0.02 0.99 -0.34 -0.07 -0.87 0.00 0.00 176.83 176.52 1jzq h LEU 562 N 0.05 -0.81 -0.28 5.97 3.38 -0.85 -1.80 115.31 120.97 1jzq h LEU 562 Ca -0.04 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1jzq h LEU 562 Cb 1.58 0.21 -0.04 0.00 0.09 0.00 0.00 40.66 42.50 1jzq h LEU 562 CO 0.13 -0.58 0.03 -0.74 0.09 0.00 0.00 178.44 177.37 1jzq h HIS 563 N -0.96 0.04 -0.66 1.13 2.76 -1.33 0.25 115.15 116.37 1jzq h HIS 563 Ca -0.10 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.02 1jzq h HIS 563 Cb 0.74 0.03 -0.03 0.00 1.55 0.00 0.00 27.41 29.70 1jzq h HIS 563 CO -0.02 -0.02 0.13 1.96 -1.30 0.00 0.00 177.93 178.68 1jzq h GLN 564 N 0.12 1.06 0.00 5.26 4.20 -1.22 -1.76 115.11 122.77 1jzq h GLN 564 Ca 0.13 -0.26 -0.13 0.00 0.06 0.00 0.00 58.65 58.45 1jzq h GLN 564 Cb 0.16 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.79 1jzq h GLN 564 CO -0.20 0.95 -0.62 -0.07 -0.67 0.00 0.00 178.83 178.23 1jzq h LEU 565 N 1.00 0.00 0.16 1.46 4.07 -1.12 -1.80 115.31 119.08 1jzq h LEU 565 Ca 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.16 1jzq h LEU 565 Cb 0.39 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.13 1jzq h LEU 565 CO 0.01 0.62 -0.08 1.23 -1.08 0.00 0.00 178.44 179.13 1jzq h GLY 566 N 2.19 -0.23 1.10 0.83 0.00 -0.56 -1.77 103.07 104.63 1jzq h GLY 566 Ca -0.01 0.08 -0.15 0.00 0.00 0.00 0.00 47.33 47.26 1jzq h GLY 566 CO 0.08 -0.08 -0.34 -2.08 0.00 0.00 0.00 176.54 174.11 1jzq h VAL 567 N -0.47 1.28 0.00 4.60 2.07 -0.81 -0.81 116.25 122.10 1jzq h VAL 567 Ca -0.02 -1.51 -0.14 0.00 0.82 0.00 0.00 66.70 65.84 1jzq h VAL 567 Cb 0.37 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1jzq h VAL 567 CO 0.04 0.51 -0.68 0.24 0.02 0.00 0.00 177.57 177.69 1jzq h MET 568 N 0.72 0.00 0.00 1.57 2.07 -1.38 -2.36 114.93 115.55 1jzq h MET 568 Ca 0.07 0.00 -0.40 0.00 -2.07 0.00 0.00 59.70 57.30 1jzq h MET 568 Cb 0.93 0.00 -0.07 0.00 -1.87 0.00 0.00 31.60 30.59 1jzq h MET 568 CO 0.09 0.68 -2.48 1.28 1.07 0.00 0.00 176.91 177.55 1jzq n LEU 569 N -3.73 2.83 -0.17 1.22 4.77 -0.66 -4.66 117.00 116.60 1jzq n LEU 569 Ca -0.01 -0.07 0.02 0.00 -0.03 0.00 0.00 56.01 55.92 1jzq n LEU 569 Cb 0.67 -0.90 0.03 0.00 -2.33 0.00 0.00 43.42 40.88 1jzq n LEU 569 CO 0.43 0.89 0.37 0.49 -1.33 0.00 0.00 177.39 178.23 1jzq n PHE 570 N -3.40 0.04 -3.66 -1.77 3.01 -0.41 -5.00 117.46 106.27 1jzq n PHE 570 Ca -0.47 -0.12 -0.22 0.00 1.01 0.00 0.00 57.45 57.66 1jzq n PHE 570 Cb 0.98 -0.01 0.05 0.00 -0.01 0.00 0.00 39.48 40.49 1jzq n PHE 570 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jzq n GLY 571 N 0.13 -0.36 3.31 1.37 0.00 -0.60 -4.94 105.19 104.11 1jzq n GLY 571 Ca 0.03 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 1jzq n GLY 571 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jzq s SER 572 N -4.14 -0.27 0.68 1.61 0.15 -0.92 -4.90 113.70 105.92 1jzq s SER 572 Ca 0.14 0.06 -0.14 0.00 0.70 0.00 0.00 55.95 56.72 1jzq s SER 572 Cb -0.07 0.39 0.01 0.00 -1.71 0.00 0.00 66.02 64.64 1jzq s SER 572 CO 0.79 -0.59 1.09 0.27 1.20 0.00 0.00 173.24 176.00 1jzq s ILE 573 N -2.03 3.41 -2.52 6.45 -0.00 -1.26 -2.16 121.20 123.08 1jzq s ILE 573 Ca -0.08 0.59 0.23 0.00 -0.00 0.00 0.00 60.65 61.39 1jzq s ILE 573 Cb -0.02 -3.12 0.09 0.00 -0.00 0.00 0.00 42.46 39.41 1jzq s ILE 573 CO 0.01 -0.47 1.18 0.00 -0.00 0.00 0.00 174.94 175.66 1jzq n ALA 574 N -2.68 3.00 -3.53 2.27 0.00 -1.26 -4.58 120.51 113.74 1jzq n ALA 574 Ca 0.10 -0.67 -0.16 0.00 0.00 0.00 0.00 53.44 52.71 1jzq n ALA 574 Cb 0.52 -0.80 -0.07 0.00 0.00 0.00 0.00 19.45 19.10 1jzq n ALA 574 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1jzq s PHE 575 N -2.24 -0.66 -0.13 0.00 -0.12 -1.26 -2.49 117.98 111.08 1jzq s PHE 575 Ca 0.23 1.35 0.18 0.00 -0.05 0.00 0.00 56.93 58.65 1jzq s PHE 575 Cb 0.19 0.32 -0.24 0.00 -0.63 0.00 0.00 43.02 42.66 1jzq s PHE 575 CO 0.43 -0.49 0.36 1.63 -0.05 0.00 0.00 175.22 177.11 1jzq n LYS 576 N 1.69 0.66 -4.07 1.99 5.02 -0.52 -4.79 118.16 118.15 1jzq n LYS 576 Ca -0.17 0.02 -0.14 0.00 -2.02 0.00 0.00 58.31 56.00 1jzq n LYS 576 Cb 0.56 -1.60 -0.14 0.00 -0.02 0.00 0.00 35.03 33.83 1jzq n LYS 576 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1jzq s ASN 577 N -5.39 0.50 0.02 4.39 0.01 -1.17 -1.45 114.94 111.84 1jzq s ASN 577 Ca -0.08 -0.17 0.02 0.00 -0.71 0.00 0.00 52.86 51.92 1jzq s ASN 577 Cb 0.08 -0.03 -0.02 0.00 0.41 0.00 0.00 41.25 41.70 1jzq s ASN 577 CO 0.84 -0.01 -0.06 -0.69 -1.51 0.00 0.00 177.10 175.67 1jzq s VAL 578 N -0.38 0.41 -0.17 1.60 1.01 -0.26 -2.48 120.40 120.13 1jzq s VAL 578 Ca -0.01 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.25 1jzq s VAL 578 Cb -0.03 -0.44 0.04 0.00 0.00 0.00 0.00 36.38 35.95 1jzq s VAL 578 CO -0.00 -0.21 -0.04 -0.63 0.00 0.00 0.00 175.10 174.21 1jzq s ILE 579 N -0.90 1.04 -0.35 2.22 1.01 -1.14 0.28 121.20 123.36 1jzq s ILE 579 Ca -0.06 -0.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.84 1jzq s ILE 579 Cb -0.07 -1.25 -0.01 0.00 0.01 0.00 0.00 42.46 41.14 1jzq s ILE 579 CO 0.00 0.09 0.25 0.00 0.00 0.00 0.00 174.94 175.28 1jzq s HIS 581 N 1.71 3.47 0.00 0.00 -3.43 -0.36 -3.74 115.29 112.93 1jzq s HIS 581 Ca 0.06 0.77 0.00 0.00 -0.80 0.00 0.00 55.06 55.09 1jzq s HIS 581 Cb -0.18 -2.21 0.00 0.00 -1.43 0.00 0.00 32.58 28.77 1jzq s HIS 581 CO 0.10 0.12 0.00 0.41 -2.00 0.00 0.00 174.74 173.37 1jzq n GLY 582 N -0.92 -2.59 3.09 -1.38 0.00 0.20 -2.77 105.19 100.81 1jzq n GLY 582 Ca -0.00 -1.01 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 1jzq n GLY 582 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1jzq s LEU 583 N 0.00 2.17 -0.09 0.99 0.20 -1.23 -4.73 118.68 116.00 1jzq s LEU 583 Ca 0.00 -0.43 -0.25 0.00 0.69 0.00 0.00 54.13 54.14 1jzq s LEU 583 Cb 0.00 -0.42 -0.03 0.00 -0.43 0.00 0.00 46.19 45.31 1jzq s LEU 583 CO 0.00 -0.03 0.80 -0.63 -0.29 0.00 0.00 176.35 176.19 1jzq s ILE 584 N -0.89 4.96 0.40 6.68 1.01 -1.26 -2.64 121.20 129.46 1jzq s ILE 584 Ca -0.02 1.62 0.08 0.00 0.00 0.00 0.00 60.65 62.33 1jzq s ILE 584 Cb -0.08 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 38.25 1jzq s ILE 584 CO 0.01 0.16 0.39 -0.76 0.00 0.00 0.00 174.94 174.73 1jzq s LEU 585 N 1.29 3.47 1.07 2.97 1.43 0.42 -4.09 118.68 125.24 1jzq s LEU 585 Ca 0.40 -0.65 -0.12 0.00 -1.03 0.00 0.00 54.13 52.73 1jzq s LEU 585 Cb -0.18 -2.17 0.23 0.00 0.03 0.00 0.00 46.19 44.11 1jzq s LEU 585 CO 0.18 -0.61 1.06 -0.62 0.23 0.00 0.00 176.35 176.60 1jzq s ASP 586 N -4.13 1.75 0.63 2.29 3.68 0.47 0.11 116.67 121.47 1jzq s ASP 586 Ca 0.48 1.61 0.19 0.00 2.13 0.00 0.00 52.55 56.96 1jzq s ASP 586 Cb -0.05 -2.30 0.79 0.00 -1.45 0.00 0.00 42.92 39.91 1jzq s ASP 586 CO 0.28 -3.74 1.36 -0.08 0.13 0.00 0.00 175.17 173.12 1jzq h GLU 587 N -2.30 0.00 -0.48 4.34 4.57 -1.87 -3.25 114.58 115.59 1jzq h GLU 587 Ca -0.56 0.00 0.16 0.00 -1.18 0.00 0.00 59.36 57.78 1jzq h GLU 587 Cb 1.32 0.00 -0.20 0.00 -0.16 0.00 0.00 28.75 29.71 1jzq h GLU 587 CO 0.50 0.00 -0.11 0.15 -1.18 0.00 0.00 179.01 178.37 1jzq s LYS 588 N -4.28 0.27 0.00 1.92 -0.14 -1.26 -4.74 119.74 111.51 1jzq s LYS 588 Ca -0.02 0.29 0.00 0.00 -1.36 0.00 0.00 55.97 54.88 1jzq s LYS 588 Cb 0.09 0.14 0.00 0.00 -1.68 0.00 0.00 37.83 36.38 1jzq s LYS 588 CO 0.31 -0.49 0.00 0.41 -0.76 0.00 0.00 175.35 174.82 1jzq n GLY 589 N 5.23 2.15 3.28 -3.33 0.00 -1.25 -5.01 105.19 106.26 1jzq n GLY 589 Ca 0.07 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 1jzq n GLY 589 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1jzq n GLN 590 N 0.00 0.03 -3.57 1.61 6.02 -1.26 -4.37 117.38 115.84 1jzq n GLN 590 Ca 0.00 0.04 -0.37 0.00 -0.01 0.00 0.00 57.00 56.66 1jzq n GLN 590 Cb 0.00 -1.45 -0.07 0.00 1.02 0.00 0.00 30.24 29.75 1jzq n GLN 590 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1jzq s LYS 591 N -2.43 4.05 0.22 -1.09 2.20 -1.26 0.18 119.74 121.61 1jzq s LYS 591 Ca 0.54 0.16 -0.32 0.00 -0.36 0.00 0.00 55.97 56.00 1jzq s LYS 591 Cb -0.29 -3.34 -0.12 0.00 -1.51 0.00 0.00 37.83 32.57 1jzq s LYS 591 CO 0.69 0.43 1.67 -1.33 -0.36 0.00 0.00 175.35 176.45 1jzq n MET 592 N 2.88 2.68 -3.80 4.03 2.81 -1.26 -4.81 117.12 119.65 1jzq n MET 592 Ca -0.13 0.96 -0.10 0.00 -1.81 0.00 0.00 57.70 56.62 1jzq n MET 592 Cb 0.52 -2.78 -0.07 0.00 -0.71 0.00 0.00 33.22 30.18 1jzq n MET 592 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1jzq s SER 593 N 0.96 -0.00 0.07 7.83 0.15 -1.26 -4.98 113.70 116.47 1jzq s SER 593 Ca 0.73 -0.44 -0.15 0.00 0.70 0.00 0.00 55.95 56.79 1jzq s SER 593 Cb -0.53 0.35 -0.19 0.00 -1.71 0.00 0.00 66.02 63.94 1jzq s SER 593 CO 0.37 -0.68 1.23 0.07 1.20 0.00 0.00 173.24 175.43 1jzq h LYS 594 N 2.95 0.69 -0.18 5.44 2.10 -1.97 -2.77 116.57 122.83 1jzq h LYS 594 Ca -0.33 -0.64 -0.03 0.00 -2.00 0.00 0.00 60.65 57.65 1jzq h LYS 594 Cb 1.20 0.16 -0.01 0.00 -0.90 0.00 0.00 32.23 32.68 1jzq h LYS 594 CO 0.51 1.24 -0.01 0.66 -2.00 0.00 0.00 179.45 179.85 1jzq h SER 595 N 0.37 0.31 0.19 7.07 4.64 -2.00 -2.75 113.55 121.38 1jzq h SER 595 Ca -0.08 -0.32 -0.02 0.00 -0.47 0.00 0.00 61.79 60.91 1jzq h SER 595 Cb 1.46 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1jzq h SER 595 CO 0.16 0.55 -0.08 0.50 -0.87 0.00 0.00 176.83 177.10 1jzq h LYS 596 N 0.06 0.00 -0.77 4.77 3.11 -1.96 -3.46 116.57 118.32 1jzq h LYS 596 Ca 0.05 0.00 -0.22 0.00 -2.81 0.00 0.00 60.65 57.67 1jzq h LYS 596 Cb 0.40 0.00 -0.07 0.00 -1.00 0.00 0.00 32.23 31.56 1jzq h LYS 596 CO 0.01 0.08 -0.22 0.41 -2.81 0.00 0.00 179.45 176.92 1jzq n GLY 597 N -0.99 0.87 0.98 5.01 0.00 -1.04 -4.91 105.19 105.12 1jzq n GLY 597 Ca -0.02 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 45.60 1jzq n GLY 597 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jzq n ASN 598 N 0.20 3.00 -4.69 1.61 6.94 -1.22 -4.98 115.26 116.12 1jzq n ASN 598 Ca -0.11 -1.94 -0.42 0.00 -0.02 0.00 0.00 54.58 52.08 1jzq n ASN 598 Cb 0.41 -0.12 -0.03 0.00 -2.36 0.00 0.00 39.78 37.69 1jzq n ASN 598 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1jzq s VAL 599 N -1.77 2.74 -0.38 3.53 -7.23 -1.25 -4.84 120.40 111.20 1jzq s VAL 599 Ca 0.34 0.21 -0.14 0.00 -1.81 0.00 0.00 61.98 60.58 1jzq s VAL 599 Cb 0.21 -3.14 0.00 0.00 0.56 0.00 0.00 36.38 34.02 1jzq s VAL 599 CO 0.31 -0.00 0.29 -0.69 -0.31 0.00 0.00 175.10 174.70 1jzq s VAL 600 N 2.77 5.25 0.16 1.32 1.01 -1.26 -5.05 120.40 124.60 1jzq s VAL 600 Ca 0.78 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 1jzq s VAL 600 Cb -0.43 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.01 1jzq s VAL 600 CO 0.35 -0.20 1.28 -0.62 0.00 0.00 0.00 175.10 175.91 1jzq s ASP 601 N 1.71 6.96 0.25 3.32 -1.08 -1.26 -4.41 116.67 122.15 1jzq s ASP 601 Ca 0.06 2.29 -0.03 0.00 -0.52 0.00 0.00 52.55 54.34 1jzq s ASP 601 Cb -0.18 -2.60 0.49 0.00 -1.46 0.00 0.00 42.92 39.17 1jzq s ASP 601 CO 0.10 -0.50 1.72 1.55 0.52 0.00 0.00 175.17 178.57 1jzq h PRO 602 N 5.83 0.42 -0.36 4.34 0.13 -1.92 -0.86 132.00 139.59 1jzq h PRO 602 Ca -0.44 -0.03 0.10 0.00 -0.87 0.00 0.00 66.00 64.77 1jzq h PRO 602 Cb 1.21 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1jzq h PRO 602 CO 0.79 0.28 0.43 -1.49 -0.23 0.00 0.00 178.00 177.78 1jzq h TRP 603 N 0.43 0.00 -0.60 1.56 4.06 -1.98 0.19 115.95 119.60 1jzq h TRP 603 Ca 0.43 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.35 1jzq h TRP 603 Cb 0.68 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.81 1jzq h TRP 603 CO -0.17 0.00 0.27 -0.44 -3.56 0.00 0.00 178.44 174.54 1jzq h ASP 604 N 0.00 0.81 -0.06 -3.49 3.32 -1.53 -2.12 116.42 113.35 1jzq h ASP 604 Ca 0.17 -0.15 -0.12 0.00 0.02 0.00 0.00 57.03 56.95 1jzq h ASP 604 Cb 1.04 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 40.38 1jzq h ASP 604 CO -0.00 0.74 -0.43 0.40 -1.72 0.00 0.00 179.24 178.22 1jzq h ILE 605 N 0.83 1.41 -0.99 0.35 1.08 -0.78 -3.04 117.51 116.38 1jzq h ILE 605 Ca 0.20 -1.84 0.09 0.00 -0.39 0.00 0.00 64.86 62.92 1jzq h ILE 605 Cb 0.16 2.36 -0.07 0.00 -3.07 0.00 0.00 36.82 36.20 1jzq h ILE 605 CO -0.02 0.54 0.63 0.40 -0.69 0.00 0.00 178.15 179.01 1jzq h ILE 606 N -0.07 1.01 -0.06 -0.67 2.04 -1.28 0.58 117.51 119.06 1jzq h ILE 606 Ca -0.04 -0.37 -0.21 0.00 1.00 0.00 0.00 64.86 65.25 1jzq h ILE 606 Cb 1.10 -0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1jzq h ILE 606 CO 0.09 0.20 -0.82 0.08 0.00 0.00 0.00 178.15 177.70 1jzq h ARG 607 N 1.07 0.46 0.08 2.37 0.11 -1.46 0.31 114.38 117.33 1jzq h ARG 607 Ca 0.45 -0.42 -0.12 0.00 0.10 0.00 0.00 59.98 59.99 1jzq h ARG 607 Cb 0.31 0.10 0.01 0.00 1.11 0.00 0.00 29.97 31.51 1jzq h ARG 607 CO -0.20 1.06 -0.52 0.87 0.10 0.00 0.00 179.97 181.28 1jzq h LYS 608 N 0.30 0.20 0.00 0.08 1.57 -1.27 -3.41 116.57 114.03 1jzq h LYS 608 Ca -0.05 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 1jzq h LYS 608 Cb 1.42 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.85 1jzq h LYS 608 CO 0.14 1.15 -0.50 1.19 -0.57 0.00 0.00 179.45 180.86 1jzq n PHE 609 N -4.30 0.00 0.00 -1.35 3.01 0.20 -4.81 117.46 110.20 1jzq n PHE 609 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.34 1jzq n PHE 609 Cb 0.69 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 40.13 1jzq n PHE 609 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jzq n GLY 610 N 1.49 0.02 0.15 1.37 0.00 0.11 -4.41 105.19 103.92 1jzq n GLY 610 Ca 0.00 -1.93 -0.17 0.00 0.00 0.00 0.00 46.02 43.93 1jzq n GLY 610 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jzq h ALA 611 N 0.00 0.12 -0.71 4.61 0.00 -1.86 -3.25 119.26 118.17 1jzq h ALA 611 Ca 0.00 -0.56 0.09 0.00 0.00 0.00 0.00 54.91 54.44 1jzq h ALA 611 Cb 0.00 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 1jzq h ALA 611 CO 0.00 0.38 0.36 -0.44 0.00 0.00 0.00 179.25 179.55 1jzq h ASP 612 N -0.00 0.48 -0.63 0.00 3.32 -1.92 -1.82 116.42 115.85 1jzq h ASP 612 Ca -0.07 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.06 1jzq h ASP 612 Cb 1.28 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.77 1jzq h ASP 612 CO 0.12 0.28 0.40 0.00 -1.72 0.00 0.00 179.24 178.32 1jzq h ALA 613 N 1.42 0.81 0.37 3.45 0.00 -1.77 0.71 119.26 124.25 1jzq h ALA 613 Ca 0.35 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 1jzq h ALA 613 Cb 0.35 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1jzq h ALA 613 CO -0.26 0.17 -0.31 1.25 0.00 0.00 0.00 179.25 180.11 1jzq h LEU 614 N 0.80 -0.81 0.06 0.00 6.46 -1.42 -1.94 115.31 118.46 1jzq h LEU 614 Ca 0.24 0.06 0.01 0.00 -0.12 0.00 0.00 57.88 58.08 1jzq h LEU 614 Cb -0.03 0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 40.13 1jzq h LEU 614 CO -0.08 -0.45 -0.36 0.03 -0.62 0.00 0.00 178.44 176.96 1jzq h ARG 615 N -0.68 -0.47 -0.96 1.25 3.08 -0.76 -2.68 114.38 113.15 1jzq h ARG 615 Ca -0.03 0.03 0.14 0.00 0.07 0.00 0.00 59.98 60.19 1jzq h ARG 615 Cb 0.60 0.11 -0.15 0.00 0.08 0.00 0.00 29.97 30.61 1jzq h ARG 615 CO -0.02 -0.32 -0.42 2.35 -1.07 0.00 0.00 179.97 180.49 1jzq h TRP 616 N -0.49 -1.24 -0.06 3.04 2.91 0.51 -1.76 115.95 118.86 1jzq h TRP 616 Ca -0.00 0.11 0.01 0.00 1.13 0.00 0.00 58.89 60.14 1jzq h TRP 616 Cb 0.50 0.68 -0.03 0.00 -0.51 0.00 0.00 29.16 29.80 1jzq h TRP 616 CO -0.42 -0.40 -0.27 -0.92 -1.03 0.00 0.00 178.44 175.40 1jzq h TYR 617 N -0.02 -0.80 -0.55 2.65 3.20 -1.07 0.17 116.97 120.55 1jzq h TYR 617 Ca 0.30 0.03 0.16 0.00 3.14 0.00 0.00 58.73 62.36 1jzq h TYR 617 Cb 0.56 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.17 1jzq h TYR 617 CO -0.88 -0.27 0.95 0.82 -1.64 0.00 0.00 178.16 177.14 1jzq h ILE 618 N -0.29 0.06 0.00 1.81 1.08 -1.01 0.26 117.51 119.41 1jzq h ILE 618 Ca 0.02 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.42 1jzq h ILE 618 Cb 0.34 0.17 -0.01 0.00 -3.07 0.00 0.00 36.82 34.25 1jzq h ILE 618 CO -0.21 0.00 -0.57 1.88 -0.69 0.00 0.00 178.15 178.55 1jzq h TYR 619 N 0.00 0.00 0.00 1.37 0.99 -0.36 -3.40 116.97 115.57 1jzq h TYR 619 Ca 0.26 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.99 1jzq h TYR 619 Cb 2.16 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.89 1jzq h TYR 619 CO 0.00 0.54 -0.09 1.55 -0.00 0.00 0.00 178.16 180.16 1jzq n VAL 620 N -4.59 0.56 0.09 -2.88 3.14 -0.53 -4.07 118.33 110.06 1jzq n VAL 620 Ca -0.13 -0.28 -0.07 0.00 -2.96 0.00 0.00 64.34 60.89 1jzq n VAL 620 Cb 0.36 -0.52 -0.04 0.00 -1.06 0.00 0.00 33.84 32.58 1jzq n VAL 620 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 1jzq h SER 621 N 0.00 -0.64 -4.27 6.55 0.02 -0.73 -3.47 113.55 111.01 1jzq h SER 621 Ca 0.00 0.06 0.11 0.00 -0.84 0.00 0.00 61.79 61.12 1jzq h SER 621 Cb 0.74 0.22 -0.20 0.00 0.14 0.00 0.00 62.40 63.30 1jzq h SER 621 CO 0.00 -0.27 0.57 0.00 -1.14 0.00 0.00 176.83 176.00 1jzq s ALA 622 N -4.39 -1.92 0.53 3.77 0.00 -1.26 -5.12 121.76 113.37 1jzq s ALA 622 Ca -0.07 1.42 -0.17 0.00 0.00 0.00 0.00 51.96 53.13 1jzq s ALA 622 Cb 0.02 -0.31 -0.14 0.00 0.00 0.00 0.00 23.12 22.68 1jzq s ALA 622 CO 0.26 -0.46 -0.18 -2.30 0.00 0.00 0.00 175.76 173.07 1jzq n PRO 623 N 0.32 0.00 -0.28 0.00 -0.02 -1.26 -4.81 135.00 128.95 1jzq n PRO 623 Ca -0.08 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.50 1jzq n PRO 623 Cb 0.59 -0.96 0.24 0.00 -0.02 0.00 0.00 33.50 33.35 1jzq n PRO 623 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1jzq h PRO 624 N -0.10 0.22 -0.13 0.52 0.11 -1.91 -2.74 132.00 127.97 1jzq h PRO 624 Ca -0.40 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.73 1jzq h PRO 624 Cb 1.38 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.41 1jzq h PRO 624 CO 0.39 0.15 -0.06 0.93 -0.21 0.00 0.00 178.00 179.19 1jzq h GLU 625 N 0.23 -0.04 -6.34 1.05 3.07 -1.87 0.56 114.58 111.23 1jzq h GLU 625 Ca 0.50 0.00 -0.49 0.00 -0.50 0.00 0.00 59.36 58.87 1jzq h GLU 625 Cb 0.94 0.01 0.24 0.00 -0.84 0.00 0.00 28.75 29.10 1jzq h GLU 625 CO -0.61 -0.03 -1.74 0.00 -1.40 0.00 0.00 179.01 175.23 1jzq n ALA 626 N -2.36 -4.78 -3.65 3.43 0.00 -1.03 -1.33 120.51 110.78 1jzq n ALA 626 Ca -0.04 -1.16 -0.35 0.00 0.00 0.00 0.00 53.44 51.90 1jzq n ALA 626 Cb 0.12 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.20 1jzq n ALA 626 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1jzq s ASP 627 N -1.43 4.03 0.19 0.00 1.11 -1.26 -2.74 116.67 116.56 1jzq s ASP 627 Ca 0.46 -0.47 0.11 0.00 0.18 0.00 0.00 52.55 52.83 1jzq s ASP 627 Cb -0.06 -1.68 -0.04 0.00 1.07 0.00 0.00 42.92 42.22 1jzq s ASP 627 CO 0.69 -0.02 -0.20 0.00 1.18 0.00 0.00 175.17 176.82 1jzq s ARG 628 N 1.43 1.67 -0.00 8.23 3.03 -1.08 -4.91 118.95 127.31 1jzq s ARG 628 Ca 0.05 -1.44 -0.29 0.00 2.03 0.00 0.00 55.73 56.08 1jzq s ARG 628 Cb -0.14 -1.94 -0.03 0.00 -1.03 0.00 0.00 34.95 31.81 1jzq s ARG 628 CO -0.06 0.41 0.96 1.03 -1.13 0.00 0.00 175.30 176.51 1jzq s ARG 629 N -2.69 4.55 -0.30 3.89 0.52 -1.26 -0.44 118.95 123.22 1jzq s ARG 629 Ca 0.22 1.37 -0.02 0.00 -0.52 0.00 0.00 55.73 56.78 1jzq s ARG 629 Cb -0.08 -3.46 0.04 0.00 0.52 0.00 0.00 34.95 31.97 1jzq s ARG 629 CO 0.11 -0.04 0.01 0.12 0.02 0.00 0.00 175.30 175.52 1jzq s PHE 630 N 0.99 3.24 0.01 -0.53 5.36 0.12 -4.84 117.98 122.33 1jzq s PHE 630 Ca 0.51 -1.76 -0.09 0.00 -0.96 0.00 0.00 56.93 54.63 1jzq s PHE 630 Cb -0.21 -2.13 0.00 0.00 -0.34 0.00 0.00 43.02 40.35 1jzq s PHE 630 CO 0.27 -0.78 0.18 0.20 -1.46 0.00 0.00 175.22 173.63 1jzq s GLY 631 N 1.29 0.02 0.35 13.12 0.00 -1.26 -3.90 107.32 116.93 1jzq s GLY 631 Ca -0.04 -0.14 0.10 0.00 0.00 0.00 0.00 44.72 44.65 1jzq s GLY 631 CO -0.01 -0.30 1.81 -0.56 0.00 0.00 0.00 173.10 174.05 1jzq h PRO 632 N 3.89 0.62 -0.39 2.90 0.13 -1.98 -1.78 132.00 135.38 1jzq h PRO 632 Ca -0.31 -0.04 -0.10 0.00 -0.87 0.00 0.00 66.00 64.68 1jzq h PRO 632 Cb 1.19 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1jzq h PRO 632 CO 0.44 0.41 -0.17 -0.91 -0.23 0.00 0.00 178.00 177.54 1jzq h ASN 633 N 0.64 0.74 -0.16 1.44 4.21 -1.98 -2.51 115.58 117.97 1jzq h ASN 633 Ca 0.53 -0.24 -0.04 0.00 1.21 0.00 0.00 56.30 57.75 1jzq h ASN 633 Cb 0.98 -0.20 -0.00 0.00 -1.12 0.00 0.00 38.32 37.97 1jzq h ASN 633 CO -0.29 0.91 -0.07 -0.07 -1.29 0.00 0.00 177.43 176.62 1jzq h LEU 634 N 0.66 0.34 -0.37 1.61 4.07 -1.73 -2.60 115.31 117.29 1jzq h LEU 634 Ca 0.10 -0.41 0.08 0.00 0.08 0.00 0.00 57.88 57.73 1jzq h LEU 634 Cb 0.65 -0.09 -0.07 0.00 1.08 0.00 0.00 40.66 42.22 1jzq h LEU 634 CO 0.05 0.67 -0.11 0.58 -1.08 0.00 0.00 178.44 178.56 1jzq h VAL 635 N 0.01 0.60 -0.55 1.22 2.07 -1.37 0.33 116.25 118.56 1jzq h VAL 635 Ca 0.04 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.68 1jzq h VAL 635 Cb 0.54 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 1jzq h VAL 635 CO 0.02 0.00 0.38 -0.09 0.02 0.00 0.00 177.57 177.90 1jzq h ARG 636 N -0.02 0.19 -0.66 1.57 2.43 -1.40 -1.19 114.38 115.30 1jzq h ARG 636 Ca 0.18 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1jzq h ARG 636 Cb 0.29 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.76 1jzq h ARG 636 CO -0.39 0.13 0.42 1.49 -1.51 0.00 0.00 179.97 180.10 1jzq h GLU 637 N 0.20 0.80 0.04 0.20 4.57 0.06 -1.68 114.58 118.77 1jzq h GLU 637 Ca 0.26 -0.05 -0.26 0.00 -1.18 0.00 0.00 59.36 58.14 1jzq h GLU 637 Cb 0.76 -0.18 0.01 0.00 -0.16 0.00 0.00 28.75 29.19 1jzq h GLU 637 CO -0.04 0.53 -1.06 1.79 -1.18 0.00 0.00 179.01 179.04 1jzq h THR 638 N 0.82 1.36 -0.93 0.32 1.35 -0.99 -2.42 112.91 112.43 1jzq h THR 638 Ca 0.26 -2.48 0.08 0.00 -0.55 0.00 0.00 66.41 63.72 1jzq h THR 638 Cb -0.00 2.53 -0.07 0.00 -1.73 0.00 0.00 68.15 68.88 1jzq h THR 638 CO -0.09 0.75 0.58 0.58 -0.25 0.00 0.00 175.52 177.08 1jzq h VAL 639 N 0.25 1.00 -0.07 6.82 2.07 -1.11 0.25 116.25 125.46 1jzq h VAL 639 Ca -0.12 -0.34 -0.15 0.00 0.82 0.00 0.00 66.70 66.91 1jzq h VAL 639 Cb 1.72 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1jzq h VAL 639 CO 0.19 0.18 -0.62 0.03 0.02 0.00 0.00 177.57 177.38 1jzq h ARG 640 N 1.00 0.23 0.17 1.57 -0.00 -1.29 -1.09 114.38 114.98 1jzq h ARG 640 Ca 0.43 -0.17 -0.01 0.00 -0.50 0.00 0.00 59.98 59.73 1jzq h ARG 640 Cb 0.29 0.03 0.00 0.00 0.00 0.00 0.00 29.97 30.29 1jzq h ARG 640 CO -0.21 0.78 -0.08 0.22 0.00 0.00 0.00 179.97 180.67 1jzq h ASP 641 N 0.17 -0.19 0.00 7.04 3.58 -0.63 -3.40 116.42 123.00 1jzq h ASP 641 Ca -0.01 -0.25 0.00 0.00 0.42 0.00 0.00 57.03 57.19 1jzq h ASP 641 Cb 1.13 0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.23 1jzq h ASP 641 CO 0.10 0.36 -0.42 0.00 -2.88 0.00 0.00 179.24 176.40 1jzq n TYR 642 N -4.91 0.38 -0.26 0.28 9.36 0.72 -4.25 117.16 118.48 1jzq n TYR 642 Ca -0.06 0.17 0.07 0.00 3.32 0.00 0.00 57.90 61.40 1jzq n TYR 642 Cb 0.22 -0.48 0.21 0.00 -0.63 0.00 0.00 39.34 38.66 1jzq n TYR 642 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 1jzq h PHE 643 N -0.62 0.39 0.33 2.98 -1.00 -1.55 -2.45 116.94 115.02 1jzq h PHE 643 Ca 0.00 0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.81 1jzq h PHE 643 Cb 0.42 -0.05 0.00 0.00 3.61 0.00 0.00 35.95 39.93 1jzq h PHE 643 CO -0.18 -0.06 -0.16 -0.07 -1.61 0.00 0.00 178.31 176.23 1jzq h LEU 644 N 0.32 -0.37 -1.24 1.54 3.38 -1.41 -2.44 115.31 115.09 1jzq h LEU 644 Ca 0.45 -0.17 0.30 0.00 0.09 0.00 0.00 57.88 58.55 1jzq h LEU 644 Cb 0.78 0.10 -0.11 0.00 0.09 0.00 0.00 40.66 41.52 1jzq h LEU 644 CO -0.51 0.03 0.67 0.74 0.09 0.00 0.00 178.44 179.47 1jzq h THR 645 N -0.85 0.43 0.41 0.22 2.02 -1.69 0.22 112.91 113.67 1jzq h THR 645 Ca -0.04 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.99 1jzq h THR 645 Cb 0.52 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.96 1jzq h THR 645 CO 0.07 0.07 -0.20 0.25 0.37 0.00 0.00 175.52 176.08 1jzq h LEU 646 N 0.37 -0.47 -1.87 2.58 5.85 -1.42 -2.05 115.31 118.29 1jzq h LEU 646 Ca 0.66 -0.11 0.25 0.00 0.84 0.00 0.00 57.88 59.52 1jzq h LEU 646 Cb 1.65 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.76 1jzq h LEU 646 CO -0.40 -0.06 0.63 -0.25 -0.34 0.00 0.00 178.44 178.02 1jzq h TRP 647 N -0.97 0.14 0.25 1.25 2.91 -0.55 0.79 115.95 119.77 1jzq h TRP 647 Ca -0.06 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.96 1jzq h TRP 647 Cb 0.55 -0.04 0.00 0.00 -0.51 0.00 0.00 29.16 29.16 1jzq h TRP 647 CO 0.02 0.03 -0.12 -0.97 -1.03 0.00 0.00 178.44 176.37 1jzq h ASN 648 N 0.10 -0.28 0.00 2.65 -0.73 -0.54 -0.32 115.58 116.46 1jzq h ASN 648 Ca 0.44 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.62 1jzq h ASN 648 Cb 1.58 0.07 0.00 0.00 0.27 0.00 0.00 38.32 40.24 1jzq h ASN 648 CO -0.05 -0.12 0.01 0.55 -0.37 0.00 0.00 177.43 177.45 1jzq n VAL 649 N -3.32 0.56 -0.08 2.57 3.14 -0.75 -0.94 118.33 119.51 1jzq n VAL 649 Ca -0.04 0.15 -0.22 0.00 -2.96 0.00 0.00 64.34 61.27 1jzq n VAL 649 Cb 0.13 -1.15 -0.12 0.00 -1.06 0.00 0.00 33.84 31.64 1jzq n VAL 649 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1jzq n TYR 650 N -1.12 0.64 0.17 1.45 9.36 0.20 -3.67 117.16 124.20 1jzq n TYR 650 Ca 0.00 0.18 0.02 0.00 3.32 0.00 0.00 57.90 61.41 1jzq n TYR 650 Cb 0.01 -1.08 0.30 0.00 -0.63 0.00 0.00 39.34 37.94 1jzq n TYR 650 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 1jzq h SER 651 N -0.33 0.00 -0.10 2.98 0.87 0.75 -2.61 113.55 115.11 1jzq h SER 651 Ca -0.50 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1jzq h SER 651 Cb 1.79 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.74 1jzq h SER 651 CO -0.11 0.46 0.05 0.15 -0.53 0.00 0.00 176.83 176.85 1jzq h PHE 652 N 0.00 0.14 0.79 2.24 3.57 -1.37 -0.71 116.94 121.60 1jzq h PHE 652 Ca -0.00 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.45 1jzq h PHE 652 Cb 0.84 -0.04 0.01 0.00 2.79 0.00 0.00 35.95 39.54 1jzq h PHE 652 CO 0.00 0.22 -0.38 0.35 -2.23 0.00 0.00 178.31 176.27 1jzq h PHE 653 N 0.03 -0.98 -0.28 0.41 3.57 -1.60 -2.83 116.94 115.26 1jzq h PHE 653 Ca 0.03 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.54 1jzq h PHE 653 Cb 0.13 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 39.14 1jzq h PHE 653 CO -0.03 -0.61 -0.37 0.28 -2.23 0.00 0.00 178.31 175.35 1jzq h VAL 654 N -1.17 0.00 -0.50 1.41 2.07 -1.50 0.11 116.25 116.67 1jzq h VAL 654 Ca -0.11 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.46 1jzq h VAL 654 Cb 0.81 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.51 1jzq h VAL 654 CO 0.18 0.00 -0.39 0.74 0.02 0.00 0.00 177.57 178.12 1jzq h THR 655 N -0.27 0.00 0.00 2.57 2.02 -1.20 -0.07 112.91 115.97 1jzq h THR 655 Ca 0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.23 1jzq h THR 655 Cb 0.40 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1jzq h THR 655 CO -0.40 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.27 1jzq n TYR 656 N -4.51 0.03 0.06 3.16 0.53 -1.07 -2.61 117.16 112.76 1jzq n TYR 656 Ca -0.00 0.01 -0.11 0.00 -1.02 0.00 0.00 57.90 56.78 1jzq n TYR 656 Cb 0.20 -0.52 -0.13 0.00 -1.03 0.00 0.00 39.34 37.86 1jzq n TYR 656 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1jzq h ALA 657 N 2.62 0.32 0.00 -0.72 0.00 0.11 -2.68 119.26 118.91 1jzq h ALA 657 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1jzq h ALA 657 Cb 0.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1jzq h ALA 657 CO 0.00 1.20 0.00 0.09 0.00 0.00 0.00 179.25 180.54 1jzq n ASN 658 N -3.38 0.00 0.00 0.00 4.13 -0.61 -3.10 115.26 112.30 1jzq n ASN 658 Ca -0.06 -1.05 0.00 0.00 1.68 0.00 0.00 54.58 55.15 1jzq n ASN 658 Cb 0.99 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 39.23 1jzq n ASN 658 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1jzq n LEU 659 N -0.87 0.00 -3.08 3.41 7.99 -1.19 -4.67 117.00 118.59 1jzq n LEU 659 Ca 0.15 0.00 -0.14 0.00 -0.01 0.00 0.00 56.01 56.01 1jzq n LEU 659 Cb 0.07 0.00 -0.01 0.00 -0.11 0.00 0.00 43.42 43.36 1jzq n LEU 659 CO 0.11 0.00 1.86 0.47 -1.51 0.00 0.00 177.39 178.32 1jzq n ASP 660 N -0.92 3.20 -3.26 -1.43 9.92 -1.01 -4.86 116.55 118.17 1jzq n ASP 660 Ca 0.00 -2.20 -0.38 0.00 -0.53 0.00 0.00 54.79 51.69 1jzq n ASP 660 Cb 0.00 -0.88 -0.10 0.00 -0.64 0.00 0.00 41.12 39.50 1jzq n ASP 660 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1jzq n ARG 661 N 4.41 0.00 -3.19 -1.24 5.12 -1.18 -4.86 116.66 115.72 1jzq n ARG 661 Ca 0.29 0.00 -0.26 0.00 -1.93 0.00 0.00 57.85 55.94 1jzq n ARG 661 Cb 0.10 -1.12 -0.02 0.00 -1.16 0.00 0.00 32.46 30.26 1jzq n ARG 661 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1jzq s PRO 662 N 5.61 3.55 -1.21 5.56 0.04 -1.26 -5.01 135.00 142.28 1jzq s PRO 662 Ca 0.96 -0.09 -0.06 0.00 0.04 0.00 0.00 61.00 61.85 1jzq s PRO 662 Cb -1.03 -2.59 0.20 0.00 0.04 0.00 0.00 34.50 31.13 1jzq s PRO 662 CO 0.43 0.09 1.97 -3.47 0.04 0.00 0.00 177.00 176.05 1jzq n ASP 663 N -1.60 6.74 -0.26 6.66 4.64 -1.26 -4.78 116.55 126.69 1jzq n ASP 663 Ca -0.02 -3.28 0.22 0.00 -1.38 0.00 0.00 54.79 50.32 1jzq n ASP 663 Cb 0.55 -1.35 0.54 0.00 -1.04 0.00 0.00 41.12 39.83 1jzq n ASP 663 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 1jzq h LEU 664 N 5.99 0.36 -0.60 -2.67 3.38 -1.98 -0.16 115.31 119.63 1jzq h LEU 664 Ca 0.49 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.45 1jzq h LEU 664 Cb 0.46 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1jzq h LEU 664 CO 1.45 0.12 0.15 0.11 0.09 0.00 0.00 178.44 180.36 1jzq h LYS 665 N 0.35 0.96 -2.54 1.13 1.57 -1.94 -3.32 116.57 112.77 1jzq h LYS 665 Ca 0.51 -0.23 -0.63 0.00 -1.87 0.00 0.00 60.65 58.43 1jzq h LYS 665 Cb 1.37 -0.13 -0.40 0.00 0.08 0.00 0.00 32.23 33.15 1jzq h LYS 665 CO -0.19 0.88 -0.44 0.09 -0.57 0.00 0.00 179.45 179.22 1jzq n ASN 666 N -4.36 3.83 -4.85 0.86 3.02 -0.08 -5.08 115.26 108.60 1jzq n ASN 666 Ca 0.03 -3.37 -0.32 0.00 -0.03 0.00 0.00 54.58 50.90 1jzq n ASN 666 Cb 0.24 -0.77 -0.04 0.00 -0.61 0.00 0.00 39.78 38.61 1jzq n ASN 666 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1jzq s PRO 667 N -2.19 3.92 0.28 3.52 0.04 -1.14 -4.83 135.00 134.61 1jzq s PRO 667 Ca 0.35 0.85 -0.29 0.00 0.04 0.00 0.00 61.00 61.94 1jzq s PRO 667 Cb 0.08 -2.20 -0.10 0.00 0.04 0.00 0.00 34.50 32.32 1jzq s PRO 667 CO -0.05 -0.20 1.27 -2.14 0.04 0.00 0.00 177.00 175.92 1jzq s PRO 668 N -3.96 4.42 0.65 0.56 0.02 -1.26 -4.97 135.00 130.46 1jzq s PRO 668 Ca 0.57 2.09 -0.17 0.00 0.02 0.00 0.00 61.00 63.51 1jzq s PRO 668 Cb -0.10 -3.13 -0.07 0.00 0.02 0.00 0.00 34.50 31.22 1jzq s PRO 668 CO 0.30 -0.13 0.47 -2.30 -0.33 0.00 0.00 177.00 175.01 1jzq n PRO 669 N 1.44 0.39 -0.04 5.54 -0.02 -1.26 -4.75 135.00 136.30 1jzq n PRO 669 Ca 0.02 0.16 0.12 0.00 -2.02 0.00 0.00 63.50 61.78 1jzq n PRO 669 Cb 0.43 -1.72 0.52 0.00 -0.02 0.00 0.00 33.50 32.71 1jzq n PRO 669 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1jzq h PRO 670 N -0.08 0.35 0.10 0.52 0.11 -1.95 -2.73 132.00 128.31 1jzq h PRO 670 Ca -0.45 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.65 1jzq h PRO 670 Cb 1.38 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.38 1jzq h PRO 670 CO 0.44 0.23 -0.18 0.93 -0.21 0.00 0.00 178.00 179.21 1jzq h GLU 671 N 0.36 -0.33 0.00 1.05 3.07 -1.97 -1.86 114.58 114.89 1jzq h GLU 671 Ca 0.24 0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 59.11 1jzq h GLU 671 Cb 0.49 0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.47 1jzq h GLU 671 CO -0.06 -0.22 -0.06 0.87 -1.40 0.00 0.00 179.01 178.14 1jzq h LYS 672 N -0.34 0.00 -7.06 2.33 1.57 -1.84 -3.44 116.57 107.79 1jzq h LYS 672 Ca 0.03 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.27 1jzq h LYS 672 Cb 0.36 0.00 0.12 0.00 0.08 0.00 0.00 32.23 32.80 1jzq h LYS 672 CO -0.10 0.06 0.54 1.03 -0.57 0.00 0.00 179.45 180.41 1jzq s ARG 673 N -4.04 3.09 1.27 3.15 1.81 -0.70 -4.99 118.95 118.54 1jzq s ARG 673 Ca -0.02 2.03 -0.19 0.00 -1.72 0.00 0.00 55.73 55.83 1jzq s ARG 673 Cb 0.12 -2.12 0.29 0.00 -0.45 0.00 0.00 34.95 32.79 1jzq s ARG 673 CO 0.53 -1.17 0.67 -2.30 -0.68 0.00 0.00 175.30 172.35 1jzq n PRO 674 N -1.24 -3.73 -0.02 3.54 -0.02 -1.26 -4.65 135.00 127.62 1jzq n PRO 674 Ca 0.12 -1.11 -0.13 0.00 -2.02 0.00 0.00 63.50 60.36 1jzq n PRO 674 Cb 0.47 -1.74 -0.10 0.00 -0.02 0.00 0.00 33.50 32.11 1jzq n PRO 674 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1jzq h GLU 675 N -3.24 0.01 -0.95 -0.52 3.07 -1.95 -1.84 114.58 109.16 1jzq h GLU 675 Ca -0.34 -0.00 0.14 0.00 -0.50 0.00 0.00 59.36 58.66 1jzq h GLU 675 Cb 1.08 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 28.90 1jzq h GLU 675 CO 0.21 0.51 0.56 1.98 -1.40 0.00 0.00 179.01 180.87 1jzq h MET 676 N -0.50 0.80 -0.09 2.33 4.05 -2.01 -2.27 114.93 117.24 1jzq h MET 676 Ca 0.00 -0.05 -0.13 0.00 -0.28 0.00 0.00 59.70 59.24 1jzq h MET 676 Cb 0.51 -0.18 0.01 0.00 -0.80 0.00 0.00 31.60 31.13 1jzq h MET 676 CO 0.00 0.53 -0.45 -0.44 0.23 0.00 0.00 176.91 176.77 1jzq h ASP 677 N 0.82 0.55 -0.68 1.39 3.32 -1.90 -3.08 116.42 116.84 1jzq h ASP 677 Ca 0.50 -0.65 0.18 0.00 0.02 0.00 0.00 57.03 57.08 1jzq h ASP 677 Cb 0.63 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 1jzq h ASP 677 CO -0.32 1.11 0.48 0.03 -1.72 0.00 0.00 179.24 178.82 1jzq h ARG 678 N 0.03 0.12 0.31 3.56 3.08 -0.78 -2.19 114.38 118.51 1jzq h ARG 678 Ca -0.03 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1jzq h ARG 678 Cb 1.10 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.13 1jzq h ARG 678 CO 0.09 0.08 -0.15 2.35 -1.07 0.00 0.00 179.97 181.28 1jzq h TRP 679 N 0.13 -0.38 -0.40 3.04 7.01 -1.40 -3.08 115.95 120.86 1jzq h TRP 679 Ca 0.33 -0.01 0.12 0.00 2.11 0.00 0.00 58.89 61.44 1jzq h TRP 679 Cb 1.13 0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 28.30 1jzq h TRP 679 CO -0.00 -0.06 0.43 1.25 -2.79 0.00 0.00 178.44 177.27 1jzq h LEU 680 N -0.97 0.00 -0.23 0.65 5.85 -1.32 0.35 115.31 119.63 1jzq h LEU 680 Ca -0.04 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.47 1jzq h LEU 680 Cb 0.49 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1jzq h LEU 680 CO 0.07 0.00 -0.91 -0.07 -0.34 0.00 0.00 178.44 177.19 1jzq h LEU 681 N 0.00 0.28 -0.35 2.25 3.38 -1.46 -2.01 115.31 117.40 1jzq h LEU 681 Ca 0.19 -0.23 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 1jzq h LEU 681 Cb 1.05 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1jzq h LEU 681 CO -0.00 1.05 -0.83 0.00 0.09 0.00 0.00 178.44 178.75 1jzq h ALA 682 N 0.93 0.61 -0.41 1.53 0.00 -0.38 -3.02 119.26 118.52 1jzq h ALA 682 Ca -0.05 -0.73 -0.11 0.00 0.00 0.00 0.00 54.91 54.02 1jzq h ALA 682 Cb 1.56 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1jzq h ALA 682 CO 0.14 0.97 -0.20 -0.09 0.00 0.00 0.00 179.25 180.07 1jzq h ARG 683 N 0.04 0.80 0.00 0.00 9.65 -0.58 -2.50 114.38 121.79 1jzq h ARG 683 Ca -0.02 -0.31 -0.06 0.00 -1.10 0.00 0.00 59.98 58.49 1jzq h ARG 683 Cb 1.45 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.98 1jzq h ARG 683 CO 0.12 0.93 -0.29 0.52 2.80 0.00 0.00 179.97 184.05 1jzq h MET 684 N 0.70 0.00 -0.16 0.20 2.86 -1.30 -0.62 114.93 116.61 1jzq h MET 684 Ca 0.10 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.60 1jzq h MET 684 Cb 0.71 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 1jzq h MET 684 CO 0.05 0.29 -0.52 1.96 1.06 0.00 0.00 176.91 179.76 1jzq h GLN 685 N 0.00 0.43 0.59 1.72 1.08 -1.32 -2.02 115.11 115.58 1jzq h GLN 685 Ca -0.00 -0.26 -0.03 0.00 -1.45 0.00 0.00 58.65 56.91 1jzq h GLN 685 Cb 0.57 0.02 0.01 0.00 -0.05 0.00 0.00 27.48 28.03 1jzq h GLN 685 CO 0.04 0.85 -0.28 0.22 -0.95 0.00 0.00 178.83 178.71 1jzq h ASP 686 N 0.34 -0.67 -0.97 1.46 -0.00 -1.11 -2.46 116.42 113.02 1jzq h ASP 686 Ca 0.01 0.02 0.30 0.00 -0.00 0.00 0.00 57.03 57.37 1jzq h ASP 686 Cb 1.02 0.17 -0.18 0.00 -0.00 0.00 0.00 39.33 40.35 1jzq h ASP 686 CO 0.09 -0.36 0.15 -0.11 -0.00 0.00 0.00 179.24 179.01 1jzq n LEU 687 N -4.73 0.01 -0.17 2.28 7.94 -0.31 0.11 117.00 122.12 1jzq n LEU 687 Ca -0.10 1.63 -0.08 0.00 -1.11 0.00 0.00 56.01 56.35 1jzq n LEU 687 Cb 0.31 -0.65 0.01 0.00 0.53 0.00 0.00 43.42 43.62 1jzq n LEU 687 CO 0.24 -1.70 0.93 0.40 -1.11 0.00 0.00 177.39 176.15 1jzq h ILE 688 N 0.00 1.22 0.17 1.96 2.04 -1.29 -0.50 117.51 121.11 1jzq h ILE 688 Ca 0.65 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1jzq h ILE 688 Cb 1.46 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 38.31 1jzq h ILE 688 CO -0.86 0.27 -0.08 1.56 0.00 0.00 0.00 178.15 179.03 1jzq h GLN 689 N 0.66 -0.22 0.16 2.37 4.20 0.13 -1.27 115.11 121.15 1jzq h GLN 689 Ca 0.16 0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.89 1jzq h GLN 689 Cb 0.24 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1jzq h GLN 689 CO -0.01 0.10 -0.27 0.00 -0.67 0.00 0.00 178.83 177.99 1jzq h ARG 690 N -0.55 -0.44 -0.95 1.46 3.08 -0.78 0.62 114.38 116.81 1jzq h ARG 690 Ca -0.02 0.03 0.26 0.00 0.07 0.00 0.00 59.98 60.32 1jzq h ARG 690 Cb 0.42 0.10 -0.13 0.00 0.08 0.00 0.00 29.97 30.44 1jzq h ARG 690 CO 0.04 -0.29 0.47 0.28 -1.07 0.00 0.00 179.97 179.40 1jzq h VAL 691 N -0.46 0.41 -0.20 2.04 2.07 -1.17 -0.05 116.25 118.89 1jzq h VAL 691 Ca -0.02 -0.14 -0.10 0.00 0.82 0.00 0.00 66.70 67.26 1jzq h VAL 691 Cb 0.42 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1jzq h VAL 691 CO -0.09 0.07 -0.28 0.74 0.02 0.00 0.00 177.57 178.03 1jzq h THR 692 N 0.39 1.33 -0.68 2.57 2.02 -0.52 -3.08 112.91 114.94 1jzq h THR 692 Ca 0.63 -1.48 0.09 0.00 0.77 0.00 0.00 66.41 66.42 1jzq h THR 692 Cb 1.29 1.80 -0.07 0.00 -1.74 0.00 0.00 68.15 69.44 1jzq h THR 692 CO -0.56 0.46 0.33 -0.33 0.37 0.00 0.00 175.52 175.79 1jzq h GLU 693 N 0.23 0.57 -0.11 6.66 5.08 0.21 -0.95 114.58 126.26 1jzq h GLU 693 Ca 0.02 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1jzq h GLU 693 Cb 0.85 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1jzq h GLU 693 CO 0.07 0.38 0.06 0.00 -1.00 0.00 0.00 179.01 178.51 1jzq h ALA 694 N 1.41 0.15 0.00 3.43 0.00 -1.34 -2.61 119.26 120.30 1jzq h ALA 694 Ca 0.33 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1jzq h ALA 694 Cb 0.33 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1jzq h ALA 694 CO -0.25 -0.30 -0.21 -0.07 0.00 0.00 0.00 179.25 178.42 1jzq h LEU 695 N 0.06 0.00 -0.75 0.00 3.38 -1.42 0.20 115.31 116.79 1jzq h LEU 695 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1jzq h LEU 695 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1jzq h LEU 695 CO -0.01 0.21 0.00 -0.08 0.09 0.00 0.00 178.44 178.66 1jzq h GLU 696 N 0.00 0.00 -0.43 1.13 4.57 -0.93 -2.59 114.58 116.32 1jzq h GLU 696 Ca -0.00 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 57.91 1jzq h GLU 696 Cb 0.68 0.00 -0.17 0.00 -0.16 0.00 0.00 28.75 29.10 1jzq h GLU 696 CO 0.03 0.00 -0.23 0.00 -1.18 0.00 0.00 179.01 177.63 1jzq n ALA 697 N -2.01 4.54 -3.98 2.92 0.00 -0.69 -4.97 120.51 116.32 1jzq n ALA 697 Ca 0.02 -3.34 -0.28 0.00 0.00 0.00 0.00 53.44 49.84 1jzq n ALA 697 Cb 0.37 -0.67 -0.08 0.00 0.00 0.00 0.00 19.45 19.08 1jzq n ALA 697 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1jzq n TYR 698 N -1.02 -1.00 -3.85 0.00 4.02 -0.98 -4.92 117.16 109.40 1jzq n TYR 698 Ca 0.36 0.51 -0.34 0.00 -0.01 0.00 0.00 57.90 58.42 1jzq n TYR 698 Cb 0.94 -2.07 -0.13 0.00 -0.02 0.00 0.00 39.34 38.06 1jzq n TYR 698 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1jzq s ASP 699 N -3.78 5.08 0.00 7.72 3.68 0.63 -4.97 116.67 125.04 1jzq s ASP 699 Ca 0.19 -2.13 0.29 0.00 2.13 0.00 0.00 52.55 53.03 1jzq s ASP 699 Cb -0.11 -1.76 1.22 0.00 -1.45 0.00 0.00 42.92 40.82 1jzq s ASP 699 CO 0.82 -0.48 1.85 -0.81 0.13 0.00 0.00 175.17 176.68 1jzq n PRO 700 N 4.41 0.79 -0.02 4.34 -0.04 -1.26 -3.86 135.00 139.36 1jzq n PRO 700 Ca 0.00 -0.29 0.07 0.00 -0.04 0.00 0.00 63.50 63.24 1jzq n PRO 700 Cb 0.41 -1.49 -0.15 0.00 -0.04 0.00 0.00 33.50 32.23 1jzq n PRO 700 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1jzq n THR 701 N -0.85 0.20 -0.02 0.52 -2.24 -1.26 -3.39 114.28 107.25 1jzq n THR 701 Ca 0.15 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.35 1jzq n THR 701 Cb 0.28 -0.04 -0.14 0.00 -2.10 0.00 0.00 70.33 68.33 1jzq n THR 701 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1jzq h THR 702 N 0.00 0.89 0.50 4.28 1.35 -1.87 -2.69 112.91 115.37 1jzq h THR 702 Ca -0.08 -2.74 -0.02 0.00 -0.55 0.00 0.00 66.41 63.02 1jzq h THR 702 Cb 1.09 2.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.96 1jzq h THR 702 CO 0.00 0.52 -0.24 0.77 -0.25 0.00 0.00 175.52 176.32 1jzq h SER 703 N 0.00 -0.57 -0.72 5.36 4.64 -1.77 0.36 113.55 120.85 1jzq h SER 703 Ca -0.27 -0.05 0.16 0.00 -0.47 0.00 0.00 61.79 61.16 1jzq h SER 703 Cb 2.00 0.15 -0.11 0.00 -0.31 0.00 0.00 62.40 64.13 1jzq h SER 703 CO 0.08 -0.17 0.12 0.00 -0.87 0.00 0.00 176.83 176.00 1jzq h ALA 704 N -0.92 0.87 -0.77 5.18 0.00 -1.71 -0.13 119.26 121.78 1jzq h ALA 704 Ca -0.07 0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1jzq h ALA 704 Cb 0.58 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1jzq h ALA 704 CO 0.11 -0.36 0.29 0.00 0.00 0.00 0.00 179.25 179.29 1jzq h ARG 705 N 0.22 1.16 -0.93 0.00 3.08 -1.36 -1.08 114.38 115.47 1jzq h ARG 705 Ca 0.40 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1jzq h ARG 705 Cb 0.68 -0.18 -0.05 0.00 0.08 0.00 0.00 29.97 30.50 1jzq h ARG 705 CO -0.53 0.96 0.58 0.00 -1.07 0.00 0.00 179.97 179.91 1jzq h ALA 706 N 1.15 1.18 0.28 0.04 0.00 0.14 -0.90 119.26 121.15 1jzq h ALA 706 Ca 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1jzq h ALA 706 Cb 0.25 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1jzq h ALA 706 CO -0.02 0.61 -0.16 1.25 0.00 0.00 0.00 179.25 180.94 1jzq h LEU 707 N 1.27 -0.39 -0.78 0.00 7.12 -0.60 -1.95 115.31 119.98 1jzq h LEU 707 Ca 0.33 0.02 0.13 0.00 0.13 0.00 0.00 57.88 58.50 1jzq h LEU 707 Cb -0.09 0.11 -0.09 0.00 -0.53 0.00 0.00 40.66 40.06 1jzq h LEU 707 CO -0.07 -0.26 0.36 -0.09 -0.13 0.00 0.00 178.44 178.25 1jzq h ARG 708 N -0.42 0.52 0.34 1.25 1.12 -0.67 -2.88 114.38 113.65 1jzq h ARG 708 Ca -0.03 -0.03 -0.02 0.00 -1.11 0.00 0.00 59.98 58.79 1jzq h ARG 708 Cb 0.33 -0.12 0.00 0.00 -0.01 0.00 0.00 29.97 30.18 1jzq h ARG 708 CO 0.04 0.35 -0.16 -0.44 -3.11 0.00 0.00 179.97 176.65 1jzq h ASP 709 N 0.54 -0.39 -0.92 -3.80 3.32 -0.84 -2.87 116.42 111.47 1jzq h ASP 709 Ca 0.42 -0.14 0.26 0.00 0.02 0.00 0.00 57.03 57.59 1jzq h ASP 709 Cb 0.59 0.10 -0.15 0.00 0.22 0.00 0.00 39.33 40.08 1jzq h ASP 709 CO -0.36 -0.06 0.23 0.15 -1.72 0.00 0.00 179.24 177.48 1jzq h PHE 710 N -0.75 0.34 0.00 4.55 3.57 -1.16 0.85 116.94 124.34 1jzq h PHE 710 Ca -0.05 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 1jzq h PHE 710 Cb 0.51 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 1jzq h PHE 710 CO 0.01 -0.28 -0.21 0.28 -2.23 0.00 0.00 178.31 175.89 1jzq h VAL 711 N 0.15 1.04 -0.81 1.41 2.07 -1.43 -1.28 116.25 117.41 1jzq h VAL 711 Ca 0.60 -0.74 -0.29 0.00 0.82 0.00 0.00 66.70 67.08 1jzq h VAL 711 Cb 1.26 1.41 -0.17 0.00 -1.52 0.00 0.00 31.29 32.27 1jzq h VAL 711 CO -0.72 0.20 0.37 0.52 0.02 0.00 0.00 177.57 177.97 1jzq n VAL 712 N -4.14 3.00 -1.17 2.57 0.31 0.29 -1.57 118.33 117.63 1jzq n VAL 712 Ca -0.02 -1.68 0.00 0.00 -0.01 0.00 0.00 64.34 62.63 1jzq n VAL 712 Cb 0.28 -0.39 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 1jzq n VAL 712 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1jzq n GLU 713 N -0.37 0.00 -0.04 5.55 0.28 -0.89 -4.06 120.64 121.10 1jzq n GLU 713 Ca 0.46 -0.36 -0.05 0.00 -0.16 0.00 0.00 57.16 57.05 1jzq n GLU 713 Cb 1.46 -0.42 -0.05 0.00 1.43 0.00 0.00 31.44 33.87 1jzq n GLU 713 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1jzq n ASP 714 N 0.00 3.31 0.00 -1.84 2.03 -0.53 -4.11 116.55 115.40 1jzq n ASP 714 Ca 0.00 -0.03 0.00 0.00 0.52 0.00 0.00 54.79 55.28 1jzq n ASP 714 Cb 0.46 0.13 0.00 0.00 -0.72 0.00 0.00 41.12 41.00 1jzq n ASP 714 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1jzq n LEU 715 N -2.59 0.00 0.00 -2.67 -0.00 -0.61 -1.09 117.00 110.04 1jzq n LEU 715 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.87 1jzq n LEU 715 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.11 1jzq n LEU 715 CO 0.11 0.00 0.00 -0.24 -0.00 0.00 0.00 177.39 177.26 1jzq n SER 716 N 0.00 0.00 -0.97 1.96 2.88 -1.26 -2.54 113.62 113.69 1jzq n SER 716 Ca 0.00 0.00 -0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1jzq n SER 716 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1jzq n SER 716 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1jzq n GLN 717 N 0.00 0.00 0.00 -1.46 7.27 -1.26 -4.94 117.38 116.99 1jzq n GLN 717 Ca 0.00 -1.17 0.00 0.00 0.07 0.00 0.00 57.00 55.90 1jzq n GLN 717 Cb 0.00 0.01 0.00 0.00 2.41 0.00 0.00 30.24 32.66 1jzq n GLN 717 CO 0.00 0.00 0.00 1.87 0.07 0.00 0.00 177.06 179.00 1jzq n TRP 718 N 0.17 0.00 0.00 3.69 -0.00 -1.05 -4.77 117.44 115.48 1jzq n TRP 718 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.45 1jzq n TRP 718 Cb 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 32.13 1jzq n TRP 718 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 177.69 178.67 1jzq n TYR 719 N 0.00 0.00 0.00 5.87 9.36 -1.26 0.11 117.16 131.24 1jzq n TYR 719 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1jzq n TYR 719 Cb 0.00 -0.43 0.00 0.00 -0.63 0.00 0.00 39.34 38.28 1jzq n TYR 719 CO 0.00 0.00 0.00 1.55 0.22 0.00 0.00 176.86 178.63 1jzq n VAL 720 N -2.15 1.06 -0.08 2.97 3.14 -0.25 -1.55 118.33 121.47 1jzq n VAL 720 Ca 0.00 0.32 -0.08 0.00 -2.96 0.00 0.00 64.34 61.62 1jzq n VAL 720 Cb 0.00 -1.32 -0.03 0.00 -1.06 0.00 0.00 33.84 31.44 1jzq n VAL 720 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23 1jzq n ARG 721 N -1.24 0.50 -0.35 1.45 3.00 0.02 -3.81 116.66 116.24 1jzq n ARG 721 Ca 0.00 0.33 0.04 0.00 -0.00 0.00 0.00 57.85 58.22 1jzq n ARG 721 Cb 0.05 -1.53 0.18 0.00 0.00 0.00 0.00 32.46 31.15 1jzq n ARG 721 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 1jzq n ARG 722 N -4.51 2.53 0.00 -0.14 0.63 0.29 -3.27 116.66 112.19 1jzq n ARG 722 Ca -0.12 -1.40 0.00 0.00 -0.92 0.00 0.00 57.85 55.40 1jzq n ARG 722 Cb 0.43 -1.69 0.00 0.00 0.45 0.00 0.00 32.46 31.65 1jzq n ARG 722 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1jzq n ASN 723 N 0.35 0.56 0.32 6.15 3.02 -0.59 -4.78 115.26 120.29 1jzq n ASN 723 Ca 0.13 -1.27 0.20 0.00 -0.03 0.00 0.00 54.58 53.61 1jzq n ASN 723 Cb 0.58 0.00 1.02 0.00 -0.61 0.00 0.00 39.78 40.77 1jzq n ASN 723 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1jzq h ARG 724 N 0.00 0.00 0.04 3.52 2.43 -1.65 -2.62 114.38 116.10 1jzq h ARG 724 Ca 0.00 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 58.94 1jzq h ARG 724 Cb 0.83 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 1jzq h ARG 724 CO 0.00 0.01 -1.02 0.07 -1.51 0.00 0.00 179.97 177.52 1jzq h ARG 725 N 0.00 0.21 0.00 0.20 0.11 -1.86 -3.24 114.38 109.80 1jzq h ARG 725 Ca -0.00 -0.28 0.00 0.00 0.10 0.00 0.00 59.98 59.80 1jzq h ARG 725 Cb 0.17 0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.35 1jzq h ARG 725 CO 0.00 1.06 0.00 0.54 0.10 0.00 0.00 179.97 181.67 1jzq n ARG 726 N -3.58 0.09 -0.50 0.08 1.74 -0.99 -2.02 116.66 111.49 1jzq n ARG 726 Ca -0.05 0.56 0.09 0.00 -0.77 0.00 0.00 57.85 57.68 1jzq n ARG 726 Cb 0.90 -1.78 0.31 0.00 -1.02 0.00 0.00 32.46 30.87 1jzq n ARG 726 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1jzq n PHE 727 N -1.98 1.22 -4.36 -1.55 3.72 -1.22 -4.65 117.46 108.64 1jzq n PHE 727 Ca -0.00 -0.51 -0.26 0.00 -0.05 0.00 0.00 57.45 56.62 1jzq n PHE 727 Cb 0.04 -0.16 -0.09 0.00 -0.94 0.00 0.00 39.48 38.33 1jzq n PHE 727 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 1jzq s TRP 728 N -1.63 2.56 0.31 1.38 -0.00 -0.85 -4.95 118.94 115.76 1jzq s TRP 728 Ca 0.46 -0.60 0.07 0.00 -0.00 0.00 0.00 56.10 56.02 1jzq s TRP 728 Cb 0.28 -1.83 0.86 0.00 -0.00 0.00 0.00 33.47 32.78 1jzq s TRP 728 CO 0.24 0.33 1.66 1.57 -0.00 0.00 0.00 176.95 180.75 1jzq h LYS 729 N 1.62 0.26 -1.49 5.86 5.09 -1.92 -0.69 116.57 125.30 1jzq h LYS 729 Ca -0.43 -0.02 0.43 0.00 0.09 0.00 0.00 60.65 60.72 1jzq h LYS 729 Cb 1.25 -0.06 -0.06 0.00 0.10 0.00 0.00 32.23 33.46 1jzq h LYS 729 CO 0.74 0.17 1.18 -0.97 -2.09 0.00 0.00 179.45 178.48 1jzq h ASN 730 N 0.27 0.00 -2.75 7.07 -0.00 -1.96 -3.37 115.58 114.84 1jzq h ASN 730 Ca 0.62 0.00 -0.56 0.00 -0.00 0.00 0.00 56.30 56.36 1jzq h ASN 730 Cb 1.32 0.00 -0.04 0.00 -0.00 0.00 0.00 38.32 39.61 1jzq h ASN 730 CO -0.63 0.00 1.22 -1.61 -0.00 0.00 0.00 177.43 176.41 1jzq s GLU 731 N -4.78 3.30 0.00 6.67 0.41 -0.27 -4.78 118.70 119.25 1jzq s GLU 731 Ca -0.04 1.14 0.00 0.00 -0.41 0.00 0.00 54.97 55.66 1jzq s GLU 731 Cb 0.23 -4.17 0.00 0.00 -1.78 0.00 0.00 34.13 28.40 1jzq s GLU 731 CO 0.77 -1.90 0.42 -0.40 -0.49 0.00 0.00 175.26 173.65 1jzq n ASP 732 N 10.19 0.84 -4.54 -0.19 3.85 -1.26 -4.92 116.55 120.52 1jzq n ASP 732 Ca 0.20 -0.94 -0.42 0.00 -0.71 0.00 0.00 54.79 52.92 1jzq n ASP 732 Cb 0.48 0.12 -0.02 0.00 -1.35 0.00 0.00 41.12 40.35 1jzq n ASP 732 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jzq s ALA 733 N -0.12 3.13 0.00 2.12 0.00 -1.26 -4.90 121.76 120.73 1jzq s ALA 733 Ca 0.00 -2.65 0.00 0.00 0.00 0.00 0.00 51.96 49.31 1jzq s ALA 733 Cb 0.00 -4.44 0.00 0.00 0.00 0.00 0.00 23.12 18.68 1jzq s ALA 733 CO 0.00 -3.33 0.00 -0.11 0.00 0.00 0.00 175.76 172.32 1jzq n LEU 734 N 8.01 0.00 0.02 0.00 7.94 -1.26 0.14 117.00 131.85 1jzq n LEU 734 Ca 0.36 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 55.14 1jzq n LEU 734 Cb 0.48 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.37 1jzq n LEU 734 CO 0.66 0.00 0.59 0.44 -1.11 0.00 0.00 177.39 177.97 1jzq h ASP 735 N 0.00 -1.26 -0.54 1.96 5.19 -1.94 -0.17 116.42 119.65 1jzq h ASP 735 Ca 0.00 0.16 0.06 0.00 -0.62 0.00 0.00 57.03 56.64 1jzq h ASP 735 Cb 0.00 0.51 -0.05 0.00 0.18 0.00 0.00 39.33 39.96 1jzq h ASP 735 CO 0.00 -0.43 0.24 0.03 -3.12 0.00 0.00 179.24 175.96 1jzq h ARG 736 N -0.51 0.44 -0.99 3.56 3.08 0.85 0.17 114.38 120.98 1jzq h ARG 736 Ca 0.07 -0.03 0.20 0.00 0.07 0.00 0.00 59.98 60.29 1jzq h ARG 736 Cb 0.63 -0.10 -0.10 0.00 0.08 0.00 0.00 29.97 30.48 1jzq h ARG 736 CO -0.37 0.29 0.62 0.93 -1.07 0.00 0.00 179.97 180.37 1jzq h GLU 737 N 0.45 0.65 -2.33 0.04 5.08 0.02 -1.27 114.58 117.21 1jzq h GLU 737 Ca 0.25 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.49 1jzq h GLU 737 Cb 0.22 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 1jzq h GLU 737 CO -0.21 0.43 0.00 0.00 -1.00 0.00 0.00 179.01 178.23 1jzq n ALA 738 N -2.37 3.72 0.08 3.43 0.00 0.60 -3.03 120.51 122.93 1jzq n ALA 738 Ca 0.23 -0.76 0.11 0.00 0.00 0.00 0.00 53.44 53.02 1jzq n ALA 738 Cb 0.63 -2.08 -0.13 0.00 0.00 0.00 0.00 19.45 17.87 1jzq n ALA 738 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jzq n ALA 739 N 2.47 2.86 0.18 0.00 0.00 -0.48 -3.88 120.51 121.66 1jzq n ALA 739 Ca 0.18 -0.46 0.17 0.00 0.00 0.00 0.00 53.44 53.32 1jzq n ALA 739 Cb 0.45 -0.83 0.79 0.00 0.00 0.00 0.00 19.45 19.86 1jzq n ALA 739 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1jzq h TYR 740 N 0.00 0.00 0.56 0.00 -1.99 -1.81 -2.36 116.97 111.38 1jzq h TYR 740 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 1jzq h TYR 740 Cb 0.97 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.69 1jzq h TYR 740 CO 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 178.16 177.74 1jzq h ALA 741 N 1.79 -1.16 0.06 3.88 0.00 -1.87 0.44 119.26 122.40 1jzq h ALA 741 Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1jzq h ALA 741 Cb 0.51 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1jzq h ALA 741 CO -0.00 -1.15 -0.05 1.79 0.00 0.00 0.00 179.25 179.83 1jzq h THR 742 N -0.94 0.88 0.00 0.00 1.35 -1.69 0.65 112.91 113.16 1jzq h THR 742 Ca -0.07 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.79 1jzq h THR 742 Cb 0.78 0.88 -0.00 0.00 -1.73 0.00 0.00 68.15 68.08 1jzq h THR 742 CO 0.03 0.00 -0.00 0.25 -0.25 0.00 0.00 175.52 175.54 1jzq h LEU 743 N -0.13 0.00 0.00 3.87 5.85 -1.44 0.25 115.31 123.72 1jzq h LEU 743 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1jzq h LEU 743 Cb 0.12 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1jzq h LEU 743 CO -0.01 0.00 -0.01 0.22 -0.34 0.00 0.00 178.44 178.31 1jzq h TYR 744 N 0.00 0.00 -0.31 1.25 3.20 0.10 -3.09 116.97 118.13 1jzq h TYR 744 Ca -0.00 0.00 0.09 0.00 3.14 0.00 0.00 58.73 61.96 1jzq h TYR 744 Cb 0.19 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1jzq h TYR 744 CO 0.00 0.07 0.28 0.93 -1.64 0.00 0.00 178.16 177.79 1jzq h GLU 745 N -1.00 0.00 0.09 1.82 5.08 0.61 -0.52 114.58 120.66 1jzq h GLU 745 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1jzq h GLU 745 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1jzq h GLU 745 CO -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 179.01 177.96 1jzq h ALA 746 N 1.74 -0.48 -0.87 3.43 0.00 -0.62 -2.10 119.26 120.35 1jzq h ALA 746 Ca 0.15 -0.03 0.23 0.00 0.00 0.00 0.00 54.91 55.26 1jzq h ALA 746 Cb 0.70 0.05 -0.15 0.00 0.00 0.00 0.00 17.79 18.39 1jzq h ALA 746 CO -0.00 -0.47 0.13 -0.07 0.00 0.00 0.00 179.25 178.83 1jzq h LEU 747 N -0.24 -0.21 -1.33 0.00 3.38 -1.41 1.51 115.31 117.01 1jzq h LEU 747 Ca -0.01 0.22 0.06 0.00 0.09 0.00 0.00 57.88 58.24 1jzq h LEU 747 Cb 0.10 0.34 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 1jzq h LEU 747 CO 0.02 -0.22 0.49 0.58 0.09 0.00 0.00 178.44 179.41 1jzq h VAL 748 N 0.13 1.04 0.07 1.22 2.07 -1.16 0.22 116.25 119.84 1jzq h VAL 748 Ca 0.53 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.77 1jzq h VAL 748 Cb 1.05 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1jzq h VAL 748 CO -0.73 0.15 -0.03 0.25 0.02 0.00 0.00 177.57 177.23 1jzq h LEU 749 N 0.81 -0.08 0.09 2.57 5.85 0.28 -2.82 115.31 122.01 1jzq h LEU 749 Ca 0.32 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1jzq h LEU 749 Cb 0.23 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.23 1jzq h LEU 749 CO -0.11 0.23 -0.45 0.58 -0.34 0.00 0.00 178.44 178.35 1jzq h VAL 750 N -0.40 0.11 -1.23 1.05 2.07 -0.20 -0.24 116.25 117.42 1jzq h VAL 750 Ca -0.01 0.00 0.35 0.00 0.82 0.00 0.00 66.70 67.86 1jzq h VAL 750 Cb 0.34 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.16 1jzq h VAL 750 CO 0.02 0.00 0.86 0.00 0.02 0.00 0.00 177.57 178.46 1jzq h ALA 751 N -0.23 2.96 0.14 1.67 0.00 -0.57 0.16 119.26 123.39 1jzq h ALA 751 Ca 0.02 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.68 1jzq h ALA 751 Cb 0.70 0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.59 1jzq h ALA 751 CO -0.28 -1.35 -1.17 1.15 0.00 0.00 0.00 179.25 177.59 1jzq h THR 752 N 0.09 1.25 -0.82 0.00 2.02 -0.94 -3.15 112.91 111.36 1jzq h THR 752 Ca 0.62 -2.48 -0.03 0.00 0.77 0.00 0.00 66.41 65.29 1jzq h THR 752 Cb 2.25 2.94 -0.04 0.00 -1.74 0.00 0.00 68.15 71.56 1jzq h THR 752 CO -0.10 0.72 0.41 -0.07 0.37 0.00 0.00 175.52 176.84 1jzq h LEU 753 N -0.29 1.07 -1.61 2.58 3.38 0.26 -2.61 115.31 118.09 1jzq h LEU 753 Ca -0.23 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 1jzq h LEU 753 Cb 1.75 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 42.22 1jzq h LEU 753 CO 0.12 0.89 -0.08 0.00 0.09 0.00 0.00 178.44 179.46 1jzq h ALA 754 N 1.22 1.68 -0.65 1.53 0.00 -0.87 -3.32 119.26 118.85 1jzq h ALA 754 Ca 0.28 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.13 1jzq h ALA 754 Cb 0.10 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 17.74 1jzq h ALA 754 CO -0.04 0.24 -0.34 0.00 0.00 0.00 0.00 179.25 179.11 1jzq n ALA 755 N -2.50 -0.31 0.25 0.00 0.00 -0.98 0.44 120.51 117.41 1jzq n ALA 755 Ca -0.01 0.58 0.10 0.00 0.00 0.00 0.00 53.44 54.11 1jzq n ALA 755 Cb 0.20 -0.16 0.66 0.00 0.00 0.00 0.00 19.45 20.16 1jzq n ALA 755 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1jzq h PRO 756 N 0.00 0.00 0.00 0.00 0.11 -1.79 -2.91 132.00 127.41 1jzq h PRO 756 Ca 0.14 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.24 1jzq h PRO 756 Cb 0.31 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.41 1jzq h PRO 756 CO -0.62 0.13 -0.49 0.74 -0.21 0.00 0.00 178.00 177.54 1jzq h PHE 757 N 0.00 0.00 -3.03 0.65 -1.00 -0.24 -3.39 116.94 109.93 1jzq h PHE 757 Ca -0.00 0.00 -0.66 0.00 2.81 0.00 0.00 57.97 60.11 1jzq h PHE 757 Cb 0.28 0.00 -0.38 0.00 3.61 0.00 0.00 35.95 39.46 1jzq h PHE 757 CO 0.00 0.13 -0.28 0.25 -1.61 0.00 0.00 178.31 176.79 1jzq n THR 758 N -4.62 2.58 -0.22 -1.55 -2.24 -0.21 -4.65 114.28 103.36 1jzq n THR 758 Ca -0.08 -5.10 0.27 0.00 -2.27 0.00 0.00 64.05 56.87 1jzq n THR 758 Cb 0.26 -2.25 0.67 0.00 -2.10 0.00 0.00 70.33 66.91 1jzq n THR 758 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1jzq h PRO 759 N 5.45 0.11 0.04 -0.78 0.13 -1.70 -1.95 132.00 133.30 1jzq h PRO 759 Ca 0.17 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1jzq h PRO 759 Cb 0.75 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1jzq h PRO 759 CO 0.84 0.07 -0.02 0.74 -0.23 0.00 0.00 178.00 179.40 1jzq h PHE 760 N 0.11 -0.04 -0.89 1.56 -1.00 -1.93 -3.20 116.94 111.55 1jzq h PHE 760 Ca 0.47 -0.00 0.10 0.00 2.81 0.00 0.00 57.97 61.35 1jzq h PHE 760 Cb 1.66 0.01 -0.07 0.00 3.61 0.00 0.00 35.95 41.17 1jzq h PHE 760 CO -0.00 0.19 0.58 1.25 -1.61 0.00 0.00 178.31 178.72 1jzq h LEU 761 N -1.00 0.79 -0.02 1.54 5.85 -1.96 -1.02 115.31 119.48 1jzq h LEU 761 Ca -0.00 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1jzq h LEU 761 Cb 0.26 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1jzq h LEU 761 CO 0.01 0.46 -0.06 0.00 -0.34 0.00 0.00 178.44 178.51 1jzq h ALA 762 N 1.56 -0.04 -0.09 1.25 0.00 -1.49 -2.36 119.26 118.08 1jzq h ALA 762 Ca 0.42 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.38 1jzq h ALA 762 Cb 0.44 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1jzq h ALA 762 CO -0.18 -0.54 -0.16 1.49 0.00 0.00 0.00 179.25 179.85 1jzq h GLU 763 N -0.09 -0.22 0.06 0.00 4.57 -1.22 -2.18 114.58 115.50 1jzq h GLU 763 Ca 0.03 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.25 1jzq h GLU 763 Cb 0.13 0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.73 1jzq h GLU 763 CO -0.07 -0.14 -0.24 -0.39 -1.18 0.00 0.00 179.01 176.98 1jzq h VAL 764 N -0.22 0.46 -0.21 0.32 -1.51 -1.07 0.76 116.25 114.78 1jzq h VAL 764 Ca 0.08 0.00 0.06 0.00 -1.23 0.00 0.00 66.70 65.61 1jzq h VAL 764 Cb 0.34 0.46 -0.01 0.00 -2.13 0.00 0.00 31.29 29.95 1jzq h VAL 764 CO -0.22 0.00 0.20 -0.07 -1.23 0.00 0.00 177.57 176.24 1jzq h LEU 765 N -0.40 0.00 0.09 4.19 3.38 -1.27 -2.32 115.31 118.98 1jzq h LEU 765 Ca 0.05 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 1jzq h LEU 765 Cb 0.46 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1jzq h LEU 765 CO -0.18 0.00 -0.56 -0.25 0.09 0.00 0.00 178.44 177.54 1jzq h TRP 766 N 0.00 0.39 -0.87 1.13 2.91 -0.57 -1.19 115.95 117.75 1jzq h TRP 766 Ca 0.10 -0.28 0.14 0.00 1.13 0.00 0.00 58.89 59.98 1jzq h TRP 766 Cb 0.49 -0.02 -0.09 0.00 -0.51 0.00 0.00 29.16 29.04 1jzq h TRP 766 CO 0.00 1.21 0.48 1.96 -1.03 0.00 0.00 178.44 181.05 1jzq h GLN 767 N -0.54 0.69 0.00 2.65 1.08 -0.36 0.85 115.11 119.48 1jzq h GLN 767 Ca -0.10 -0.04 -0.06 0.00 -1.45 0.00 0.00 58.65 57.00 1jzq h GLN 767 Cb 1.43 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 28.70 1jzq h GLN 767 CO 0.11 0.45 -0.36 -0.97 -0.95 0.00 0.00 178.83 177.11 1jzq h ASN 768 N 0.71 0.00 -0.05 1.46 -0.73 -1.57 -3.22 115.58 112.18 1jzq h ASN 768 Ca 0.46 -0.76 -0.05 0.00 1.87 0.00 0.00 56.30 57.83 1jzq h ASN 768 Cb 0.59 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.18 1jzq h ASN 768 CO -0.33 1.09 -0.15 -0.07 -0.37 0.00 0.00 177.43 177.59 1jzq h LEU 769 N -1.00 0.22 0.05 0.34 4.07 -1.14 -3.14 115.31 114.70 1jzq h LEU 769 Ca -0.09 -0.62 -0.15 0.00 0.08 0.00 0.00 57.88 57.10 1jzq h LEU 769 Cb 0.99 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.66 1jzq h LEU 769 CO -0.06 0.80 -0.74 0.58 -1.08 0.00 0.00 178.44 177.94 1jzq h VAL 770 N -0.35 1.39 0.00 1.22 2.07 -1.01 -3.32 116.25 116.24 1jzq h VAL 770 Ca -0.01 -2.36 0.00 0.00 0.82 0.00 0.00 66.70 65.15 1jzq h VAL 770 Cb 0.78 2.96 0.00 0.00 -1.52 0.00 0.00 31.29 33.51 1jzq h VAL 770 CO 0.03 0.59 0.00 0.03 0.02 0.00 0.00 177.57 178.24 1jzq h ARG 771 N -0.72 0.00 0.07 1.57 2.47 -1.41 -1.48 114.38 114.88 1jzq h ARG 771 Ca -0.17 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.55 1jzq h ARG 771 Cb 1.36 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.68 1jzq h ARG 771 CO 0.00 0.00 -0.03 0.77 0.56 0.00 0.00 179.97 181.27 1jzq h SER 772 N 0.00 -0.07 0.79 7.04 0.02 -1.66 -3.06 113.55 116.60 1jzq h SER 772 Ca 0.00 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1jzq h SER 772 Cb 0.25 0.02 0.01 0.00 0.14 0.00 0.00 62.40 62.82 1jzq h SER 772 CO 0.00 0.36 -0.38 0.58 -1.14 0.00 0.00 176.83 176.25 1jzq h VAL 773 N -0.91 0.18 -2.66 2.27 2.07 -1.65 -3.32 116.25 112.24 1jzq h VAL 773 Ca -0.01 -0.08 -0.68 0.00 0.82 0.00 0.00 66.70 66.75 1jzq h VAL 773 Cb 0.07 0.20 -0.37 0.00 -1.52 0.00 0.00 31.29 29.67 1jzq h VAL 773 CO 0.01 0.01 -0.12 0.54 0.02 0.00 0.00 177.57 178.03 1jzq n ARG 774 N -5.52 3.04 0.26 1.57 3.00 -0.56 -4.87 116.66 113.59 1jzq n ARG 774 Ca -0.14 -4.60 0.13 0.00 -0.01 0.00 0.00 57.85 53.23 1jzq n ARG 774 Cb 0.43 -2.36 0.70 0.00 0.00 0.00 0.00 32.46 31.23 1jzq n ARG 774 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.63 179.00 1jzq h LEU 775 N 4.93 0.00 -1.49 0.55 -0.00 -1.64 0.18 115.31 117.84 1jzq h LEU 775 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.07 1jzq h LEU 775 Cb 0.68 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.34 1jzq h LEU 775 CO 0.97 0.00 0.00 -1.84 -0.00 0.00 0.00 178.44 177.57 1jzq n GLU 776 N -2.58 2.01 -2.57 0.17 0.00 -1.26 -4.88 120.64 111.53 1jzq n GLU 776 Ca -0.02 -0.95 -0.23 0.00 0.00 0.00 0.00 57.16 55.96 1jzq n GLU 776 Cb 0.29 -1.55 0.04 0.00 0.00 0.00 0.00 31.44 30.22 1jzq n GLU 776 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1jzq s ALA 777 N -1.61 3.66 0.39 -1.84 0.00 0.64 -5.02 121.76 117.98 1jzq s ALA 777 Ca 0.17 -1.14 -0.25 0.00 0.00 0.00 0.00 51.96 50.73 1jzq s ALA 777 Cb 0.12 -2.25 -0.11 0.00 0.00 0.00 0.00 23.12 20.88 1jzq s ALA 777 CO 0.07 -0.83 1.08 1.63 0.00 0.00 0.00 175.76 177.71 1jzq n LYS 778 N -2.46 1.52 0.03 0.00 4.76 -1.26 -4.90 118.16 115.85 1jzq n LYS 778 Ca 0.07 0.54 0.03 0.00 -2.87 0.00 0.00 58.31 56.08 1jzq n LYS 778 Cb 0.59 -2.10 0.40 0.00 -1.84 0.00 0.00 35.03 32.09 1jzq n LYS 778 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1jzq h GLU 779 N 1.79 0.48 -5.32 1.97 5.08 -1.95 -3.44 114.58 113.18 1jzq h GLU 779 Ca -0.44 -0.05 -0.44 0.00 -1.00 0.00 0.00 59.36 57.43 1jzq h GLU 779 Cb 1.33 -0.10 -0.24 0.00 0.50 0.00 0.00 28.75 30.24 1jzq h GLU 779 CO 0.58 0.38 -0.79 0.45 -1.00 0.00 0.00 179.01 178.64 1jzq s SER 780 N -6.74 1.66 0.31 1.42 0.15 -1.26 -4.88 113.70 104.36 1jzq s SER 780 Ca -0.08 -0.49 0.02 0.00 0.70 0.00 0.00 55.95 56.10 1jzq s SER 780 Cb 0.17 -0.09 0.57 0.00 -1.71 0.00 0.00 66.02 64.96 1jzq s SER 780 CO 0.74 0.01 1.92 0.58 1.20 0.00 0.00 173.24 177.68 1jzq h VAL 781 N 4.46 1.05 0.00 4.45 2.07 -1.90 0.15 116.25 126.54 1jzq h VAL 781 Ca -0.39 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 66.80 1jzq h VAL 781 Cb 1.18 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1jzq h VAL 781 CO 0.43 0.18 0.00 1.41 0.02 0.00 0.00 177.57 179.61 1jzq n HIS 782 N -4.49 0.00 0.00 1.57 8.25 -1.26 -0.23 115.22 119.06 1jzq n HIS 782 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 1jzq n HIS 782 Cb 0.21 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.31 1jzq n HIS 782 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1jzq n LEU 783 N -0.32 0.00 -4.80 2.41 4.77 0.52 -4.66 117.00 114.92 1jzq n LEU 783 Ca 0.00 -0.39 -0.29 0.00 -0.03 0.00 0.00 56.01 55.30 1jzq n LEU 783 Cb 0.01 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.25 1jzq n LEU 783 CO 0.00 0.00 0.74 0.00 -1.33 0.00 0.00 177.39 176.80 1jzq s ALA 784 N -0.85 1.81 0.24 -1.18 0.00 0.68 -5.01 121.76 117.45 1jzq s ALA 784 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.29 1jzq s ALA 784 Cb 0.00 -2.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.11 1jzq s ALA 784 CO 0.00 -2.39 0.40 -0.51 0.00 0.00 0.00 175.76 173.27 1jzq s ASP 785 N -4.20 6.34 -0.06 0.00 1.01 -1.26 -4.64 116.67 113.85 1jzq s ASP 785 Ca 0.66 0.28 -0.30 0.00 0.71 0.00 0.00 52.55 53.91 1jzq s ASP 785 Cb -0.12 -1.96 -0.03 0.00 1.01 0.00 0.00 42.92 41.82 1jzq s ASP 785 CO 0.53 -0.10 1.17 0.86 0.21 0.00 0.00 175.17 177.85 1jzq s TRP 786 N -1.99 3.24 0.82 4.23 -0.11 0.31 -4.99 118.94 120.45 1jzq s TRP 786 Ca 0.37 1.27 -0.13 0.00 1.22 0.00 0.00 56.10 58.83 1jzq s TRP 786 Cb -0.10 -3.39 0.09 0.00 -1.50 0.00 0.00 33.47 28.57 1jzq s TRP 786 CO 0.31 -1.15 1.20 -0.35 -4.62 0.00 0.00 176.95 172.33 1jzq n PRO 787 N 5.15 0.11 -4.40 5.86 -0.04 -1.26 -4.98 135.00 135.45 1jzq n PRO 787 Ca 0.11 0.12 -0.20 0.00 -0.04 0.00 0.00 63.50 63.48 1jzq n PRO 787 Cb 0.47 -2.43 -0.10 0.00 -0.04 0.00 0.00 33.50 31.39 1jzq n PRO 787 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1jzq s GLU 788 N -4.17 1.55 -0.03 0.54 2.02 -1.26 -5.04 118.70 112.31 1jzq s GLU 788 Ca 0.73 -1.83 -0.12 0.00 0.02 0.00 0.00 54.97 53.77 1jzq s GLU 788 Cb -0.29 -0.75 -0.05 0.00 0.10 0.00 0.00 34.13 33.14 1jzq s GLU 788 CO 0.51 -0.17 0.32 0.00 0.02 0.00 0.00 175.26 175.95 1jzq s ALA 789 N -3.37 3.76 -0.31 5.21 0.00 -1.26 -5.03 121.76 120.76 1jzq s ALA 789 Ca 0.35 -0.37 -0.17 0.00 0.00 0.00 0.00 51.96 51.77 1jzq s ALA 789 Cb 0.08 -2.24 -0.02 0.00 0.00 0.00 0.00 23.12 20.93 1jzq s ALA 789 CO 0.14 0.54 0.46 0.34 0.00 0.00 0.00 175.76 177.23 1jzq s ASP 790 N -1.14 6.31 0.47 0.00 2.15 -1.26 -4.93 116.67 118.27 1jzq s ASP 790 Ca 0.22 0.15 0.30 0.00 0.43 0.00 0.00 52.55 53.65 1jzq s ASP 790 Cb -0.15 -2.25 1.38 0.00 -0.30 0.00 0.00 42.92 41.61 1jzq s ASP 790 CO 0.11 -0.34 1.74 -0.65 -0.17 0.00 0.00 175.17 175.85 1jzq h PRO 791 N 8.29 0.15 0.72 4.34 0.11 -1.97 -1.21 132.00 142.43 1jzq h PRO 791 Ca -0.29 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 1jzq h PRO 791 Cb 1.14 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1jzq h PRO 791 CO 0.72 0.10 -0.50 0.00 -0.21 0.00 0.00 178.00 178.10 1jzq h ALA 792 N 1.49 -1.24 0.00 -0.75 0.00 -2.03 -2.93 119.26 113.80 1jzq h ALA 792 Ca 0.66 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1jzq h ALA 792 Cb 2.18 0.65 0.00 0.00 0.00 0.00 0.00 17.79 20.63 1jzq h ALA 792 CO -0.19 -1.22 0.00 1.28 0.00 0.00 0.00 179.25 179.11 1jzq n LEU 793 N -5.61 0.00 -4.66 0.00 4.32 -0.50 -4.80 117.00 105.75 1jzq n LEU 793 Ca -0.14 0.28 -0.43 0.00 -0.02 0.00 0.00 56.01 55.71 1jzq n LEU 793 Cb 0.50 -0.28 -0.02 0.00 -1.62 0.00 0.00 43.42 41.99 1jzq n LEU 793 CO 0.33 -0.08 1.08 0.00 -1.22 0.00 0.00 177.39 177.49 1jzq s ALA 794 N -2.57 3.63 -0.55 -1.18 0.00 -0.93 -3.13 121.76 117.03 1jzq s ALA 794 Ca 0.21 0.39 0.04 0.00 0.00 0.00 0.00 51.96 52.60 1jzq s ALA 794 Cb 0.15 -3.63 0.17 0.00 0.00 0.00 0.00 23.12 19.80 1jzq s ALA 794 CO 0.34 -1.24 0.41 0.34 0.00 0.00 0.00 175.76 175.60 1jzq s ASP 795 N 2.02 3.11 0.22 0.00 -1.08 -1.26 -4.99 116.67 114.69 1jzq s ASP 795 Ca 0.54 -3.42 -0.17 0.00 -0.52 0.00 0.00 52.55 48.98 1jzq s ASP 795 Cb -0.20 -1.02 0.23 0.00 -1.46 0.00 0.00 42.92 40.47 1jzq s ASP 795 CO 0.15 -0.13 1.57 -0.08 0.52 0.00 0.00 175.17 177.19 1jzq h GLU 796 N 5.57 -0.05 0.85 4.34 4.57 -1.93 -1.61 114.58 126.32 1jzq h GLU 796 Ca 0.20 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.34 1jzq h GLU 796 Cb 0.84 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.45 1jzq h GLU 796 CO 0.54 -0.03 -0.41 0.00 -1.18 0.00 0.00 179.01 177.92 1jzq h ALA 797 N 1.35 -1.15 -0.80 2.92 0.00 -1.98 -0.07 119.26 119.54 1jzq h ALA 797 Ca 0.32 -0.25 0.19 0.00 0.00 0.00 0.00 54.91 55.17 1jzq h ALA 797 Cb 0.59 0.44 -0.12 0.00 0.00 0.00 0.00 17.79 18.71 1jzq h ALA 797 CO -0.87 -1.12 0.22 1.25 0.00 0.00 0.00 179.25 178.72 1jzq h LEU 798 N -1.19 0.05 -0.37 0.00 5.85 -1.91 0.41 115.31 118.14 1jzq h LEU 798 Ca -0.12 0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1jzq h LEU 798 Cb 0.89 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 1jzq h LEU 798 CO 0.19 -0.06 0.05 0.58 -0.34 0.00 0.00 178.44 178.86 1jzq h VAL 799 N 0.27 1.24 -0.11 1.05 2.07 -1.24 -1.48 116.25 118.05 1jzq h VAL 799 Ca 0.47 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 67.14 1jzq h VAL 799 Cb 0.85 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 1jzq h VAL 799 CO -0.55 0.30 -0.12 0.00 0.02 0.00 0.00 177.57 177.21 1jzq h ALA 800 N 0.90 -0.04 0.53 1.67 0.00 0.15 0.22 119.26 122.68 1jzq h ALA 800 Ca 0.11 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1jzq h ALA 800 Cb 0.39 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1jzq h ALA 800 CO 0.01 -0.58 -0.26 1.96 0.00 0.00 0.00 179.25 180.38 1jzq h GLN 801 N -0.15 -0.69 0.00 0.00 4.20 -0.31 -1.83 115.11 116.32 1jzq h GLN 801 Ca 0.08 0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 1jzq h GLN 801 Cb 0.27 0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 1jzq h GLN 801 CO -0.21 -0.46 -0.00 1.98 -0.67 0.00 0.00 178.83 179.47 1jzq h MET 802 N -0.72 0.00 0.03 1.46 4.05 -1.07 0.58 114.93 119.27 1jzq h MET 802 Ca -0.07 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1jzq h MET 802 Cb 0.55 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.35 1jzq h MET 802 CO 0.12 0.00 -0.02 -0.09 0.23 0.00 0.00 176.91 177.16 1jzq h ARG 803 N 0.00 -0.04 -0.00 0.39 2.43 -0.09 -1.67 114.38 115.40 1jzq h ARG 803 Ca -0.00 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1jzq h ARG 803 Cb 0.05 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1jzq h ARG 803 CO 0.00 0.56 -0.08 0.00 -1.51 0.00 0.00 179.97 178.93 1jzq h ALA 804 N 0.23 -0.09 -0.75 2.80 0.00 -0.27 -1.41 119.26 119.78 1jzq h ALA 804 Ca -0.00 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1jzq h ALA 804 Cb 0.62 0.15 -0.11 0.00 0.00 0.00 0.00 17.79 18.44 1jzq h ALA 804 CO 0.01 -0.58 -0.52 0.28 0.00 0.00 0.00 179.25 178.44 1jzq h VAL 805 N -0.14 0.02 0.02 0.00 2.07 0.08 -0.09 116.25 118.21 1jzq h VAL 805 Ca 0.03 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.57 1jzq h VAL 805 Cb 0.18 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 29.93 1jzq h VAL 805 CO -0.09 0.00 -0.47 -0.07 0.02 0.00 0.00 177.57 176.96 1jzq h LEU 806 N -0.15 -1.45 -0.96 2.57 3.38 -0.82 -1.11 115.31 116.77 1jzq h LEU 806 Ca 0.17 0.16 0.12 0.00 0.09 0.00 0.00 57.88 58.41 1jzq h LEU 806 Cb 0.52 0.55 -0.14 0.00 0.09 0.00 0.00 40.66 41.68 1jzq h LEU 806 CO -0.80 -0.47 -0.50 0.50 0.09 0.00 0.00 178.44 177.26 1jzq h LYS 807 N -0.61 -0.02 -0.80 1.13 3.64 -0.18 0.59 116.57 120.32 1jzq h LYS 807 Ca 0.01 0.00 0.17 0.00 -1.27 0.00 0.00 60.65 59.56 1jzq h LYS 807 Cb 0.64 0.01 -0.11 0.00 -0.41 0.00 0.00 32.23 32.36 1jzq h LYS 807 CO -0.30 -0.02 0.30 0.28 -2.27 0.00 0.00 179.45 177.44 1jzq h VAL 808 N -0.02 0.56 0.08 2.00 2.07 -0.41 -1.71 116.25 118.82 1jzq h VAL 808 Ca 0.24 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.62 1jzq h VAL 808 Cb 0.50 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1jzq h VAL 808 CO -0.94 0.07 -0.08 0.58 0.02 0.00 0.00 177.57 177.23 1jzq h VAL 809 N 0.39 0.00 -0.54 2.57 2.07 0.14 -0.13 116.25 120.75 1jzq h VAL 809 Ca 0.46 0.00 0.16 0.00 0.82 0.00 0.00 66.70 68.14 1jzq h VAL 809 Cb 0.78 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1jzq h VAL 809 CO -0.47 0.00 0.40 -2.24 0.02 0.00 0.00 177.57 175.28 1jzq h ASP 810 N -0.16 0.00 -0.12 0.57 2.03 -1.36 0.23 116.42 117.61 1jzq h ASP 810 Ca -0.01 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.29 1jzq h ASP 810 Cb 0.14 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.63 1jzq h ASP 810 CO -0.01 0.00 0.07 -0.07 -1.03 0.00 0.00 179.24 178.20 1jzq h LEU 811 N 0.00 0.15 -0.18 0.15 -0.00 -0.87 0.36 115.31 114.92 1jzq h LEU 811 Ca 0.25 -0.06 -0.09 0.00 -0.00 0.00 0.00 57.88 57.99 1jzq h LEU 811 Cb 1.05 -0.04 -0.00 0.00 -0.00 0.00 0.00 40.66 41.67 1jzq h LEU 811 CO -0.00 0.16 -0.23 0.00 -0.00 0.00 0.00 178.44 178.37 1jzq h ALA 812 N 0.99 0.27 -0.11 1.53 0.00 0.12 0.12 119.26 122.18 1jzq h ALA 812 Ca 0.04 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 1jzq h ALA 812 Cb 0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1jzq h ALA 812 CO -0.01 0.22 -0.15 0.00 0.00 0.00 0.00 179.25 179.31 1jzq h ARG 813 N 0.11 0.17 0.00 0.00 -0.00 -0.69 0.53 114.38 114.50 1jzq h ARG 813 Ca 0.02 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.46 1jzq h ARG 813 Cb 0.79 -0.02 0.00 0.00 0.00 0.00 0.00 29.97 30.74 1jzq h ARG 813 CO 0.05 0.33 0.00 0.00 0.00 0.00 0.00 179.97 180.35 1jzq n ALA 814 N -2.49 2.27 0.04 0.04 0.00 0.12 -2.52 120.51 117.97 1jzq n ALA 814 Ca -0.01 -0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.43 1jzq n ALA 814 Cb 0.27 -1.47 0.20 0.00 0.00 0.00 0.00 19.45 18.45 1jzq n ALA 814 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jzq n ALA 815 N -1.74 3.22 -3.74 0.00 0.00 0.18 -4.48 120.51 113.95 1jzq n ALA 815 Ca 0.06 -0.97 -0.29 0.00 0.00 0.00 0.00 53.44 52.23 1jzq n ALA 815 Cb 0.41 -1.07 -0.13 0.00 0.00 0.00 0.00 19.45 18.66 1jzq n ALA 815 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1jzq s ARG 816 N -1.88 1.49 0.00 0.00 3.52 -1.05 -4.90 118.95 116.13 1jzq s ARG 816 Ca 0.27 -2.27 0.23 0.00 -0.13 0.00 0.00 55.73 53.84 1jzq s ARG 816 Cb 0.21 -2.52 0.10 0.00 -1.56 0.00 0.00 34.95 31.18 1jzq s ARG 816 CO 0.08 -1.19 1.13 0.00 -0.81 0.00 0.00 175.30 174.51 1jzq n ALA 817 N 3.22 4.10 -3.73 6.12 0.00 -1.26 -4.82 120.51 124.14 1jzq n ALA 817 Ca 0.11 -0.52 -0.24 0.00 0.00 0.00 0.00 53.44 52.79 1jzq n ALA 817 Cb 0.35 -0.91 -0.17 0.00 0.00 0.00 0.00 19.45 18.73 1jzq n ALA 817 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1jzq s LYS 818 N -2.88 1.29 -0.70 0.00 2.47 -1.26 -5.08 119.74 113.59 1jzq s LYS 818 Ca 0.12 -0.20 -0.27 0.00 -1.56 0.00 0.00 55.97 54.05 1jzq s LYS 818 Cb 0.17 -1.31 -0.13 0.00 -1.46 0.00 0.00 37.83 35.10 1jzq s LYS 818 CO 0.75 -0.17 2.51 -1.13 0.16 0.00 0.00 175.35 177.46 1jzq n SER 819 N 4.54 1.48 -0.57 1.43 3.41 -1.26 -4.76 113.62 117.89 1jzq n SER 819 Ca -0.16 -0.34 0.05 0.00 -0.26 0.00 0.00 58.87 58.16 1jzq n SER 819 Cb 0.51 -1.33 0.13 0.00 -0.26 0.00 0.00 64.21 63.26 1jzq n SER 819 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jzq n GLY 820 N 6.20 0.47 0.00 5.00 0.00 -1.26 -5.25 105.19 110.35 1jzq n GLY 820 Ca 0.48 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1jzq n GLY 820 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87