#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k9t n GLU 2 N 0.00 0.00 0.34 1.61 -0.58 -1.26 -4.58 120.64 116.16 3k9t n GLU 2 Ca 0.00 0.00 0.23 0.00 -0.42 0.00 0.00 57.16 56.97 3k9t n GLU 2 Cb 0.00 -2.50 1.23 0.00 -0.57 0.00 0.00 31.44 29.60 3k9t n GLU 2 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3k9t h GLU 3 N 0.00 0.00 0.00 3.49 5.08 -2.02 -0.65 114.58 120.48 3k9t h GLU 3 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3k9t h GLU 3 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 3k9t h GLU 3 CO 0.00 0.00 -0.12 0.97 -1.00 0.00 0.00 179.01 178.86 3k9t h ILE 4 N 0.00 0.47 -0.77 3.13 2.10 -1.99 -3.26 117.51 117.19 3k9t h ILE 4 Ca 0.00 -0.63 0.07 0.00 1.08 0.00 0.00 64.86 65.38 3k9t h ILE 4 Cb 0.00 1.44 -0.05 0.00 -1.09 0.00 0.00 36.82 37.12 3k9t h ILE 4 CO 0.00 0.12 0.50 0.78 -1.08 0.00 0.00 178.15 178.47 3k9t h ASN 5 N 0.00 0.70 0.19 2.19 2.35 -1.53 -1.16 115.58 118.32 3k9t h ASN 5 Ca -0.00 0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.64 3k9t h ASN 5 Cb 0.43 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 3k9t h ASN 5 CO 0.02 0.45 -0.44 0.07 -1.65 0.00 0.00 177.43 175.87 3k9t h LYS 6 N 0.79 0.31 -0.40 0.81 2.10 -1.77 0.60 116.57 119.02 3k9t h LYS 6 Ca 0.33 -0.16 -0.10 0.00 -2.00 0.00 0.00 60.65 58.72 3k9t h LYS 6 Cb 0.28 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.61 3k9t h LYS 6 CO -0.12 0.70 -0.15 1.88 -2.00 0.00 0.00 179.45 179.76 3k9t h TYR 7 N 0.26 0.93 -0.47 0.07 0.05 -1.43 -1.56 116.97 114.82 3k9t h TYR 7 Ca 0.02 -0.22 -0.04 0.00 0.05 0.00 0.00 58.73 58.54 3k9t h TYR 7 Cb 0.88 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 38.38 3k9t h TYR 7 CO 0.02 0.96 0.14 0.82 -1.05 0.00 0.00 178.16 179.05 3k9t h ILE 8 N 0.63 1.23 0.00 -2.88 2.04 -1.02 -2.72 117.51 114.78 3k9t h ILE 8 Ca 0.10 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 3k9t h ILE 8 Cb 0.70 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.61 3k9t h ILE 8 CO 0.05 0.28 -0.07 1.56 0.00 0.00 0.00 178.15 179.97 3k9t h GLN 9 N 0.64 0.00 -0.54 2.37 4.20 -0.73 -2.50 115.11 118.55 3k9t h GLN 9 Ca 0.15 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.78 3k9t h GLN 9 Cb 0.28 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.02 3k9t h GLN 9 CO -0.00 0.07 0.08 -1.71 -0.67 0.00 0.00 178.83 176.60 3k9t n ASN 10 N -3.36 4.81 0.21 1.46 5.15 -0.60 -4.67 115.26 118.26 3k9t n ASN 10 Ca -0.01 -3.10 0.05 0.00 -0.60 0.00 0.00 54.58 50.91 3k9t n ASN 10 Cb 0.23 -0.67 0.45 0.00 -0.53 0.00 0.00 39.78 39.26 3k9t n ASN 10 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 3k9t h SER 11 N 2.85 0.00 0.21 1.20 4.64 -1.29 -1.97 113.55 119.19 3k9t h SER 11 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3k9t h SER 11 Cb 1.95 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 64.02 3k9t h SER 11 CO 0.50 0.28 -0.20 -1.28 -0.87 0.00 0.00 176.83 175.26 3k9t h SER 12 N 0.00 -0.52 -0.64 4.97 0.87 -1.84 0.36 113.55 116.74 3k9t h SER 12 Ca -0.00 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.63 3k9t h SER 12 Cb 0.51 0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 62.61 3k9t h SER 12 CO 0.04 -0.30 0.39 -0.08 -0.53 0.00 0.00 176.83 176.35 3k9t h GLU 13 N -0.44 0.75 -0.38 2.24 4.81 -1.78 -2.60 114.58 117.18 3k9t h GLU 13 Ca -0.00 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 3k9t h GLU 13 Cb 0.40 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 3k9t h GLU 13 CO -0.04 0.50 0.04 1.15 -0.73 0.00 0.00 179.01 179.92 3k9t h THR 14 N 0.77 1.20 -0.87 0.32 2.02 -0.98 -2.01 112.91 113.36 3k9t h THR 14 Ca 0.26 -0.75 0.08 0.00 0.77 0.00 0.00 66.41 66.77 3k9t h THR 14 Cb 0.02 0.87 -0.06 0.00 -1.74 0.00 0.00 68.15 67.25 3k9t h THR 14 CO -0.11 0.26 0.56 1.23 0.37 0.00 0.00 175.52 177.84 3k9t h GLY 15 N 0.84 1.24 0.97 2.16 0.00 0.09 0.14 103.07 108.50 3k9t h GLY 15 Ca 0.12 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 3k9t h GLY 15 CO 0.01 0.24 0.15 -1.33 0.00 0.00 0.00 176.54 175.60 3k9t h GLY 16 N 0.90 0.84 2.00 4.60 0.00 -1.21 -0.98 103.07 109.23 3k9t h GLY 16 Ca 0.39 -0.50 -0.12 0.00 0.00 0.00 0.00 47.33 47.10 3k9t h GLY 16 CO -0.15 0.47 -0.57 0.83 0.00 0.00 0.00 176.54 177.12 3k9t h GLU 17 N 0.68 0.00 -0.53 4.80 4.39 -0.89 -2.00 114.58 121.03 3k9t h GLU 17 Ca 0.16 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.79 3k9t h GLU 17 Cb 0.28 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 3k9t h GLU 17 CO -0.00 0.57 0.06 0.82 -1.16 0.00 0.00 179.01 179.29 3k9t h ILE 18 N 0.00 1.26 -0.38 3.13 2.04 -0.63 -2.60 117.51 120.32 3k9t h ILE 18 Ca -0.01 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 64.87 3k9t h ILE 18 Cb 1.11 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 3k9t h ILE 18 CO 0.07 0.36 0.23 0.22 0.00 0.00 0.00 178.15 179.03 3k9t h TYR 19 N 0.77 0.43 -0.65 1.37 3.20 -0.81 -2.33 116.97 118.96 3k9t h TYR 19 Ca 0.16 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.06 3k9t h TYR 19 Cb 0.44 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 3k9t h TYR 19 CO 0.03 0.26 0.43 -0.91 -1.64 0.00 0.00 178.16 176.33 3k9t h ASN 20 N 0.47 0.71 -0.48 -2.11 2.35 -1.22 0.25 115.58 115.54 3k9t h ASN 20 Ca 0.15 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.82 3k9t h ASN 20 Cb -0.01 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 3k9t h ASN 20 CO -0.06 0.51 0.04 0.25 -1.65 0.00 0.00 177.43 176.51 3k9t h LEU 21 N 0.84 0.80 -0.12 1.61 5.85 -1.23 -1.17 115.31 121.88 3k9t h LEU 21 Ca 0.25 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3k9t h LEU 21 Cb -0.03 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 3k9t h LEU 21 CO -0.06 0.89 0.08 0.40 -0.34 0.00 0.00 178.44 179.41 3k9t h ILE 22 N 0.69 1.03 -0.55 4.05 2.04 -0.68 0.06 117.51 124.16 3k9t h ILE 22 Ca 0.14 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.96 3k9t h ILE 22 Cb 0.46 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 3k9t h ILE 22 CO 0.02 0.03 0.35 -0.08 0.00 0.00 0.00 178.15 178.47 3k9t h GLU 23 N 0.17 0.68 -0.93 2.37 4.81 -0.43 0.88 114.58 122.14 3k9t h GLU 23 Ca 0.05 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3k9t h GLU 23 Cb -0.02 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.16 3k9t h GLU 23 CO -0.01 0.45 0.61 1.49 -0.73 0.00 0.00 179.01 180.82 3k9t h GLU 24 N 0.70 1.22 0.00 1.92 4.81 -0.95 -2.75 114.58 119.54 3k9t h GLU 24 Ca 0.21 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3k9t h GLU 24 Cb -0.03 -0.27 -0.00 0.00 0.63 0.00 0.00 28.75 29.07 3k9t h GLU 24 CO -0.07 0.81 -0.06 -0.07 -0.73 0.00 0.00 179.01 178.89 3k9t h LEU 25 N 1.26 0.00 -0.34 1.64 3.38 -0.09 -3.40 115.31 117.75 3k9t h LEU 25 Ca 0.34 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.37 3k9t h LEU 25 Cb -0.14 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.55 3k9t h LEU 25 CO -0.07 0.06 -0.03 0.15 0.09 0.00 0.00 178.44 178.64 3k9t h PHE 26 N 0.00 -0.08 0.00 1.13 3.57 -0.54 -2.63 116.94 118.40 3k9t h PHE 26 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3k9t h PHE 26 Cb 0.87 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.70 3k9t h PHE 26 CO 0.00 -0.09 0.00 -1.35 -2.23 0.00 0.00 178.31 174.64 3k9t h PRO 27 N 0.06 0.00 -6.71 6.41 0.11 -1.77 -3.33 132.00 126.76 3k9t h PRO 27 Ca 0.17 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.76 3k9t h PRO 27 Cb 0.24 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.37 3k9t h PRO 27 CO -0.31 0.00 0.52 0.42 -0.21 0.00 0.00 178.00 178.42 3k9t s ILE 28 N -3.76 3.58 -1.10 4.15 1.01 -0.99 -4.88 121.20 119.20 3k9t s ILE 28 Ca -0.01 1.41 -0.17 0.00 0.00 0.00 0.00 60.65 61.89 3k9t s ILE 28 Cb 0.10 -3.90 0.14 0.00 0.01 0.00 0.00 42.46 38.81 3k9t s ILE 28 CO 0.47 0.27 1.35 0.00 0.00 0.00 0.00 174.94 177.03 3k9t s ARG 30 N 2.48 3.25 0.00 0.00 0.52 -1.26 -4.10 118.95 119.84 3k9t s ARG 30 Ca 0.40 1.17 0.00 0.00 -0.52 0.00 0.00 55.73 56.78 3k9t s ARG 30 Cb -0.03 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 33.42 3k9t s ARG 30 CO -0.03 -0.86 0.00 0.45 0.02 0.00 0.00 175.30 174.87 3k9t n SER 31 N -2.20 0.00 0.15 0.23 2.88 -1.16 -3.80 113.62 109.72 3k9t n SER 31 Ca 0.09 -0.68 0.13 0.00 -1.33 0.00 0.00 58.87 57.07 3k9t n SER 31 Cb 0.53 0.00 0.52 0.00 -0.75 0.00 0.00 64.21 64.51 3k9t n SER 31 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 3k9t h ILE 32 N 0.68 0.00 -4.31 2.46 3.07 -1.92 -3.37 117.51 114.12 3k9t h ILE 32 Ca 0.00 -0.28 -0.23 0.00 1.55 0.00 0.00 64.86 65.90 3k9t h ILE 32 Cb 0.00 1.06 -0.12 0.00 -0.27 0.00 0.00 36.82 37.49 3k9t h ILE 32 CO 0.00 0.00 -0.41 0.42 -1.05 0.00 0.00 178.15 177.11 3k9t s THR 33 N -3.37 0.00 0.00 0.16 -4.23 -1.26 -4.66 115.64 102.27 3k9t s THR 33 Ca 0.04 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 3k9t s THR 33 Cb 0.09 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.49 3k9t s THR 33 CO 0.42 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.11 3k9t n GLY 34 N -0.38 2.27 0.22 3.99 0.00 -1.25 -4.63 105.19 105.40 3k9t n GLY 34 Ca 0.02 -2.15 0.16 0.00 0.00 0.00 0.00 46.02 44.05 3k9t n GLY 34 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3k9t h ASN 35 N 0.00 0.00 -0.18 1.61 2.35 -1.91 -1.94 115.58 115.51 3k9t h ASN 35 Ca 0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.56 3k9t h ASN 35 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3k9t h ASN 35 CO 0.00 0.00 -0.62 1.23 -1.65 0.00 0.00 177.43 176.39 3k9t h GLY 36 N 1.36 0.87 1.00 2.83 0.00 -1.86 0.22 103.07 107.49 3k9t h GLY 36 Ca 0.00 -1.08 -0.05 0.00 0.00 0.00 0.00 47.33 46.20 3k9t h GLY 36 CO 0.00 0.96 0.14 -2.08 0.00 0.00 0.00 176.54 175.57 3k9t h VAL 37 N 0.59 1.24 -0.79 4.60 2.07 -1.61 -1.50 116.25 120.85 3k9t h VAL 37 Ca -0.01 -0.86 -0.05 0.00 0.82 0.00 0.00 66.70 66.60 3k9t h VAL 37 Cb 1.22 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 3k9t h VAL 37 CO 0.13 0.32 0.30 0.03 0.02 0.00 0.00 177.57 178.37 3k9t h ARG 38 N 0.79 1.20 -0.08 1.57 3.08 -1.06 -2.01 114.38 117.86 3k9t h ARG 38 Ca 0.18 -0.23 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 3k9t h ARG 38 Cb 0.33 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 3k9t h ARG 38 CO 0.00 0.98 -0.22 -0.22 -1.07 0.00 0.00 179.97 179.44 3k9t h LYS 39 N 1.16 0.13 -1.12 0.04 1.63 -0.35 -1.09 116.57 116.97 3k9t h LYS 39 Ca 0.26 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 60.03 3k9t h LYS 39 Cb 0.24 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.86 3k9t h LYS 39 CO -0.02 0.35 0.00 2.41 -3.45 0.00 0.00 179.45 178.74 3k9t n THR 40 N -4.22 0.37 0.00 1.00 -1.04 -0.58 -2.14 114.28 107.66 3k9t n THR 40 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 3k9t n THR 40 Cb 0.31 -0.61 0.00 0.00 -1.82 0.00 0.00 70.33 68.21 3k9t n THR 40 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 3k9t n ASP 42 N 0.54 0.00 -0.12 8.00 8.00 -0.41 -1.40 116.55 131.15 3k9t n ASP 42 Ca 0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 3k9t n ASP 42 Cb 0.24 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.31 3k9t n ASP 42 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3k9t h ILE 43 N 0.00 1.28 -0.87 0.53 2.04 -1.71 -2.39 117.51 116.40 3k9t h ILE 43 Ca 0.00 -1.21 0.08 0.00 1.00 0.00 0.00 64.86 64.73 3k9t h ILE 43 Cb 0.00 1.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.33 3k9t h ILE 43 CO 0.00 0.40 0.56 0.40 0.00 0.00 0.00 178.15 179.51 3k9t h ILE 44 N 0.51 1.01 0.00 -0.67 2.04 -1.52 -1.08 117.51 117.80 3k9t h ILE 44 Ca 0.09 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.64 3k9t h ILE 44 Cb 0.64 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 3k9t h ILE 44 CO 0.04 0.17 0.00 0.54 0.00 0.00 0.00 178.15 178.90 3k9t n ARG 45 N -4.51 0.51 0.06 2.37 1.74 -0.92 -0.54 116.66 115.38 3k9t n ARG 45 Ca 0.14 0.03 0.12 0.00 -0.77 0.00 0.00 57.85 57.38 3k9t n ARG 45 Cb 0.26 -1.50 0.48 0.00 -1.02 0.00 0.00 32.46 30.68 3k9t n ARG 45 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3k9t n LYS 46 N -1.18 0.12 -0.05 5.56 5.02 -0.41 -4.23 118.16 122.99 3k9t n LYS 46 Ca 0.14 0.17 -0.08 0.00 -2.02 0.00 0.00 58.31 56.53 3k9t n LYS 46 Cb 0.16 -1.66 -0.04 0.00 -0.02 0.00 0.00 35.03 33.46 3k9t n LYS 46 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3k9t n HIS 47 N -1.88 0.00 -4.11 2.13 8.25 0.30 -5.07 115.22 114.83 3k9t n HIS 47 Ca 0.05 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.41 3k9t n HIS 47 Cb 0.33 -0.38 -0.10 0.00 1.12 0.00 0.00 29.99 30.96 3k9t n HIS 47 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 3k9t s ILE 48 N -2.20 0.49 0.52 1.59 -4.36 -0.59 -4.87 121.20 111.78 3k9t s ILE 48 Ca -0.14 -1.62 -0.19 0.00 -0.26 0.00 0.00 60.65 58.44 3k9t s ILE 48 Cb 0.04 -1.28 -0.07 0.00 1.25 0.00 0.00 42.46 42.41 3k9t s ILE 48 CO 0.22 -0.76 1.08 -2.84 0.24 0.00 0.00 174.94 172.88 3k9t s PRO 49 N -3.14 3.55 0.01 0.37 0.02 -1.26 -3.91 135.00 130.65 3k9t s PRO 49 Ca 0.03 1.45 -0.02 0.00 0.02 0.00 0.00 61.00 62.49 3k9t s PRO 49 Cb 0.01 -2.05 -0.01 0.00 0.02 0.00 0.00 34.50 32.47 3k9t s PRO 49 CO -0.05 -0.66 0.01 -0.51 -0.33 0.00 0.00 177.00 175.47 3k9t s LEU 50 N -3.73 2.07 -0.22 -5.54 1.43 -1.26 -4.65 118.68 106.77 3k9t s LEU 50 Ca 0.69 -0.39 -0.16 0.00 -1.03 0.00 0.00 54.13 53.24 3k9t s LEU 50 Cb -0.20 0.21 -0.04 0.00 0.03 0.00 0.00 46.19 46.20 3k9t s LEU 50 CO 0.25 -0.29 0.41 -0.70 0.23 0.00 0.00 176.35 176.25 3k9t s GLU 51 N -1.31 4.13 -0.17 1.70 2.12 0.53 -4.90 118.70 120.80 3k9t s GLU 51 Ca -0.14 0.18 -0.13 0.00 0.36 0.00 0.00 54.97 55.24 3k9t s GLU 51 Cb -0.09 -3.58 -0.05 0.00 0.26 0.00 0.00 34.13 30.68 3k9t s GLU 51 CO -0.00 -0.13 0.27 0.42 -0.54 0.00 0.00 175.26 175.27 3k9t s ILE 52 N 1.60 5.32 0.03 -3.70 -1.09 -1.26 -1.12 121.20 120.97 3k9t s ILE 52 Ca 0.18 0.49 0.05 0.00 -2.23 0.00 0.00 60.65 59.14 3k9t s ILE 52 Cb -0.15 -3.61 -0.03 0.00 -1.58 0.00 0.00 42.46 37.09 3k9t s ILE 52 CO 0.08 0.40 -0.10 -1.00 -1.23 0.00 0.00 174.94 173.09 3k9t s HIS 53 N 0.45 2.78 -0.21 3.97 3.76 0.12 -4.98 115.29 121.18 3k9t s HIS 53 Ca 0.15 -0.12 -0.01 0.00 -0.15 0.00 0.00 55.06 54.93 3k9t s HIS 53 Cb -0.13 -1.54 0.06 0.00 1.11 0.00 0.00 32.58 32.08 3k9t s HIS 53 CO 0.03 0.35 -0.01 -1.21 -0.85 0.00 0.00 174.74 173.05 3k9t s GLU 54 N -1.56 1.13 -0.24 1.40 0.41 -1.26 -1.60 118.70 117.00 3k9t s GLU 54 Ca 0.17 -0.67 -0.10 0.00 -0.41 0.00 0.00 54.97 53.97 3k9t s GLU 54 Cb -0.11 -2.30 -0.05 0.00 -1.78 0.00 0.00 34.13 29.90 3k9t s GLU 54 CO 0.08 -0.60 0.14 0.08 -0.49 0.00 0.00 175.26 174.46 3k9t s VAL 55 N 1.64 5.11 0.32 2.63 1.01 -0.30 -4.83 120.40 125.97 3k9t s VAL 55 Ca -0.03 0.09 -0.29 0.00 0.00 0.00 0.00 61.98 61.75 3k9t s VAL 55 Cb -0.18 -3.38 -0.12 0.00 0.00 0.00 0.00 36.38 32.70 3k9t s VAL 55 CO -0.07 0.35 1.44 0.29 0.00 0.00 0.00 175.10 177.11 3k9t n LYS 56 N 4.38 2.39 -1.67 2.72 5.02 -1.26 -0.56 118.16 129.18 3k9t n LYS 56 Ca -0.15 0.84 -0.43 0.00 -2.02 0.00 0.00 58.31 56.55 3k9t n LYS 56 Cb 0.52 -2.53 -0.01 0.00 -0.02 0.00 0.00 35.03 32.99 3k9t n LYS 56 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3k9t n SER 57 N 1.34 2.36 0.00 4.39 7.64 -0.50 -1.93 113.62 126.92 3k9t n SER 57 Ca 0.06 1.20 0.00 0.00 1.01 0.00 0.00 58.87 61.14 3k9t n SER 57 Cb 0.36 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.13 3k9t n SER 57 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3k9t n GLY 58 N 1.00 0.87 3.73 0.23 0.00 0.12 -4.86 105.19 106.28 3k9t n GLY 58 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 3k9t n GLY 58 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k9t s THR 59 N -2.26 3.04 -0.28 2.61 2.01 -0.81 -4.64 115.64 115.30 3k9t s THR 59 Ca 0.00 0.79 -0.26 0.00 0.31 0.00 0.00 61.69 62.53 3k9t s THR 59 Cb 0.00 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 69.01 3k9t s THR 59 CO 0.00 0.08 0.91 -0.54 -0.69 0.00 0.00 174.62 174.38 3k9t s LYS 60 N 0.60 4.10 -0.37 4.92 -0.14 -1.26 0.04 119.74 127.62 3k9t s LYS 60 Ca 0.63 0.92 0.03 0.00 -1.36 0.00 0.00 55.97 56.19 3k9t s LYS 60 Cb -0.39 -3.69 0.11 0.00 -1.68 0.00 0.00 37.83 32.17 3k9t s LYS 60 CO 0.34 -0.68 0.10 0.14 -0.76 0.00 0.00 175.35 174.50 3k9t s VAL 61 N 3.12 2.49 0.00 3.17 -7.23 0.89 -4.98 120.40 117.85 3k9t s VAL 61 Ca 0.38 -2.42 0.00 0.00 -1.81 0.00 0.00 61.98 58.12 3k9t s VAL 61 Cb -0.14 -2.80 0.00 0.00 0.56 0.00 0.00 36.38 34.00 3k9t s VAL 61 CO 0.11 -0.64 0.00 0.49 -0.31 0.00 0.00 175.10 174.75 3k9t n PHE 62 N 4.16 0.00 0.94 2.82 3.72 -1.26 -0.90 117.46 126.94 3k9t n PHE 62 Ca 0.03 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.56 3k9t n PHE 62 Cb 0.41 0.00 0.57 0.00 -0.94 0.00 0.00 39.48 39.51 3k9t n PHE 62 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3k9t n ASP 63 N 3.12 0.00 -4.96 4.37 2.03 -1.26 -4.83 116.55 115.02 3k9t n ASP 63 Ca 0.00 0.41 -0.22 0.00 0.52 0.00 0.00 54.79 55.51 3k9t n ASP 63 Cb 0.00 -0.47 -0.01 0.00 -0.72 0.00 0.00 41.12 39.92 3k9t n ASP 63 CO 0.00 0.00 0.00 0.26 -1.92 0.00 0.00 177.20 175.54 3k9t s TRP 64 N -2.94 3.33 -0.11 -0.67 0.52 -0.08 -5.10 118.94 113.89 3k9t s TRP 64 Ca 0.14 0.07 0.04 0.00 0.02 0.00 0.00 56.10 56.37 3k9t s TRP 64 Cb 0.17 -1.92 0.00 0.00 -1.15 0.00 0.00 33.47 30.57 3k9t s TRP 64 CO 0.46 0.07 -0.24 0.99 0.02 0.00 0.00 176.95 178.26 3k9t s THR 65 N -2.24 2.08 0.00 2.01 2.01 -1.26 -0.08 115.64 118.16 3k9t s THR 65 Ca 0.41 -1.01 -0.30 0.00 0.31 0.00 0.00 61.69 61.11 3k9t s THR 65 Cb -0.09 -1.79 -0.08 0.00 0.01 0.00 0.00 72.50 70.54 3k9t s THR 65 CO 0.33 0.56 1.91 -0.69 -0.69 0.00 0.00 174.62 176.04 3k9t s VAL 66 N 0.39 3.15 1.17 3.82 1.01 0.11 -4.85 120.40 125.20 3k9t s VAL 66 Ca -0.18 0.18 -0.15 0.00 0.00 0.00 0.00 61.98 61.83 3k9t s VAL 66 Cb -0.18 -3.12 0.27 0.00 0.00 0.00 0.00 36.38 33.35 3k9t s VAL 66 CO 0.08 -0.02 1.04 -2.16 0.00 0.00 0.00 175.10 174.04 3k9t s PRO 67 N 4.46 -0.93 0.79 2.72 0.04 -1.26 0.14 135.00 140.95 3k9t s PRO 67 Ca 0.85 0.47 -0.13 0.00 0.04 0.00 0.00 61.00 62.23 3k9t s PRO 67 Cb -0.40 -1.58 0.07 0.00 0.04 0.00 0.00 34.50 32.63 3k9t s PRO 67 CO 0.39 -3.63 1.16 0.15 0.04 0.00 0.00 177.00 175.10 3k9t s LYS 68 N -4.85 1.88 0.04 4.56 1.02 -1.26 -4.32 119.74 116.80 3k9t s LYS 68 Ca 0.68 1.57 -0.20 0.00 0.02 0.00 0.00 55.97 58.04 3k9t s LYS 68 Cb -0.19 -1.82 -0.06 0.00 -0.52 0.00 0.00 37.83 35.24 3k9t s LYS 68 CO 0.60 -2.00 0.58 -2.00 -0.92 0.00 0.00 175.35 171.62 3k9t s GLU 69 N -4.30 4.26 -0.05 1.68 2.12 0.13 -4.86 118.70 117.68 3k9t s GLU 69 Ca 0.69 0.75 0.04 0.00 0.36 0.00 0.00 54.97 56.81 3k9t s GLU 69 Cb -0.25 -3.28 -0.03 0.00 0.26 0.00 0.00 34.13 30.83 3k9t s GLU 69 CO 0.50 0.52 -0.15 -0.46 -0.54 0.00 0.00 175.26 175.14 3k9t s TRP 70 N -0.70 2.69 0.05 5.30 -0.00 -1.26 -1.68 118.94 123.34 3k9t s TRP 70 Ca 0.30 -0.16 -0.04 0.00 -0.00 0.00 0.00 56.10 56.20 3k9t s TRP 70 Cb -0.19 -1.62 -0.02 0.00 -0.00 0.00 0.00 33.47 31.64 3k9t s TRP 70 CO 0.18 0.18 0.06 -0.80 -0.00 0.00 0.00 176.95 176.58 3k9t s ASN 71 N -0.74 0.28 -0.11 5.86 0.01 -0.62 -3.89 114.94 115.73 3k9t s ASN 71 Ca 0.11 -0.71 -0.06 0.00 -0.71 0.00 0.00 52.86 51.49 3k9t s ASN 71 Cb -0.11 0.23 0.04 0.00 0.41 0.00 0.00 41.25 41.83 3k9t s ASN 71 CO 0.01 -0.56 0.26 -0.51 -1.51 0.00 0.00 177.10 174.78 3k9t s ILE 72 N -3.19 -0.03 -0.24 0.60 2.07 -1.26 -1.12 121.20 118.01 3k9t s ILE 72 Ca 0.00 0.12 -0.10 0.00 -1.41 0.00 0.00 60.65 59.26 3k9t s ILE 72 Cb 0.02 -0.40 -0.16 0.00 0.13 0.00 0.00 42.46 42.06 3k9t s ILE 72 CO -0.07 0.05 -0.15 0.29 -1.91 0.00 0.00 174.94 173.15 3k9t n LYS 73 N 4.06 0.62 -3.45 3.50 5.02 -0.35 -5.01 118.16 122.56 3k9t n LYS 73 Ca -0.24 0.29 -0.12 0.00 -2.02 0.00 0.00 58.31 56.22 3k9t n LYS 73 Cb 0.54 -1.57 -0.02 0.00 -0.02 0.00 0.00 35.03 33.96 3k9t n LYS 73 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3k9t s ASP 74 N -7.08 -0.55 -0.19 4.39 2.15 -1.21 -5.02 116.67 109.16 3k9t s ASP 74 Ca -0.34 -0.03 -0.23 0.00 0.43 0.00 0.00 52.55 52.37 3k9t s ASP 74 Cb 0.11 0.60 0.06 0.00 -0.30 0.00 0.00 42.92 43.39 3k9t s ASP 74 CO 0.57 -0.98 0.61 0.00 -0.17 0.00 0.00 175.17 175.20 3k9t s ALA 75 N -3.75 -1.54 -0.09 3.66 0.00 -1.26 -0.12 121.76 118.67 3k9t s ALA 75 Ca 0.02 1.60 -0.30 0.00 0.00 0.00 0.00 51.96 53.28 3k9t s ALA 75 Cb -0.01 -0.79 0.11 0.00 0.00 0.00 0.00 23.12 22.43 3k9t s ALA 75 CO -0.12 -0.30 0.94 1.52 0.00 0.00 0.00 175.76 177.80 3k9t s TYR 76 N -0.01 -0.37 -0.20 0.00 -0.85 0.18 -1.95 117.35 114.15 3k9t s TYR 76 Ca -0.03 0.48 -0.02 0.00 -0.52 0.00 0.00 57.07 56.98 3k9t s TYR 76 Cb -0.04 0.48 -0.00 0.00 0.38 0.00 0.00 41.96 42.78 3k9t s TYR 76 CO 0.03 -0.44 -0.08 0.08 -1.52 0.00 0.00 175.55 173.62 3k9t s VAL 77 N -1.96 3.11 -0.03 -3.49 1.01 -0.72 -0.46 120.40 117.85 3k9t s VAL 77 Ca 0.01 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.46 3k9t s VAL 77 Cb -0.01 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 3k9t s VAL 77 CO -0.02 0.46 -0.24 -0.60 0.00 0.00 0.00 175.10 174.70 3k9t s ARG 78 N 1.26 2.26 0.67 2.72 3.52 0.11 -0.34 118.95 129.14 3k9t s ARG 78 Ca 0.03 -0.89 -0.02 0.00 -0.13 0.00 0.00 55.73 54.72 3k9t s ARG 78 Cb -0.14 -2.12 0.08 0.00 -1.56 0.00 0.00 34.95 31.21 3k9t s ARG 78 CO -0.04 0.54 0.93 0.54 -0.81 0.00 0.00 175.30 176.46 3k9t s ASN 79 N -0.54 4.73 0.44 -2.12 2.20 -0.34 -0.53 114.94 118.79 3k9t s ASN 79 Ca 0.08 -0.03 0.13 0.00 -0.94 0.00 0.00 52.86 52.10 3k9t s ASN 79 Cb -0.11 -0.57 0.99 0.00 -2.00 0.00 0.00 41.25 39.56 3k9t s ASN 79 CO 0.00 -1.58 2.01 0.28 -2.94 0.00 0.00 177.10 174.87 3k9t h SER 80 N -0.37 0.08 0.18 3.54 0.02 -1.90 0.20 113.55 115.30 3k9t h SER 80 Ca -0.41 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 3k9t h SER 80 Cb 1.29 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.81 3k9t h SER 80 CO 0.49 0.20 0.00 0.29 -1.14 0.00 0.00 176.83 176.67 3k9t n LYS 81 N -4.36 0.32 -0.18 3.45 4.01 -1.26 -4.88 118.16 115.26 3k9t n LYS 81 Ca -0.02 0.09 0.00 0.00 -0.51 0.00 0.00 58.31 57.87 3k9t n LYS 81 Cb 0.21 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.23 3k9t n LYS 81 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3k9t n GLY 82 N -0.01 1.06 3.68 0.72 0.00 0.71 -5.05 105.19 106.31 3k9t n GLY 82 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3k9t n GLY 82 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k9t s GLU 83 N -0.56 4.39 -0.86 1.61 2.02 -1.25 -4.69 118.70 119.35 3k9t s GLU 83 Ca 0.00 1.30 -0.25 0.00 0.02 0.00 0.00 54.97 56.04 3k9t s GLU 83 Cb 0.00 -3.55 -0.05 0.00 0.10 0.00 0.00 34.13 30.62 3k9t s GLU 83 CO 0.00 -0.33 1.99 0.15 0.02 0.00 0.00 175.26 177.09 3k9t s LYS 84 N 2.08 2.46 0.51 1.61 1.02 -1.26 -1.19 119.74 124.97 3k9t s LYS 84 Ca 0.46 -0.11 0.30 0.00 0.02 0.00 0.00 55.97 56.63 3k9t s LYS 84 Cb -0.18 -4.97 1.17 0.00 -0.52 0.00 0.00 37.83 33.33 3k9t s LYS 84 CO 0.16 -3.42 1.91 -0.39 -0.92 0.00 0.00 175.35 172.69 3k9t h VAL 85 N 7.27 0.16 -3.66 3.17 -1.51 -1.04 -3.39 116.25 117.25 3k9t h VAL 85 Ca 0.05 -0.72 -0.46 0.00 -1.23 0.00 0.00 66.70 64.34 3k9t h VAL 85 Cb 1.02 1.62 -0.32 0.00 -2.13 0.00 0.00 31.29 31.48 3k9t h VAL 85 CO 1.19 0.06 -0.80 -0.63 -1.23 0.00 0.00 177.57 176.16 3k9t s ILE 86 N -3.63 0.91 -0.18 7.19 1.01 -1.03 -4.97 121.20 120.50 3k9t s ILE 86 Ca 0.01 -0.39 -0.05 0.00 0.00 0.00 0.00 60.65 60.22 3k9t s ILE 86 Cb 0.09 -0.82 0.07 0.00 0.01 0.00 0.00 42.46 41.80 3k9t s ILE 86 CO 0.58 0.29 0.12 -0.62 0.00 0.00 0.00 174.94 175.31 3k9t s ASP 87 N 0.42 2.10 0.30 3.58 -1.08 -1.26 -1.76 116.67 118.97 3k9t s ASP 87 Ca -0.08 -0.51 0.05 0.00 -0.52 0.00 0.00 52.55 51.49 3k9t s ASP 87 Cb -0.12 -0.09 0.71 0.00 -1.46 0.00 0.00 42.92 41.97 3k9t s ASP 87 CO 0.02 -0.34 1.78 0.15 0.52 0.00 0.00 175.17 177.30 3k9t h PHE 88 N 8.39 1.09 0.00 -5.34 3.57 -1.60 0.01 116.94 123.06 3k9t h PHE 88 Ca -0.16 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 3k9t h PHE 88 Cb 1.15 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.56 3k9t h PHE 88 CO 0.15 0.27 -0.01 0.87 -2.23 0.00 0.00 178.31 177.36 3k9t h LYS 89 N 0.80 0.00 0.13 1.11 1.57 -1.96 -2.42 116.57 115.79 3k9t h LYS 89 Ca 0.57 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 59.07 3k9t h LYS 89 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.16 3k9t h LYS 89 CO -0.37 0.01 -1.32 0.93 -0.57 0.00 0.00 179.45 178.13 3k9t h GLU 90 N 0.00 0.27 -2.00 3.15 5.08 -1.40 -3.46 114.58 116.21 3k9t h GLU 90 Ca -0.00 -0.46 0.06 0.00 -1.00 0.00 0.00 59.36 57.96 3k9t h GLU 90 Cb 0.02 0.17 -0.20 0.00 0.50 0.00 0.00 28.75 29.24 3k9t h GLU 90 CO 0.00 1.19 -0.07 1.21 -1.00 0.00 0.00 179.01 180.34 3k9t s ASN 91 N -7.10 -1.07 0.00 1.42 3.84 -0.92 -5.03 114.94 106.08 3k9t s ASN 91 Ca -0.05 1.55 0.24 0.00 0.21 0.00 0.00 52.86 54.81 3k9t s ASN 91 Cb 0.07 1.95 1.23 0.00 -0.55 0.00 0.00 41.25 43.95 3k9t s ASN 91 CO 0.88 -0.23 1.80 -0.46 -2.79 0.00 0.00 177.10 176.30 3k9t n ASN 92 N 5.02 0.00 0.19 -4.21 0.23 -1.21 -2.19 115.26 113.09 3k9t n ASN 92 Ca -0.15 -0.11 0.14 0.00 -0.53 0.00 0.00 54.58 53.93 3k9t n ASN 92 Cb 0.53 -0.26 0.49 0.00 -2.08 0.00 0.00 39.78 38.46 3k9t n ASN 92 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 3k9t h LEU 93 N 0.00 0.00 -2.68 -4.53 3.38 -1.91 -3.11 115.31 106.47 3k9t h LEU 93 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k9t h LEU 93 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3k9t h LEU 93 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 178.44 178.98 3k9t h HIS 94 N 0.00 0.00 0.00 1.13 3.86 -1.65 -3.39 115.15 115.10 3k9t h HIS 94 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3k9t h HIS 94 Cb 0.57 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.04 3k9t h HIS 94 CO 0.00 0.00 0.00 0.28 0.86 0.00 0.00 177.93 179.07 3k9t n VAL 95 N -2.92 0.00 -5.19 2.45 0.31 -1.18 -0.53 118.33 111.27 3k9t n VAL 95 Ca -0.03 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.00 3k9t n VAL 95 Cb 0.06 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 32.83 3k9t n VAL 95 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3k9t s SER 97 N 0.51 2.87 -0.25 4.52 0.15 -0.22 -4.78 113.70 116.50 3k9t s SER 97 Ca 0.00 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.19 3k9t s SER 97 Cb 0.00 -0.60 0.00 0.00 -1.71 0.00 0.00 66.02 63.71 3k9t s SER 97 CO 0.00 0.26 0.00 -1.22 1.20 0.00 0.00 173.24 173.48 3k9t n TYR 98 N 2.78 0.00 -1.70 3.44 4.02 -1.26 -0.83 117.16 123.62 3k9t n TYR 98 Ca -0.17 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.30 3k9t n TYR 98 Cb 0.52 -0.81 -0.03 0.00 -0.02 0.00 0.00 39.34 39.00 3k9t n TYR 98 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3k9t n SER 99 N 1.32 4.07 -4.73 7.72 7.64 -1.26 -4.66 113.62 123.72 3k9t n SER 99 Ca -0.02 1.00 -0.37 0.00 1.01 0.00 0.00 58.87 60.48 3k9t n SER 99 Cb 0.09 -1.56 0.07 0.00 -1.01 0.00 0.00 64.21 61.80 3k9t n SER 99 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 3k9t n VAL 100 N 4.59 4.79 -2.12 0.44 0.24 0.19 -4.76 118.33 121.69 3k9t n VAL 100 Ca 0.18 -0.50 -0.39 0.00 -2.04 0.00 0.00 64.34 61.58 3k9t n VAL 100 Cb 0.37 -1.52 -0.01 0.00 -1.47 0.00 0.00 33.84 31.21 3k9t n VAL 100 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3k9t s PRO 101 N -3.29 4.01 -0.04 7.34 0.04 -1.26 -4.84 135.00 136.95 3k9t s PRO 101 Ca 0.81 2.07 -0.06 0.00 0.04 0.00 0.00 61.00 63.86 3k9t s PRO 101 Cb -0.39 -2.75 0.01 0.00 0.04 0.00 0.00 34.50 31.41 3k9t s PRO 101 CO 0.42 -0.43 0.15 0.14 0.04 0.00 0.00 177.00 177.32 3k9t s VAL 102 N -1.29 0.02 -0.27 -0.36 -7.23 -0.68 -4.97 120.40 105.63 3k9t s VAL 102 Ca 0.56 -0.19 -0.02 0.00 -1.81 0.00 0.00 61.98 60.53 3k9t s VAL 102 Cb -0.36 -0.29 0.12 0.00 0.56 0.00 0.00 36.38 36.42 3k9t s VAL 102 CO 0.46 -0.11 0.27 -2.28 -0.31 0.00 0.00 175.10 173.14 3k9t s HIS 103 N -0.32 -0.37 0.09 2.82 5.04 -1.24 -0.55 115.29 120.75 3k9t s HIS 103 Ca -0.04 -0.12 -0.09 0.00 -1.54 0.00 0.00 55.06 53.27 3k9t s HIS 103 Cb -0.03 -0.46 -0.00 0.00 0.04 0.00 0.00 32.58 32.13 3k9t s HIS 103 CO 0.01 -0.84 0.19 0.15 -2.34 0.00 0.00 174.74 171.90 3k9t s LYS 104 N 2.34 0.84 0.29 2.88 1.02 -0.12 -4.99 119.74 122.00 3k9t s LYS 104 Ca 0.09 -0.93 0.08 0.00 0.02 0.00 0.00 55.97 55.23 3k9t s LYS 104 Cb -0.14 0.34 -0.04 0.00 -0.52 0.00 0.00 37.83 37.47 3k9t s LYS 104 CO -0.29 -0.26 0.15 0.99 -0.92 0.00 0.00 175.35 175.02 3k9t s THR 105 N -3.77 3.78 0.32 2.17 2.01 -1.26 0.10 115.64 119.00 3k9t s THR 105 Ca 0.04 -1.58 0.09 0.00 0.31 0.00 0.00 61.69 60.55 3k9t s THR 105 Cb 0.04 -3.15 -0.05 0.00 0.01 0.00 0.00 72.50 69.36 3k9t s THR 105 CO -0.11 -0.30 0.06 0.42 -0.69 0.00 0.00 174.62 174.01 3k9t s THR 107 N -2.26 3.02 0.23 -0.82 -4.23 -1.26 -4.93 115.64 105.39 3k9t s THR 107 Ca 0.35 -1.84 -0.06 0.00 -1.18 0.00 0.00 61.69 58.95 3k9t s THR 107 Cb -0.06 -2.88 0.19 0.00 1.34 0.00 0.00 72.50 71.09 3k9t s THR 107 CO 0.23 -0.24 1.75 0.25 -0.54 0.00 0.00 174.62 176.07 3k9t h LEU 108 N 1.72 0.32 -1.67 4.79 5.85 -1.76 -0.77 115.31 123.78 3k9t h LEU 108 Ca -0.44 0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.34 3k9t h LEU 108 Cb 1.25 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.33 3k9t h LEU 108 CO 0.63 0.16 -0.18 0.44 -0.34 0.00 0.00 178.44 179.15 3k9t h ASP 109 N 0.48 0.00 0.73 1.25 3.32 -1.93 0.16 116.42 120.43 3k9t h ASP 109 Ca 0.37 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 57.17 3k9t h ASP 109 Cb 0.50 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 3k9t h ASP 109 CO -0.34 0.18 -1.29 -0.33 -1.72 0.00 0.00 179.24 175.73 3k9t h GLU 110 N 0.00 0.09 -0.18 3.56 5.08 -1.67 -3.34 114.58 118.12 3k9t h GLU 110 Ca -0.00 -0.15 -0.16 0.00 -1.00 0.00 0.00 59.36 58.05 3k9t h GLU 110 Cb 0.32 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3k9t h GLU 110 CO 0.02 0.95 -0.52 1.25 -1.00 0.00 0.00 179.01 179.72 3k9t h LEU 111 N 0.02 0.77 -0.97 1.33 5.85 -0.65 -3.37 115.31 118.28 3k9t h LEU 111 Ca -0.13 -0.58 0.32 0.00 0.84 0.00 0.00 57.88 58.32 3k9t h LEU 111 Cb 1.90 -0.22 -0.17 0.00 0.37 0.00 0.00 40.66 42.53 3k9t h LEU 111 CO 0.14 1.22 0.27 0.11 -0.34 0.00 0.00 178.44 179.83 3k9t h LYS 112 N 0.36 0.06 0.00 1.25 1.57 -0.82 0.24 116.57 119.23 3k9t h LYS 112 Ca -0.01 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3k9t h LYS 112 Cb 1.13 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 3k9t h LYS 112 CO 0.11 0.04 -0.09 -1.35 -0.57 0.00 0.00 179.45 177.59 3k9t h PRO 113 N 0.06 0.00 -0.15 3.15 0.11 -1.78 -1.75 132.00 131.64 3k9t h PRO 113 Ca 0.68 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.79 3k9t h PRO 113 Cb 1.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.67 3k9t h PRO 113 CO -0.80 0.09 0.00 0.66 -0.21 0.00 0.00 178.00 177.74 3k9t n TYR 114 N -3.64 0.18 -3.77 0.65 4.02 0.85 -4.90 117.16 110.55 3k9t n TYR 114 Ca -0.02 -0.09 -0.36 0.00 -0.01 0.00 0.00 57.90 57.42 3k9t n TYR 114 Cb 0.21 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.47 3k9t n TYR 114 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3k9t s LEU 115 N -1.69 4.39 -0.05 7.72 1.43 -0.66 -1.33 118.68 128.49 3k9t s LEU 115 Ca 0.34 0.57 0.01 0.00 -1.03 0.00 0.00 54.13 54.02 3k9t s LEU 115 Cb 0.19 -2.50 0.02 0.00 0.03 0.00 0.00 46.19 43.93 3k9t s LEU 115 CO 0.29 0.30 -0.04 -1.00 0.23 0.00 0.00 176.35 176.13 3k9t s HIS 116 N -1.21 0.79 0.42 0.29 3.76 0.24 -4.95 115.29 114.63 3k9t s HIS 116 Ca 0.24 -0.23 0.04 0.00 -0.15 0.00 0.00 55.06 54.96 3k9t s HIS 116 Cb -0.13 -0.71 -0.02 0.00 1.11 0.00 0.00 32.58 32.83 3k9t s HIS 116 CO 0.13 -0.22 0.14 0.95 -0.85 0.00 0.00 174.74 174.89 3k9t s THR 117 N 1.03 0.55 -0.42 1.30 -4.23 -1.26 -1.32 115.64 111.29 3k9t s THR 117 Ca -0.09 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.44 3k9t s THR 117 Cb -0.14 -2.30 0.13 0.00 1.34 0.00 0.00 72.50 71.52 3k9t s THR 117 CO -0.01 0.00 0.20 -0.63 -0.54 0.00 0.00 174.62 173.65 3k9t s ILE 118 N -3.18 1.62 0.40 2.99 1.01 -1.26 -4.86 121.20 117.92 3k9t s ILE 118 Ca 0.22 -2.49 0.13 0.00 0.00 0.00 0.00 60.65 58.51 3k9t s ILE 118 Cb 0.02 -2.15 0.34 0.00 0.01 0.00 0.00 42.46 40.68 3k9t s ILE 118 CO 0.15 -0.82 1.91 -0.65 0.00 0.00 0.00 174.94 175.53 3k9t h PRO 119 N 6.98 0.49 0.00 2.79 0.11 -1.97 -0.74 132.00 139.67 3k9t h PRO 119 Ca -0.05 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.03 3k9t h PRO 119 Cb 0.94 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.94 3k9t h PRO 119 CO 0.52 0.33 0.00 0.41 -0.21 0.00 0.00 178.00 179.05 3k9t n GLY 120 N -1.49 -1.35 2.46 -0.55 0.00 -1.26 -4.16 105.19 98.83 3k9t n GLY 120 Ca 0.15 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 3k9t n GLY 120 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k9t s ASN 121 N -3.76 1.00 0.00 1.61 0.01 -0.29 -5.01 114.94 108.50 3k9t s ASN 121 Ca 0.08 -2.81 0.05 0.00 -0.71 0.00 0.00 52.86 49.47 3k9t s ASN 121 Cb 0.12 -0.06 0.30 0.00 0.41 0.00 0.00 41.25 42.02 3k9t s ASN 121 CO 0.44 -0.16 0.87 0.29 -1.51 0.00 0.00 177.10 177.03 3k9t n LYS 122 N 2.92 0.13 -0.10 -0.60 5.02 -1.21 -1.17 118.16 123.16 3k9t n LYS 122 Ca 0.27 0.09 0.04 0.00 -2.02 0.00 0.00 58.31 56.69 3k9t n LYS 122 Cb 0.49 -1.50 0.09 0.00 -0.02 0.00 0.00 35.03 34.09 3k9t n LYS 122 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3k9t n ASP 123 N -1.11 2.43 -4.69 4.39 5.75 -1.26 -0.80 116.55 121.26 3k9t n ASP 123 Ca 0.03 -1.83 -0.32 0.00 -0.01 0.00 0.00 54.79 52.65 3k9t n ASP 123 Cb 0.03 -0.13 -0.09 0.00 -1.03 0.00 0.00 41.12 39.90 3k9t n ASP 123 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3k9t s ARG 124 N -0.92 2.79 -0.25 0.11 0.52 -0.31 -4.90 118.95 115.99 3k9t s ARG 124 Ca 0.15 -0.61 -0.13 0.00 -0.52 0.00 0.00 55.73 54.62 3k9t s ARG 124 Cb 0.08 -2.68 -0.04 0.00 0.52 0.00 0.00 34.95 32.83 3k9t s ARG 124 CO 0.11 0.62 0.29 0.42 0.02 0.00 0.00 175.30 176.77 3k9t s ILE 125 N -1.10 5.25 0.34 1.52 1.01 -1.26 -4.04 121.20 122.92 3k9t s ILE 125 Ca 0.20 0.43 -0.26 0.00 0.00 0.00 0.00 60.65 61.02 3k9t s ILE 125 Cb -0.12 -3.62 -0.09 0.00 0.01 0.00 0.00 42.46 38.64 3k9t s ILE 125 CO 0.11 0.24 1.01 -2.16 0.00 0.00 0.00 174.94 174.14 3k9t s PRO 126 N 1.59 4.45 -0.26 2.79 0.04 -1.26 -1.84 135.00 140.52 3k9t s PRO 126 Ca 0.13 1.49 -0.19 0.00 0.04 0.00 0.00 61.00 62.46 3k9t s PRO 126 Cb -0.15 -2.80 -0.02 0.00 0.04 0.00 0.00 34.50 31.57 3k9t s PRO 126 CO 0.08 0.13 0.58 -0.47 0.04 0.00 0.00 177.00 177.36 3k9t s TYR 127 N -1.53 3.27 0.11 0.56 5.04 -0.12 -4.72 117.35 119.96 3k9t s TYR 127 Ca 0.51 0.73 0.06 0.00 -2.44 0.00 0.00 57.07 55.94 3k9t s TYR 127 Cb -0.23 -2.80 -0.04 0.00 0.35 0.00 0.00 41.96 39.25 3k9t s TYR 127 CO 0.29 -0.32 -0.15 -0.51 -1.34 0.00 0.00 175.55 173.51 3k9t s LEU 128 N 2.43 2.36 0.12 6.97 1.43 -1.26 -4.93 118.68 125.80 3k9t s LEU 128 Ca 0.24 -0.75 0.02 0.00 -1.03 0.00 0.00 54.13 52.62 3k9t s LEU 128 Cb -0.16 -0.61 -0.04 0.00 0.03 0.00 0.00 46.19 45.41 3k9t s LEU 128 CO 0.09 -0.09 -0.07 0.42 0.23 0.00 0.00 176.35 176.93 3k9t s THR 129 N -1.78 0.81 -0.43 5.49 -4.23 -1.26 -1.06 115.64 113.17 3k9t s THR 129 Ca 0.06 -1.97 0.07 0.00 -1.18 0.00 0.00 61.69 58.68 3k9t s THR 129 Cb -0.07 -1.77 0.27 0.00 1.34 0.00 0.00 72.50 72.27 3k9t s THR 129 CO 0.03 -0.80 0.77 -0.24 -0.54 0.00 0.00 174.62 173.84 3k9t n SER 130 N -0.10 -1.26 -0.08 3.99 2.88 -0.01 -4.82 113.62 114.22 3k9t n SER 130 Ca -0.11 -3.10 -0.10 0.00 -1.33 0.00 0.00 58.87 54.23 3k9t n SER 130 Cb 0.61 0.66 0.05 0.00 -0.75 0.00 0.00 64.21 64.77 3k9t n SER 130 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 3k9t h TYR 131 N 3.74 0.91 0.00 0.66 0.05 -1.92 -3.38 116.97 117.04 3k9t h TYR 131 Ca -0.03 -0.25 0.00 0.00 0.05 0.00 0.00 58.73 58.49 3k9t h TYR 131 Cb 0.98 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.52 3k9t h TYR 131 CO 0.24 1.01 -0.32 0.66 -1.05 0.00 0.00 178.16 178.70 3k9t n TYR 132 N -4.06 0.00 -5.04 4.88 4.01 -1.26 -4.89 117.16 110.80 3k9t n TYR 132 Ca -0.01 0.00 -0.32 0.00 -0.16 0.00 0.00 57.90 57.40 3k9t n TYR 132 Cb 0.51 -0.01 -0.15 0.00 -0.31 0.00 0.00 39.34 39.38 3k9t n TYR 132 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3k9t s LYS 133 N -1.59 2.63 0.29 -0.72 -0.14 -1.26 -5.11 119.74 113.84 3k9t s LYS 133 Ca 0.02 -0.79 -0.29 0.00 -1.36 0.00 0.00 55.97 53.55 3k9t s LYS 133 Cb 0.04 -2.31 -0.10 0.00 -1.68 0.00 0.00 37.83 33.78 3k9t s LYS 133 CO 0.24 0.47 1.36 -1.21 -0.76 0.00 0.00 175.35 175.45 3k9t s GLU 134 N -0.35 4.31 0.03 1.68 2.02 -1.26 -4.85 118.70 120.28 3k9t s GLU 134 Ca 0.03 2.25 -0.28 0.00 0.02 0.00 0.00 54.97 56.99 3k9t s GLU 134 Cb -0.12 -3.09 0.10 0.00 0.10 0.00 0.00 34.13 31.11 3k9t s GLU 134 CO 0.02 -0.30 1.22 1.21 0.02 0.00 0.00 175.26 177.44 3k9t s ASN 135 N -0.08 -0.03 -0.12 -0.19 2.47 -1.26 -5.04 114.94 110.69 3k9t s ASN 135 Ca 0.54 -0.28 -0.23 0.00 0.42 0.00 0.00 52.86 53.31 3k9t s ASN 135 Cb -0.41 0.24 0.05 0.00 -1.45 0.00 0.00 41.25 39.68 3k9t s ASN 135 CO 0.48 -0.46 0.55 -1.66 -3.72 0.00 0.00 177.10 172.30 3k9t s TRP 136 N -2.26 -0.55 0.13 0.43 1.48 -1.26 -0.64 118.94 116.27 3k9t s TRP 136 Ca 0.22 1.13 -0.21 0.00 -1.06 0.00 0.00 56.10 56.18 3k9t s TRP 136 Cb 0.01 0.26 0.06 0.00 -1.16 0.00 0.00 33.47 32.63 3k9t s TRP 136 CO -0.01 -0.43 0.52 0.20 -4.06 0.00 0.00 176.95 173.18 3k9t s GLY 137 N -0.55 -0.47 -0.03 3.67 0.00 -1.26 -4.88 107.32 103.80 3k9t s GLY 137 Ca -0.07 0.35 0.07 0.00 0.00 0.00 0.00 44.72 45.07 3k9t s GLY 137 CO 0.05 0.05 -0.24 -1.36 0.00 0.00 0.00 173.10 171.59 3k9t s PHE 138 N -3.50 2.21 0.02 1.90 0.08 -0.44 -4.45 117.98 113.79 3k9t s PHE 138 Ca 0.00 -0.48 0.01 0.00 0.12 0.00 0.00 56.93 56.58 3k9t s PHE 138 Cb 0.00 -1.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.98 3k9t s PHE 138 CO -0.10 -0.08 0.06 -1.12 -0.10 0.00 0.00 175.22 173.88 3k9t s SER 139 N -0.45 5.50 0.23 1.36 0.01 0.31 -0.59 113.70 120.06 3k9t s SER 139 Ca 0.06 0.07 -0.18 0.00 1.31 0.00 0.00 55.95 57.21 3k9t s SER 139 Cb -0.10 -1.52 0.02 0.00 0.21 0.00 0.00 66.02 64.63 3k9t s SER 139 CO 0.00 0.25 0.58 -1.48 0.41 0.00 0.00 173.24 173.01 3k9t s LEU 140 N -1.85 -0.02 0.46 2.44 2.34 -0.44 -4.43 118.68 117.19 3k9t s LEU 140 Ca 0.24 -0.61 -0.22 0.00 0.06 0.00 0.00 54.13 53.60 3k9t s LEU 140 Cb -0.12 2.28 -0.08 0.00 -0.56 0.00 0.00 46.19 47.71 3k9t s LEU 140 CO 0.15 -1.17 1.07 0.42 -1.06 0.00 0.00 176.35 175.76 3k9t s THR 141 N -3.92 3.60 0.24 5.48 -4.23 -1.26 -4.18 115.64 111.38 3k9t s THR 141 Ca 0.12 1.10 -0.05 0.00 -1.18 0.00 0.00 61.69 61.68 3k9t s THR 141 Cb -0.03 -3.51 0.20 0.00 1.34 0.00 0.00 72.50 70.51 3k9t s THR 141 CO 0.03 -0.12 1.80 -0.61 -0.54 0.00 0.00 174.62 175.19 3k9t h GLN 142 N 1.90 0.72 -0.98 3.99 5.75 -1.71 0.70 115.11 125.48 3k9t h GLN 142 Ca -0.49 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 57.98 3k9t h GLN 142 Cb 1.23 -0.16 -0.05 0.00 1.07 0.00 0.00 27.48 29.56 3k9t h GLN 142 CO 0.60 0.48 0.65 -0.91 -2.65 0.00 0.00 178.83 177.00 3k9t h ASN 143 N 0.74 1.11 0.06 -0.69 2.35 -1.32 0.15 115.58 117.98 3k9t h ASN 143 Ca 0.38 -0.02 -0.22 0.00 -0.55 0.00 0.00 56.30 55.88 3k9t h ASN 143 Cb 0.34 -0.27 0.01 0.00 0.05 0.00 0.00 38.32 38.45 3k9t h ASN 143 CO -0.24 0.79 -0.83 0.50 -1.65 0.00 0.00 177.43 176.00 3k9t h LYS 144 N 1.31 0.61 -0.26 0.81 3.11 -1.71 -3.00 116.57 117.44 3k9t h LYS 144 Ca 0.37 -0.54 0.04 0.00 -2.81 0.00 0.00 60.65 57.71 3k9t h LYS 144 Cb -0.10 0.13 -0.04 0.00 -1.00 0.00 0.00 32.23 31.21 3k9t h LYS 144 CO -0.09 1.16 0.01 0.35 -2.81 0.00 0.00 179.45 178.07 3k9t h PHE 145 N 0.40 -0.00 0.00 1.91 3.04 -0.19 -2.68 116.94 119.42 3k9t h PHE 145 Ca -0.06 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.91 3k9t h PHE 145 Cb 1.45 0.04 -0.00 0.00 2.56 0.00 0.00 35.95 40.00 3k9t h PHE 145 CO 0.07 -0.03 -0.01 -0.44 -2.02 0.00 0.00 178.31 175.88 3k9t h ASP 146 N 0.09 0.00 -0.12 0.41 3.32 -0.64 0.09 116.42 119.57 3k9t h ASP 146 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3k9t h ASP 146 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3k9t h ASP 146 CO -0.20 0.01 0.00 -0.62 -1.72 0.00 0.00 179.24 176.70 3k9t n GLU 147 N -3.50 1.88 -2.82 3.56 4.71 -1.02 -4.95 120.64 118.50 3k9t n GLU 147 Ca -0.03 -1.30 -0.38 0.00 -0.01 0.00 0.00 57.16 55.44 3k9t n GLU 147 Cb 0.09 -1.45 -0.06 0.00 -1.01 0.00 0.00 31.44 29.01 3k9t n GLU 147 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3k9t s LEU 148 N -1.77 4.50 0.34 -4.62 1.43 0.02 -5.06 118.68 113.51 3k9t s LEU 148 Ca 0.35 1.83 0.02 0.00 -1.03 0.00 0.00 54.13 55.29 3k9t s LEU 148 Cb 0.20 -3.73 -0.03 0.00 0.03 0.00 0.00 46.19 42.66 3k9t s LEU 148 CO 0.30 0.07 0.52 0.00 0.23 0.00 0.00 176.35 177.47 3k9t s ASP 150 N -4.06 6.58 -0.03 0.00 1.11 -1.26 -4.62 116.67 114.39 3k9t s ASP 150 Ca 0.40 2.64 -0.30 0.00 0.18 0.00 0.00 52.55 55.47 3k9t s ASP 150 Cb -0.10 -2.60 0.11 0.00 1.07 0.00 0.00 42.92 41.41 3k9t s ASP 150 CO 0.34 -0.82 1.31 -0.62 1.18 0.00 0.00 175.17 176.57 3k9t s ASP 151 N 1.04 -0.02 -0.25 0.27 2.15 -1.26 -4.97 116.67 113.63 3k9t s ASP 151 Ca 0.69 -0.14 -0.08 0.00 0.43 0.00 0.00 52.55 53.44 3k9t s ASP 151 Cb -0.44 0.13 -0.04 0.00 -0.30 0.00 0.00 42.92 42.27 3k9t s ASP 151 CO 0.33 -0.25 0.11 -1.81 -0.17 0.00 0.00 175.17 173.38 3k9t s ASP 152 N -3.34 5.47 -0.08 -0.34 1.01 -1.26 -2.62 116.67 115.50 3k9t s ASP 152 Ca 0.21 -0.11 0.01 0.00 0.71 0.00 0.00 52.55 53.37 3k9t s ASP 152 Cb 0.03 -1.99 -0.02 0.00 1.01 0.00 0.00 42.92 41.95 3k9t s ASP 152 CO -0.03 -0.01 -0.11 -0.31 0.21 0.00 0.00 175.17 174.92 3k9t s TYR 153 N 1.50 2.83 -0.10 4.23 2.02 -1.26 -3.35 117.35 123.22 3k9t s TYR 153 Ca 0.06 -0.23 -0.27 0.00 -0.37 0.00 0.00 57.07 56.26 3k9t s TYR 153 Cb -0.15 -1.74 -0.02 0.00 -0.40 0.00 0.00 41.96 39.65 3k9t s TYR 153 CO 0.05 0.11 0.90 -2.00 -1.57 0.00 0.00 175.55 173.05 3k9t s GLU 154 N -0.39 4.41 -0.23 -0.62 2.12 0.31 -4.13 118.70 120.16 3k9t s GLU 154 Ca 0.05 1.20 0.01 0.00 0.36 0.00 0.00 54.97 56.59 3k9t s GLU 154 Cb -0.12 -3.52 0.04 0.00 0.26 0.00 0.00 34.13 30.78 3k9t s GLU 154 CO 0.02 -0.22 -0.12 0.08 -0.54 0.00 0.00 175.26 174.49 3k9t s VAL 155 N 1.70 2.35 -0.12 3.70 1.01 0.12 0.08 120.40 129.23 3k9t s VAL 155 Ca 0.44 -1.26 0.01 0.00 0.00 0.00 0.00 61.98 61.17 3k9t s VAL 155 Cb -0.18 -2.21 0.02 0.00 0.00 0.00 0.00 36.38 34.00 3k9t s VAL 155 CO 0.18 0.20 -0.12 -0.69 0.00 0.00 0.00 175.10 174.67 3k9t s VAL 156 N 1.22 1.32 -0.29 2.92 1.01 0.39 -0.94 120.40 126.03 3k9t s VAL 156 Ca -0.02 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.48 3k9t s VAL 156 Cb -0.17 -1.26 0.08 0.00 0.00 0.00 0.00 36.38 35.03 3k9t s VAL 156 CO -0.07 0.41 0.01 -0.63 0.00 0.00 0.00 175.10 174.82 3k9t s ILE 157 N 1.39 1.78 -1.08 2.22 1.01 0.28 0.47 121.20 127.27 3k9t s ILE 157 Ca 0.01 -1.75 -0.15 0.00 0.00 0.00 0.00 60.65 58.76 3k9t s ILE 157 Cb -0.13 -2.18 0.16 0.00 0.01 0.00 0.00 42.46 40.32 3k9t s ILE 157 CO -0.07 -0.39 1.27 -0.62 0.00 0.00 0.00 174.94 175.13 3k9t s ASP 158 N 1.21 6.91 0.36 3.58 2.15 0.83 -1.68 116.67 130.03 3k9t s ASP 158 Ca 0.03 -2.66 0.04 0.00 0.43 0.00 0.00 52.55 50.38 3k9t s ASP 158 Cb -0.19 -2.38 -0.05 0.00 -0.30 0.00 0.00 42.92 40.00 3k9t s ASP 158 CO -0.10 -0.83 0.07 -0.94 -0.17 0.00 0.00 175.17 173.20 3k9t s SER 159 N 3.01 2.68 0.01 -0.34 1.04 -1.26 -1.21 113.70 117.63 3k9t s SER 159 Ca 0.37 -1.48 -0.00 0.00 0.48 0.00 0.00 55.95 55.32 3k9t s SER 159 Cb -0.04 0.11 -0.01 0.00 0.10 0.00 0.00 66.02 66.17 3k9t s SER 159 CO -0.04 -0.71 -0.02 -0.94 0.98 0.00 0.00 173.24 172.51 3k9t s SER 160 N -3.56 0.16 -0.30 7.02 1.04 -0.28 -4.46 113.70 113.33 3k9t s SER 160 Ca 0.31 -0.34 -0.03 0.00 0.48 0.00 0.00 55.95 56.36 3k9t s SER 160 Cb 0.07 0.07 0.10 0.00 0.10 0.00 0.00 66.02 66.36 3k9t s SER 160 CO 0.14 -0.21 0.13 -0.22 0.98 0.00 0.00 173.24 174.07 3k9t s LEU 161 N -1.02 0.68 0.05 2.42 2.96 -1.26 -1.59 118.68 120.93 3k9t s LEU 161 Ca -0.11 -1.38 -0.06 0.00 -0.22 0.00 0.00 54.13 52.36 3k9t s LEU 161 Cb -0.07 -0.39 -0.01 0.00 0.50 0.00 0.00 46.19 46.22 3k9t s LEU 161 CO -0.01 -0.43 0.10 -1.61 -1.32 0.00 0.00 176.35 173.08 3k9t s GLU 162 N 1.99 0.66 0.22 1.98 0.41 -0.67 -4.94 118.70 118.35 3k9t s GLU 162 Ca 0.10 -0.90 -0.32 0.00 -0.41 0.00 0.00 54.97 53.44 3k9t s GLU 162 Cb -0.17 0.26 -0.14 0.00 -1.78 0.00 0.00 34.13 32.31 3k9t s GLU 162 CO -0.33 -0.17 1.43 -0.25 -0.49 0.00 0.00 175.26 175.45 3k9t n ASP 163 N 0.42 2.78 0.00 -0.19 8.00 -1.26 0.22 116.55 126.51 3k9t n ASP 163 Ca -0.17 1.13 0.00 0.00 0.71 0.00 0.00 54.79 56.46 3k9t n ASP 163 Cb 0.60 -1.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.28 3k9t n ASP 163 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k9t n GLY 164 N 2.36 3.02 3.33 0.44 0.00 -1.26 -4.72 105.19 108.36 3k9t n GLY 164 Ca 0.13 0.03 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 3k9t n GLY 164 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k9t s SER 165 N 1.92 -0.30 -0.25 1.61 1.04 -1.26 -1.41 113.70 115.06 3k9t s SER 165 Ca 0.00 -0.14 -0.11 0.00 0.48 0.00 0.00 55.95 56.18 3k9t s SER 165 Cb 0.00 0.47 -0.05 0.00 0.10 0.00 0.00 66.02 66.54 3k9t s SER 165 CO 0.00 -0.79 0.20 -0.22 0.98 0.00 0.00 173.24 173.41 3k9t s LEU 166 N -2.45 4.09 -0.05 2.42 0.20 0.27 -4.51 118.68 118.65 3k9t s LEU 166 Ca -0.01 0.12 -0.21 0.00 0.69 0.00 0.00 54.13 54.72 3k9t s LEU 166 Cb 0.01 -2.15 -0.05 0.00 -0.43 0.00 0.00 46.19 43.57 3k9t s LEU 166 CO -0.08 0.01 0.61 -0.89 -0.29 0.00 0.00 176.35 175.72 3k9t s THR 167 N 1.31 5.01 0.02 3.68 2.01 -1.26 -1.15 115.64 125.26 3k9t s THR 167 Ca 0.09 1.27 0.01 0.00 0.31 0.00 0.00 61.69 63.36 3k9t s THR 167 Cb -0.14 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.40 3k9t s THR 167 CO 0.07 0.34 -0.04 -0.72 -0.69 0.00 0.00 174.62 173.58 3k9t s TYR 168 N 0.32 0.35 0.15 4.92 -0.85 -0.63 -4.49 117.35 117.13 3k9t s TYR 168 Ca 0.32 -0.46 0.08 0.00 -0.52 0.00 0.00 57.07 56.50 3k9t s TYR 168 Cb -0.17 -0.23 -0.04 0.00 0.38 0.00 0.00 41.96 41.89 3k9t s TYR 168 CO 0.16 -0.14 -0.08 0.20 -1.52 0.00 0.00 175.55 174.17 3k9t s GLY 169 N -1.31 1.76 -0.15 5.49 0.00 0.57 0.14 107.32 113.81 3k9t s GLY 169 Ca -0.12 -1.36 -0.12 0.00 0.00 0.00 0.00 44.72 43.12 3k9t s GLY 169 CO -0.01 -1.36 0.39 1.85 0.00 0.00 0.00 173.10 173.97 3k9t s GLU 170 N -2.57 0.42 -0.05 2.90 2.12 -0.28 -0.90 118.70 120.34 3k9t s GLU 170 Ca 0.24 0.60 0.02 0.00 0.36 0.00 0.00 54.97 56.18 3k9t s GLU 170 Cb -0.10 0.14 0.02 0.00 0.26 0.00 0.00 34.13 34.45 3k9t s GLU 170 CO 0.15 -0.09 -0.08 -0.47 -0.54 0.00 0.00 175.26 174.24 3k9t s TYR 171 N 0.57 1.01 -0.11 5.30 5.04 -0.68 -0.35 117.35 128.12 3k9t s TYR 171 Ca -0.03 -0.32 0.02 0.00 -2.44 0.00 0.00 57.07 54.31 3k9t s TYR 171 Cb -0.05 -0.80 0.01 0.00 0.35 0.00 0.00 41.96 41.48 3k9t s TYR 171 CO -0.03 -0.20 -0.19 -0.47 -1.34 0.00 0.00 175.55 173.31 3k9t s TYR 172 N 0.71 2.29 -0.23 4.97 5.04 -1.26 -0.29 117.35 128.57 3k9t s TYR 172 Ca -0.12 -1.07 -0.06 0.00 -2.44 0.00 0.00 57.07 53.39 3k9t s TYR 172 Cb -0.14 -1.59 -0.02 0.00 0.35 0.00 0.00 41.96 40.56 3k9t s TYR 172 CO 0.02 -0.50 0.02 0.42 -1.34 0.00 0.00 175.55 174.17 3k9t s ILE 173 N 0.78 3.91 -0.13 3.14 1.01 0.31 -4.99 121.20 125.22 3k9t s ILE 173 Ca -0.10 -0.31 -0.29 0.00 0.00 0.00 0.00 60.65 59.95 3k9t s ILE 173 Cb -0.16 -2.81 -0.01 0.00 0.01 0.00 0.00 42.46 39.50 3k9t s ILE 173 CO 0.01 0.38 1.06 -0.60 0.00 0.00 0.00 174.94 175.79 3k9t s ARG 174 N 1.51 4.36 0.18 2.79 6.06 -1.26 -1.06 118.95 131.52 3k9t s ARG 174 Ca 0.06 1.45 0.03 0.00 -2.50 0.00 0.00 55.73 54.76 3k9t s ARG 174 Cb -0.15 -3.59 0.03 0.00 0.06 0.00 0.00 34.95 31.31 3k9t s ARG 174 CO 0.01 -0.44 0.25 0.41 -2.50 0.00 0.00 175.30 173.02 3k9t n GLY 175 N 3.23 1.82 0.34 8.12 0.00 -1.24 -4.85 105.19 112.62 3k9t n GLY 175 Ca 0.10 -2.14 0.04 0.00 0.00 0.00 0.00 46.02 44.02 3k9t n GLY 175 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3k9t h GLU 176 N 0.00 0.78 -6.44 1.61 4.39 -0.60 -3.43 114.58 110.89 3k9t h GLU 176 Ca -0.08 -0.05 -0.64 0.00 0.34 0.00 0.00 59.36 58.94 3k9t h GLU 176 Cb 0.37 -0.18 -0.14 0.00 -0.10 0.00 0.00 28.75 28.71 3k9t h GLU 176 CO 0.11 0.52 -0.70 -0.51 -1.16 0.00 0.00 179.01 177.27 3k9t s LEU 177 N -9.71 3.15 0.43 1.33 1.43 0.52 -5.03 118.68 110.81 3k9t s LEU 177 Ca -0.10 -0.42 0.29 0.00 -1.03 0.00 0.00 54.13 52.87 3k9t s LEU 177 Cb 0.18 -1.87 1.01 0.00 0.03 0.00 0.00 46.19 45.55 3k9t s LEU 177 CO 0.77 0.13 1.83 -0.33 0.23 0.00 0.00 176.35 178.97 3k9t h GLU 178 N 3.14 0.00 -6.94 1.70 5.08 -1.86 -3.13 114.58 112.57 3k9t h GLU 178 Ca -0.48 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.34 3k9t h GLU 178 Cb 1.19 0.00 0.11 0.00 0.50 0.00 0.00 28.75 30.54 3k9t h GLU 178 CO 0.55 0.00 0.79 -1.21 -1.00 0.00 0.00 179.01 178.15 3k9t s GLU 179 N -3.44 4.10 -0.01 2.33 2.02 -1.26 -4.71 118.70 117.72 3k9t s GLU 179 Ca 0.04 2.59 0.05 0.00 0.02 0.00 0.00 54.97 57.67 3k9t s GLU 179 Cb 0.09 -2.97 -0.01 0.00 0.10 0.00 0.00 34.13 31.34 3k9t s GLU 179 CO 0.54 -0.56 -0.16 -2.00 0.02 0.00 0.00 175.26 173.11 3k9t s GLU 180 N -2.01 1.28 -0.17 1.61 2.12 0.45 -1.26 118.70 120.72 3k9t s GLU 180 Ca 0.54 -0.55 -0.05 0.00 0.36 0.00 0.00 54.97 55.26 3k9t s GLU 180 Cb -0.47 -1.23 -0.03 0.00 0.26 0.00 0.00 34.13 32.66 3k9t s GLU 180 CO 0.63 0.33 -0.00 0.42 -0.54 0.00 0.00 175.26 176.09 3k9t s ILE 181 N -0.34 4.15 -0.18 -3.70 -1.09 0.19 -0.36 121.20 119.86 3k9t s ILE 181 Ca 0.06 -0.26 -0.05 0.00 -2.23 0.00 0.00 60.65 58.16 3k9t s ILE 181 Cb -0.06 -2.84 -0.03 0.00 -1.58 0.00 0.00 42.46 37.95 3k9t s ILE 181 CO -0.00 0.47 0.00 -0.22 -1.23 0.00 0.00 174.94 173.96 3k9t s LEU 182 N 0.46 3.38 -0.16 2.97 2.96 -1.26 -1.37 118.68 125.65 3k9t s LEU 182 Ca -0.01 -0.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 3k9t s LEU 182 Cb -0.14 -1.85 0.03 0.00 0.50 0.00 0.00 46.19 44.74 3k9t s LEU 182 CO 0.02 0.12 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.30 3k9t s LEU 183 N 0.68 1.84 0.19 -0.68 1.43 -0.26 -0.96 118.68 120.91 3k9t s LEU 183 Ca 0.00 -0.63 0.11 0.00 -1.03 0.00 0.00 54.13 52.58 3k9t s LEU 183 Cb -0.14 -1.14 -0.04 0.00 0.03 0.00 0.00 46.19 44.90 3k9t s LEU 183 CO 0.02 -0.11 -0.23 0.42 0.23 0.00 0.00 176.35 176.68 3k9t s THR 184 N 1.49 2.29 0.11 5.49 -4.23 -0.78 -1.68 115.64 118.34 3k9t s THR 184 Ca 0.02 -2.03 -0.14 0.00 -1.18 0.00 0.00 61.69 58.37 3k9t s THR 184 Cb -0.14 -2.09 0.03 0.00 1.34 0.00 0.00 72.50 71.63 3k9t s THR 184 CO -0.09 -0.15 0.34 0.28 -0.54 0.00 0.00 174.62 174.46 3k9t s THR 185 N -1.73 0.09 -0.09 3.99 -1.32 -0.28 -1.17 115.64 115.13 3k9t s THR 185 Ca 0.20 -0.74 -0.01 0.00 -1.21 0.00 0.00 61.69 59.93 3k9t s THR 185 Cb -0.08 -1.21 -0.03 0.00 -1.51 0.00 0.00 72.50 69.67 3k9t s THR 185 CO 0.10 -0.41 -0.03 -0.72 -2.21 0.00 0.00 174.62 171.35 3k9t s TYR 186 N -3.80 3.07 -1.17 9.09 -0.85 -1.25 -2.46 117.35 119.97 3k9t s TYR 186 Ca 0.03 0.07 0.13 0.00 -0.52 0.00 0.00 57.07 56.79 3k9t s TYR 186 Cb 0.03 -1.79 0.38 0.00 0.38 0.00 0.00 41.96 40.96 3k9t s TYR 186 CO -0.12 0.35 1.31 0.25 -1.52 0.00 0.00 175.55 175.83 3k9t n THR 187 N 2.37 0.99 0.39 -3.49 -2.24 -0.69 -4.63 114.28 106.98 3k9t n THR 187 Ca -0.18 -0.99 0.12 0.00 -2.27 0.00 0.00 64.05 60.72 3k9t n THR 187 Cb 0.53 0.51 0.10 0.00 -2.10 0.00 0.00 70.33 69.38 3k9t n THR 187 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k9t s HIS 189 N -3.24 3.79 0.00 0.00 3.76 -1.26 -3.00 115.29 115.34 3k9t s HIS 189 Ca 0.04 1.78 0.00 0.00 -0.15 0.00 0.00 55.06 56.73 3k9t s HIS 189 Cb 0.12 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.73 3k9t s HIS 189 CO 0.75 0.14 0.00 -0.35 -0.85 0.00 0.00 174.74 174.42 3k9t n PRO 190 N 2.82 0.00 -2.57 8.40 -0.04 -1.25 -4.52 135.00 137.84 3k9t n PRO 190 Ca 0.03 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.06 3k9t n PRO 190 Cb 0.49 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.93 3k9t n PRO 190 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 3k9t s SER 191 N -1.17 6.47 0.20 3.54 0.01 -1.25 -4.80 113.70 116.69 3k9t s SER 191 Ca 0.00 0.21 0.00 0.00 1.31 0.00 0.00 55.95 57.47 3k9t s SER 191 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 3k9t s SER 191 CO 0.00 -1.45 0.00 0.00 0.41 0.00 0.00 173.24 172.20 3k9t h ASN 194 N 0.00 0.51 -4.00 0.00 -1.24 -1.88 0.26 115.58 109.23 3k9t h ASN 194 Ca 0.00 -0.11 -0.68 0.00 0.71 0.00 0.00 56.30 56.22 3k9t h ASN 194 Cb 0.00 -0.13 -0.37 0.00 0.73 0.00 0.00 38.32 38.55 3k9t h ASN 194 CO 0.00 0.48 -0.51 -0.62 -1.29 0.00 0.00 177.43 175.48 3k9t s ASP 195 N -5.74 4.95 -0.33 1.15 2.15 -1.26 -1.83 116.67 115.76 3k9t s ASP 195 Ca -0.13 -2.63 0.16 0.00 0.43 0.00 0.00 52.55 50.38 3k9t s ASP 195 Cb 0.10 -1.77 0.45 0.00 -0.30 0.00 0.00 42.92 41.40 3k9t s ASP 195 CO 0.74 -0.37 1.12 -3.20 -0.17 0.00 0.00 175.17 173.28 3k9t n ASN 196 N 3.72 0.41 0.21 -0.34 5.15 -1.26 -4.91 115.26 118.25 3k9t n ASN 196 Ca 0.04 -2.52 0.10 0.00 -0.60 0.00 0.00 54.58 51.60 3k9t n ASN 196 Cb 0.38 -0.05 0.36 0.00 -0.53 0.00 0.00 39.78 39.94 3k9t n ASN 196 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 3k9t h LEU 197 N 2.56 0.00 -0.43 1.20 3.38 -1.31 -3.21 115.31 117.50 3k9t h LEU 197 Ca -0.17 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 3k9t h LEU 197 Cb 1.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 3k9t h LEU 197 CO 0.27 0.22 0.01 0.77 0.09 0.00 0.00 178.44 179.79 3k9t h SER 198 N 0.00 0.74 -0.52 -0.43 4.64 -1.16 -0.70 113.55 116.11 3k9t h SER 198 Ca -0.00 -0.30 -0.12 0.00 -0.47 0.00 0.00 61.79 60.90 3k9t h SER 198 Cb 0.88 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.76 3k9t h SER 198 CO 0.03 0.86 -0.14 1.23 -0.87 0.00 0.00 176.83 177.94 3k9t h GLY 199 N 0.60 1.10 0.87 -0.77 0.00 -1.78 0.48 103.07 103.57 3k9t h GLY 199 Ca 0.12 -0.91 -0.01 0.00 0.00 0.00 0.00 47.33 46.53 3k9t h GLY 199 CO 0.02 0.83 -0.05 -2.08 0.00 0.00 0.00 176.54 175.26 3k9t h VAL 200 N 0.90 0.96 -0.29 4.60 2.07 -1.53 -1.31 116.25 121.65 3k9t h VAL 200 Ca 0.13 -0.28 -0.12 0.00 0.82 0.00 0.00 66.70 67.26 3k9t h VAL 200 Cb 0.71 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 3k9t h VAL 200 CO 0.05 0.07 -0.31 0.00 0.02 0.00 0.00 177.57 177.40 3k9t h ALA 201 N 0.60 0.92 0.29 1.67 0.00 -1.01 -2.57 119.26 119.17 3k9t h ALA 201 Ca -0.02 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 3k9t h ALA 201 Cb 0.23 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3k9t h ALA 201 CO 0.02 0.62 -0.14 1.25 0.00 0.00 0.00 179.25 181.00 3k9t h LEU 202 N 0.52 -0.33 -1.46 0.00 5.85 -0.77 -2.57 115.31 116.54 3k9t h LEU 202 Ca 0.06 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.67 3k9t h LEU 202 Cb 0.79 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 3k9t h LEU 202 CO 0.06 -0.07 0.37 0.40 -0.34 0.00 0.00 178.44 178.87 3k9t h ILE 203 N -0.60 1.13 -0.21 4.05 1.08 -1.28 -0.30 117.51 121.37 3k9t h ILE 203 Ca -0.04 -0.25 0.02 0.00 -0.39 0.00 0.00 64.86 64.20 3k9t h ILE 203 Cb 0.44 0.33 -0.02 0.00 -3.07 0.00 0.00 36.82 34.49 3k9t h ILE 203 CO 0.07 0.13 0.07 0.74 -0.69 0.00 0.00 178.15 178.47 3k9t h THR 204 N 0.73 0.94 0.00 -0.27 2.02 -1.28 -0.15 112.91 114.90 3k9t h THR 204 Ca 0.21 -0.06 -0.11 0.00 0.77 0.00 0.00 66.41 67.22 3k9t h THR 204 Cb -0.05 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 3k9t h THR 204 CO -0.05 0.03 -0.54 -0.26 0.37 0.00 0.00 175.52 175.08 3k9t h PHE 205 N 0.17 0.00 -0.01 3.16 -1.00 -0.92 0.30 116.94 118.64 3k9t h PHE 205 Ca 0.09 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.87 3k9t h PHE 205 Cb 0.06 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.62 3k9t h PHE 205 CO -0.12 0.54 0.00 0.82 -1.61 0.00 0.00 178.31 177.94 3k9t h ILE 206 N 0.00 1.23 -0.71 -0.55 2.04 -0.74 -1.62 117.51 117.15 3k9t h ILE 206 Ca -0.01 -0.67 0.10 0.00 1.00 0.00 0.00 64.86 65.28 3k9t h ILE 206 Cb 1.01 1.66 -0.07 0.00 -0.74 0.00 0.00 36.82 38.67 3k9t h ILE 206 CO 0.07 0.18 0.35 0.00 0.00 0.00 0.00 178.15 178.74 3k9t h ALA 207 N 0.72 0.98 -0.80 1.87 0.00 -0.78 -0.67 119.26 120.58 3k9t h ALA 207 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3k9t h ALA 207 Cb 0.29 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3k9t h ALA 207 CO 0.00 -0.06 0.48 -0.22 0.00 0.00 0.00 179.25 179.44 3k9t h LYS 208 N 0.58 1.10 -0.05 0.00 3.64 -0.77 -1.28 116.57 119.79 3k9t h LYS 208 Ca 0.35 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.61 3k9t h LYS 208 Cb 0.39 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 3k9t h LYS 208 CO -0.28 0.78 -0.05 0.00 -2.27 0.00 0.00 179.45 177.63 3k9t h ALA 209 N 1.25 0.07 -0.63 5.00 0.00 -0.63 -3.33 119.26 120.99 3k9t h ALA 209 Ca 0.29 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3k9t h ALA 209 Cb -0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3k9t h ALA 209 CO -0.05 -0.14 0.34 -0.07 0.00 0.00 0.00 179.25 179.33 3k9t h LEU 210 N -0.34 0.78 -1.98 0.00 3.38 -0.94 -2.02 115.31 114.19 3k9t h LEU 210 Ca 0.01 -0.06 0.42 0.00 0.09 0.00 0.00 57.88 58.34 3k9t h LEU 210 Cb 0.56 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 3k9t h LEU 210 CO 0.01 0.63 1.04 0.28 0.09 0.00 0.00 178.44 180.50 3k9t h SER 211 N 0.88 0.01 -0.14 -0.43 0.02 -1.34 -0.69 113.55 111.87 3k9t h SER 211 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3k9t h SER 211 Cb 0.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.57 3k9t h SER 211 CO -0.04 -0.00 0.00 0.29 -1.14 0.00 0.00 176.83 175.94 3k9t n LYS 212 N -4.11 2.08 -4.38 3.45 5.02 -0.76 -4.96 118.16 114.50 3k9t n LYS 212 Ca 0.32 -1.60 -0.26 0.00 -2.02 0.00 0.00 58.31 54.76 3k9t n LYS 212 Cb 1.50 -1.46 -0.10 0.00 -0.02 0.00 0.00 35.03 34.95 3k9t n LYS 212 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3k9t s LEU 213 N -1.79 2.68 -0.53 -0.35 1.43 -0.27 -5.10 118.68 114.76 3k9t s LEU 213 Ca 0.34 -0.80 -0.20 0.00 -1.03 0.00 0.00 54.13 52.44 3k9t s LEU 213 Cb 0.20 -1.34 0.06 0.00 0.03 0.00 0.00 46.19 45.15 3k9t s LEU 213 CO 0.30 0.09 0.68 -0.75 0.23 0.00 0.00 176.35 176.90 3k9t s LYS 214 N -2.96 3.13 0.10 1.70 2.20 -1.26 -5.02 119.74 117.64 3k9t s LYS 214 Ca 0.25 -0.88 0.02 0.00 -0.36 0.00 0.00 55.97 54.99 3k9t s LYS 214 Cb -0.07 -4.12 -0.04 0.00 -1.51 0.00 0.00 37.83 32.09 3k9t s LYS 214 CO 0.13 -1.31 0.20 0.95 -0.36 0.00 0.00 175.35 174.96 3k9t s THR 215 N 2.82 5.14 -0.06 3.43 -4.23 -1.26 -5.02 115.64 116.45 3k9t s THR 215 Ca 0.16 -0.61 -0.26 0.00 -1.18 0.00 0.00 61.69 59.80 3k9t s THR 215 Cb -0.19 -3.55 -0.23 0.00 1.34 0.00 0.00 72.50 69.87 3k9t s THR 215 CO 0.12 0.04 1.06 0.50 -0.54 0.00 0.00 174.62 175.80 3k9t h LYS 216 N 2.77 0.05 -6.92 3.99 3.64 -1.94 -1.98 116.57 116.19 3k9t h LYS 216 Ca -0.47 -0.05 -0.49 0.00 -1.27 0.00 0.00 60.65 58.37 3k9t h LYS 216 Cb 1.17 0.01 0.03 0.00 -0.41 0.00 0.00 32.23 33.03 3k9t h LYS 216 CO 0.71 0.75 0.12 0.71 -2.27 0.00 0.00 179.45 179.47 3k9t s TYR 217 N -3.38 3.54 0.25 1.91 2.02 -1.26 -0.36 117.35 120.08 3k9t s TYR 217 Ca -0.17 0.89 -0.11 0.00 -0.37 0.00 0.00 57.07 57.31 3k9t s TYR 217 Cb 0.00 -2.35 -0.08 0.00 -0.40 0.00 0.00 41.96 39.13 3k9t s TYR 217 CO 0.70 -0.25 0.60 -1.12 -1.57 0.00 0.00 175.55 173.91 3k9t s SER 218 N -3.86 6.68 -0.04 2.29 0.01 -0.39 -3.65 113.70 114.73 3k9t s SER 218 Ca 0.49 1.02 0.02 0.00 1.31 0.00 0.00 55.95 58.79 3k9t s SER 218 Cb -0.10 -2.27 0.01 0.00 0.21 0.00 0.00 66.02 63.87 3k9t s SER 218 CO 0.42 -0.09 -0.10 -0.31 0.41 0.00 0.00 173.24 173.56 3k9t s TYR 219 N -1.83 1.16 -0.06 2.43 1.51 -0.22 -0.63 117.35 119.70 3k9t s TYR 219 Ca 0.48 -0.35 0.05 0.00 -1.01 0.00 0.00 57.07 56.24 3k9t s TYR 219 Cb -0.11 -0.85 -0.00 0.00 -0.11 0.00 0.00 41.96 40.88 3k9t s TYR 219 CO 0.20 -0.18 -0.22 0.50 -1.11 0.00 0.00 175.55 174.75 3k9t s ARG 220 N 0.44 2.35 -0.20 -0.62 3.52 -0.47 -0.53 118.95 123.44 3k9t s ARG 220 Ca -0.08 -0.78 0.01 0.00 -0.13 0.00 0.00 55.73 54.75 3k9t s ARG 220 Cb -0.12 -1.95 0.02 0.00 -1.56 0.00 0.00 34.95 31.34 3k9t s ARG 220 CO 0.02 0.28 -0.18 -0.06 -0.81 0.00 0.00 175.30 174.55 3k9t s PHE 221 N 0.04 2.87 -0.21 5.12 0.40 0.60 -1.11 117.98 125.69 3k9t s PHE 221 Ca -0.07 -1.72 -0.06 0.00 -0.60 0.00 0.00 56.93 54.48 3k9t s PHE 221 Cb -0.14 -1.93 -0.03 0.00 0.51 0.00 0.00 43.02 41.43 3k9t s PHE 221 CO 0.04 -0.81 0.02 -1.17 0.70 0.00 0.00 175.22 174.01 3k9t s LEU 222 N 1.27 3.38 -0.31 -0.37 2.96 -0.68 -1.68 118.68 123.25 3k9t s LEU 222 Ca 0.03 -0.16 -0.01 0.00 -0.22 0.00 0.00 54.13 53.77 3k9t s LEU 222 Cb -0.14 -1.86 0.06 0.00 0.50 0.00 0.00 46.19 44.74 3k9t s LEU 222 CO -0.11 0.07 0.01 -0.36 -1.32 0.00 0.00 176.35 174.63 3k9t s PHE 223 N 1.00 3.33 0.03 5.38 0.40 -0.08 -1.12 117.98 126.92 3k9t s PHE 223 Ca 0.02 -2.06 -0.16 0.00 -0.60 0.00 0.00 56.93 54.13 3k9t s PHE 223 Cb -0.14 -2.25 0.03 0.00 0.51 0.00 0.00 43.02 41.17 3k9t s PHE 223 CO 0.02 -0.84 0.36 0.00 0.70 0.00 0.00 175.22 175.46 3k9t s ALA 224 N 1.20 -0.86 0.57 5.36 0.00 -1.03 -0.32 121.76 126.68 3k9t s ALA 224 Ca -0.03 0.24 -0.21 0.00 0.00 0.00 0.00 51.96 51.96 3k9t s ALA 224 Cb -0.20 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 3k9t s ALA 224 CO -0.02 -0.39 1.33 -0.35 0.00 0.00 0.00 175.76 176.33 3k9t n PRO 225 N 0.73 1.56 -1.75 0.00 -0.04 -1.26 -1.70 135.00 132.54 3k9t n PRO 225 Ca -0.19 0.58 -0.38 0.00 -0.04 0.00 0.00 63.50 63.46 3k9t n PRO 225 Cb 0.59 -2.55 0.05 0.00 -0.04 0.00 0.00 33.50 31.54 3k9t n PRO 225 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3k9t s GLU 226 N -2.97 3.05 0.00 0.54 2.12 -1.26 -0.89 118.70 119.29 3k9t s GLU 226 Ca 0.74 2.25 0.00 0.00 0.36 0.00 0.00 54.97 58.32 3k9t s GLU 226 Cb -0.41 -2.21 0.00 0.00 0.26 0.00 0.00 34.13 31.77 3k9t s GLU 226 CO 0.47 -1.27 0.00 2.41 -0.54 0.00 0.00 175.26 176.34 3k9t n THR 227 N -1.14 0.00 -0.19 -1.70 -1.04 -1.26 -3.85 114.28 105.09 3k9t n THR 227 Ca 0.11 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.15 3k9t n THR 227 Cb 0.45 0.00 0.29 0.00 -1.82 0.00 0.00 70.33 69.25 3k9t n THR 227 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 3k9t h ILE 228 N 0.00 1.13 0.08 12.58 6.09 -1.99 -1.55 117.51 133.85 3k9t h ILE 228 Ca 0.00 -0.31 -0.00 0.00 -1.37 0.00 0.00 64.86 63.17 3k9t h ILE 228 Cb 0.00 0.14 0.00 0.00 0.47 0.00 0.00 36.82 37.44 3k9t h ILE 228 CO 0.00 0.17 -0.04 1.23 -3.07 0.00 0.00 178.15 176.44 3k9t h GLY 229 N 0.91 -0.11 1.07 8.18 0.00 -1.12 -0.49 103.07 111.51 3k9t h GLY 229 Ca 0.28 0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.65 3k9t h GLY 229 CO -0.08 -0.04 0.54 1.48 0.00 0.00 0.00 176.54 178.44 3k9t h SER 230 N -0.49 1.08 -0.25 0.19 4.64 -1.57 0.04 113.55 117.20 3k9t h SER 230 Ca -0.01 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 3k9t h SER 230 Cb 0.42 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 3k9t h SER 230 CO 0.02 0.84 0.10 0.40 -0.87 0.00 0.00 176.83 177.32 3k9t h ILE 231 N 1.24 1.16 -0.61 0.95 2.04 -1.29 0.13 117.51 121.13 3k9t h ILE 231 Ca 0.32 -0.49 0.06 0.00 1.00 0.00 0.00 64.86 65.75 3k9t h ILE 231 Cb -0.05 1.03 -0.05 0.00 -0.74 0.00 0.00 36.82 37.01 3k9t h ILE 231 CO -0.06 0.16 0.32 0.74 0.00 0.00 0.00 178.15 179.32 3k9t h THR 232 N 0.26 0.94 -0.18 -0.27 2.02 -0.64 -0.18 112.91 114.86 3k9t h THR 232 Ca 0.08 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 3k9t h THR 232 Cb 0.16 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 3k9t h THR 232 CO -0.01 0.11 0.03 -0.25 0.37 0.00 0.00 175.52 175.77 3k9t h TRP 233 N 0.60 0.32 -0.83 3.16 7.01 -0.72 -2.33 115.95 123.16 3k9t h TRP 233 Ca 0.28 -0.04 0.03 0.00 2.11 0.00 0.00 58.89 61.26 3k9t h TRP 233 Cb 0.19 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.12 3k9t h TRP 233 CO -0.09 0.46 0.55 -0.07 -2.79 0.00 0.00 178.44 176.49 3k9t h LEU 234 N 0.10 0.90 -1.52 0.65 3.38 -0.70 -1.33 115.31 116.80 3k9t h LEU 234 Ca 0.06 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3k9t h LEU 234 Cb 0.31 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3k9t h LEU 234 CO 0.00 0.63 -0.08 0.77 0.09 0.00 0.00 178.44 179.85 3k9t h SER 235 N 1.06 0.00 -0.13 -0.43 4.64 -0.72 -2.43 113.55 115.54 3k9t h SER 235 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 3k9t h SER 235 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3k9t h SER 235 CO -0.09 0.08 0.00 0.54 -0.87 0.00 0.00 176.83 176.49 3k9t n ARG 236 N -3.25 2.17 -1.84 4.77 1.74 -0.57 -4.58 116.66 115.12 3k9t n ARG 236 Ca -0.00 -1.94 0.03 0.00 -0.77 0.00 0.00 57.85 55.17 3k9t n ARG 236 Cb 0.32 -1.44 0.03 0.00 -1.02 0.00 0.00 32.46 30.34 3k9t n ARG 236 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3k9t n ASN 237 N 1.29 1.06 -0.25 0.55 3.02 -0.81 -4.89 115.26 115.22 3k9t n ASN 237 Ca 0.14 -2.01 0.05 0.00 -0.03 0.00 0.00 54.58 52.74 3k9t n ASN 237 Cb 0.56 -0.32 0.29 0.00 -0.61 0.00 0.00 39.78 39.70 3k9t n ASN 237 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3k9t h GLU 238 N 1.38 0.89 -0.33 3.52 5.08 -1.78 -0.96 114.58 122.37 3k9t h GLU 238 Ca -0.22 -0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.18 3k9t h GLU 238 Cb 1.72 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.76 3k9t h GLU 238 CO 0.11 0.59 0.27 0.38 -1.00 0.00 0.00 179.01 179.35 3k9t h ASP 239 N 0.91 0.00 0.83 1.42 2.03 -1.91 -2.70 116.42 117.00 3k9t h ASP 239 Ca 0.36 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.66 3k9t h ASP 239 Cb 0.24 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.74 3k9t h ASP 239 CO -0.13 0.00 -0.74 0.11 -1.03 0.00 0.00 179.24 177.45 3k9t h LYS 240 N 0.00 0.00 -0.48 4.15 1.57 -1.57 -3.39 116.57 116.85 3k9t h LYS 240 Ca 0.16 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.91 3k9t h LYS 240 Cb 0.69 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 3k9t h LYS 240 CO -0.00 0.00 0.17 -0.07 -0.57 0.00 0.00 179.45 178.98 3k9t h LEU 241 N 0.00 0.63 -2.34 2.94 3.38 -1.43 -2.55 115.31 115.94 3k9t h LEU 241 Ca 0.00 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 57.93 3k9t h LEU 241 Cb 0.79 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 3k9t h LEU 241 CO 0.00 0.58 0.17 0.07 0.09 0.00 0.00 178.44 179.36 3k9t h LYS 242 N 0.68 0.00 0.00 1.13 2.10 -1.77 -2.07 116.57 116.64 3k9t h LYS 242 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 3k9t h LYS 242 Cb 0.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 3k9t h LYS 242 CO -0.01 0.00 -0.72 0.09 -2.00 0.00 0.00 179.45 176.81 3k9t n ASN 243 N -3.57 0.64 -4.58 7.07 3.02 -0.96 -4.85 115.26 112.03 3k9t n ASN 243 Ca 0.00 -0.03 -0.42 0.00 -0.03 0.00 0.00 54.58 54.10 3k9t n ASN 243 Cb 0.27 0.35 -0.03 0.00 -0.61 0.00 0.00 39.78 39.77 3k9t n ASN 243 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3k9t s ILE 244 N -3.15 3.81 -0.23 2.41 1.01 -0.78 -0.41 121.20 123.86 3k9t s ILE 244 Ca 0.06 0.70 0.17 0.00 0.00 0.00 0.00 60.65 61.59 3k9t s ILE 244 Cb 0.14 -4.45 0.12 0.00 0.01 0.00 0.00 42.46 38.28 3k9t s ILE 244 CO 0.74 -1.17 1.44 0.50 0.00 0.00 0.00 174.94 176.46 3k9t h LYS 245 N 10.92 0.00 -1.09 2.79 3.64 -1.02 -3.45 116.57 128.37 3k9t h LYS 245 Ca -0.27 0.00 0.34 0.00 -1.27 0.00 0.00 60.65 59.45 3k9t h LYS 245 Cb 1.09 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 32.72 3k9t h LYS 245 CO 1.17 0.35 0.97 0.20 -2.27 0.00 0.00 179.45 179.87 3k9t s GLY 247 N -4.41 -0.26 -0.01 5.01 0.00 0.05 -4.60 107.32 103.09 3k9t s GLY 247 Ca 0.04 1.70 0.01 0.00 0.00 0.00 0.00 44.72 46.47 3k9t s GLY 247 CO 0.73 0.54 -0.01 1.08 0.00 0.00 0.00 173.10 175.44 3k9t s LEU 248 N -2.22 1.64 -0.25 0.66 1.43 -0.14 -1.53 118.68 118.28 3k9t s LEU 248 Ca 0.12 -0.03 -0.13 0.00 -1.03 0.00 0.00 54.13 53.07 3k9t s LEU 248 Cb 0.01 -0.15 -0.04 0.00 0.03 0.00 0.00 46.19 46.03 3k9t s LEU 248 CO -0.03 -0.03 0.26 -0.69 0.23 0.00 0.00 176.35 176.09 3k9t s VAL 249 N 0.41 5.27 -0.26 -1.59 1.01 0.17 -1.86 120.40 123.55 3k9t s VAL 249 Ca -0.04 0.37 -0.10 0.00 0.00 0.00 0.00 61.98 62.21 3k9t s VAL 249 Cb -0.06 -3.60 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 3k9t s VAL 249 CO -0.01 0.26 0.17 0.00 0.00 0.00 0.00 175.10 175.52 3k9t s ALA 250 N 1.48 3.51 0.14 5.51 0.00 -0.32 -3.42 121.76 128.66 3k9t s ALA 250 Ca 0.11 -1.03 -0.18 0.00 0.00 0.00 0.00 51.96 50.87 3k9t s ALA 250 Cb -0.15 -2.38 0.04 0.00 0.00 0.00 0.00 23.12 20.63 3k9t s ALA 250 CO 0.08 -0.43 0.46 -0.08 0.00 0.00 0.00 175.76 175.79 3k9t s THR 251 N 1.52 0.05 -1.44 0.00 -1.32 -1.26 -4.48 115.64 108.70 3k9t s THR 251 Ca 0.07 -0.47 -0.05 0.00 -1.21 0.00 0.00 61.69 60.04 3k9t s THR 251 Cb -0.15 -1.18 0.04 0.00 -1.51 0.00 0.00 72.50 69.70 3k9t s THR 251 CO 0.08 -0.22 0.62 0.00 -2.21 0.00 0.00 174.62 172.90 3k9t n VAL 253 N -4.41 1.72 0.09 0.00 0.24 -1.26 -0.38 118.33 114.33 3k9t n VAL 253 Ca -0.20 -1.32 0.01 0.00 -2.04 0.00 0.00 64.34 60.79 3k9t n VAL 253 Cb 0.63 0.13 -0.01 0.00 -1.47 0.00 0.00 33.84 33.13 3k9t n VAL 253 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3k9t n GLY 254 N 0.54 0.71 3.93 7.63 0.00 -1.26 -4.17 105.19 112.57 3k9t n GLY 254 Ca 0.21 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 3k9t n GLY 254 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3k9t s ASP 255 N -1.31 3.56 0.00 1.61 -4.77 -1.26 -0.84 116.67 113.66 3k9t s ASP 255 Ca 0.01 0.31 0.25 0.00 -3.30 0.00 0.00 52.55 49.82 3k9t s ASP 255 Cb 0.02 -0.49 1.27 0.00 -1.09 0.00 0.00 42.92 42.62 3k9t s ASP 255 CO 0.08 -2.45 1.85 0.00 0.70 0.00 0.00 175.17 175.35 3k9t n ALA 256 N -3.56 2.27 -1.51 2.11 0.00 -1.26 -4.53 120.51 114.03 3k9t n ALA 256 Ca 0.14 -0.12 -0.19 0.00 0.00 0.00 0.00 53.44 53.27 3k9t n ALA 256 Cb 0.60 -1.41 0.21 0.00 0.00 0.00 0.00 19.45 18.84 3k9t n ALA 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k9t n GLY 257 N 0.87 -2.02 3.82 0.00 0.00 -1.26 -4.99 105.19 101.62 3k9t n GLY 257 Ca 0.12 -1.61 -0.31 0.00 0.00 0.00 0.00 46.02 44.22 3k9t n GLY 257 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k9t s ILE 258 N -3.30 3.69 0.38 -0.61 -4.36 -1.26 -4.74 121.20 111.00 3k9t s ILE 258 Ca 0.67 0.55 -0.25 0.00 -0.26 0.00 0.00 60.65 61.36 3k9t s ILE 258 Cb -0.04 -3.34 -0.09 0.00 1.25 0.00 0.00 42.46 40.25 3k9t s ILE 258 CO 0.49 -0.72 1.08 -0.54 0.24 0.00 0.00 174.94 175.49 3k9t s LYS 259 N -5.13 4.21 -0.07 0.37 1.02 -1.26 -3.77 119.74 115.12 3k9t s LYS 259 Ca 0.59 1.61 0.02 0.00 0.02 0.00 0.00 55.97 58.20 3k9t s LYS 259 Cb -0.14 -2.66 0.02 0.00 -0.52 0.00 0.00 37.83 34.53 3k9t s LYS 259 CO 0.54 -0.12 -0.10 -0.80 -0.92 0.00 0.00 175.35 173.95 3k9t s ASN 260 N -1.39 1.68 -0.20 2.83 0.01 -1.23 -1.51 114.94 115.12 3k9t s ASN 260 Ca 0.56 -0.27 -0.03 0.00 -0.71 0.00 0.00 52.86 52.41 3k9t s ASN 260 Cb -0.25 -0.76 -0.01 0.00 0.41 0.00 0.00 41.25 40.65 3k9t s ASN 260 CO 0.31 -0.00 -0.07 -0.47 -1.51 0.00 0.00 177.10 175.36 3k9t s TYR 261 N 0.85 2.92 -0.22 2.20 5.04 -0.29 -4.40 117.35 123.45 3k9t s TYR 261 Ca -0.11 -0.96 -0.16 0.00 -2.44 0.00 0.00 57.07 53.39 3k9t s TYR 261 Cb -0.15 -2.05 -0.04 0.00 0.35 0.00 0.00 41.96 40.08 3k9t s TYR 261 CO 0.01 -0.52 0.42 0.21 -1.34 0.00 0.00 175.55 174.33 3k9t s LYS 262 N 1.28 4.14 0.74 4.97 2.20 0.18 -0.54 119.74 132.70 3k9t s LYS 262 Ca 0.03 0.21 -0.11 0.00 -0.36 0.00 0.00 55.97 55.74 3k9t s LYS 262 Cb -0.14 -3.57 0.04 0.00 -1.51 0.00 0.00 37.83 32.64 3k9t s LYS 262 CO -0.03 -0.13 1.08 1.03 -0.36 0.00 0.00 175.35 176.94 3k9t s ARG 263 N 1.58 2.54 1.00 4.03 0.52 -0.66 -1.69 118.95 126.27 3k9t s ARG 263 Ca 0.19 1.11 -0.11 0.00 -0.52 0.00 0.00 55.73 56.40 3k9t s ARG 263 Cb -0.15 -1.93 0.19 0.00 0.52 0.00 0.00 34.95 33.58 3k9t s ARG 263 CO 0.09 -1.42 1.10 0.95 0.02 0.00 0.00 175.30 176.03 3k9t s THR 264 N -2.91 2.13 0.57 0.02 -4.23 -1.26 -3.74 115.64 106.22 3k9t s THR 264 Ca 0.60 0.04 0.26 0.00 -1.18 0.00 0.00 61.69 61.42 3k9t s THR 264 Cb -0.16 -2.12 0.34 0.00 1.34 0.00 0.00 72.50 71.89 3k9t s THR 264 CO 0.54 -0.06 2.20 0.07 -0.54 0.00 0.00 174.62 176.83 3k9t h LYS 265 N -2.10 0.00 0.00 3.99 2.10 -1.88 -0.89 116.57 117.79 3k9t h LYS 265 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 3k9t h LYS 265 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 3k9t h LYS 265 CO 0.46 0.00 0.00 0.74 -2.00 0.00 0.00 179.45 178.65 3k9t h PHE 266 N 0.00 0.00 0.00 0.07 0.04 -1.93 -3.47 116.94 111.65 3k9t h PHE 266 Ca 0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.79 3k9t h PHE 266 Cb 0.12 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.27 3k9t h PHE 266 CO 0.00 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.12 3k9t n GLY 267 N 1.18 1.03 0.67 -1.45 0.00 -0.34 -4.47 105.19 101.82 3k9t n GLY 267 Ca 0.05 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.13 3k9t n GLY 267 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k9t n ASP 268 N 1.10 1.54 -4.63 1.61 5.75 -1.26 -4.79 116.55 115.87 3k9t n ASP 268 Ca 0.00 -3.17 -0.29 0.00 -0.01 0.00 0.00 54.79 51.32 3k9t n ASP 268 Cb 0.00 -0.43 0.19 0.00 -1.03 0.00 0.00 41.12 39.85 3k9t n ASP 268 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k9t s ALA 269 N -2.19 0.75 0.22 2.12 0.00 -1.26 -4.68 121.76 116.72 3k9t s ALA 269 Ca 0.33 -0.01 -0.07 0.00 0.00 0.00 0.00 51.96 52.20 3k9t s ALA 269 Cb 0.32 -3.25 0.33 0.00 0.00 0.00 0.00 23.12 20.53 3k9t s ALA 269 CO -0.06 -3.01 1.77 1.49 0.00 0.00 0.00 175.76 175.95 3k9t h GLU 270 N -2.03 0.55 -0.87 0.00 4.81 -1.97 -1.43 114.58 113.64 3k9t h GLU 270 Ca -0.53 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.66 3k9t h GLU 270 Cb 1.30 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 30.52 3k9t h GLU 270 CO 0.51 0.36 0.52 0.97 -0.73 0.00 0.00 179.01 180.64 3k9t h ILE 271 N 0.57 1.24 -0.28 2.32 6.09 -1.92 0.24 117.51 125.77 3k9t h ILE 271 Ca 0.35 -0.53 -0.01 0.00 -1.37 0.00 0.00 64.86 63.30 3k9t h ILE 271 Cb 0.38 0.02 -0.01 0.00 0.47 0.00 0.00 36.82 37.68 3k9t h ILE 271 CO -0.28 0.25 0.14 0.44 -3.07 0.00 0.00 178.15 175.64 3k9t h ASP 272 N 1.20 0.36 -0.63 2.19 3.32 -1.63 0.46 116.42 121.69 3k9t h ASP 272 Ca 0.31 -0.11 -0.08 0.00 0.02 0.00 0.00 57.03 57.18 3k9t h ASP 272 Cb -0.04 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 3k9t h ASP 272 CO -0.06 0.36 0.10 0.11 -1.72 0.00 0.00 179.24 178.03 3k9t h LYS 273 N 0.33 1.07 0.20 3.56 1.79 -0.84 -0.76 116.57 121.92 3k9t h LYS 273 Ca 0.10 -0.28 -0.01 0.00 -2.18 0.00 0.00 60.65 58.27 3k9t h LYS 273 Cb 0.09 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.62 3k9t h LYS 273 CO -0.01 0.98 -0.10 0.82 -1.08 0.00 0.00 179.45 180.06 3k9t h ILE 274 N 1.00 0.87 -0.97 1.86 2.04 -0.26 -2.17 117.51 119.88 3k9t h ILE 274 Ca 0.20 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.25 3k9t h ILE 274 Cb 0.44 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 3k9t h ILE 274 CO 0.01 0.17 0.64 0.58 0.00 0.00 0.00 178.15 179.55 3k9t h VAL 275 N -0.72 1.19 -0.03 1.67 2.07 -0.86 -1.34 116.25 118.23 3k9t h VAL 275 Ca -0.03 -0.43 -0.12 0.00 0.82 0.00 0.00 66.70 66.95 3k9t h VAL 275 Cb 0.49 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 3k9t h VAL 275 CO 0.05 0.23 -0.51 -0.33 0.02 0.00 0.00 177.57 177.02 3k9t h GLU 276 N 1.25 0.09 -0.21 1.57 5.08 -1.14 -1.74 114.58 119.48 3k9t h GLU 276 Ca 0.38 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.53 3k9t h GLU 276 Cb -0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 3k9t h GLU 276 CO -0.11 0.58 -0.51 -0.22 -1.00 0.00 0.00 179.01 177.76 3k9t h LYS 277 N 0.07 0.58 -0.15 2.33 1.63 -0.88 -3.05 116.57 117.11 3k9t h LYS 277 Ca -0.00 -0.34 -0.02 0.00 -0.85 0.00 0.00 60.65 59.44 3k9t h LYS 277 Cb 0.93 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.59 3k9t h LYS 277 CO 0.07 0.95 0.02 0.28 -3.45 0.00 0.00 179.45 177.32 3k9t h VAL 278 N 0.46 1.22 0.00 2.00 2.07 -0.99 -3.19 116.25 117.82 3k9t h VAL 278 Ca 0.02 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.83 3k9t h VAL 278 Cb 1.04 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 3k9t h VAL 278 CO 0.10 0.21 0.00 0.18 0.02 0.00 0.00 177.57 178.08 3k9t n LEU 279 N -4.80 0.04 0.00 2.57 4.77 -0.68 -1.92 117.00 116.98 3k9t n LEU 279 Ca -0.05 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 3k9t n LEU 279 Cb 0.18 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3k9t n LEU 279 CO 0.35 0.01 0.00 1.41 -1.33 0.00 0.00 177.39 177.83 3k9t n HIS 281 N 1.27 0.00 0.73 -1.77 8.25 -1.21 -4.35 115.22 118.14 3k9t n HIS 281 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.59 3k9t n HIS 281 Cb 0.01 0.00 0.47 0.00 1.12 0.00 0.00 29.99 31.59 3k9t n HIS 281 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3k9t n GLY 283 N 1.31 0.77 3.57 0.00 0.00 -1.26 -5.04 105.19 104.53 3k9t n GLY 283 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 3k9t n GLY 283 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k9t s SER 284 N -2.67 3.53 0.54 1.61 0.01 -1.26 -5.14 113.70 110.32 3k9t s SER 284 Ca 0.00 -1.34 -0.18 0.00 1.31 0.00 0.00 55.95 55.75 3k9t s SER 284 Cb 0.00 -0.32 -0.06 0.00 0.21 0.00 0.00 66.02 65.85 3k9t s SER 284 CO 0.00 -0.44 1.04 -1.61 0.41 0.00 0.00 173.24 172.64 3k9t s GLU 285 N -3.73 3.58 0.29 12.44 2.02 -1.26 -5.01 118.70 127.03 3k9t s GLU 285 Ca 0.35 1.24 -0.17 0.00 0.02 0.00 0.00 54.97 56.40 3k9t s GLU 285 Cb 0.08 -2.07 0.02 0.00 0.10 0.00 0.00 34.13 32.27 3k9t s GLU 285 CO 0.17 -0.60 0.67 1.52 0.02 0.00 0.00 175.26 177.03 3k9t s TYR 286 N -2.29 0.04 -0.00 1.61 1.13 -1.26 -4.01 117.35 112.57 3k9t s TYR 286 Ca 0.64 -0.51 -0.00 0.00 -1.41 0.00 0.00 57.07 55.79 3k9t s TYR 286 Cb -0.15 0.58 0.00 0.00 -1.10 0.00 0.00 41.96 41.29 3k9t s TYR 286 CO 0.30 -1.24 0.01 -0.47 -2.51 0.00 0.00 175.55 171.63 3k9t s TYR 287 N -3.62 -0.00 -0.08 -3.49 5.04 -0.57 -4.99 117.35 109.63 3k9t s TYR 287 Ca 0.15 0.02 0.02 0.00 -2.44 0.00 0.00 57.07 54.82 3k9t s TYR 287 Cb -0.04 -0.01 -0.02 0.00 0.35 0.00 0.00 41.96 42.24 3k9t s TYR 287 CO 0.09 -0.01 -0.13 0.08 -1.34 0.00 0.00 175.55 174.24 3k9t s VAL 288 N 0.04 3.14 0.14 3.14 1.01 -1.26 -1.14 120.40 125.46 3k9t s VAL 288 Ca -0.00 -0.67 0.10 0.00 0.00 0.00 0.00 61.98 61.41 3k9t s VAL 288 Cb -0.00 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 3k9t s VAL 288 CO -0.00 0.56 -0.25 0.00 0.00 0.00 0.00 175.10 175.42 3k9t s ALA 289 N -0.31 2.27 0.72 5.51 0.00 0.30 -4.95 121.76 125.30 3k9t s ALA 289 Ca 0.03 -1.46 -0.11 0.00 0.00 0.00 0.00 51.96 50.42 3k9t s ALA 289 Cb -0.13 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.68 3k9t s ALA 289 CO 0.03 0.47 1.08 -0.51 0.00 0.00 0.00 175.76 176.82 3k9t s ASP 290 N -2.17 5.24 0.53 0.00 1.01 -1.26 -1.65 116.67 118.37 3k9t s ASP 290 Ca 0.14 1.38 -0.22 0.00 0.71 0.00 0.00 52.55 54.55 3k9t s ASP 290 Cb -0.09 -2.22 -0.05 0.00 1.01 0.00 0.00 42.92 41.56 3k9t s ASP 290 CO 0.06 -1.50 1.36 0.12 0.21 0.00 0.00 175.17 175.43 3k9t s PHE 291 N -3.17 2.33 -0.05 4.23 5.36 -1.25 -4.57 117.98 120.87 3k9t s PHE 291 Ca 0.58 1.36 -0.05 0.00 -0.96 0.00 0.00 56.93 57.86 3k9t s PHE 291 Cb -0.13 -3.81 0.01 0.00 -0.34 0.00 0.00 43.02 38.75 3k9t s PHE 291 CO 0.54 -2.87 0.14 -0.59 -1.46 0.00 0.00 175.22 170.98 3k9t s PHE 292 N -1.29 -0.14 0.00 10.12 -0.71 -1.26 -5.02 117.98 119.68 3k9t s PHE 292 Ca 0.70 0.33 -0.03 0.00 -1.04 0.00 0.00 56.93 56.89 3k9t s PHE 292 Cb -0.41 0.04 -0.14 0.00 -1.21 0.00 0.00 43.02 41.31 3k9t s PHE 292 CO 0.49 -0.10 2.74 -0.35 -1.34 0.00 0.00 175.22 176.66 3k9t n PRO 293 N 2.85 1.46 -4.05 1.99 -0.04 -1.26 -4.75 135.00 131.20 3k9t n PRO 293 Ca -0.13 -0.51 -0.14 0.00 -0.04 0.00 0.00 63.50 62.68 3k9t n PRO 293 Cb 0.59 -1.53 -0.03 0.00 -0.04 0.00 0.00 33.50 32.48 3k9t n PRO 293 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 3k9t s TRP 294 N 0.64 0.92 0.00 0.54 -2.14 -1.26 -4.91 118.94 112.73 3k9t s TRP 294 Ca 0.34 -1.22 0.00 0.00 2.66 0.00 0.00 56.10 57.88 3k9t s TRP 294 Cb 0.16 0.05 0.00 0.00 -3.10 0.00 0.00 33.47 30.58 3k9t s TRP 294 CO 0.00 -1.20 0.00 0.41 -2.66 0.00 0.00 176.95 173.50 3k9t n GLY 295 N -0.56 0.74 0.00 3.67 0.00 -1.26 -4.83 105.19 102.96 3k9t n GLY 295 Ca -0.00 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.88 3k9t n GLY 295 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3k9t n SER 296 N 0.00 0.85 0.00 1.61 2.88 -1.26 -4.99 113.62 112.71 3k9t n SER 296 Ca 0.00 0.00 0.05 0.00 -1.33 0.00 0.00 58.87 57.59 3k9t n SER 296 Cb 0.00 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 63.69 3k9t n SER 296 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3k9t n ASP 297 N 0.00 0.00 0.24 -3.46 8.00 -1.26 -2.24 116.55 117.83 3k9t n ASP 297 Ca 0.00 0.18 0.15 0.00 0.71 0.00 0.00 54.79 55.83 3k9t n ASP 297 Cb 0.00 -0.30 0.82 0.00 -0.02 0.00 0.00 41.12 41.62 3k9t n ASP 297 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 3k9t h GLU 298 N 0.00 0.00 -0.99 -1.24 9.09 -1.92 -0.15 114.58 119.37 3k9t h GLU 298 Ca 0.00 0.00 0.04 0.00 0.05 0.00 0.00 59.36 59.45 3k9t h GLU 298 Cb 0.09 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 27.14 3k9t h GLU 298 CO 0.00 0.00 0.65 0.07 0.05 0.00 0.00 179.01 179.78 3k9t h ARG 299 N 0.00 1.22 -0.06 1.06 0.11 -1.77 0.97 114.38 115.91 3k9t h ARG 299 Ca 0.05 -0.07 -0.13 0.00 0.10 0.00 0.00 59.98 59.93 3k9t h ARG 299 Cb 0.24 -0.28 0.01 0.00 1.11 0.00 0.00 29.97 31.05 3k9t h ARG 299 CO -0.00 0.81 -0.46 1.96 0.10 0.00 0.00 179.97 182.38 3k9t h GLN 300 N 1.26 0.42 0.00 0.08 1.08 -1.30 -2.56 115.11 114.09 3k9t h GLN 300 Ca 0.39 -0.37 -0.03 0.00 -1.45 0.00 0.00 58.65 57.20 3k9t h GLN 300 Cb -0.00 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 27.51 3k9t h GLN 300 CO -0.12 1.02 -0.14 0.74 -0.95 0.00 0.00 178.83 179.37 3k9t h PHE 301 N -0.06 0.00 -0.36 2.96 0.04 -1.26 -2.49 116.94 115.78 3k9t h PHE 301 Ca -0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3k9t h PHE 301 Cb 1.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.28 3k9t h PHE 301 CO 0.13 0.14 0.00 0.43 -0.60 0.00 0.00 178.31 178.41 3k9t n SER 302 N -3.49 3.38 -4.46 2.17 7.64 0.32 -1.57 113.62 117.62 3k9t n SER 302 Ca -0.01 -1.97 -0.35 0.00 1.01 0.00 0.00 58.87 57.55 3k9t n SER 302 Cb 0.30 -0.23 0.09 0.00 -1.01 0.00 0.00 64.21 63.36 3k9t n SER 302 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3k9t n SER 303 N 1.43 -1.40 0.23 6.43 7.64 -0.94 -4.56 113.62 122.44 3k9t n SER 303 Ca 0.18 0.49 0.10 0.00 1.01 0.00 0.00 58.87 60.66 3k9t n SER 303 Cb 0.59 -1.23 0.48 0.00 -1.01 0.00 0.00 64.21 63.04 3k9t n SER 303 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3k9t h PRO 304 N -0.83 0.00 -0.00 1.43 0.13 -1.92 0.49 132.00 131.30 3k9t h PRO 304 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3k9t h PRO 304 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3k9t h PRO 304 CO 0.40 0.21 -0.21 0.41 -0.23 0.00 0.00 178.00 178.57 3k9t n GLY 305 N 0.11 -1.04 0.68 1.56 0.00 -1.26 -4.41 105.19 100.84 3k9t n GLY 305 Ca 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 46.02 45.71 3k9t n GLY 305 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3k9t n ILE 306 N -1.11 0.86 -3.24 -0.61 2.08 -0.87 -5.05 119.36 111.42 3k9t n ILE 306 Ca 0.11 0.27 -0.16 0.00 0.56 0.00 0.00 62.75 63.52 3k9t n ILE 306 Cb 0.31 -1.62 0.06 0.00 -0.75 0.00 0.00 39.64 37.64 3k9t n ILE 306 CO 0.00 0.00 0.00 -3.20 0.56 0.00 0.00 176.55 173.91 3k9t n ASN 307 N -3.36 -4.57 -4.94 4.38 5.15 0.11 -4.99 115.26 107.02 3k9t n ASN 307 Ca -0.03 -0.40 -0.24 0.00 -0.60 0.00 0.00 54.58 53.31 3k9t n ASN 307 Cb 0.12 -3.76 0.02 0.00 -0.53 0.00 0.00 39.78 35.64 3k9t n ASN 307 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3k9t s LEU 308 N -5.44 3.46 -0.83 1.20 1.43 -0.61 -5.01 118.68 112.88 3k9t s LEU 308 Ca 0.34 0.38 -0.16 0.00 -1.03 0.00 0.00 54.13 53.66 3k9t s LEU 308 Cb -0.15 -3.24 0.17 0.00 0.03 0.00 0.00 46.19 43.01 3k9t s LEU 308 CO 0.52 -0.88 0.87 -0.44 0.23 0.00 0.00 176.35 176.65 3k9t s SER 309 N -4.28 6.64 -0.14 2.29 0.01 -1.26 -4.55 113.70 112.42 3k9t s SER 309 Ca 0.51 -2.31 0.01 0.00 1.31 0.00 0.00 55.95 55.47 3k9t s SER 309 Cb -0.10 -2.28 0.02 0.00 0.21 0.00 0.00 66.02 63.86 3k9t s SER 309 CO 0.40 -0.81 -0.16 -0.69 0.41 0.00 0.00 173.24 172.40 3k9t s VAL 310 N 1.33 1.64 0.00 3.43 1.01 -1.26 -0.77 120.40 125.78 3k9t s VAL 310 Ca 0.22 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.51 3k9t s VAL 310 Cb -0.10 -1.51 0.00 0.00 0.00 0.00 0.00 36.38 34.76 3k9t s VAL 310 CO -0.07 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.11 3k9t n GLY 311 N 4.55 3.52 3.10 4.51 0.00 -0.58 -4.04 105.19 116.25 3k9t n GLY 311 Ca -0.18 -2.09 -0.10 0.00 0.00 0.00 0.00 46.02 43.65 3k9t n GLY 311 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3k9t s SER 312 N -0.58 0.09 -0.13 1.61 0.15 -0.68 -0.66 113.70 113.49 3k9t s SER 312 Ca 0.00 0.68 -0.03 0.00 0.70 0.00 0.00 55.95 57.30 3k9t s SER 312 Cb 0.00 1.08 -0.03 0.00 -1.71 0.00 0.00 66.02 65.36 3k9t s SER 312 CO 0.00 -0.25 -0.04 -0.22 1.20 0.00 0.00 173.24 173.93 3k9t s LEU 313 N 2.53 3.27 0.00 3.45 2.96 -1.22 -0.65 118.68 129.03 3k9t s LEU 313 Ca 0.02 -0.08 0.00 0.00 -0.22 0.00 0.00 54.13 53.85 3k9t s LEU 313 Cb -0.13 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 44.79 3k9t s LEU 313 CO -0.12 0.22 0.00 0.54 -1.32 0.00 0.00 176.35 175.67 3k9t n ARG 315 N 3.19 0.00 -2.29 1.98 1.74 0.49 -4.38 116.66 117.39 3k9t n ARG 315 Ca -0.18 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.47 3k9t n ARG 315 Cb 0.53 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.94 3k9t n ARG 315 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 3k9t s SER 316 N 0.21 6.26 0.59 0.55 0.01 -1.24 -3.58 113.70 116.50 3k9t s SER 316 Ca 0.00 0.90 -0.20 0.00 1.31 0.00 0.00 55.95 57.96 3k9t s SER 316 Cb 0.00 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.65 3k9t s SER 316 CO 0.00 -1.49 1.21 0.00 0.41 0.00 0.00 173.24 173.37 3k9t n TYR 318 N -1.50 0.64 0.00 0.00 0.18 -1.26 -2.07 117.16 113.16 3k9t n TYR 318 Ca 0.13 0.83 0.00 0.00 1.88 0.00 0.00 57.90 60.75 3k9t n TYR 318 Cb 0.46 -2.15 0.00 0.00 -0.38 0.00 0.00 39.34 37.28 3k9t n TYR 318 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3k9t n GLY 319 N 1.80 2.11 3.54 -7.48 0.00 -1.26 -5.10 105.19 98.80 3k9t n GLY 319 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 3k9t n GLY 319 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3k9t n PHE 320 N -0.79 -0.09 -1.82 1.61 1.16 -0.88 -4.84 117.46 111.81 3k9t n PHE 320 Ca 0.00 0.37 -0.42 0.00 -1.87 0.00 0.00 57.45 55.53 3k9t n PHE 320 Cb 0.00 -1.99 -0.03 0.00 -1.61 0.00 0.00 39.48 35.85 3k9t n PHE 320 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 3k9t s ASP 321 N -1.59 6.48 0.00 5.98 2.15 -1.26 -1.06 116.67 127.37 3k9t s ASP 321 Ca 0.69 2.41 0.00 0.00 0.43 0.00 0.00 52.55 56.08 3k9t s ASP 321 Cb -0.34 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.75 3k9t s ASP 321 CO 0.55 -1.06 0.00 0.61 -0.17 0.00 0.00 175.17 175.09 3k9t n GLY 322 N 4.45 0.24 3.75 2.66 0.00 -1.26 -4.94 105.19 110.10 3k9t n GLY 322 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 3k9t n GLY 322 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3k9t s TYR 323 N -2.00 2.40 -1.49 1.61 1.13 -0.22 -2.15 117.35 116.62 3k9t s TYR 323 Ca 0.00 1.53 -0.00 0.00 -1.41 0.00 0.00 57.07 57.18 3k9t s TYR 323 Cb 0.00 -3.45 0.00 0.00 -1.10 0.00 0.00 41.96 37.41 3k9t s TYR 323 CO 0.00 -2.17 0.04 0.72 -2.51 0.00 0.00 175.55 171.64 3k9t n HIS 324 N -1.71 -1.23 -4.15 -3.49 8.25 -1.26 -4.97 115.22 106.67 3k9t n HIS 324 Ca 0.13 0.04 -0.11 0.00 -0.26 0.00 0.00 57.72 57.52 3k9t n HIS 324 Cb 0.50 -3.53 -0.09 0.00 1.12 0.00 0.00 29.99 27.99 3k9t n HIS 324 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3k9t s THR 325 N -2.89 0.01 -1.11 1.59 -4.23 -0.91 -0.94 115.64 107.15 3k9t s THR 325 Ca 0.03 -1.85 0.07 0.00 -1.18 0.00 0.00 61.69 58.76 3k9t s THR 325 Cb -0.01 -2.39 0.08 0.00 1.34 0.00 0.00 72.50 71.51 3k9t s THR 325 CO 0.03 -0.03 1.20 -1.54 -0.54 0.00 0.00 174.62 173.74 3k9t n SER 326 N -0.28 0.00 0.18 3.99 3.41 -0.77 -1.85 113.62 118.29 3k9t n SER 326 Ca 0.01 0.42 0.02 0.00 -0.26 0.00 0.00 58.87 59.06 3k9t n SER 326 Cb 0.65 -0.44 0.33 0.00 -0.26 0.00 0.00 64.21 64.48 3k9t n SER 326 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k9t h ALA 327 N 2.28 1.23 0.00 7.33 0.00 -1.87 -3.31 119.26 124.92 3k9t h ALA 327 Ca 0.00 -0.38 -0.68 0.00 0.00 0.00 0.00 54.91 53.85 3k9t h ALA 327 Cb 0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3k9t h ALA 327 CO 0.00 0.53 2.89 -3.47 0.00 0.00 0.00 179.25 179.19 3k9t n ASP 328 N -3.93 3.67 -2.81 0.00 2.03 -0.77 -4.68 116.55 110.05 3k9t n ASP 328 Ca -0.02 -2.76 -0.08 0.00 0.52 0.00 0.00 54.79 52.45 3k9t n ASP 328 Cb 0.46 -1.46 -0.01 0.00 -0.72 0.00 0.00 41.12 39.39 3k9t n ASP 328 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 3k9t n ASN 329 N 6.39 1.84 -0.30 1.67 0.23 -1.25 -1.03 115.26 122.80 3k9t n ASN 329 Ca 0.52 -1.59 -0.01 0.00 -0.53 0.00 0.00 54.58 52.97 3k9t n ASN 329 Cb 0.38 0.03 0.11 0.00 -2.08 0.00 0.00 39.78 38.23 3k9t n ASN 329 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 3k9t h LEU 330 N 0.00 0.87 -0.61 -4.53 3.38 -1.92 -0.42 115.31 112.08 3k9t h LEU 330 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3k9t h LEU 330 Cb 0.37 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3k9t h LEU 330 CO 0.18 0.59 0.00 0.00 0.09 0.00 0.00 178.44 179.30 3k9t n TYR 332 N -2.01 1.78 -3.48 0.00 9.36 -0.17 -5.10 117.16 117.54 3k9t n TYR 332 Ca 0.02 -2.61 0.02 0.00 3.32 0.00 0.00 57.90 58.64 3k9t n TYR 332 Cb 0.16 -2.15 -0.05 0.00 -0.63 0.00 0.00 39.34 36.66 3k9t n TYR 332 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3k9t s ASN 334 N 1.87 -0.21 0.29 2.98 3.84 -0.02 -4.36 114.94 119.33 3k9t s ASN 334 Ca 0.67 0.32 -0.01 0.00 0.21 0.00 0.00 52.86 54.05 3k9t s ASN 334 Cb 0.23 1.16 0.43 0.00 -0.55 0.00 0.00 41.25 42.52 3k9t s ASN 334 CO -0.05 -0.05 1.87 0.11 -2.79 0.00 0.00 177.10 176.19 3k9t h LYS 335 N 6.17 0.88 -0.00 0.43 1.57 -1.89 -1.02 116.57 122.71 3k9t h LYS 335 Ca -0.21 -0.14 -0.11 0.00 -1.87 0.00 0.00 60.65 58.31 3k9t h LYS 335 Cb 1.15 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.29 3k9t h LYS 335 CO 0.16 0.72 -0.54 -0.44 -0.57 0.00 0.00 179.45 178.78 3k9t h ASP 336 N 0.87 0.00 -0.01 0.86 3.32 -1.93 0.29 116.42 119.84 3k9t h ASP 336 Ca 0.21 -0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 3k9t h ASP 336 Cb 0.17 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 3k9t h ASP 336 CO -0.02 0.54 -0.00 1.23 -1.72 0.00 0.00 179.24 179.27 3k9t h GLY 337 N 1.62 0.02 0.99 2.75 0.00 -1.57 0.16 103.07 107.03 3k9t h GLY 337 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.31 3k9t h GLY 337 CO 0.07 0.01 0.20 1.41 0.00 0.00 0.00 176.54 178.24 3k9t h LEU 338 N -0.41 0.38 -0.59 3.11 3.38 -1.06 0.92 115.31 121.05 3k9t h LEU 338 Ca 0.00 -0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.01 3k9t h LEU 338 Cb 0.43 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 3k9t h LEU 338 CO 0.00 0.31 0.24 0.00 0.09 0.00 0.00 178.44 179.08 3k9t h ALA 339 N 1.09 0.75 -0.28 1.53 0.00 -0.39 -1.07 119.26 120.90 3k9t h ALA 339 Ca 0.12 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 3k9t h ALA 339 Cb -0.01 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3k9t h ALA 339 CO -0.02 -0.16 -0.38 0.22 0.00 0.00 0.00 179.25 178.91 3k9t h ASP 340 N 0.44 0.81 -0.98 0.00 3.58 -0.25 -1.14 116.42 118.88 3k9t h ASP 340 Ca 0.29 -0.50 0.01 0.00 0.42 0.00 0.00 57.03 57.24 3k9t h ASP 340 Cb 0.31 -0.23 -0.05 0.00 1.72 0.00 0.00 39.33 41.08 3k9t h ASP 340 CO -0.26 1.16 0.65 0.28 -2.88 0.00 0.00 179.24 178.18 3k9t h SER 341 N 0.49 1.13 -0.16 2.28 0.02 -0.60 -0.88 113.55 115.83 3k9t h SER 341 Ca 0.03 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 3k9t h SER 341 Cb 0.97 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 3k9t h SER 341 CO 0.09 0.82 -0.02 0.22 -1.14 0.00 0.00 176.83 176.80 3k9t h TYR 342 N 1.34 0.33 -0.79 3.45 3.20 -1.01 -1.54 116.97 121.94 3k9t h TYR 342 Ca 0.36 -0.07 0.11 0.00 3.14 0.00 0.00 58.73 62.27 3k9t h TYR 342 Cb -0.15 -0.08 -0.08 0.00 1.54 0.00 0.00 36.73 37.96 3k9t h TYR 342 CO -0.00 0.55 0.42 -0.22 -1.64 0.00 0.00 178.16 177.27 3k9t h LYS 343 N 0.02 0.66 -0.30 1.82 3.64 -1.13 -0.80 116.57 120.48 3k9t h LYS 343 Ca 0.04 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 3k9t h LYS 343 Cb 0.43 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3k9t h LYS 343 CO 0.01 0.43 -0.16 1.15 -2.27 0.00 0.00 179.45 178.61 3k9t h THR 344 N 0.67 1.30 -0.53 1.00 2.02 -0.88 -0.36 112.91 116.14 3k9t h THR 344 Ca 0.40 -1.28 0.01 0.00 0.77 0.00 0.00 66.41 66.31 3k9t h THR 344 Cb 0.45 1.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.32 3k9t h THR 344 CO -0.29 0.41 0.34 1.88 0.37 0.00 0.00 175.52 178.23 3k9t h TYR 345 N 0.39 0.65 -0.62 3.16 -1.99 -1.06 0.98 116.97 118.48 3k9t h TYR 345 Ca 0.06 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.79 3k9t h TYR 345 Cb 0.69 -0.22 -0.03 0.00 2.00 0.00 0.00 36.73 39.18 3k9t h TYR 345 CO 0.06 0.40 0.29 -0.07 -0.00 0.00 0.00 178.16 178.84 3k9t h LEU 346 N 0.70 0.80 -0.54 3.88 3.38 -0.82 -0.98 115.31 121.72 3k9t h LEU 346 Ca 0.20 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.94 3k9t h LEU 346 Cb -0.07 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3k9t h LEU 346 CO -0.05 0.69 -0.32 -0.08 0.09 0.00 0.00 178.44 178.77 3k9t h GLU 347 N 0.88 0.84 -0.32 1.13 4.57 -0.46 0.26 114.58 121.48 3k9t h GLU 347 Ca 0.22 -0.39 0.03 0.00 -1.18 0.00 0.00 59.36 58.04 3k9t h GLU 347 Cb 0.11 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.66 3k9t h GLU 347 CO -0.03 1.03 0.11 0.28 -1.18 0.00 0.00 179.01 179.23 3k9t h VAL 348 N 0.70 0.91 -0.35 0.32 2.07 -0.46 -0.51 116.25 118.94 3k9t h VAL 348 Ca 0.08 -0.09 -0.07 0.00 0.82 0.00 0.00 66.70 67.44 3k9t h VAL 348 Cb 0.87 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 3k9t h VAL 348 CO 0.08 0.05 -0.04 0.40 0.02 0.00 0.00 177.57 178.07 3k9t h ILE 349 N 0.25 1.27 -0.88 4.57 2.04 -0.70 0.19 117.51 124.24 3k9t h ILE 349 Ca 0.14 -1.06 0.13 0.00 1.00 0.00 0.00 64.86 65.07 3k9t h ILE 349 Cb 0.11 1.25 -0.09 0.00 -0.74 0.00 0.00 36.82 37.35 3k9t h ILE 349 CO -0.14 0.35 0.50 0.22 0.00 0.00 0.00 178.15 179.07 3k9t h TYR 350 N 0.44 0.89 -0.27 1.37 5.03 -0.41 -0.83 116.97 123.19 3k9t h TYR 350 Ca 0.09 0.03 -0.08 0.00 2.58 0.00 0.00 58.73 61.36 3k9t h TYR 350 Cb 0.52 -0.26 -0.01 0.00 1.55 0.00 0.00 36.73 38.53 3k9t h TYR 350 CO 0.04 0.29 -0.15 1.15 -1.32 0.00 0.00 178.16 178.17 3k9t h THR 351 N 0.75 1.30 -0.44 1.81 2.02 -0.04 -1.84 112.91 116.46 3k9t h THR 351 Ca 0.46 -1.25 0.06 0.00 0.77 0.00 0.00 66.41 66.45 3k9t h THR 351 Cb 0.55 1.53 -0.06 0.00 -1.74 0.00 0.00 68.15 68.44 3k9t h THR 351 CO -0.31 0.39 0.12 0.40 0.37 0.00 0.00 175.52 176.50 3k9t h ILE 352 N 0.31 0.81 -0.43 3.11 2.04 -0.60 -1.86 117.51 120.90 3k9t h ILE 352 Ca 0.06 -0.09 -0.15 0.00 1.00 0.00 0.00 64.86 65.68 3k9t h ILE 352 Cb 0.67 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 3k9t h ILE 352 CO 0.04 0.05 -0.32 -0.33 0.00 0.00 0.00 178.15 177.59 3k9t h GLU 353 N 0.27 0.97 -0.60 2.37 4.39 -1.04 -3.26 114.58 117.67 3k9t h GLU 353 Ca 0.21 -0.47 0.00 0.00 0.34 0.00 0.00 59.36 59.44 3k9t h GLU 353 Cb 0.24 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 3k9t h GLU 353 CO -0.25 1.14 0.00 0.09 -1.16 0.00 0.00 179.01 178.83 3k9t n ASN 354 N -4.08 3.38 -3.75 1.42 3.02 -0.70 -4.76 115.26 109.80 3k9t n ASN 354 Ca -0.01 -2.11 -0.42 0.00 -0.03 0.00 0.00 54.58 52.01 3k9t n ASN 354 Cb 0.51 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 3k9t n ASN 354 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3k9t n ASN 355 N 1.11 3.93 -4.93 6.41 5.15 -0.71 -4.91 115.26 121.32 3k9t n ASN 355 Ca 0.20 -2.85 -0.26 0.00 -0.60 0.00 0.00 54.58 51.07 3k9t n ASN 355 Cb 0.57 -1.65 0.07 0.00 -0.53 0.00 0.00 39.78 38.23 3k9t n ASN 355 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3k9t s ARG 356 N 3.09 2.27 -0.06 1.20 0.52 -1.26 -4.70 118.95 120.01 3k9t s ARG 356 Ca 0.47 -0.21 0.05 0.00 -0.52 0.00 0.00 55.73 55.52 3k9t s ARG 356 Cb 0.14 -2.17 -0.01 0.00 0.52 0.00 0.00 34.95 33.43 3k9t s ARG 356 CO -0.08 -1.20 -0.22 0.99 0.02 0.00 0.00 175.30 174.81 3k9t s THR 357 N -3.23 1.86 0.24 0.02 2.01 -1.26 -1.59 115.64 113.67 3k9t s THR 357 Ca 0.60 -0.94 0.07 0.00 0.31 0.00 0.00 61.69 61.72 3k9t s THR 357 Cb -0.11 -1.59 -0.05 0.00 0.01 0.00 0.00 72.50 70.76 3k9t s THR 357 CO 0.45 0.52 -0.10 -0.31 -0.69 0.00 0.00 174.62 174.49 3k9t s TYR 358 N 0.02 1.79 -0.15 4.92 2.02 -1.26 -1.66 117.35 123.03 3k9t s TYR 358 Ca -0.07 -0.65 0.02 0.00 -0.37 0.00 0.00 57.07 55.99 3k9t s TYR 358 Cb -0.14 -0.93 0.01 0.00 -0.40 0.00 0.00 41.96 40.50 3k9t s TYR 358 CO 0.04 0.29 -0.19 -1.17 -1.57 0.00 0.00 175.55 172.95 3k9t s LEU 359 N -3.36 2.25 -0.06 -1.29 2.96 0.62 -2.99 118.68 116.80 3k9t s LEU 359 Ca 0.26 -0.55 -0.30 0.00 -0.22 0.00 0.00 54.13 53.32 3k9t s LEU 359 Cb 0.02 -1.49 -0.06 0.00 0.50 0.00 0.00 46.19 45.15 3k9t s LEU 359 CO 0.09 0.08 1.80 0.21 -1.32 0.00 0.00 176.35 177.21 3k9t s ASN 360 N 0.83 6.45 0.00 3.68 3.84 -0.30 -0.94 114.94 128.50 3k9t s ASN 360 Ca -0.06 2.26 0.31 0.00 0.21 0.00 0.00 52.86 55.57 3k9t s ASN 360 Cb -0.15 -2.53 1.58 0.00 -0.55 0.00 0.00 41.25 39.60 3k9t s ASN 360 CO -0.02 -1.11 2.08 0.18 -2.79 0.00 0.00 177.10 175.45 3k9t n LEU 361 N 7.85 0.03 -3.16 3.21 4.77 0.44 -3.81 117.00 126.34 3k9t n LEU 361 Ca 0.19 0.21 -0.24 0.00 -0.03 0.00 0.00 56.01 56.15 3k9t n LEU 361 Cb 0.43 -0.22 -0.05 0.00 -2.33 0.00 0.00 43.42 41.24 3k9t n LEU 361 CO 0.65 0.01 -0.07 -3.20 -1.33 0.00 0.00 177.39 173.45 3k9t n ASN 362 N -1.21 2.41 0.23 -1.43 5.15 -1.26 -4.96 115.26 114.18 3k9t n ASN 362 Ca 0.16 -3.24 0.11 0.00 -0.60 0.00 0.00 54.58 51.01 3k9t n ASN 362 Cb 0.22 -0.62 0.42 0.00 -0.53 0.00 0.00 39.78 39.27 3k9t n ASN 362 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3k9t h PRO 363 N 3.42 0.00 -6.27 1.20 0.13 -1.95 -3.41 132.00 125.11 3k9t h PRO 363 Ca 0.12 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.70 3k9t h PRO 363 Cb 0.75 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.79 3k9t h PRO 363 CO 0.66 0.16 1.18 0.15 -0.23 0.00 0.00 178.00 179.92 3k9t s LYS 364 N -3.50 3.26 0.41 0.86 1.02 -1.26 -4.79 119.74 115.75 3k9t s LYS 364 Ca 0.02 -0.43 0.00 0.00 0.02 0.00 0.00 55.97 55.58 3k9t s LYS 364 Cb 0.09 -4.51 0.00 0.00 -0.52 0.00 0.00 37.83 32.89 3k9t s LYS 364 CO 0.63 -2.21 0.00 0.00 -0.92 0.00 0.00 175.35 172.85 3k9t s GLU 366 N -3.14 3.33 0.63 0.00 -1.05 -1.26 -4.96 118.70 112.25 3k9t s GLU 366 Ca 0.00 1.26 -0.14 0.00 -0.15 0.00 0.00 54.97 55.94 3k9t s GLU 366 Cb 0.00 -2.03 -0.02 0.00 -0.44 0.00 0.00 34.13 31.64 3k9t s GLU 366 CO 0.00 -0.81 1.06 -1.25 0.95 0.00 0.00 175.26 175.21 3k9t s PRO 367 N -3.93 3.16 -1.27 -4.83 0.04 -1.26 -4.92 135.00 121.99 3k9t s PRO 367 Ca 0.65 1.13 -0.19 0.00 0.04 0.00 0.00 61.00 62.63 3k9t s PRO 367 Cb -0.17 -2.01 0.05 0.00 0.04 0.00 0.00 34.50 32.41 3k9t s PRO 367 CO 0.35 -0.94 1.74 -1.14 0.04 0.00 0.00 177.00 177.05 3k9t s GLN 368 N -4.39 3.79 -0.00 4.56 0.74 -1.26 -4.93 119.66 118.17 3k9t s GLN 368 Ca 0.62 -1.84 -0.34 0.00 0.05 0.00 0.00 55.36 53.85 3k9t s GLN 368 Cb -0.16 -5.49 -0.12 0.00 1.10 0.00 0.00 33.01 28.34 3k9t s GLN 368 CO 0.43 -2.45 1.81 1.28 -0.55 0.00 0.00 175.29 175.81 3k9t n LEU 369 N 9.11 3.47 0.00 3.68 4.77 -1.26 -2.34 117.00 134.43 3k9t n LEU 369 Ca 0.47 0.99 0.00 0.00 -0.03 0.00 0.00 56.01 57.45 3k9t n LEU 369 Cb 0.46 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 3k9t n LEU 369 CO 0.75 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 3k9t n GLY 370 N 4.16 1.27 0.06 -0.72 0.00 -1.26 -4.95 105.19 103.75 3k9t n GLY 370 Ca 0.21 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.32 3k9t n GLY 370 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k9t n LYS 371 N 0.00 0.09 0.00 1.61 5.02 -0.99 -4.22 118.16 119.68 3k9t n LYS 371 Ca 0.00 0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 3k9t n LYS 371 Cb 0.00 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 33.34 3k9t n LYS 371 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3k9t n ARG 372 N -1.84 2.72 -2.57 1.97 1.74 -1.26 -5.19 116.66 112.22 3k9t n ARG 372 Ca 0.03 -0.03 -0.03 0.00 -0.77 0.00 0.00 57.85 57.05 3k9t n ARG 372 Cb 0.20 -0.30 -0.02 0.00 -1.02 0.00 0.00 32.46 31.32 3k9t n ARG 372 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k9t n GLY 373 N 0.40 -3.97 0.17 -0.13 0.00 -1.26 -4.97 105.19 95.43 3k9t n GLY 373 Ca 0.00 0.89 0.00 0.00 0.00 0.00 0.00 46.02 46.91 3k9t n GLY 373 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3k9t n ASP 387 N 1.94 0.00 0.17 1.61 2.03 -1.26 -5.00 116.55 116.04 3k9t n ASP 387 Ca -0.20 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.13 3k9t n ASP 387 Cb 0.31 0.00 0.28 0.00 -0.72 0.00 0.00 41.12 41.00 3k9t n ASP 387 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 3k9t h GLU 388 N 0.16 0.00 -0.02 -0.67 4.11 -2.03 -3.17 114.58 112.97 3k9t h GLU 388 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k9t h GLU 388 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 3k9t h GLU 388 CO 0.00 0.47 -0.00 0.74 0.07 0.00 0.00 179.01 180.29 3k9t h PHE 389 N 0.00 0.05 0.00 2.06 0.04 -2.05 -1.51 116.94 115.52 3k9t h PHE 389 Ca -0.00 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3k9t h PHE 389 Cb 0.90 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.04 3k9t h PHE 389 CO 0.00 0.34 0.00 0.00 -0.60 0.00 0.00 178.31 178.05 3k9t n ALA 390 N -2.26 0.95 0.00 2.45 0.00 -1.20 -2.36 120.51 118.09 3k9t n ALA 390 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3k9t n ALA 390 Cb 0.18 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 18.92 3k9t n ALA 390 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3k9t n PHE 392 N 0.69 0.00 -0.08 0.00 3.72 -0.57 -1.70 117.46 119.52 3k9t n PHE 392 Ca 0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.30 3k9t n PHE 392 Cb 0.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 3k9t n PHE 392 CO 0.00 0.00 0.00 -1.49 -0.05 0.00 0.00 176.76 175.22 3k9t h TRP 393 N 0.00 0.40 -0.61 1.38 4.06 -1.74 -1.14 115.95 118.30 3k9t h TRP 393 Ca 0.00 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.91 3k9t h TRP 393 Cb 0.00 -0.12 -0.03 0.00 -1.00 0.00 0.00 29.16 28.01 3k9t h TRP 393 CO 0.00 0.40 0.35 0.28 -3.56 0.00 0.00 178.44 175.91 3k9t h VAL 394 N 0.29 1.19 -0.64 1.49 2.07 -1.62 -2.57 116.25 116.45 3k9t h VAL 394 Ca 0.09 -0.45 -0.09 0.00 0.82 0.00 0.00 66.70 67.07 3k9t h VAL 394 Cb 0.16 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 3k9t h VAL 394 CO -0.01 0.20 0.05 -0.07 0.02 0.00 0.00 177.57 177.76 3k9t h LEU 395 N 0.82 1.07 -0.73 2.57 3.38 -1.82 -1.84 115.31 118.76 3k9t h LEU 395 Ca 0.22 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3k9t h LEU 395 Cb 0.01 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.47 3k9t h LEU 395 CO -0.04 1.09 0.00 -3.20 0.09 0.00 0.00 178.44 176.38 3k9t n ASN 396 N -4.19 0.48 -3.19 -0.43 2.85 -0.44 -4.79 115.26 105.55 3k9t n ASN 396 Ca 0.04 -1.32 -0.22 0.00 -0.11 0.00 0.00 54.58 52.97 3k9t n ASN 396 Cb 0.32 -0.24 0.01 0.00 1.24 0.00 0.00 39.78 41.11 3k9t n ASN 396 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 3k9t n SER 398 N -0.01 -3.56 -0.90 1.20 7.64 -0.69 -5.09 113.62 112.21 3k9t n SER 398 Ca 0.00 -0.49 0.11 0.00 1.01 0.00 0.00 58.87 59.50 3k9t n SER 398 Cb 0.12 -1.13 0.27 0.00 -1.01 0.00 0.00 64.21 62.47 3k9t n SER 398 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3k9t n ASP 399 N -1.04 2.70 0.00 6.43 5.68 -1.26 -1.15 116.55 127.91 3k9t n ASP 399 Ca -0.17 -1.88 0.00 0.00 -0.50 0.00 0.00 54.79 52.24 3k9t n ASP 399 Cb 0.49 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 3k9t n ASP 399 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3k9t n GLY 400 N 1.34 1.40 0.01 6.12 0.00 -1.16 -4.90 105.19 108.00 3k9t n GLY 400 Ca 0.18 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 3k9t n GLY 400 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k9t n LYS 401 N -1.88 0.51 -3.75 1.61 5.02 -1.26 -4.87 118.16 113.55 3k9t n LYS 401 Ca 0.00 -0.15 -0.35 0.00 -2.02 0.00 0.00 58.31 55.78 3k9t n LYS 401 Cb 0.00 -1.40 -0.08 0.00 -0.02 0.00 0.00 35.03 33.52 3k9t n LYS 401 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3k9t s ASN 402 N -3.95 6.12 0.69 4.39 0.01 -1.26 -5.09 114.94 115.85 3k9t s ASN 402 Ca -0.06 0.19 -0.10 0.00 -0.71 0.00 0.00 52.86 52.18 3k9t s ASN 402 Cb 0.11 -2.08 0.02 0.00 0.41 0.00 0.00 41.25 39.71 3k9t s ASN 402 CO 0.71 0.16 1.07 -0.94 -1.51 0.00 0.00 177.10 176.58 3k9t s SER 403 N 0.49 5.36 0.43 -1.22 1.04 -1.26 -4.26 113.70 114.27 3k9t s SER 403 Ca 0.07 0.99 0.10 0.00 0.48 0.00 0.00 55.95 57.60 3k9t s SER 403 Cb -0.12 -1.79 0.94 0.00 0.10 0.00 0.00 66.02 65.15 3k9t s SER 403 CO -0.01 -1.35 2.03 -0.07 0.98 0.00 0.00 173.24 174.82 3k9t h LEU 404 N -0.60 0.25 -0.72 2.42 3.38 -1.57 -1.67 115.31 116.79 3k9t h LEU 404 Ca -0.45 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.39 3k9t h LEU 404 Cb 1.26 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 3k9t h LEU 404 CO 0.63 0.27 -0.12 0.25 0.09 0.00 0.00 178.44 179.56 3k9t h LEU 405 N 0.28 0.85 -0.76 1.67 5.85 -1.91 0.18 115.31 121.47 3k9t h LEU 405 Ca 0.07 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 3k9t h LEU 405 Cb 0.13 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 3k9t h LEU 405 CO -0.00 0.98 0.45 0.44 -0.34 0.00 0.00 178.44 179.97 3k9t h ASP 406 N 0.77 0.92 -0.19 1.25 3.32 -1.69 0.58 116.42 121.37 3k9t h ASP 406 Ca 0.12 -0.07 -0.18 0.00 0.02 0.00 0.00 57.03 56.93 3k9t h ASP 406 Cb 0.63 -0.23 0.01 0.00 0.22 0.00 0.00 39.33 39.96 3k9t h ASP 406 CO 0.04 0.72 -0.57 0.40 -1.72 0.00 0.00 179.24 178.11 3k9t h ILE 407 N 1.04 1.31 -0.51 0.35 2.04 -0.97 -0.53 117.51 120.23 3k9t h ILE 407 Ca 0.27 -1.80 0.00 0.00 1.00 0.00 0.00 64.86 64.34 3k9t h ILE 407 Cb -0.02 1.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 3k9t h ILE 407 CO -0.05 0.56 0.33 0.00 0.00 0.00 0.00 178.15 179.00 3k9t h ALA 408 N 0.58 0.65 0.52 1.87 0.00 -0.38 0.14 119.26 122.64 3k9t h ALA 408 Ca -0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3k9t h ALA 408 Cb 1.19 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.78 3k9t h ALA 408 CO 0.12 0.11 -0.25 1.88 0.00 0.00 0.00 179.25 181.11 3k9t h TYR 409 N 0.69 -0.64 -0.81 0.00 0.05 -0.74 -1.32 116.97 114.20 3k9t h TYR 409 Ca 0.19 -0.02 0.04 0.00 0.05 0.00 0.00 58.73 58.99 3k9t h TYR 409 Cb -0.06 0.21 -0.05 0.00 1.01 0.00 0.00 36.73 37.85 3k9t h TYR 409 CO -0.04 -0.35 0.51 -0.22 -1.05 0.00 0.00 178.16 177.01 3k9t h LYS 410 N -0.81 0.96 0.00 4.88 1.63 -0.92 -1.96 116.57 120.36 3k9t h LYS 410 Ca -0.07 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 3k9t h LYS 410 Cb 0.58 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 3k9t h LYS 410 CO 0.12 0.63 0.00 0.66 -3.45 0.00 0.00 179.45 177.41 3k9t h SER 411 N 0.99 0.00 -4.10 4.20 4.64 -0.72 -3.51 113.55 115.05 3k9t h SER 411 Ca 0.33 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.61 3k9t h SER 411 Cb 0.03 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.15 3k9t h SER 411 CO -0.12 0.00 -0.11 0.61 -0.87 0.00 0.00 176.83 176.34 3k9t n GLY 412 N 0.35 -0.53 3.83 -0.77 0.00 -0.50 -5.06 105.19 102.51 3k9t n GLY 412 Ca 0.02 0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 3k9t n GLY 412 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3k9t s GLU 414 N -3.18 3.22 0.11 1.61 -6.30 -1.26 -5.02 118.70 107.88 3k9t s GLU 414 Ca 0.06 -0.39 -0.21 0.00 -2.50 0.00 0.00 54.97 51.93 3k9t s GLU 414 Cb -0.01 -2.97 -0.11 0.00 0.00 0.00 0.00 34.13 31.04 3k9t s GLU 414 CO 0.34 0.67 1.75 0.35 0.02 0.00 0.00 175.26 178.40 3k9t h PHE 415 N 4.16 0.10 -0.36 5.30 3.57 -1.92 -2.32 116.94 125.46 3k9t h PHE 415 Ca -0.50 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.06 3k9t h PHE 415 Cb 1.19 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.88 3k9t h PHE 415 CO 0.66 0.06 0.25 0.00 -2.23 0.00 0.00 178.31 177.05 3k9t h ARG 416 N 0.11 0.23 -0.66 1.11 3.08 -1.99 -0.81 114.38 115.44 3k9t h ARG 416 Ca 0.04 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 3k9t h ARG 416 Cb -0.00 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.96 3k9t h ARG 416 CO -0.02 0.15 0.34 -0.09 -1.07 0.00 0.00 179.97 179.29 3k9t h ARG 417 N 0.24 0.94 -0.44 0.04 2.43 -1.86 -0.41 114.38 115.32 3k9t h ARG 417 Ca 0.16 -0.13 -0.07 0.00 -0.81 0.00 0.00 59.98 59.13 3k9t h ARG 417 Cb 0.34 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 3k9t h ARG 417 CO -0.03 0.73 -0.00 0.82 -1.51 0.00 0.00 179.97 179.98 3k9t h ILE 418 N 0.91 1.26 -0.15 1.20 1.08 -1.22 -1.96 117.51 118.63 3k9t h ILE 418 Ca 0.23 -1.04 -0.01 0.00 -0.39 0.00 0.00 64.86 63.65 3k9t h ILE 418 Cb 0.08 1.06 -0.01 0.00 -3.07 0.00 0.00 36.82 34.88 3k9t h ILE 418 CO -0.03 0.36 0.07 0.50 -0.69 0.00 0.00 178.15 178.36 3k9t h LYS 419 N 0.63 0.22 -0.06 2.37 3.11 -0.73 -0.44 116.57 121.66 3k9t h LYS 419 Ca 0.13 -0.03 -0.11 0.00 -2.81 0.00 0.00 60.65 57.83 3k9t h LYS 419 Cb 0.50 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.67 3k9t h LYS 419 CO 0.02 0.27 -0.44 1.88 -2.81 0.00 0.00 179.45 178.37 3k9t h TYR 420 N 0.11 0.16 -0.32 1.91 0.05 -1.13 0.99 116.97 118.74 3k9t h TYR 420 Ca 0.05 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 3k9t h TYR 420 Cb 0.13 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 3k9t h TYR 420 CO -0.03 0.56 0.07 0.00 -1.05 0.00 0.00 178.16 177.71 3k9t h ALA 421 N 1.43 0.43 -0.57 3.88 0.00 -0.91 -2.30 119.26 121.22 3k9t h ALA 421 Ca 0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 3k9t h ALA 421 Cb 0.83 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 3k9t h ALA 421 CO 0.06 0.11 0.25 0.00 0.00 0.00 0.00 179.25 179.67 3k9t h ALA 422 N 0.90 1.38 0.34 0.00 0.00 -0.73 -2.26 119.26 118.89 3k9t h ALA 422 Ca 0.10 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3k9t h ALA 422 Cb 0.32 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3k9t h ALA 422 CO 0.00 0.48 -0.20 -0.44 0.00 0.00 0.00 179.25 179.09 3k9t h ASP 423 N 0.80 -0.50 -0.89 0.00 3.32 -0.55 -1.10 116.42 117.50 3k9t h ASP 423 Ca 0.20 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.33 3k9t h ASP 423 Cb 0.12 0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.75 3k9t h ASP 423 CO -0.02 -0.33 0.56 0.00 -1.72 0.00 0.00 179.24 177.74 3k9t h ALA 424 N 0.13 1.22 -0.24 3.45 0.00 -1.16 -1.32 119.26 121.33 3k9t h ALA 424 Ca -0.04 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 3k9t h ALA 424 Cb 0.42 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3k9t h ALA 424 CO 0.04 0.35 -0.39 -0.07 0.00 0.00 0.00 179.25 179.18 3k9t h LEU 425 N 1.05 0.60 -0.79 0.00 3.38 -1.28 -2.82 115.31 115.44 3k9t h LEU 425 Ca 0.38 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3k9t h LEU 425 Cb 0.13 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3k9t h LEU 425 CO -0.16 0.92 0.23 0.22 0.09 0.00 0.00 178.44 179.75 3k9t h TYR 426 N 0.47 1.18 -0.61 1.13 3.20 -0.15 -1.41 116.97 120.77 3k9t h TYR 426 Ca 0.04 -0.12 0.02 0.00 3.14 0.00 0.00 58.73 61.81 3k9t h TYR 426 Cb 0.89 -0.34 -0.04 0.00 1.54 0.00 0.00 36.73 38.78 3k9t h TYR 426 CO 0.04 0.93 0.39 0.00 -1.64 0.00 0.00 178.16 177.88 3k9t h ARG 427 N 1.10 0.76 -0.32 1.82 3.08 -1.13 -1.15 114.38 118.54 3k9t h ARG 427 Ca 0.24 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.24 3k9t h ARG 427 Cb 0.30 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3k9t h ARG 427 CO -0.01 0.50 0.00 1.33 -1.07 0.00 0.00 179.97 180.73 3k9t n VAL 428 N -4.69 0.36 -2.03 2.04 0.24 -1.08 -4.90 118.33 108.26 3k9t n VAL 428 Ca 0.05 -0.29 -0.13 0.00 -2.04 0.00 0.00 64.34 61.92 3k9t n VAL 428 Cb 0.05 0.04 -0.02 0.00 -1.47 0.00 0.00 33.84 32.44 3k9t n VAL 428 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3k9t n GLU 429 N 0.11 -1.04 0.00 7.34 1.02 -0.44 -4.90 120.64 122.75 3k9t n GLU 429 Ca 0.07 0.73 0.14 0.00 -0.02 0.00 0.00 57.16 58.08 3k9t n GLU 429 Cb 0.23 -4.93 0.49 0.00 -0.02 0.00 0.00 31.44 27.21 3k9t n GLU 429 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3k9t n LEU 430 N -1.82 1.02 -4.03 -4.62 4.77 -0.56 -4.81 117.00 106.94 3k9t n LEU 430 Ca -0.15 -0.27 -0.17 0.00 -0.03 0.00 0.00 56.01 55.38 3k9t n LEU 430 Cb 0.57 -0.09 -0.14 0.00 -2.33 0.00 0.00 43.42 41.44 3k9t n LEU 430 CO 0.19 0.18 -0.43 -0.76 -1.33 0.00 0.00 177.39 175.25 3k9t s LEU 431 N -2.32 2.08 -0.05 2.23 1.43 -1.25 -0.42 118.68 120.38 3k9t s LEU 431 Ca 0.30 -0.26 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 3k9t s LEU 431 Cb 0.20 -0.39 -0.03 0.00 0.03 0.00 0.00 46.19 46.01 3k9t s LEU 431 CO 0.45 0.03 -0.15 -0.75 0.23 0.00 0.00 176.35 176.16 3k9t s LYS 432 N -0.58 2.50 0.06 1.70 2.20 -0.12 -4.79 119.74 120.71 3k9t s LYS 432 Ca 0.00 -0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 54.61 3k9t s LYS 432 Cb -0.05 -2.37 -0.05 0.00 -1.51 0.00 0.00 37.83 33.86 3k9t s LYS 432 CO 0.00 0.61 1.03 -1.17 -0.36 0.00 0.00 175.35 175.46 3k9t s LEU 433 N -0.69 4.41 0.00 5.43 2.96 -1.26 -0.28 118.68 129.25 3k9t s LEU 433 Ca 0.11 1.80 0.00 0.00 -0.22 0.00 0.00 54.13 55.82 3k9t s LEU 433 Cb -0.11 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.00 3k9t s LEU 433 CO 0.01 -0.25 0.08 1.33 -1.32 0.00 0.00 176.35 176.20