#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k83 n ARG 34 N 0.00 1.00 -0.35 1.61 5.12 -1.26 -4.85 116.66 117.93 3k83 n ARG 34 Ca 0.00 -0.82 0.01 0.00 -1.93 0.00 0.00 57.85 55.10 3k83 n ARG 34 Cb 0.00 -0.68 0.14 0.00 -1.16 0.00 0.00 32.46 30.77 3k83 n ARG 34 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 3k83 h GLN 35 N 0.00 1.12 -0.06 5.56 4.20 -1.99 -1.87 115.11 122.07 3k83 h GLN 35 Ca 0.00 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 3k83 h GLN 35 Cb 0.80 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 28.33 3k83 h GLN 35 CO 0.00 0.74 -0.01 -0.22 -0.67 0.00 0.00 178.83 178.67 3k83 h LYS 36 N 1.15 0.11 -0.81 1.46 1.63 -1.90 -1.18 116.57 117.04 3k83 h LYS 36 Ca 0.39 -0.04 0.05 0.00 -0.85 0.00 0.00 60.65 60.20 3k83 h LYS 36 Cb 0.08 -0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 31.65 3k83 h LYS 36 CO -0.15 0.42 0.51 0.00 -3.45 0.00 0.00 179.45 176.78 3k83 h ALA 37 N 0.68 1.09 -0.09 5.00 0.00 -1.72 -0.13 119.26 124.09 3k83 h ALA 37 Ca 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3k83 h ALA 37 Cb 0.38 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3k83 h ALA 37 CO 0.00 0.28 0.03 0.00 0.00 0.00 0.00 179.25 179.57 3k83 h ARG 38 N 0.96 0.13 -0.51 0.00 3.08 -1.29 -1.95 114.38 114.80 3k83 h ARG 38 Ca 0.34 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.43 3k83 h ARG 38 Cb 0.09 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 3k83 h ARG 38 CO -0.14 0.26 0.21 0.78 -1.07 0.00 0.00 179.97 180.01 3k83 h GLY 39 N -0.03 0.70 0.72 0.04 0.00 -0.98 -1.25 103.07 102.26 3k83 h GLY 39 Ca 0.03 -0.13 0.06 0.00 0.00 0.00 0.00 47.33 47.29 3k83 h GLY 39 CO -0.00 0.04 0.50 0.00 0.00 0.00 0.00 176.54 177.08 3k83 h ALA 40 N 1.32 1.13 -0.28 3.60 0.00 -0.92 -1.21 119.26 122.91 3k83 h ALA 40 Ca 0.24 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 3k83 h ALA 40 Cb 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3k83 h ALA 40 CO -0.22 0.24 -0.18 0.00 0.00 0.00 0.00 179.25 179.09 3k83 h ALA 41 N 1.39 0.40 -0.08 0.00 0.00 -0.80 -0.62 119.26 119.55 3k83 h ALA 41 Ca 0.36 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3k83 h ALA 41 Cb 0.17 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3k83 h ALA 41 CO -0.17 0.31 -0.05 1.15 0.00 0.00 0.00 179.25 180.49 3k83 h THR 42 N 0.35 0.83 -0.37 0.00 2.02 -0.98 0.01 112.91 114.76 3k83 h THR 42 Ca 0.06 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.23 3k83 h THR 42 Cb 0.71 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 3k83 h THR 42 CO 0.05 0.00 0.20 0.03 0.37 0.00 0.00 175.52 176.17 3k83 h ARG 43 N -0.06 0.52 -0.51 6.66 3.08 -1.18 -1.40 114.38 121.50 3k83 h ARG 43 Ca 0.05 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.05 3k83 h ARG 43 Cb 0.13 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 3k83 h ARG 43 CO -0.12 0.43 0.33 0.00 -1.07 0.00 0.00 179.97 179.54 3k83 h ALA 44 N 1.06 0.64 -0.50 0.04 0.00 -0.86 -0.22 119.26 119.43 3k83 h ALA 44 Ca 0.13 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3k83 h ALA 44 Cb 0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3k83 h ALA 44 CO -0.02 0.07 0.09 0.00 0.00 0.00 0.00 179.25 179.39 3k83 h ARG 45 N 0.67 0.78 -0.44 0.00 3.08 -0.91 -0.44 114.38 117.12 3k83 h ARG 45 Ca 0.19 -0.16 -0.13 0.00 0.07 0.00 0.00 59.98 59.95 3k83 h ARG 45 Cb -0.06 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 3k83 h ARG 45 CO -0.05 0.72 -0.23 0.37 -1.07 0.00 0.00 179.97 179.71 3k83 h GLN 46 N 0.75 0.93 -0.34 0.04 5.75 -0.59 -0.88 115.11 120.76 3k83 h GLN 46 Ca 0.16 -0.41 0.00 0.00 -0.15 0.00 0.00 58.65 58.25 3k83 h GLN 46 Cb 0.32 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 3k83 h GLN 46 CO 0.00 1.07 0.22 0.87 -2.65 0.00 0.00 178.83 178.35 3k83 h LYS 47 N 0.76 0.44 -0.41 1.69 1.57 -0.76 0.45 116.57 120.32 3k83 h LYS 47 Ca 0.10 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3k83 h LYS 47 Cb 0.80 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 3k83 h LYS 47 CO 0.07 0.29 0.27 0.37 -0.57 0.00 0.00 179.45 179.88 3k83 h GLN 48 N 0.46 0.54 -0.71 3.15 4.15 -0.97 -0.48 115.11 121.25 3k83 h GLN 48 Ca 0.12 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.53 3k83 h GLN 48 Cb -0.05 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.47 3k83 h GLN 48 CO -0.03 0.36 0.45 -0.09 -1.93 0.00 0.00 178.83 177.59 3k83 h ARG 49 N 0.56 0.87 -0.17 1.69 2.43 -0.91 -1.41 114.38 117.43 3k83 h ARG 49 Ca 0.15 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.17 3k83 h ARG 49 Cb -0.06 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.28 3k83 h ARG 49 CO -0.03 0.57 -0.34 0.00 -1.51 0.00 0.00 179.97 178.66 3k83 h ALA 50 N 1.29 1.11 -0.27 2.80 0.00 -0.51 -2.23 119.26 121.45 3k83 h ALA 50 Ca 0.28 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 3k83 h ALA 50 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3k83 h ALA 50 CO -0.10 0.57 -0.03 0.77 0.00 0.00 0.00 179.25 180.46 3k83 h SER 51 N 0.31 0.49 -0.69 0.00 0.02 -0.54 -0.28 113.55 112.86 3k83 h SER 51 Ca 0.04 -0.33 -0.06 0.00 -0.84 0.00 0.00 61.79 60.59 3k83 h SER 51 Cb 0.74 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 3k83 h SER 51 CO 0.06 0.71 0.19 -0.07 -1.14 0.00 0.00 176.83 176.58 3k83 h LEU 52 N 0.27 1.04 -0.56 5.07 3.38 -1.22 -0.75 115.31 122.53 3k83 h LEU 52 Ca 0.07 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 3k83 h LEU 52 Cb 0.47 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3k83 h LEU 52 CO 0.02 0.98 0.26 -0.08 0.09 0.00 0.00 178.44 179.71 3k83 h GLU 53 N 1.05 0.81 -0.86 1.13 4.57 -1.30 0.59 114.58 120.58 3k83 h GLU 53 Ca 0.22 -0.12 0.01 0.00 -1.18 0.00 0.00 59.36 58.29 3k83 h GLU 53 Cb 0.33 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 28.74 3k83 h GLU 53 CO -0.00 0.67 0.57 1.15 -1.18 0.00 0.00 179.01 180.21 3k83 h THR 54 N 0.76 1.21 -0.06 0.32 2.02 -0.57 -1.77 112.91 114.82 3k83 h THR 54 Ca 0.19 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.97 3k83 h THR 54 Cb 0.13 -0.04 -0.00 0.00 -1.74 0.00 0.00 68.15 66.50 3k83 h THR 54 CO -0.02 0.21 0.02 0.24 0.37 0.00 0.00 175.52 176.34 3k83 h MET 55 N 1.15 0.09 -0.20 6.66 2.86 -0.71 -1.84 114.93 122.93 3k83 h MET 55 Ca 0.32 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 58.00 3k83 h MET 55 Cb -0.11 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.47 3k83 h MET 55 CO -0.08 0.22 -0.28 0.22 1.06 0.00 0.00 176.91 178.06 3k83 h ASP 56 N -0.06 -0.87 -0.61 1.22 3.58 -0.63 0.23 116.42 119.28 3k83 h ASP 56 Ca 0.02 0.14 0.03 0.00 0.42 0.00 0.00 57.03 57.64 3k83 h ASP 56 Cb 0.16 0.39 -0.04 0.00 1.72 0.00 0.00 39.33 41.57 3k83 h ASP 56 CO -0.00 -0.31 0.37 0.11 -2.88 0.00 0.00 179.24 176.53 3k83 h LYS 57 N -0.31 0.71 -0.68 0.28 1.57 -1.28 -0.39 116.57 116.47 3k83 h LYS 57 Ca 0.12 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 3k83 h LYS 57 Cb 0.50 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 3k83 h LYS 57 CO -0.38 0.47 0.38 0.00 -0.57 0.00 0.00 179.45 179.35 3k83 h ALA 58 N 1.27 0.88 -0.46 3.86 0.00 -0.74 -1.57 119.26 122.49 3k83 h ALA 58 Ca 0.24 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3k83 h ALA 58 Cb 0.02 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3k83 h ALA 58 CO -0.10 0.39 0.08 0.28 0.00 0.00 0.00 179.25 179.89 3k83 h VAL 59 N 0.94 1.25 -0.51 0.00 2.07 0.19 -1.68 116.25 118.51 3k83 h VAL 59 Ca 0.24 -0.89 -0.13 0.00 0.82 0.00 0.00 66.70 66.74 3k83 h VAL 59 Cb 0.03 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3k83 h VAL 59 CO -0.04 0.32 -0.17 1.56 0.02 0.00 0.00 177.57 179.25 3k83 h GLN 60 N 0.63 1.01 -0.27 1.57 1.08 -0.95 -0.70 115.11 117.49 3k83 h GLN 60 Ca 0.14 -0.41 0.02 0.00 -1.45 0.00 0.00 58.65 56.95 3k83 h GLN 60 Cb 0.38 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.74 3k83 h GLN 60 CO 0.01 1.09 0.11 -0.09 -0.95 0.00 0.00 178.83 179.00 3k83 h ARG 61 N 0.87 0.23 -0.41 1.46 1.12 -1.16 -2.04 114.38 114.47 3k83 h ARG 61 Ca 0.12 -0.01 -0.02 0.00 -1.11 0.00 0.00 59.98 58.95 3k83 h ARG 61 Cb 0.75 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 30.64 3k83 h ARG 61 CO 0.06 0.15 0.16 0.35 -3.11 0.00 0.00 179.97 177.59 3k83 h PHE 62 N 0.24 0.62 -0.85 2.20 3.57 -0.93 -3.08 116.94 118.70 3k83 h PHE 62 Ca 0.12 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 3k83 h PHE 62 Cb 0.07 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.58 3k83 h PHE 62 CO -0.12 0.55 0.53 0.00 -2.23 0.00 0.00 178.31 177.04 3k83 h ARG 63 N 0.51 1.14 -0.26 1.11 3.08 -0.84 -1.36 114.38 117.76 3k83 h ARG 63 Ca 0.14 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 3k83 h ARG 63 Cb 0.19 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 3k83 h ARG 63 CO -0.01 0.79 0.04 -0.07 -1.07 0.00 0.00 179.97 179.65 3k83 h LEU 64 N 1.17 0.34 0.00 3.04 3.38 -1.31 -1.55 115.31 120.38 3k83 h LEU 64 Ca 0.31 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.24 3k83 h LEU 64 Cb -0.08 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.59 3k83 h LEU 64 CO -0.06 0.37 -0.05 0.00 0.09 0.00 0.00 178.44 178.79 3k83 n GLN 65 N -4.37 0.19 -2.98 1.13 1.13 -0.59 -4.38 117.38 107.51 3k83 n GLN 65 Ca 0.01 0.14 -0.19 0.00 -1.94 0.00 0.00 57.00 55.02 3k83 n GLN 65 Cb 0.18 -1.71 -0.02 0.00 0.11 0.00 0.00 30.24 28.80 3k83 n GLN 65 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3k83 n ASN 66 N -2.03 2.11 0.28 1.08 3.02 -0.60 -4.93 115.26 114.20 3k83 n ASN 66 Ca 0.06 -3.17 0.16 0.00 -0.03 0.00 0.00 54.58 51.60 3k83 n ASN 66 Cb 0.40 -0.58 0.82 0.00 -0.61 0.00 0.00 39.78 39.82 3k83 n ASN 66 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3k83 h PRO 67 N 2.96 0.00 -0.37 3.52 0.13 -1.73 -2.90 132.00 133.61 3k83 h PRO 67 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3k83 h PRO 67 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 3k83 h PRO 67 CO 0.60 0.07 0.00 -0.25 -0.23 0.00 0.00 178.00 178.19 3k83 n ASP 68 N -3.39 2.83 -4.70 1.44 8.00 -1.26 -4.93 116.55 114.53 3k83 n ASP 68 Ca -0.01 -1.92 -0.42 0.00 0.71 0.00 0.00 54.79 53.15 3k83 n ASP 68 Cb 0.22 -0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 41.05 3k83 n ASP 68 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3k83 s LEU 69 N -1.38 4.34 -1.21 0.64 2.96 -1.10 -4.92 118.68 118.02 3k83 s LEU 69 Ca 0.37 2.23 -0.20 0.00 -0.22 0.00 0.00 54.13 56.31 3k83 s LEU 69 Cb 0.20 -3.57 0.06 0.00 0.50 0.00 0.00 46.19 43.39 3k83 s LEU 69 CO 0.28 -0.71 1.64 -0.62 -1.32 0.00 0.00 176.35 175.62 3k83 s ASP 70 N 1.66 6.73 0.21 3.68 3.68 -1.26 -4.80 116.67 126.57 3k83 s ASP 70 Ca 0.65 -2.14 -0.10 0.00 2.13 0.00 0.00 52.55 53.10 3k83 s ASP 70 Cb -0.34 -2.57 0.17 0.00 -1.45 0.00 0.00 42.92 38.72 3k83 s ASP 70 CO 0.29 -1.27 1.88 0.77 0.13 0.00 0.00 175.17 176.96 3k83 h SER 71 N 8.28 0.86 -0.69 -0.34 4.64 -1.98 -2.11 113.55 122.22 3k83 h SER 71 Ca 0.37 -0.02 0.01 0.00 -0.47 0.00 0.00 61.79 61.68 3k83 h SER 71 Cb 0.92 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.76 3k83 h SER 71 CO 1.45 0.62 0.45 -0.08 -0.87 0.00 0.00 176.83 178.40 3k83 h GLU 72 N 1.02 0.88 -0.36 4.77 4.57 -1.99 -0.03 114.58 123.44 3k83 h GLU 72 Ca 0.28 -0.05 -0.13 0.00 -1.18 0.00 0.00 59.36 58.28 3k83 h GLU 72 Cb -0.10 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.28 3k83 h GLU 72 CO -0.07 0.58 -0.28 0.00 -1.18 0.00 0.00 179.01 178.06 3k83 h ALA 73 N 1.26 0.82 -0.17 2.92 0.00 -1.90 -2.19 119.26 120.00 3k83 h ALA 73 Ca 0.26 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3k83 h ALA 73 Cb -0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3k83 h ALA 73 CO -0.07 0.64 0.02 1.25 0.00 0.00 0.00 179.25 181.09 3k83 h LEU 74 N 0.65 0.28 -2.21 0.00 6.46 -0.77 -2.75 115.31 116.96 3k83 h LEU 74 Ca 0.08 -0.28 -0.01 0.00 -0.12 0.00 0.00 57.88 57.54 3k83 h LEU 74 Cb 0.81 -0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 40.66 3k83 h LEU 74 CO 0.07 0.49 -0.06 -0.07 -0.62 0.00 0.00 178.44 178.25 3k83 h LEU 75 N 0.06 0.00 0.00 2.25 3.38 -0.95 -2.91 115.31 117.13 3k83 h LEU 75 Ca 0.05 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 3k83 h LEU 75 Cb 0.34 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3k83 h LEU 75 CO 0.01 0.06 -1.27 0.41 0.09 0.00 0.00 178.44 177.73 3k83 n THR 76 N -3.55 0.93 -1.67 0.22 -1.04 -0.83 -4.90 114.28 103.44 3k83 n THR 76 Ca -0.02 -0.63 -0.46 0.00 -2.04 0.00 0.00 64.05 60.90 3k83 n THR 76 Cb 0.17 -0.56 -0.04 0.00 -1.82 0.00 0.00 70.33 68.09 3k83 n THR 76 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3k83 n LEU 77 N -2.79 3.03 -4.70 -4.42 4.77 -1.05 -4.93 117.00 106.92 3k83 n LEU 77 Ca -0.06 1.10 -0.40 0.00 -0.03 0.00 0.00 56.01 56.61 3k83 n LEU 77 Cb 0.72 -1.42 0.02 0.00 -2.33 0.00 0.00 43.42 40.41 3k83 n LEU 77 CO 0.42 -0.36 0.86 -2.65 -1.33 0.00 0.00 177.39 174.33 3k83 n PRO 78 N 3.12 1.83 -0.31 3.23 -0.02 -1.26 -4.74 135.00 136.85 3k83 n PRO 78 Ca 0.16 0.65 0.15 0.00 -2.02 0.00 0.00 63.50 62.44 3k83 n PRO 78 Cb 0.29 -2.38 0.31 0.00 -0.02 0.00 0.00 33.50 31.70 3k83 n PRO 78 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3k83 h LEU 79 N 1.91 -0.07 -0.44 2.45 5.85 -1.91 -1.26 115.31 121.83 3k83 h LEU 79 Ca -0.48 0.22 0.08 0.00 0.84 0.00 0.00 57.88 58.54 3k83 h LEU 79 Cb 1.30 0.31 -0.07 0.00 0.37 0.00 0.00 40.66 42.57 3k83 h LEU 79 CO 0.59 -0.22 0.03 0.25 -0.34 0.00 0.00 178.44 178.75 3k83 h LEU 80 N 0.15 -0.12 -0.89 2.25 5.85 -1.94 0.21 115.31 120.83 3k83 h LEU 80 Ca 0.58 0.09 -0.12 0.00 0.84 0.00 0.00 57.88 59.28 3k83 h LEU 80 Cb 1.22 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.40 3k83 h LEU 80 CO -0.72 -0.03 -0.53 1.56 -0.34 0.00 0.00 178.44 178.38 3k83 h GLN 81 N 0.14 0.06 -0.19 1.25 4.20 -1.63 -1.70 115.11 117.25 3k83 h GLN 81 Ca 0.22 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 3k83 h GLN 81 Cb 0.30 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3k83 h GLN 81 CO -0.34 0.58 -0.01 1.25 -0.67 0.00 0.00 178.83 179.65 3k83 h LEU 82 N 0.05 0.33 -0.44 1.46 5.85 -0.32 -1.20 115.31 121.04 3k83 h LEU 82 Ca -0.00 -0.32 0.03 0.00 0.84 0.00 0.00 57.88 58.42 3k83 h LEU 82 Cb 0.96 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 3k83 h LEU 82 CO 0.07 0.57 0.25 0.58 -0.34 0.00 0.00 178.44 179.57 3k83 h VAL 83 N 0.09 1.01 -0.92 1.05 2.07 -0.50 -1.19 116.25 117.86 3k83 h VAL 83 Ca 0.05 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.43 3k83 h VAL 83 Cb 0.41 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 3k83 h VAL 83 CO 0.01 0.09 0.61 -0.61 0.02 0.00 0.00 177.57 177.69 3k83 h GLN 84 N 0.49 1.16 -0.15 1.57 -0.00 -1.15 -0.49 115.11 116.54 3k83 h GLN 84 Ca 0.18 -0.07 -0.18 0.00 -0.00 0.00 0.00 58.65 58.59 3k83 h GLN 84 Cb 0.05 -0.26 -0.00 0.00 0.00 0.00 0.00 27.48 27.26 3k83 h GLN 84 CO -0.10 0.77 -0.63 0.87 0.00 0.00 0.00 178.83 179.73 3k83 h LYS 85 N 1.20 0.56 -0.44 1.69 1.57 -0.73 -2.14 116.57 118.27 3k83 h LYS 85 Ca 0.35 -0.39 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 3k83 h LYS 85 Cb -0.06 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 3k83 h LYS 85 CO -0.09 1.01 -0.16 -0.07 -0.57 0.00 0.00 179.45 179.57 3k83 h LEU 86 N 0.41 0.84 -0.74 2.94 3.38 -0.77 -1.87 115.31 119.49 3k83 h LEU 86 Ca -0.01 -0.28 -0.13 0.00 0.09 0.00 0.00 57.88 57.55 3k83 h LEU 86 Cb 1.20 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 3k83 h LEU 86 CO 0.12 1.00 -0.48 -0.61 0.09 0.00 0.00 178.44 178.56 3k83 h GLN 87 N 0.74 0.37 0.00 1.13 5.75 -0.97 -3.10 115.11 119.03 3k83 h GLN 87 Ca 0.11 -0.21 -0.12 0.00 -0.15 0.00 0.00 58.65 58.28 3k83 h GLN 87 Cb 0.68 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.22 3k83 h GLN 87 CO 0.05 0.77 -0.60 0.66 -2.65 0.00 0.00 178.83 177.06 3k83 h SER 88 N 0.30 0.00 0.00 -0.69 4.64 -1.25 -3.48 113.55 113.07 3k83 h SER 88 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3k83 h SER 88 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3k83 h SER 88 CO 0.08 0.58 0.00 0.61 -0.87 0.00 0.00 176.83 177.23 3k83 n GLY 89 N 1.25 0.18 0.39 -0.77 0.00 -0.76 -4.96 105.19 100.51 3k83 n GLY 89 Ca 0.01 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.20 3k83 n GLY 89 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3k83 h GLU 90 N 3.66 0.51 -6.58 1.61 4.81 -1.71 -3.39 114.58 113.49 3k83 h GLU 90 Ca 0.00 -0.03 -0.70 0.00 -0.13 0.00 0.00 59.36 58.50 3k83 h GLU 90 Cb 0.00 -0.12 -0.28 0.00 0.63 0.00 0.00 28.75 28.99 3k83 h GLU 90 CO 0.00 0.34 -0.86 -0.51 -0.73 0.00 0.00 179.01 177.25 3k83 s LEU 91 N -9.63 2.24 0.32 1.64 1.43 -1.03 -5.01 118.68 108.64 3k83 s LEU 91 Ca -0.09 -0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 52.44 3k83 s LEU 91 Cb 0.23 -1.38 -0.08 0.00 0.03 0.00 0.00 46.19 44.98 3k83 s LEU 91 CO 0.79 0.31 0.71 -0.94 0.23 0.00 0.00 176.35 177.44 3k83 s SER 92 N -0.81 6.71 0.33 2.29 1.04 -1.26 -4.38 113.70 117.63 3k83 s SER 92 Ca 0.11 1.20 0.02 0.00 0.48 0.00 0.00 55.95 57.75 3k83 s SER 92 Cb -0.10 -2.34 0.59 0.00 0.10 0.00 0.00 66.02 64.27 3k83 s SER 92 CO 0.00 -0.21 1.98 -0.65 0.98 0.00 0.00 173.24 175.35 3k83 h PRO 93 N 2.17 0.90 -0.54 4.02 0.11 -1.92 -2.26 132.00 134.48 3k83 h PRO 93 Ca -0.48 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 3k83 h PRO 93 Cb 1.18 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.06 3k83 h PRO 93 CO 0.66 0.60 0.31 0.93 -0.21 0.00 0.00 178.00 180.28 3k83 h GLU 94 N 0.93 0.75 -0.50 1.05 3.07 -1.93 0.21 114.58 118.15 3k83 h GLU 94 Ca 0.28 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.36 59.05 3k83 h GLU 94 Cb -0.03 -0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 27.71 3k83 h GLU 94 CO -0.07 0.56 0.29 0.00 -1.40 0.00 0.00 179.01 178.39 3k83 h ALA 95 N 1.14 0.64 -0.33 3.43 0.00 -1.88 -0.39 119.26 121.87 3k83 h ALA 95 Ca 0.19 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3k83 h ALA 95 Cb 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3k83 h ALA 95 CO -0.03 0.14 -0.02 0.28 0.00 0.00 0.00 179.25 179.61 3k83 h VAL 96 N 0.67 1.27 -0.08 0.00 2.07 -1.04 -2.26 116.25 116.88 3k83 h VAL 96 Ca 0.18 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 3k83 h VAL 96 Cb 0.01 1.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 3k83 h VAL 96 CO -0.03 0.33 -0.00 0.15 0.02 0.00 0.00 177.57 178.04 3k83 h PHE 97 N 0.40 0.15 0.00 1.57 3.04 -0.35 -1.92 116.94 119.82 3k83 h PHE 97 Ca 0.09 -0.03 -0.09 0.00 3.98 0.00 0.00 57.97 61.92 3k83 h PHE 97 Cb 0.49 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 3k83 h PHE 97 CO 0.04 0.42 -0.43 0.74 -2.02 0.00 0.00 178.31 177.05 3k83 h PHE 98 N -0.16 0.00 -0.17 0.41 0.04 -1.13 -0.19 116.94 115.75 3k83 h PHE 98 Ca 0.02 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.70 3k83 h PHE 98 Cb 0.36 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.51 3k83 h PHE 98 CO 0.04 0.43 -0.26 1.15 -0.60 0.00 0.00 178.31 179.07 3k83 h THR 99 N 0.00 1.35 -0.19 -1.55 2.02 -1.30 -1.37 112.91 111.87 3k83 h THR 99 Ca -0.00 -1.48 -0.07 0.00 0.77 0.00 0.00 66.41 65.63 3k83 h THR 99 Cb 0.93 1.91 -0.01 0.00 -1.74 0.00 0.00 68.15 69.24 3k83 h THR 99 CO 0.06 0.44 -0.18 1.88 0.37 0.00 0.00 175.52 178.09 3k83 h TYR 100 N 0.10 0.35 -0.23 3.16 0.05 -1.20 -2.39 116.97 116.81 3k83 h TYR 100 Ca 0.01 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 58.73 3k83 h TYR 100 Cb 0.83 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 38.47 3k83 h TYR 100 CO 0.09 0.50 0.11 1.25 -1.05 0.00 0.00 178.16 179.06 3k83 h LEU 101 N 0.30 0.31 -0.89 3.88 5.85 -0.83 0.19 115.31 124.12 3k83 h LEU 101 Ca 0.05 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 3k83 h LEU 101 Cb 0.50 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 3k83 h LEU 101 CO 0.03 0.36 0.30 1.23 -0.34 0.00 0.00 178.44 180.02 3k83 h GLY 102 N 0.24 1.20 0.92 3.75 0.00 -1.14 -1.59 103.07 106.44 3k83 h GLY 102 Ca 0.08 -0.64 -0.02 0.00 0.00 0.00 0.00 47.33 46.75 3k83 h GLY 102 CO -0.01 0.60 0.12 1.70 0.00 0.00 0.00 176.54 178.96 3k83 h LYS 103 N 1.09 0.43 -0.85 4.80 1.63 -1.11 -1.30 116.57 121.27 3k83 h LYS 103 Ca 0.25 -0.07 0.06 0.00 -0.85 0.00 0.00 60.65 60.04 3k83 h LYS 103 Cb 0.20 -0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 31.70 3k83 h LYS 103 CO -0.02 0.44 0.52 0.00 -3.45 0.00 0.00 179.45 176.94 3k83 h ALA 104 N 0.97 1.16 -0.42 5.00 0.00 -0.34 -0.20 119.26 125.43 3k83 h ALA 104 Ca 0.10 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 3k83 h ALA 104 Cb 0.16 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3k83 h ALA 104 CO -0.01 0.27 -0.03 2.35 0.00 0.00 0.00 179.25 181.83 3k83 h TRP 105 N 0.96 0.84 0.17 0.00 7.01 -1.16 -1.20 115.95 122.56 3k83 h TRP 105 Ca 0.37 -0.16 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 3k83 h TRP 105 Cb 0.16 -0.21 0.00 0.00 -2.10 0.00 0.00 29.16 27.01 3k83 h TRP 105 CO -0.03 0.84 -0.08 0.93 -2.79 0.00 0.00 178.44 177.31 3k83 h GLU 106 N 0.59 -0.22 0.00 2.65 5.08 -0.62 -3.10 114.58 118.97 3k83 h GLU 106 Ca 0.11 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 3k83 h GLU 106 Cb 0.53 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 3k83 h GLU 106 CO 0.03 -0.09 -0.28 -0.39 -1.00 0.00 0.00 179.01 177.27 3k83 h VAL 107 N -0.29 0.69 0.00 3.13 -1.51 -1.06 -2.27 116.25 114.94 3k83 h VAL 107 Ca -0.02 -1.26 -0.02 0.00 -1.23 0.00 0.00 66.70 64.16 3k83 h VAL 107 Cb 0.23 1.82 -0.00 0.00 -2.13 0.00 0.00 31.29 31.20 3k83 h VAL 107 CO 0.04 0.28 -0.10 -1.13 -1.23 0.00 0.00 177.57 175.42 3k83 h ASN 108 N 0.00 0.00 -0.96 4.19 -1.24 -1.13 -2.74 115.58 113.69 3k83 h ASN 108 Ca -0.00 0.00 0.14 0.00 0.71 0.00 0.00 56.30 57.15 3k83 h ASN 108 Cb 0.79 0.00 -0.08 0.00 0.73 0.00 0.00 38.32 39.76 3k83 h ASN 108 CO 0.04 0.10 0.61 0.11 -1.29 0.00 0.00 177.43 176.99 3k83 h LYS 109 N 0.00 0.80 -0.01 6.67 1.79 -1.40 -0.07 116.57 124.34 3k83 h LYS 109 Ca -0.00 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 3k83 h LYS 109 Cb 0.30 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 3k83 h LYS 109 CO 0.01 0.53 -0.18 0.41 -1.08 0.00 0.00 179.45 179.14 3k83 n GLY 110 N -1.38 0.04 0.01 3.86 0.00 -1.05 -4.64 105.19 102.02 3k83 n GLY 110 Ca 0.19 -0.45 -0.00 0.00 0.00 0.00 0.00 46.02 45.76 3k83 n GLY 110 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k83 n THR 111 N 0.30 0.07 -3.69 2.61 -2.24 -1.02 -4.71 114.28 105.60 3k83 n THR 111 Ca 0.08 -0.06 -0.24 0.00 -2.27 0.00 0.00 64.05 61.55 3k83 n THR 111 Cb 0.35 -0.44 0.03 0.00 -2.10 0.00 0.00 70.33 68.17 3k83 n THR 111 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3k83 n ASN 112 N -1.88 -2.79 -0.01 3.42 5.15 -0.07 -0.69 115.26 118.39 3k83 n ASN 112 Ca -0.02 -0.90 0.11 0.00 -0.60 0.00 0.00 54.58 53.17 3k83 n ASN 112 Cb 0.37 -3.79 -0.16 0.00 -0.53 0.00 0.00 39.78 35.66 3k83 n ASN 112 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3k83 s VAL 114 N -3.45 5.23 -0.12 0.00 1.01 -1.26 -1.02 120.40 120.79 3k83 s VAL 114 Ca -0.06 0.47 0.14 0.00 0.00 0.00 0.00 61.98 62.52 3k83 s VAL 114 Cb 0.14 -3.64 -0.24 0.00 0.00 0.00 0.00 36.38 32.64 3k83 s VAL 114 CO 0.90 0.23 0.36 0.35 0.00 0.00 0.00 175.10 176.93 3k83 n THR 115 N 4.78 1.52 -3.68 3.92 -2.24 -0.35 -4.88 114.28 113.35 3k83 n THR 115 Ca -0.10 -0.81 -0.14 0.00 -2.27 0.00 0.00 64.05 60.73 3k83 n THR 115 Cb 0.51 -0.83 -0.08 0.00 -2.10 0.00 0.00 70.33 67.83 3k83 n THR 115 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3k83 s SER 116 N -5.88 -0.59 -0.22 3.42 0.15 -1.15 -4.18 113.70 105.25 3k83 s SER 116 Ca -0.09 1.13 -0.20 0.00 0.70 0.00 0.00 55.95 57.49 3k83 s SER 116 Cb 0.07 1.14 -0.03 0.00 -1.71 0.00 0.00 66.02 65.50 3k83 s SER 116 CO 0.82 -0.21 0.59 -0.47 1.20 0.00 0.00 173.24 175.17 3k83 s TYR 117 N 0.25 3.34 -0.60 3.44 6.04 -1.26 -1.24 117.35 127.32 3k83 s TYR 117 Ca -0.00 0.83 -0.27 0.00 0.04 0.00 0.00 57.07 57.67 3k83 s TYR 117 Cb -0.04 -2.77 -0.01 0.00 -1.04 0.00 0.00 41.96 38.10 3k83 s TYR 117 CO 0.01 -0.21 1.71 -0.51 -1.54 0.00 0.00 175.55 175.01 3k83 s LEU 118 N 2.06 3.31 0.14 6.97 1.43 -0.15 -4.88 118.68 127.56 3k83 s LEU 118 Ca 0.26 0.31 -0.21 0.00 -1.03 0.00 0.00 54.13 53.46 3k83 s LEU 118 Cb -0.16 -2.70 0.02 0.00 0.03 0.00 0.00 46.19 43.38 3k83 s LEU 118 CO 0.09 -2.14 1.66 0.74 0.23 0.00 0.00 176.35 176.93 3k83 h THR 119 N 6.68 0.56 -0.06 5.49 2.02 -1.94 -1.96 112.91 123.69 3k83 h THR 119 Ca -0.27 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.91 3k83 h THR 119 Cb 1.14 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 3k83 h THR 119 CO 1.20 0.00 0.00 -0.90 0.37 0.00 0.00 175.52 176.19 3k83 n ASP 120 N -5.31 0.84 0.25 4.18 3.85 -1.26 -4.16 116.55 114.93 3k83 n ASP 120 Ca -0.01 -2.04 0.13 0.00 -0.71 0.00 0.00 54.79 52.16 3k83 n ASP 120 Cb 0.23 -0.25 0.59 0.00 -1.35 0.00 0.00 41.12 40.34 3k83 n ASP 120 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3k83 h GLU 122 N 0.00 0.61 -0.24 0.00 5.08 -1.82 -0.16 114.58 118.05 3k83 h GLU 122 Ca -0.00 -0.23 -0.16 0.00 -1.00 0.00 0.00 59.36 57.97 3k83 h GLU 122 Cb 0.60 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.81 3k83 h GLU 122 CO 0.02 0.78 -0.46 1.79 -1.00 0.00 0.00 179.01 180.13 3k83 h THR 123 N 0.54 1.30 -0.82 1.13 1.35 -1.61 -2.83 112.91 111.97 3k83 h THR 123 Ca 0.08 -1.67 0.11 0.00 -0.55 0.00 0.00 66.41 64.39 3k83 h THR 123 Cb 0.67 1.75 -0.06 0.00 -1.73 0.00 0.00 68.15 68.78 3k83 h THR 123 CO 0.05 0.53 0.53 -0.61 -0.25 0.00 0.00 175.52 175.77 3k83 h GLN 124 N 0.47 0.67 -0.74 4.72 5.75 -1.18 -1.79 115.11 123.02 3k83 h GLN 124 Ca 0.01 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.50 3k83 h GLN 124 Cb 1.07 -0.15 -0.05 0.00 1.07 0.00 0.00 27.48 29.42 3k83 h GLN 124 CO 0.10 0.44 0.47 1.25 -2.65 0.00 0.00 178.83 178.44 3k83 h LEU 125 N 0.69 0.77 -0.36 -2.39 5.85 -0.78 -0.63 115.31 118.46 3k83 h LEU 125 Ca 0.39 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.11 3k83 h LEU 125 Cb 0.55 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.42 3k83 h LEU 125 CO -0.16 0.53 0.00 0.77 -0.34 0.00 0.00 178.44 179.25 3k83 h SER 126 N 0.91 0.00 -0.18 1.25 4.64 -1.20 -3.26 113.55 115.72 3k83 h SER 126 Ca 0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 3k83 h SER 126 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 3k83 h SER 126 CO -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.85 3k83 n GLN 127 N -2.51 1.66 -1.73 4.77 6.02 -0.71 -5.02 117.38 119.86 3k83 n GLN 127 Ca 0.04 -1.65 -0.42 0.00 -0.01 0.00 0.00 57.00 54.96 3k83 n GLN 127 Cb 0.38 -1.29 -0.03 0.00 1.02 0.00 0.00 30.24 30.32 3k83 n GLN 127 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3k83 s ALA 128 N -1.09 3.94 -0.05 -1.58 0.00 -0.32 -4.86 121.76 117.79 3k83 s ALA 128 Ca 0.21 1.59 -0.32 0.00 0.00 0.00 0.00 51.96 53.44 3k83 s ALA 128 Cb 0.13 -3.70 -0.10 0.00 0.00 0.00 0.00 23.12 19.45 3k83 s ALA 128 CO 0.18 -0.93 1.95 -2.30 0.00 0.00 0.00 175.76 174.66 3k83 n PRO 129 N 3.95 2.43 0.27 0.00 -0.02 -1.26 -4.86 135.00 135.50 3k83 n PRO 129 Ca 0.16 0.88 0.13 0.00 -2.02 0.00 0.00 63.50 62.64 3k83 n PRO 129 Cb 0.35 -2.82 0.76 0.00 -0.02 0.00 0.00 33.50 31.76 3k83 n PRO 129 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3k83 h ARG 130 N 10.19 0.00 -0.04 -0.52 9.65 -1.96 -0.17 114.38 131.54 3k83 h ARG 130 Ca -0.48 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.40 3k83 h ARG 130 Cb 1.26 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.84 3k83 h ARG 130 CO 0.95 0.10 0.00 1.04 2.80 0.00 0.00 179.97 184.85 3k83 n GLN 131 N -3.73 2.31 -1.68 0.20 3.00 -1.26 -4.89 117.38 111.32 3k83 n GLN 131 Ca -0.02 -1.93 -0.42 0.00 -0.01 0.00 0.00 57.00 54.62 3k83 n GLN 131 Cb 0.20 -1.46 0.00 0.00 0.00 0.00 0.00 30.24 28.99 3k83 n GLN 131 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3k83 n GLY 132 N 1.34 0.42 0.06 1.08 0.00 -0.08 -4.87 105.19 103.16 3k83 n GLY 132 Ca 0.14 0.24 0.08 0.00 0.00 0.00 0.00 46.02 46.48 3k83 n GLY 132 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k83 n LEU 133 N 0.50 0.28 -0.52 0.99 4.77 -1.15 -1.88 117.00 119.99 3k83 n LEU 133 Ca 0.06 0.59 0.07 0.00 -0.03 0.00 0.00 56.01 56.70 3k83 n LEU 133 Cb 0.38 -0.57 0.14 0.00 -2.33 0.00 0.00 43.42 41.04 3k83 n LEU 133 CO 0.60 -0.50 0.38 0.18 -1.33 0.00 0.00 177.39 176.73 3k83 n LEU 134 N -1.83 2.08 -4.70 2.23 4.77 -0.22 -5.03 117.00 114.30 3k83 n LEU 134 Ca 0.02 -3.07 -0.57 0.00 -0.03 0.00 0.00 56.01 52.36 3k83 n LEU 134 Cb 0.13 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 40.78 3k83 n LEU 134 CO 0.12 0.92 1.29 0.00 -1.33 0.00 0.00 177.39 178.40 3k83 n TYR 135 N -0.91 2.01 -0.97 -1.77 4.19 -0.79 -1.39 117.16 117.54 3k83 n TYR 135 Ca 0.14 0.54 0.00 0.00 3.31 0.00 0.00 57.90 61.90 3k83 n TYR 135 Cb 0.73 -2.45 0.00 0.00 0.49 0.00 0.00 39.34 38.11 3k83 n TYR 135 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3k83 n GLY 136 N 4.06 0.72 3.69 2.98 0.00 0.10 -4.74 105.19 111.99 3k83 n GLY 136 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 3k83 n GLY 136 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k83 s VAL 137 N -2.99 4.84 0.14 1.61 1.01 -0.49 -4.66 120.40 119.87 3k83 s VAL 137 Ca 0.00 1.93 -0.30 0.00 0.00 0.00 0.00 61.98 63.61 3k83 s VAL 137 Cb 0.00 -4.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.05 3k83 s VAL 137 CO 0.00 0.07 1.02 -2.84 0.00 0.00 0.00 175.10 173.35 3k83 s PRO 138 N 1.66 4.66 -0.08 2.72 0.02 -1.26 -0.00 135.00 142.72 3k83 s PRO 138 Ca 0.47 1.55 0.03 0.00 0.02 0.00 0.00 61.00 63.07 3k83 s PRO 138 Cb -0.19 -3.34 0.01 0.00 0.02 0.00 0.00 34.50 31.00 3k83 s PRO 138 CO 0.20 0.17 -0.18 0.08 -0.33 0.00 0.00 177.00 176.94 3k83 s VAL 139 N -0.11 1.57 0.11 3.83 1.01 -0.67 -4.29 120.40 121.84 3k83 s VAL 139 Ca 0.48 -0.74 -0.14 0.00 0.00 0.00 0.00 61.98 61.59 3k83 s VAL 139 Cb -0.26 -1.38 -0.06 0.00 0.00 0.00 0.00 36.38 34.68 3k83 s VAL 139 CO 0.32 0.45 0.50 -0.94 0.00 0.00 0.00 175.10 175.43 3k83 s SER 140 N 0.48 6.80 -0.12 3.32 1.04 -0.44 -1.19 113.70 123.58 3k83 s SER 140 Ca -0.16 1.01 0.03 0.00 0.48 0.00 0.00 55.95 57.32 3k83 s SER 140 Cb -0.16 -2.26 0.01 0.00 0.10 0.00 0.00 66.02 63.70 3k83 s SER 140 CO 0.06 0.16 -0.23 -0.76 0.98 0.00 0.00 173.24 173.45 3k83 s LEU 141 N -1.77 2.10 0.38 2.42 1.43 0.11 -2.45 118.68 120.89 3k83 s LEU 141 Ca 0.34 -0.59 -0.26 0.00 -1.03 0.00 0.00 54.13 52.60 3k83 s LEU 141 Cb -0.15 -1.43 -0.11 0.00 0.03 0.00 0.00 46.19 44.52 3k83 s LEU 141 CO 0.18 0.11 1.14 1.17 0.23 0.00 0.00 176.35 179.18 3k83 n LYS 142 N 3.84 1.67 0.27 1.70 4.81 -1.03 -0.23 118.16 129.18 3k83 n LYS 142 Ca -0.20 0.59 0.17 0.00 -0.87 0.00 0.00 58.31 58.01 3k83 n LYS 142 Cb 0.52 -2.15 0.82 0.00 0.02 0.00 0.00 35.03 34.24 3k83 n LYS 142 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 3k83 h GLU 143 N 1.99 0.00 0.00 1.64 4.81 -1.65 -1.65 114.58 119.72 3k83 h GLU 143 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3k83 h GLU 143 Cb 1.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.69 3k83 h GLU 143 CO 0.60 0.00 -0.01 0.00 -0.73 0.00 0.00 179.01 178.86 3k83 s PHE 145 N -3.02 2.13 0.25 0.00 0.40 -0.62 -0.75 117.98 116.37 3k83 s PHE 145 Ca 0.13 0.06 -0.31 0.00 -0.60 0.00 0.00 56.93 56.22 3k83 s PHE 145 Cb 0.18 -4.45 -0.14 0.00 0.51 0.00 0.00 43.02 39.12 3k83 s PHE 145 CO 0.55 -2.06 1.28 0.43 0.70 0.00 0.00 175.22 176.11 3k83 n SER 146 N 10.63 2.26 -3.69 1.36 7.64 -1.26 -4.84 113.62 125.71 3k83 n SER 146 Ca 0.18 1.16 -0.21 0.00 1.01 0.00 0.00 58.87 61.01 3k83 n SER 146 Cb 0.50 -1.37 -0.18 0.00 -1.01 0.00 0.00 64.21 62.15 3k83 n SER 146 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 3k83 s TYR 147 N -0.39 0.21 0.11 1.43 5.04 -1.26 -1.49 117.35 120.99 3k83 s TYR 147 Ca 0.66 0.16 -0.36 0.00 -2.44 0.00 0.00 57.07 55.08 3k83 s TYR 147 Cb -0.68 -0.56 -0.16 0.00 0.35 0.00 0.00 41.96 40.90 3k83 s TYR 147 CO 0.54 -0.22 1.33 1.17 -1.34 0.00 0.00 175.55 177.02 3k83 n LYS 148 N 5.26 1.23 -0.20 4.97 4.81 -1.25 -1.68 118.16 131.29 3k83 n LYS 148 Ca -0.04 0.44 0.00 0.00 -0.87 0.00 0.00 58.31 57.84 3k83 n LYS 148 Cb 0.50 -2.07 0.00 0.00 0.02 0.00 0.00 35.03 33.48 3k83 n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3k83 n GLY 149 N 2.50 0.93 3.21 3.14 0.00 0.06 -4.96 105.19 110.08 3k83 n GLY 149 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 3k83 n GLY 149 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3k83 s HIS 150 N -2.60 1.74 0.61 1.61 3.76 -0.67 -4.80 115.29 114.93 3k83 s HIS 150 Ca 0.00 -0.34 -0.20 0.00 -0.15 0.00 0.00 55.06 54.37 3k83 s HIS 150 Cb 0.00 -1.08 -0.03 0.00 1.11 0.00 0.00 32.58 32.58 3k83 s HIS 150 CO 0.00 0.01 1.32 -0.51 -0.85 0.00 0.00 174.74 174.72 3k83 s ASP 151 N -0.73 4.87 -0.57 1.40 -0.00 -1.26 -0.59 116.67 119.79 3k83 s ASP 151 Ca 0.07 2.69 0.04 0.00 -0.00 0.00 0.00 52.55 55.35 3k83 s ASP 151 Cb -0.08 -2.63 0.15 0.00 -0.00 0.00 0.00 42.92 40.36 3k83 s ASP 151 CO 0.00 -1.83 0.35 -0.44 -0.00 0.00 0.00 175.17 173.25 3k83 s SER 152 N -1.21 4.25 0.25 0.27 0.01 -1.26 -4.87 113.70 111.13 3k83 s SER 152 Ca 0.78 -3.28 0.04 0.00 1.31 0.00 0.00 55.95 54.80 3k83 s SER 152 Cb -0.39 -1.48 0.30 0.00 0.21 0.00 0.00 66.02 64.67 3k83 s SER 152 CO 0.43 -0.18 1.60 0.71 0.41 0.00 0.00 173.24 176.22 3k83 h THR 153 N 4.99 1.35 -1.48 1.44 1.35 -1.84 -3.47 112.91 115.25 3k83 h THR 153 Ca 0.04 -1.77 -0.40 0.00 -0.55 0.00 0.00 66.41 63.73 3k83 h THR 153 Cb 0.85 1.83 -0.13 0.00 -1.73 0.00 0.00 68.15 68.97 3k83 h THR 153 CO 0.65 0.53 -0.39 0.18 -0.25 0.00 0.00 175.52 176.24 3k83 n LEU 154 N -3.95 -1.49 -0.13 3.87 4.77 -1.26 -1.55 117.00 117.26 3k83 n LEU 154 Ca -0.02 0.39 -0.02 0.00 -0.03 0.00 0.00 56.01 56.33 3k83 n LEU 154 Cb 0.56 -2.72 -0.01 0.00 -2.33 0.00 0.00 43.42 38.92 3k83 n LEU 154 CO 0.44 -0.86 -0.02 0.61 -1.33 0.00 0.00 177.39 176.23 3k83 n GLY 155 N -0.48 0.50 3.48 -0.72 0.00 -1.26 0.11 105.19 106.82 3k83 n GLY 155 Ca -0.20 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 3k83 n GLY 155 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k83 s LEU 156 N -0.39 3.26 0.28 0.99 1.43 -0.60 -4.25 118.68 119.40 3k83 s LEU 156 Ca 0.00 -0.15 0.02 0.00 -1.03 0.00 0.00 54.13 52.97 3k83 s LEU 156 Cb 0.00 -1.80 0.68 0.00 0.03 0.00 0.00 46.19 45.11 3k83 s LEU 156 CO 0.00 0.13 1.68 0.28 0.23 0.00 0.00 176.35 178.67 3k83 h SER 157 N 6.96 0.18 0.31 2.29 0.02 -1.88 -1.08 113.55 120.34 3k83 h SER 157 Ca -0.33 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.79 3k83 h SER 157 Cb 1.19 0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.91 3k83 h SER 157 CO 0.62 -0.06 0.00 0.00 -1.14 0.00 0.00 176.83 176.26 3k83 n LEU 158 N -5.12 0.46 -0.65 5.07 -0.00 -1.26 -1.13 117.00 114.37 3k83 n LEU 158 Ca 0.21 0.67 0.10 0.00 -0.00 0.00 0.00 56.01 56.99 3k83 n LEU 158 Cb 0.64 -0.66 0.04 0.00 -0.00 0.00 0.00 43.42 43.43 3k83 n LEU 158 CO 0.11 -0.68 0.44 0.59 -0.00 0.00 0.00 177.39 177.84 3k83 n ASN 159 N -2.07 2.33 -4.74 1.45 3.02 -0.42 -4.93 115.26 109.89 3k83 n ASN 159 Ca 0.00 -1.66 -0.41 0.00 -0.03 0.00 0.00 54.58 52.48 3k83 n ASN 159 Cb 0.11 0.24 -0.05 0.00 -0.61 0.00 0.00 39.78 39.48 3k83 n ASN 159 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3k83 s GLU 160 N -2.02 4.68 -0.82 3.52 -6.30 -0.28 -3.35 118.70 114.12 3k83 s GLU 160 Ca 0.21 1.65 -0.01 0.00 -2.50 0.00 0.00 54.97 54.32 3k83 s GLU 160 Cb 0.17 -3.27 0.00 0.00 0.00 0.00 0.00 34.13 31.03 3k83 s GLU 160 CO 0.39 0.22 0.11 0.41 0.02 0.00 0.00 175.26 176.42 3k83 n GLY 161 N 1.76 0.01 2.47 -1.50 0.00 -1.26 -4.99 105.19 101.68 3k83 n GLY 161 Ca 0.01 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.35 3k83 n GLY 161 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3k83 n MET 162 N -2.11 0.94 -2.20 1.61 2.81 -1.21 -5.11 117.12 111.85 3k83 n MET 162 Ca -0.10 -3.65 -0.38 0.00 -1.81 0.00 0.00 57.70 51.76 3k83 n MET 162 Cb 0.58 -1.78 -0.01 0.00 -0.71 0.00 0.00 33.22 31.30 3k83 n MET 162 CO 0.00 0.00 0.00 -2.14 1.51 0.00 0.00 175.97 175.34 3k83 s PRO 163 N -0.85 3.82 0.61 0.03 0.02 -1.26 -4.54 135.00 132.84 3k83 s PRO 163 Ca 0.32 1.88 -0.19 0.00 0.02 0.00 0.00 61.00 63.03 3k83 s PRO 163 Cb 0.06 -2.52 -0.03 0.00 0.02 0.00 0.00 34.50 32.04 3k83 s PRO 163 CO -0.15 -0.53 1.31 0.43 -0.33 0.00 0.00 177.00 177.73 3k83 n SER 164 N -0.29 2.25 -0.55 2.53 7.64 0.24 -4.81 113.62 120.63 3k83 n SER 164 Ca 0.06 0.88 0.09 0.00 1.01 0.00 0.00 58.87 60.91 3k83 n SER 164 Cb 0.47 -1.56 0.03 0.00 -1.01 0.00 0.00 64.21 62.14 3k83 n SER 164 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3k83 n GLU 165 N -1.55 1.58 -3.64 1.43 1.02 -1.26 -0.76 120.64 117.46 3k83 n GLU 165 Ca 0.14 -1.18 -0.14 0.00 -0.02 0.00 0.00 57.16 55.96 3k83 n GLU 165 Cb 0.47 -1.34 -0.06 0.00 -0.02 0.00 0.00 31.44 30.49 3k83 n GLU 165 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3k83 s SER 166 N -1.83 -0.36 0.33 1.62 1.04 -1.26 -4.87 113.70 108.37 3k83 s SER 166 Ca 0.18 0.17 -0.29 0.00 0.48 0.00 0.00 55.95 56.48 3k83 s SER 166 Cb 0.15 0.44 -0.12 0.00 0.10 0.00 0.00 66.02 66.59 3k83 s SER 166 CO 0.35 -0.63 1.45 0.47 0.98 0.00 0.00 173.24 175.86 3k83 n ASP 167 N 0.67 3.38 -4.63 7.02 10.43 -1.26 -3.94 116.55 128.22 3k83 n ASP 167 Ca -0.19 1.19 -0.29 0.00 2.57 0.00 0.00 54.79 58.07 3k83 n ASP 167 Cb 0.59 -1.55 0.18 0.00 1.84 0.00 0.00 41.12 42.18 3k83 n ASP 167 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3k83 h VAL 169 N -1.99 1.08 -0.33 0.00 2.07 -1.72 -1.84 116.25 113.51 3k83 h VAL 169 Ca -0.52 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 66.71 3k83 h VAL 169 Cb 1.30 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 3k83 h VAL 169 CO 0.51 0.11 -0.11 -0.37 0.02 0.00 0.00 177.57 177.74 3k83 h VAL 170 N 0.62 1.23 -0.54 2.57 -1.51 -1.81 -0.42 116.25 116.40 3k83 h VAL 170 Ca 0.19 -1.03 0.00 0.00 -1.23 0.00 0.00 66.70 64.64 3k83 h VAL 170 Cb -0.01 1.10 -0.03 0.00 -2.13 0.00 0.00 31.29 30.22 3k83 h VAL 170 CO -0.07 0.34 0.35 0.58 -1.23 0.00 0.00 177.57 177.54 3k83 h VAL 171 N 0.52 1.14 -0.25 7.19 2.07 -1.83 0.15 116.25 125.24 3k83 h VAL 171 Ca 0.10 -0.26 0.06 0.00 0.82 0.00 0.00 66.70 67.42 3k83 h VAL 171 Cb 0.50 0.35 -0.06 0.00 -1.52 0.00 0.00 31.29 30.56 3k83 h VAL 171 CO 0.03 0.13 -0.10 1.56 0.02 0.00 0.00 177.57 179.21 3k83 h GLN 172 N 0.73 -0.06 -0.45 1.57 4.20 -0.47 -0.65 115.11 119.97 3k83 h GLN 172 Ca 0.20 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.90 3k83 h GLN 172 Cb -0.08 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 3k83 h GLN 172 CO -0.04 -0.04 0.26 0.28 -0.67 0.00 0.00 178.83 178.61 3k83 h VAL 173 N -0.06 1.16 -0.38 -0.54 2.07 -0.90 0.13 116.25 117.71 3k83 h VAL 173 Ca 0.13 -0.39 0.08 0.00 0.82 0.00 0.00 66.70 67.34 3k83 h VAL 173 Cb 0.26 0.59 -0.07 0.00 -1.52 0.00 0.00 31.29 30.54 3k83 h VAL 173 CO -0.30 0.16 -0.11 -0.07 0.02 0.00 0.00 177.57 177.28 3k83 h LEU 174 N 0.60 -0.39 -0.82 2.57 3.38 -0.37 -0.46 115.31 119.81 3k83 h LEU 174 Ca 0.16 0.12 -0.07 0.00 0.09 0.00 0.00 57.88 58.18 3k83 h LEU 174 Cb 0.03 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3k83 h LEU 174 CO -0.03 -0.14 0.09 0.11 0.09 0.00 0.00 178.44 178.56 3k83 h LYS 175 N -0.02 0.97 0.00 1.13 1.57 -0.68 -1.45 116.57 118.10 3k83 h LYS 175 Ca 0.19 -0.25 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3k83 h LYS 175 Cb 0.30 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.49 3k83 h LYS 175 CO -0.40 0.91 -0.01 -0.07 -0.57 0.00 0.00 179.45 179.31 3k83 h LEU 176 N 0.92 0.00 -1.95 2.94 3.38 -0.26 -1.33 115.31 119.00 3k83 h LEU 176 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3k83 h LEU 176 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3k83 h LEU 176 CO 0.01 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.55 3k83 n GLN 177 N -3.10 2.30 -0.75 1.13 1.13 -0.23 -4.74 117.38 113.12 3k83 n GLN 177 Ca -0.00 -1.87 0.00 0.00 -1.94 0.00 0.00 57.00 53.19 3k83 n GLN 177 Cb 0.25 -1.45 0.00 0.00 0.11 0.00 0.00 30.24 29.16 3k83 n GLN 177 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3k83 n GLY 178 N 1.25 0.74 3.85 1.08 0.00 -0.50 -1.05 105.19 110.55 3k83 n GLY 178 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3k83 n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k83 s ALA 179 N -2.67 2.92 -0.50 4.61 0.00 -0.66 -0.73 121.76 124.74 3k83 s ALA 179 Ca 0.00 -0.01 0.04 0.00 0.00 0.00 0.00 51.96 51.99 3k83 s ALA 179 Cb 0.00 -3.12 0.13 0.00 0.00 0.00 0.00 23.12 20.13 3k83 s ALA 179 CO 0.00 -0.91 0.25 0.08 0.00 0.00 0.00 175.76 175.17 3k83 s VAL 180 N -3.11 2.29 0.26 0.00 1.01 0.99 -4.32 120.40 117.52 3k83 s VAL 180 Ca 0.56 -3.11 -0.30 0.00 0.00 0.00 0.00 61.98 59.13 3k83 s VAL 180 Cb -0.12 -2.59 -0.11 0.00 0.00 0.00 0.00 36.38 33.55 3k83 s VAL 180 CO 0.54 -0.82 1.54 -2.84 0.00 0.00 0.00 175.10 173.53 3k83 s PRO 181 N -0.10 4.18 0.00 2.72 0.02 -1.26 -1.68 135.00 138.88 3k83 s PRO 181 Ca 0.17 2.46 0.00 0.00 0.02 0.00 0.00 61.00 63.65 3k83 s PRO 181 Cb -0.25 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.20 3k83 s PRO 181 CO -0.00 -0.56 0.00 1.97 -0.33 0.00 0.00 177.00 178.08 3k83 n PHE 182 N 2.51 0.00 -3.78 6.54 -1.74 -0.33 -4.74 117.46 115.91 3k83 n PHE 182 Ca 0.09 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 56.85 3k83 n PHE 182 Cb 0.38 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.30 3k83 n PHE 182 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 3k83 s VAL 183 N -0.90 0.06 -0.09 1.97 -7.23 -1.26 -0.98 120.40 111.98 3k83 s VAL 183 Ca 0.00 -0.53 -0.12 0.00 -1.81 0.00 0.00 61.98 59.53 3k83 s VAL 183 Cb 0.00 -0.58 -0.05 0.00 0.56 0.00 0.00 36.38 36.31 3k83 s VAL 183 CO 0.00 -0.29 0.28 -1.00 -0.31 0.00 0.00 175.10 173.78 3k83 s HIS 184 N -1.37 3.61 0.18 2.82 3.76 -0.37 -0.72 115.29 123.20 3k83 s HIS 184 Ca -0.14 0.72 0.08 0.00 -0.15 0.00 0.00 55.06 55.57 3k83 s HIS 184 Cb -0.06 -2.18 -0.04 0.00 1.11 0.00 0.00 32.58 31.41 3k83 s HIS 184 CO 0.04 0.56 -0.04 0.95 -0.85 0.00 0.00 174.74 175.39 3k83 s THR 185 N -0.61 3.48 0.73 1.30 -4.23 0.68 -1.21 115.64 115.76 3k83 s THR 185 Ca 0.18 -1.55 -0.14 0.00 -1.18 0.00 0.00 61.69 59.00 3k83 s THR 185 Cb -0.14 -2.74 0.04 0.00 1.34 0.00 0.00 72.50 70.99 3k83 s THR 185 CO 0.07 -0.13 1.15 0.21 -0.54 0.00 0.00 174.62 175.39 3k83 s ASN 186 N -2.94 4.43 0.05 3.99 2.47 -0.19 -1.72 114.94 121.03 3k83 s ASN 186 Ca 0.27 2.16 -0.02 0.00 0.42 0.00 0.00 52.86 55.68 3k83 s ASN 186 Cb -0.09 -2.57 -0.03 0.00 -1.45 0.00 0.00 41.25 37.12 3k83 s ASN 186 CO 0.17 -2.09 0.01 0.68 -3.72 0.00 0.00 177.10 172.15 3k83 s VAL 187 N -2.27 0.18 0.60 -5.21 -7.23 -1.26 -1.86 120.40 103.35 3k83 s VAL 187 Ca 0.70 -1.50 -0.18 0.00 -1.81 0.00 0.00 61.98 59.19 3k83 s VAL 187 Cb -0.24 -1.22 -0.03 0.00 0.56 0.00 0.00 36.38 35.45 3k83 s VAL 187 CO 0.46 -0.83 1.15 -2.16 -0.31 0.00 0.00 175.10 173.42 3k83 s PRO 188 N -3.36 3.02 -0.21 4.82 0.04 -1.25 -4.28 135.00 133.78 3k83 s PRO 188 Ca 0.02 1.64 -0.39 0.00 0.04 0.00 0.00 61.00 62.31 3k83 s PRO 188 Cb 0.04 -1.96 -0.15 0.00 0.04 0.00 0.00 34.50 32.47 3k83 s PRO 188 CO -0.08 -1.12 1.73 0.94 0.04 0.00 0.00 177.00 178.51 3k83 n GLN 189 N -1.75 1.35 0.00 4.56 7.27 -0.44 -0.73 117.38 127.64 3k83 n GLN 189 Ca 0.12 0.49 0.00 0.00 0.07 0.00 0.00 57.00 57.68 3k83 n GLN 189 Cb 0.51 -2.20 0.00 0.00 2.41 0.00 0.00 30.24 30.95 3k83 n GLN 189 CO 0.00 0.00 0.00 -1.13 0.07 0.00 0.00 177.06 176.00 3k83 n SER 190 N 5.34 0.00 0.00 1.69 3.41 0.12 -4.22 113.62 119.96 3k83 n SER 190 Ca 0.25 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 3k83 n SER 190 Cb 0.16 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 3k83 n SER 190 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3k83 n MET 191 N -2.00 0.00 -1.64 4.33 2.81 0.09 -4.79 117.12 115.92 3k83 n MET 191 Ca 0.00 0.00 -0.40 0.00 -1.81 0.00 0.00 57.70 55.49 3k83 n MET 191 Cb 0.00 -1.66 -0.01 0.00 -0.71 0.00 0.00 33.22 30.83 3k83 n MET 191 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3k83 n PHE 192 N -2.00 2.77 -3.54 2.03 -0.00 -1.26 -4.50 117.46 110.96 3k83 n PHE 192 Ca 0.00 -2.99 -0.12 0.00 -0.00 0.00 0.00 57.45 54.34 3k83 n PHE 192 Cb 0.00 -2.33 -0.05 0.00 -0.00 0.00 0.00 39.48 37.10 3k83 n PHE 192 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3k83 s SER 193 N 1.94 -0.45 -0.21 -2.13 0.15 -1.26 -5.02 113.70 106.72 3k83 s SER 193 Ca 0.59 0.40 0.15 0.00 0.70 0.00 0.00 55.95 57.79 3k83 s SER 193 Cb 0.16 0.39 0.61 0.00 -1.71 0.00 0.00 66.02 65.47 3k83 s SER 193 CO -0.07 -0.48 1.52 0.00 1.20 0.00 0.00 173.24 175.42 3k83 n TYR 194 N 0.58 1.30 -2.28 3.44 0.18 -1.26 -1.91 117.16 117.21 3k83 n TYR 194 Ca -0.12 -0.90 0.00 0.00 1.88 0.00 0.00 57.90 58.75 3k83 n TYR 194 Cb 0.59 -0.39 0.00 0.00 -0.38 0.00 0.00 39.34 39.15 3k83 n TYR 194 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 3k83 n ASP 195 N -0.27 0.36 -2.74 9.48 4.64 -1.26 -1.50 116.55 125.26 3k83 n ASP 195 Ca 0.25 -0.10 -0.09 0.00 -1.38 0.00 0.00 54.79 53.47 3k83 n ASP 195 Cb 1.00 0.00 0.09 0.00 -1.04 0.00 0.00 41.12 41.17 3k83 n ASP 195 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3k83 s SER 197 N -1.49 1.74 0.10 0.00 0.15 -1.26 -1.41 113.70 111.54 3k83 s SER 197 Ca 0.24 -0.43 -0.05 0.00 0.70 0.00 0.00 55.95 56.41 3k83 s SER 197 Cb 0.36 -0.13 -0.02 0.00 -1.71 0.00 0.00 66.02 64.52 3k83 s SER 197 CO -0.06 0.07 0.13 0.54 1.20 0.00 0.00 173.24 175.11 3k83 s ASN 198 N -1.00 0.24 0.15 5.45 2.20 -0.91 -1.33 114.94 119.74 3k83 s ASN 198 Ca 0.03 -0.90 0.22 0.00 -0.94 0.00 0.00 52.86 51.26 3k83 s ASN 198 Cb -0.07 0.31 0.88 0.00 -2.00 0.00 0.00 41.25 40.37 3k83 s ASN 198 CO 0.01 -0.73 1.67 -2.65 -2.94 0.00 0.00 177.10 172.46 3k83 n PRO 199 N -0.06 0.13 -0.05 3.55 -0.02 -1.26 -0.82 135.00 136.48 3k83 n PRO 199 Ca -0.11 0.30 -0.01 0.00 -2.02 0.00 0.00 63.50 61.66 3k83 n PRO 199 Cb 0.62 -1.71 -0.00 0.00 -0.02 0.00 0.00 33.50 32.39 3k83 n PRO 199 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3k83 h LEU 200 N 0.00 0.00 -0.53 2.45 3.38 -1.92 -3.41 115.31 115.28 3k83 h LEU 200 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k83 h LEU 200 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3k83 h LEU 200 CO 0.00 0.49 -0.71 0.49 0.09 0.00 0.00 178.44 178.80 3k83 n PHE 201 N -4.55 0.00 -3.59 1.13 3.01 -1.25 -4.25 117.46 107.95 3k83 n PHE 201 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 3k83 n PHE 201 Cb 0.03 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.50 3k83 n PHE 201 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k83 n GLY 202 N 1.46 -0.40 3.55 1.37 0.00 0.00 -4.92 105.19 106.25 3k83 n GLY 202 Ca 0.07 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 3k83 n GLY 202 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k83 s GLN 203 N 0.00 3.53 -0.03 1.61 0.74 -1.26 -2.13 119.66 122.11 3k83 s GLN 203 Ca 0.00 -0.48 -0.14 0.00 0.05 0.00 0.00 55.36 54.79 3k83 s GLN 203 Cb 0.00 -2.90 -0.05 0.00 1.10 0.00 0.00 33.01 31.15 3k83 s GLN 203 CO 0.00 0.35 0.36 0.99 -0.55 0.00 0.00 175.29 176.44 3k83 s THR 204 N 0.07 5.12 0.06 -0.34 2.01 -0.50 -4.65 115.64 117.41 3k83 s THR 204 Ca 0.01 0.73 0.07 0.00 0.31 0.00 0.00 61.69 62.81 3k83 s THR 204 Cb -0.13 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 3k83 s THR 204 CO 0.02 0.57 -0.16 -0.04 -0.69 0.00 0.00 174.62 174.32 3k83 s MET 205 N -0.94 2.07 0.19 4.92 1.00 0.13 -4.37 119.30 122.29 3k83 s MET 205 Ca 0.22 -1.00 -0.32 0.00 0.00 0.00 0.00 55.69 54.60 3k83 s MET 205 Cb -0.16 -2.21 -0.11 0.00 0.00 0.00 0.00 34.83 32.35 3k83 s MET 205 CO 0.11 0.53 1.65 1.21 0.00 0.00 0.00 175.02 178.52 3k83 s ASN 206 N -1.61 6.48 0.34 3.03 3.84 -0.17 -4.64 114.94 122.20 3k83 s ASN 206 Ca 0.16 2.75 0.25 0.00 0.21 0.00 0.00 52.86 56.23 3k83 s ASN 206 Cb -0.11 -2.60 1.19 0.00 -0.55 0.00 0.00 41.25 39.19 3k83 s ASN 206 CO 0.07 -0.90 1.77 1.55 -2.79 0.00 0.00 177.10 176.79 3k83 h PRO 207 N 6.80 0.00 0.00 0.43 0.13 -1.90 -2.52 132.00 134.94 3k83 h PRO 207 Ca -0.43 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.65 3k83 h PRO 207 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 3k83 h PRO 207 CO 0.94 0.00 -0.70 -1.49 -0.23 0.00 0.00 178.00 176.52 3k83 h TRP 208 N 0.00 0.00 -0.91 1.56 4.06 -1.92 -3.46 115.95 115.28 3k83 h TRP 208 Ca 0.00 0.00 0.17 0.00 2.06 0.00 0.00 58.89 61.12 3k83 h TRP 208 Cb 0.22 0.00 -0.23 0.00 -1.00 0.00 0.00 29.16 28.15 3k83 h TRP 208 CO 0.00 0.22 0.12 0.21 -3.56 0.00 0.00 178.44 175.43 3k83 s LYS 209 N -3.15 0.32 0.55 0.49 2.20 -0.95 -5.03 119.74 114.17 3k83 s LYS 209 Ca 0.02 0.72 0.33 0.00 -0.36 0.00 0.00 55.97 56.69 3k83 s LYS 209 Cb 0.08 0.43 1.50 0.00 -1.51 0.00 0.00 37.83 38.33 3k83 s LYS 209 CO 0.75 -0.19 2.04 0.66 -0.36 0.00 0.00 175.35 178.25 3k83 h SER 210 N 7.71 0.00 0.43 1.43 4.64 -1.89 -0.57 113.55 125.30 3k83 h SER 210 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 3k83 h SER 210 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3k83 h SER 210 CO 0.06 0.05 0.00 -1.54 -0.87 0.00 0.00 176.83 174.53 3k83 n SER 211 N -3.21 0.00 -4.84 4.97 3.41 -1.26 -4.63 113.62 108.06 3k83 n SER 211 Ca -0.00 -0.15 -0.32 0.00 -0.26 0.00 0.00 58.87 58.13 3k83 n SER 211 Cb 0.27 -0.26 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 3k83 n SER 211 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3k83 s LYS 212 N -2.51 3.20 0.39 4.33 -0.14 -0.22 -1.45 119.74 123.33 3k83 s LYS 212 Ca 0.26 -0.46 -0.27 0.00 -1.36 0.00 0.00 55.97 54.14 3k83 s LYS 212 Cb 0.17 -2.93 -0.09 0.00 -1.68 0.00 0.00 37.83 33.30 3k83 s LYS 212 CO 0.38 0.64 1.33 0.45 -0.76 0.00 0.00 175.35 177.39 3k83 s SER 213 N -1.99 6.42 0.00 2.83 0.15 0.06 -1.00 113.70 120.16 3k83 s SER 213 Ca 0.27 2.71 0.23 0.00 0.70 0.00 0.00 55.95 59.86 3k83 s SER 213 Cb -0.12 -2.64 1.38 0.00 -1.71 0.00 0.00 66.02 62.92 3k83 s SER 213 CO 0.18 -0.78 1.89 -0.81 1.20 0.00 0.00 173.24 174.92 3k83 n PRO 214 N 0.32 1.02 0.00 5.44 -0.04 -1.26 -4.39 135.00 136.08 3k83 n PRO 214 Ca 0.02 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3k83 n PRO 214 Cb 0.43 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 3k83 n PRO 214 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3k83 n GLY 215 N 0.87 -2.18 0.00 0.55 0.00 -1.26 -4.17 105.19 99.00 3k83 n GLY 215 Ca 0.17 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.71 3k83 n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k83 n GLY 216 N -0.36 -1.24 0.01 -0.02 0.00 -0.56 -3.89 105.19 99.13 3k83 n GLY 216 Ca 0.00 -0.96 0.09 0.00 0.00 0.00 0.00 46.02 45.14 3k83 n GLY 216 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k83 n SER 217 N 1.15 0.04 -2.02 1.61 3.41 -0.80 -4.14 113.62 112.86 3k83 n SER 217 Ca 0.00 0.51 -0.14 0.00 -0.26 0.00 0.00 58.87 58.98 3k83 n SER 217 Cb 0.00 -0.52 -0.10 0.00 -0.26 0.00 0.00 64.21 63.34 3k83 n SER 217 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3k83 n SER 218 N -1.54 5.65 0.10 4.04 7.64 -0.77 -4.16 113.62 124.58 3k83 n SER 218 Ca 0.04 -2.69 -0.20 0.00 1.01 0.00 0.00 58.87 57.04 3k83 n SER 218 Cb 0.21 -1.30 -0.12 0.00 -1.01 0.00 0.00 64.21 61.99 3k83 n SER 218 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3k83 h GLY 219 N 4.19 0.56 0.50 0.23 0.00 -1.68 -2.65 103.07 104.22 3k83 h GLY 219 Ca 0.21 -1.24 0.08 0.00 0.00 0.00 0.00 47.33 46.39 3k83 h GLY 219 CO 0.39 1.09 0.25 -1.33 0.00 0.00 0.00 176.54 176.94 3k83 h GLY 220 N 0.72 0.84 0.73 4.60 0.00 -1.63 -0.55 103.07 107.79 3k83 h GLY 220 Ca -0.17 -0.15 0.04 0.00 0.00 0.00 0.00 47.33 47.05 3k83 h GLY 220 CO 0.23 0.03 0.23 0.83 0.00 0.00 0.00 176.54 177.85 3k83 h GLU 221 N 0.46 0.44 -0.71 4.80 4.39 -1.77 0.78 114.58 122.98 3k83 h GLU 221 Ca 0.29 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.93 3k83 h GLU 221 Cb 0.30 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 3k83 h GLU 221 CO -0.26 0.29 0.31 0.78 -1.16 0.00 0.00 179.01 178.97 3k83 h GLY 222 N 0.45 1.11 1.08 -3.84 0.00 -1.10 0.63 103.07 101.41 3k83 h GLY 222 Ca 0.21 -0.58 -0.18 0.00 0.00 0.00 0.00 47.33 46.77 3k83 h GLY 222 CO -0.15 0.55 -0.57 0.00 0.00 0.00 0.00 176.54 176.37 3k83 h ALA 223 N 1.15 0.36 -0.04 3.60 0.00 -0.91 0.15 119.26 123.57 3k83 h ALA 223 Ca 0.24 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3k83 h ALA 223 Cb 0.17 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 3k83 h ALA 223 CO -0.02 0.58 -0.05 1.25 0.00 0.00 0.00 179.25 181.01 3k83 h LEU 224 N 0.49 0.11 -0.59 0.00 5.85 -0.70 -2.53 115.31 117.94 3k83 h LEU 224 Ca -0.01 -0.51 -0.12 0.00 0.84 0.00 0.00 57.88 58.08 3k83 h LEU 224 Cb 1.19 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 3k83 h LEU 224 CO 0.12 0.60 -0.14 0.40 -0.34 0.00 0.00 178.44 179.09 3k83 h ILE 225 N -0.37 1.27 0.00 4.05 2.04 -0.95 0.17 117.51 123.72 3k83 h ILE 225 Ca 0.01 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.58 3k83 h ILE 225 Cb 0.57 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 3k83 h ILE 225 CO 0.01 0.45 0.00 1.23 0.00 0.00 0.00 178.15 179.84 3k83 h GLY 226 N 0.93 0.00 -2.06 5.37 0.00 -1.00 -1.25 103.07 105.07 3k83 h GLY 226 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3k83 h GLY 226 CO 0.05 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.45 3k83 n SER 227 N -2.46 3.51 0.00 0.19 3.41 -0.96 -4.95 113.62 112.36 3k83 n SER 227 Ca 0.02 -2.01 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 3k83 n SER 227 Cb 0.28 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 3k83 n SER 227 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k83 n GLY 228 N 1.12 0.67 0.13 5.00 0.00 -0.47 -4.95 105.19 106.68 3k83 n GLY 228 Ca 0.19 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.25 3k83 n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k83 n GLY 229 N -2.64 -0.90 3.64 -0.02 0.00 0.58 -4.82 105.19 101.03 3k83 n GLY 229 Ca 0.00 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.66 3k83 n GLY 229 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3k83 s SER 230 N -2.43 -0.86 0.30 1.61 0.15 -1.23 -4.05 113.70 107.19 3k83 s SER 230 Ca 0.30 1.45 0.26 0.00 0.70 0.00 0.00 55.95 58.66 3k83 s SER 230 Cb 0.20 1.39 0.80 0.00 -1.71 0.00 0.00 66.02 66.71 3k83 s SER 230 CO 0.46 -0.24 1.75 1.55 1.20 0.00 0.00 173.24 177.97 3k83 h PRO 231 N 6.31 0.00 -1.71 5.44 0.13 -1.88 -3.40 132.00 136.90 3k83 h PRO 231 Ca -0.30 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.88 3k83 h PRO 231 Cb 1.21 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 32.09 3k83 h PRO 231 CO 0.13 0.00 0.32 -1.17 -0.23 0.00 0.00 178.00 177.05 3k83 s LEU 232 N -5.05 -0.59 0.24 1.56 2.96 -1.26 -4.26 118.68 112.29 3k83 s LEU 232 Ca 0.08 1.05 -0.02 0.00 -0.22 0.00 0.00 54.13 55.01 3k83 s LEU 232 Cb 0.10 2.02 -0.03 0.00 0.50 0.00 0.00 46.19 48.78 3k83 s LEU 232 CO 0.56 -0.17 0.25 -0.83 -1.32 0.00 0.00 176.35 174.84 3k83 s GLY 233 N 0.73 1.41 -0.11 7.98 0.00 -0.46 -1.33 107.32 115.54 3k83 s GLY 233 Ca -0.02 -1.59 0.02 0.00 0.00 0.00 0.00 44.72 43.13 3k83 s GLY 233 CO -0.09 -1.23 -0.18 1.08 0.00 0.00 0.00 173.10 172.68 3k83 s LEU 234 N -3.17 2.47 0.00 0.66 1.43 -1.03 -0.84 118.68 118.20 3k83 s LEU 234 Ca 0.35 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 53.06 3k83 s LEU 234 Cb 0.04 -1.52 -0.00 0.00 0.03 0.00 0.00 46.19 44.74 3k83 s LEU 234 CO 0.15 0.19 0.02 0.61 0.23 0.00 0.00 176.35 177.54 3k83 n GLY 235 N 3.36 3.52 3.38 -3.19 0.00 0.06 -2.48 105.19 109.85 3k83 n GLY 235 Ca -0.18 -2.34 -0.19 0.00 0.00 0.00 0.00 46.02 43.31 3k83 n GLY 235 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k83 s THR 236 N -2.87 1.38 -0.27 2.61 -4.23 -1.26 -1.38 115.64 109.62 3k83 s THR 236 Ca 0.03 -2.09 -0.08 0.00 -1.18 0.00 0.00 61.69 58.38 3k83 s THR 236 Cb 0.00 -2.37 0.13 0.00 1.34 0.00 0.00 72.50 71.60 3k83 s THR 236 CO 0.02 -0.34 0.58 -0.62 -0.54 0.00 0.00 174.62 173.72 3k83 s ASP 237 N -3.37 -0.91 -0.00 3.99 3.68 0.32 -2.76 116.67 117.62 3k83 s ASP 237 Ca 0.28 1.28 0.02 0.00 2.13 0.00 0.00 52.55 56.27 3k83 s ASP 237 Cb 0.04 2.01 -0.03 0.00 -1.45 0.00 0.00 42.92 43.49 3k83 s ASP 237 CO 0.10 -0.23 0.06 0.00 0.13 0.00 0.00 175.17 175.22 3k83 n ILE 238 N 5.43 0.00 -1.75 4.11 3.06 -1.26 -0.75 119.36 128.20 3k83 n ILE 238 Ca -0.09 -0.13 0.00 0.00 -2.50 0.00 0.00 62.75 60.03 3k83 n ILE 238 Cb 0.49 0.56 0.00 0.00 0.54 0.00 0.00 39.64 41.24 3k83 n ILE 238 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3k83 n GLY 239 N 2.11 -0.19 0.00 4.50 0.00 -1.26 -4.75 105.19 105.60 3k83 n GLY 239 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3k83 n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k83 n GLY 240 N 0.00 -0.14 0.08 -0.02 0.00 -1.26 -2.97 105.19 100.87 3k83 n GLY 240 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 3k83 n GLY 240 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k83 n SER 241 N 0.00 0.31 0.01 1.61 7.64 -1.26 0.28 113.62 122.21 3k83 n SER 241 Ca 0.00 0.62 -0.20 0.00 1.01 0.00 0.00 58.87 60.30 3k83 n SER 241 Cb 0.00 -0.67 -0.14 0.00 -1.01 0.00 0.00 64.21 62.39 3k83 n SER 241 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 3k83 h ILE 242 N 0.00 0.67 0.17 0.44 2.04 -1.79 -2.06 117.51 116.98 3k83 h ILE 242 Ca 0.00 -2.39 -0.31 0.00 1.00 0.00 0.00 64.86 63.15 3k83 h ILE 242 Cb 0.09 2.52 0.03 0.00 -0.74 0.00 0.00 36.82 38.73 3k83 h ILE 242 CO 0.00 0.86 -1.34 0.03 0.00 0.00 0.00 178.15 177.71 3k83 h ARG 243 N 0.07 0.60 0.51 2.37 3.08 -0.53 -2.82 114.38 117.66 3k83 h ARG 243 Ca -0.40 -0.87 -0.01 0.00 0.07 0.00 0.00 59.98 58.76 3k83 h ARG 243 Cb 2.04 0.30 -0.02 0.00 0.08 0.00 0.00 29.97 32.37 3k83 h ARG 243 CO 0.10 1.41 -0.44 0.74 -1.07 0.00 0.00 179.97 180.70 3k83 h PHE 244 N 0.23 -1.19 -0.03 3.04 0.04 -0.74 0.14 116.94 118.42 3k83 h PHE 244 Ca -0.21 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.48 3k83 h PHE 244 Cb 2.01 0.46 -0.01 0.00 2.20 0.00 0.00 35.95 40.61 3k83 h PHE 244 CO 0.12 -0.61 -0.35 -1.00 -0.60 0.00 0.00 178.31 175.87 3k83 h PRO 245 N -0.94 0.06 0.07 1.51 0.13 -1.73 0.99 132.00 132.10 3k83 h PRO 245 Ca -0.06 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 3k83 h PRO 245 Cb 0.81 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 3k83 h PRO 245 CO -0.03 0.41 -0.03 0.77 -0.23 0.00 0.00 178.00 178.89 3k83 h SER 246 N 0.05 -0.08 -0.07 1.44 0.02 -1.26 -1.86 113.55 111.80 3k83 h SER 246 Ca 0.00 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 3k83 h SER 246 Cb 0.65 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 3k83 h SER 246 CO 0.05 -0.02 0.02 0.00 -1.14 0.00 0.00 176.83 175.74 3k83 h ALA 247 N 0.79 0.09 0.00 3.77 0.00 -0.54 0.16 119.26 123.53 3k83 h ALA 247 Ca -0.01 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 3k83 h ALA 247 Cb 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3k83 h ALA 247 CO 0.02 -0.30 -0.20 0.74 0.00 0.00 0.00 179.25 179.50 3k83 h PHE 248 N -0.09 0.00 -0.01 0.00 -1.00 -0.81 -2.83 116.94 112.20 3k83 h PHE 248 Ca 0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.80 3k83 h PHE 248 Cb 0.21 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.77 3k83 h PHE 248 CO -0.00 0.20 -0.28 0.00 -1.61 0.00 0.00 178.31 176.62 3k83 n GLY 250 N 1.16 0.84 3.49 0.00 0.00 -0.52 -4.69 105.19 105.47 3k83 n GLY 250 Ca 0.08 -0.63 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 3k83 n GLY 250 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k83 s ILE 251 N -2.47 0.65 -0.02 -0.61 -4.36 -0.07 -4.83 121.20 109.49 3k83 s ILE 251 Ca 0.00 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.34 3k83 s ILE 251 Cb 0.00 -2.43 -0.04 0.00 1.25 0.00 0.00 42.46 41.24 3k83 s ILE 251 CO 0.00 0.00 0.20 0.00 0.24 0.00 0.00 174.94 175.38 3k83 s GLY 253 N -1.73 -0.13 -0.09 0.00 0.00 -1.11 -0.56 107.32 103.71 3k83 s GLY 253 Ca 0.26 0.38 0.02 0.00 0.00 0.00 0.00 44.72 45.37 3k83 s GLY 253 CO 0.16 0.22 -0.12 -2.27 0.00 0.00 0.00 173.10 171.09 3k83 s LEU 254 N -0.86 1.55 -0.53 0.66 2.96 -0.46 -1.28 118.68 120.71 3k83 s LEU 254 Ca -0.09 -0.33 -0.15 0.00 -0.22 0.00 0.00 54.13 53.34 3k83 s LEU 254 Cb -0.05 -0.88 0.12 0.00 0.50 0.00 0.00 46.19 45.88 3k83 s LEU 254 CO 0.02 -0.01 0.47 -0.75 -1.32 0.00 0.00 176.35 174.77 3k83 s LYS 255 N 0.98 2.94 1.13 1.98 2.20 0.81 -3.75 119.74 126.02 3k83 s LYS 255 Ca -0.08 -1.68 -0.16 0.00 -0.36 0.00 0.00 55.97 53.69 3k83 s LYS 255 Cb -0.15 -4.25 0.25 0.00 -1.51 0.00 0.00 37.83 32.17 3k83 s LYS 255 CO -0.00 -1.28 1.10 -2.14 -0.36 0.00 0.00 175.35 172.66 3k83 s PRO 256 N 1.58 -0.63 0.37 4.03 0.02 -1.26 -0.63 135.00 138.49 3k83 s PRO 256 Ca 0.03 0.18 -0.25 0.00 0.02 0.00 0.00 61.00 60.98 3k83 s PRO 256 Cb -0.29 -1.64 -0.13 0.00 0.02 0.00 0.00 34.50 32.46 3k83 s PRO 256 CO 0.03 -3.37 0.81 2.41 -0.33 0.00 0.00 177.00 176.56 3k83 n THR 257 N -4.56 2.06 -0.27 0.99 -1.04 -1.26 -4.62 114.28 105.58 3k83 n THR 257 Ca 0.10 -0.50 0.08 0.00 -2.04 0.00 0.00 64.05 61.68 3k83 n THR 257 Cb 0.59 -0.81 0.22 0.00 -1.82 0.00 0.00 70.33 68.51 3k83 n THR 257 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 3k83 h GLY 258 N 1.37 1.19 -2.98 3.41 0.00 -1.85 -2.14 103.07 102.07 3k83 h GLY 258 Ca -0.40 -0.08 -0.07 0.00 0.00 0.00 0.00 47.33 46.77 3k83 h GLY 258 CO 0.56 -0.21 0.07 -2.01 0.00 0.00 0.00 176.54 174.95 3k83 n ASN 259 N -5.12 4.83 0.08 0.19 5.15 -1.26 -4.35 115.26 114.78 3k83 n ASN 259 Ca 0.17 -3.09 -0.04 0.00 -0.60 0.00 0.00 54.58 51.02 3k83 n ASN 259 Cb 0.52 -0.66 0.17 0.00 -0.53 0.00 0.00 39.78 39.28 3k83 n ASN 259 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 3k83 h ARG 260 N 2.88 0.29 -6.28 1.20 9.65 -1.74 -3.38 114.38 116.99 3k83 h ARG 260 Ca 0.09 -0.16 -0.59 0.00 -1.10 0.00 0.00 59.98 58.22 3k83 h ARG 260 Cb 1.93 0.01 -0.19 0.00 -1.39 0.00 0.00 29.97 30.32 3k83 h ARG 260 CO 0.49 0.70 -0.81 -0.51 2.80 0.00 0.00 179.97 182.64 3k83 s LEU 261 N -8.19 2.40 -0.04 3.80 1.43 -1.26 -4.87 118.68 111.95 3k83 s LEU 261 Ca -0.05 -0.82 -0.30 0.00 -1.03 0.00 0.00 54.13 51.93 3k83 s LEU 261 Cb 0.13 -0.98 -0.03 0.00 0.03 0.00 0.00 46.19 45.33 3k83 s LEU 261 CO 0.79 0.05 1.15 -0.55 0.23 0.00 0.00 176.35 178.02 3k83 s SER 262 N -2.48 7.11 0.00 2.29 0.15 -1.26 -4.88 113.70 114.63 3k83 s SER 262 Ca 0.16 1.79 0.20 0.00 0.70 0.00 0.00 55.95 58.79 3k83 s SER 262 Cb -0.08 -2.56 0.53 0.00 -1.71 0.00 0.00 66.02 62.20 3k83 s SER 262 CO 0.07 -0.51 1.44 0.29 1.20 0.00 0.00 173.24 175.73 3k83 n LYS 263 N 4.83 2.21 -1.98 5.44 5.02 -1.26 -4.56 118.16 127.86 3k83 n LYS 263 Ca 0.10 -1.84 -0.42 0.00 -2.02 0.00 0.00 58.31 54.12 3k83 n LYS 263 Cb 0.47 -1.44 -0.03 0.00 -0.02 0.00 0.00 35.03 34.01 3k83 n LYS 263 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3k83 s SER 264 N -1.28 6.63 0.00 4.39 0.15 -1.26 -2.14 113.70 120.19 3k83 s SER 264 Ca 0.36 2.52 0.00 0.00 0.70 0.00 0.00 55.95 59.53 3k83 s SER 264 Cb 0.20 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 3k83 s SER 264 CO 0.27 -0.82 0.00 0.61 1.20 0.00 0.00 173.24 174.51 3k83 n GLY 265 N 3.79 1.26 3.76 9.45 0.00 -1.26 -1.92 105.19 120.26 3k83 n GLY 265 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 3k83 n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k83 s LEU 266 N 0.00 3.75 -0.05 0.99 1.02 -0.91 -4.05 118.68 119.42 3k83 s LEU 266 Ca 0.00 2.43 -0.21 0.00 0.02 0.00 0.00 54.13 56.37 3k83 s LEU 266 Cb 0.00 -4.50 -0.04 0.00 0.02 0.00 0.00 46.19 41.67 3k83 s LEU 266 CO 0.00 -1.49 0.61 -0.75 0.02 0.00 0.00 176.35 174.75 3k83 s LYS 267 N -3.17 4.37 0.32 1.70 2.47 0.07 -4.92 119.74 120.58 3k83 s LYS 267 Ca 0.75 0.73 0.03 0.00 -1.56 0.00 0.00 55.97 55.92 3k83 s LYS 267 Cb -0.32 -3.40 -0.01 0.00 -1.46 0.00 0.00 37.83 32.64 3k83 s LYS 267 CO 0.35 0.20 0.12 0.41 0.16 0.00 0.00 175.35 176.59 3k83 n GLY 268 N 2.88 3.41 0.00 5.54 0.00 -1.26 -4.82 105.19 110.95 3k83 n GLY 268 Ca -0.05 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 43.90 3k83 n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k83 s VAL 270 N -0.47 0.52 -0.01 0.00 1.01 -1.26 -4.58 120.40 115.61 3k83 s VAL 270 Ca 0.00 -0.06 0.07 0.00 0.00 0.00 0.00 61.98 61.99 3k83 s VAL 270 Cb 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.77 3k83 s VAL 270 CO 0.00 0.25 -0.22 -0.31 0.00 0.00 0.00 175.10 174.82 3k83 s TYR 271 N 1.29 2.47 0.00 5.22 2.02 -1.26 -4.67 117.35 122.41 3k83 s TYR 271 Ca -0.05 -0.33 0.00 0.00 -0.37 0.00 0.00 57.07 56.32 3k83 s TYR 271 Cb -0.14 -1.52 0.00 0.00 -0.40 0.00 0.00 41.96 39.90 3k83 s TYR 271 CO -0.02 0.08 0.00 0.41 -1.57 0.00 0.00 175.55 174.45 3k83 n GLY 272 N 2.21 0.81 3.60 0.71 0.00 -1.26 -5.02 105.19 106.23 3k83 n GLY 272 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 3k83 n GLY 272 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k83 s GLN 273 N -0.30 3.83 0.00 1.61 -0.44 -1.26 -4.89 119.66 118.21 3k83 s GLN 273 Ca 0.00 0.56 0.01 0.00 -2.50 0.00 0.00 55.36 53.43 3k83 s GLN 273 Cb 0.00 -3.81 -0.00 0.00 -1.64 0.00 0.00 33.01 27.56 3k83 s GLN 273 CO 0.00 -0.97 0.30 0.25 0.50 0.00 0.00 175.29 175.38 3k83 n THR 274 N 6.01 0.00 0.11 -0.34 -2.24 -1.26 -4.71 114.28 111.84 3k83 n THR 274 Ca 0.07 -0.49 -0.13 0.00 -2.27 0.00 0.00 64.05 61.23 3k83 n THR 274 Cb 0.48 1.01 -0.06 0.00 -2.10 0.00 0.00 70.33 69.66 3k83 n THR 274 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k83 h ALA 275 N 0.17 -0.26 -3.00 6.98 0.00 -1.90 -3.40 119.26 117.86 3k83 h ALA 275 Ca 0.00 -0.04 -0.66 0.00 0.00 0.00 0.00 54.91 54.21 3k83 h ALA 275 Cb 0.03 0.18 -0.26 0.00 0.00 0.00 0.00 17.79 17.75 3k83 h ALA 275 CO 0.00 -0.66 -0.67 0.08 0.00 0.00 0.00 179.25 177.99 3k83 s VAL 276 N -6.14 3.76 -0.17 0.00 1.01 -1.26 -4.94 120.40 112.66 3k83 s VAL 276 Ca -0.15 -0.45 -0.29 0.00 0.00 0.00 0.00 61.98 61.09 3k83 s VAL 276 Cb 0.07 -2.78 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 3k83 s VAL 276 CO 0.65 0.32 1.23 -1.10 0.00 0.00 0.00 175.10 176.21 3k83 s GLN 277 N 1.52 4.24 0.09 2.72 -1.52 -1.22 -4.96 119.66 120.52 3k83 s GLN 277 Ca 0.05 1.62 -0.30 0.00 -1.95 0.00 0.00 55.36 54.78 3k83 s GLN 277 Cb -0.15 -3.74 -0.06 0.00 -0.22 0.00 0.00 33.01 28.84 3k83 s GLN 277 CO -0.00 -0.69 1.11 -1.17 -0.25 0.00 0.00 175.29 174.29 3k83 s LEU 278 N 3.42 4.41 0.09 2.90 2.96 -1.26 -4.68 118.68 126.52 3k83 s LEU 278 Ca 0.53 1.96 0.08 0.00 -0.22 0.00 0.00 54.13 56.48 3k83 s LEU 278 Cb -0.21 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.86 3k83 s LEU 278 CO 0.14 -0.33 -0.20 -0.55 -1.32 0.00 0.00 176.35 174.08 3k83 s SER 279 N 0.63 2.44 0.09 3.68 0.15 0.07 -4.66 113.70 116.11 3k83 s SER 279 Ca 0.54 -0.65 0.07 0.00 0.70 0.00 0.00 55.95 56.60 3k83 s SER 279 Cb -0.27 -0.14 -0.04 0.00 -1.71 0.00 0.00 66.02 63.86 3k83 s SER 279 CO 0.31 0.06 -0.10 -1.48 1.20 0.00 0.00 173.24 173.22 3k83 s LEU 280 N -1.78 3.02 0.15 3.45 0.05 -1.26 -0.52 118.68 121.79 3k83 s LEU 280 Ca 0.06 -0.37 -0.24 0.00 0.05 0.00 0.00 54.13 53.63 3k83 s LEU 280 Cb -0.10 -1.81 0.07 0.00 -2.05 0.00 0.00 46.19 42.31 3k83 s LEU 280 CO 0.04 0.19 1.01 -0.83 -0.55 0.00 0.00 176.35 176.21 3k83 s GLY 281 N -2.07 -0.14 0.36 -3.48 0.00 -0.48 -4.40 107.32 97.12 3k83 s GLY 281 Ca 0.20 0.02 -0.18 0.00 0.00 0.00 0.00 44.72 44.77 3k83 s GLY 281 CO 0.12 0.74 0.83 2.56 0.00 0.00 0.00 173.10 177.35 3k83 s PRO 282 N -2.86 4.14 0.03 2.90 0.04 -1.25 -0.76 135.00 137.25 3k83 s PRO 282 Ca 0.15 0.90 0.05 0.00 0.04 0.00 0.00 61.00 62.14 3k83 s PRO 282 Cb -0.01 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 32.13 3k83 s PRO 282 CO 0.03 0.10 -0.14 -1.64 0.04 0.00 0.00 177.00 175.39 3k83 s MET 283 N -2.94 0.97 0.04 4.56 -1.94 -0.02 -1.36 119.30 118.60 3k83 s MET 283 Ca 0.56 -0.68 -0.28 0.00 -1.71 0.00 0.00 55.69 53.58 3k83 s MET 283 Cb -0.11 -0.96 0.10 0.00 2.01 0.00 0.00 34.83 35.87 3k83 s MET 283 CO 0.16 0.25 1.20 0.00 -0.01 0.00 0.00 175.02 176.62 3k83 s ALA 284 N -0.71 -2.11 -0.44 3.03 0.00 0.28 -1.36 121.76 120.45 3k83 s ALA 284 Ca 0.02 0.31 0.26 0.00 0.00 0.00 0.00 51.96 52.56 3k83 s ALA 284 Cb -0.07 0.58 0.87 0.00 0.00 0.00 0.00 23.12 24.50 3k83 s ALA 284 CO 0.01 -1.08 1.77 0.00 0.00 0.00 0.00 175.76 176.46 3k83 h ARG 285 N 2.00 0.00 -3.51 0.00 3.08 -1.84 0.22 114.38 114.33 3k83 h ARG 285 Ca -0.27 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.73 3k83 h ARG 285 Cb 1.20 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.14 3k83 h ARG 285 CO 0.30 0.00 -0.10 0.16 -1.07 0.00 0.00 179.97 179.26 3k83 s ASP 286 N -5.02 -0.15 0.23 7.04 3.84 -1.26 -4.56 116.67 116.79 3k83 s ASP 286 Ca 0.06 -0.61 -0.06 0.00 -0.00 0.00 0.00 52.55 51.95 3k83 s ASP 286 Cb 0.09 0.52 0.23 0.00 -1.38 0.00 0.00 42.92 42.38 3k83 s ASP 286 CO 0.54 -0.99 1.80 0.58 -0.00 0.00 0.00 175.17 177.11 3k83 h VAL 287 N 2.33 1.25 -0.90 2.11 2.07 -1.93 -2.80 116.25 118.39 3k83 h VAL 287 Ca -0.30 -0.80 0.08 0.00 0.82 0.00 0.00 66.70 66.50 3k83 h VAL 287 Cb 1.25 0.35 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 3k83 h VAL 287 CO 0.42 0.32 0.58 -0.08 0.02 0.00 0.00 177.57 178.83 3k83 h GLU 288 N 1.10 0.95 -0.85 1.57 4.57 -1.96 -1.29 114.58 118.67 3k83 h GLU 288 Ca 0.25 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.35 3k83 h GLU 288 Cb 0.21 -0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 3k83 h GLU 288 CO -0.02 0.63 0.44 0.77 -1.18 0.00 0.00 179.01 179.65 3k83 h SER 289 N 0.97 1.08 -0.56 1.04 0.02 -1.91 0.76 113.55 114.96 3k83 h SER 289 Ca 0.40 -0.11 -0.06 0.00 -0.84 0.00 0.00 61.79 61.17 3k83 h SER 289 Cb 0.27 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 3k83 h SER 289 CO -0.16 0.89 0.11 -0.07 -1.14 0.00 0.00 176.83 176.46 3k83 h LEU 290 N 1.19 0.86 -0.50 5.07 3.38 -1.25 -1.38 115.31 122.68 3k83 h LEU 290 Ca 0.29 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3k83 h LEU 290 Cb 0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3k83 h LEU 290 CO -0.04 0.89 0.13 0.00 0.09 0.00 0.00 178.44 179.50 3k83 h ALA 291 N 1.01 0.66 -0.66 1.53 0.00 -0.98 -1.40 119.26 119.42 3k83 h ALA 291 Ca 0.17 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3k83 h ALA 291 Cb 0.38 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3k83 h ALA 291 CO 0.01 0.34 0.44 1.25 0.00 0.00 0.00 179.25 181.29 3k83 h LEU 292 N 0.69 0.76 -0.33 0.00 5.85 -0.74 -0.95 115.31 120.59 3k83 h LEU 292 Ca 0.16 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 3k83 h LEU 292 Cb 0.32 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 3k83 h LEU 292 CO 0.00 0.55 0.10 0.00 -0.34 0.00 0.00 178.44 178.75 3k83 h LEU 294 N 0.37 0.92 -0.75 0.00 5.85 -1.15 -0.74 115.31 119.80 3k83 h LEU 294 Ca 0.10 -0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.61 3k83 h LEU 294 Cb 0.25 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 3k83 h LEU 294 CO -0.00 0.78 -0.33 0.50 -0.34 0.00 0.00 178.44 179.04 3k83 h LYS 295 N 1.01 0.57 -0.13 1.25 3.64 -0.61 -1.01 116.57 121.29 3k83 h LYS 295 Ca 0.25 -0.26 -0.21 0.00 -1.27 0.00 0.00 60.65 59.16 3k83 h LYS 295 Cb 0.10 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3k83 h LYS 295 CO -0.03 0.83 -0.75 0.00 -2.27 0.00 0.00 179.45 177.23 3k83 h ALA 296 N 1.15 0.43 -0.24 5.00 0.00 -0.93 -3.27 119.26 121.40 3k83 h ALA 296 Ca 0.05 -0.60 -0.16 0.00 0.00 0.00 0.00 54.91 54.20 3k83 h ALA 296 Cb 0.81 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3k83 h ALA 296 CO 0.07 0.71 -0.52 -0.07 0.00 0.00 0.00 179.25 179.44 3k83 h LEU 297 N 0.45 0.76 -5.48 0.00 3.38 -1.01 -3.35 115.31 110.05 3k83 h LEU 297 Ca -0.04 -0.39 -0.70 0.00 0.09 0.00 0.00 57.88 56.84 3k83 h LEU 297 Cb 1.35 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 3k83 h LEU 297 CO 0.15 1.13 3.33 0.18 0.09 0.00 0.00 178.44 183.32 3k83 n LEU 298 N -3.99 7.97 -4.54 1.67 4.77 -0.39 -4.37 117.00 118.13 3k83 n LEU 298 Ca -0.03 -4.39 -0.25 0.00 -0.03 0.00 0.00 56.01 51.30 3k83 n LEU 298 Cb 0.60 -1.56 -0.09 0.00 -2.33 0.00 0.00 43.42 40.04 3k83 n LEU 298 CO 0.48 1.74 -0.24 0.00 -1.33 0.00 0.00 177.39 178.04 3k83 h GLU 300 N 1.84 0.37 -0.50 0.00 4.57 -1.94 -1.52 114.58 117.40 3k83 h GLU 300 Ca -0.39 -0.02 0.07 0.00 -1.18 0.00 0.00 59.36 57.84 3k83 h GLU 300 Cb 1.27 -0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 29.71 3k83 h GLU 300 CO 0.66 0.24 0.15 0.45 -1.18 0.00 0.00 179.01 179.33 3k83 h HIS 301 N 0.38 0.25 -0.29 0.92 3.86 -1.96 0.28 115.15 118.60 3k83 h HIS 301 Ca 0.52 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.74 3k83 h HIS 301 Cb 0.94 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.36 3k83 h HIS 301 CO -0.17 0.06 0.12 1.25 0.86 0.00 0.00 177.93 180.04 3k83 h LEU 302 N 0.31 0.40 -0.91 2.43 5.85 -1.50 -1.11 115.31 120.79 3k83 h LEU 302 Ca 0.24 -0.16 -0.11 0.00 0.84 0.00 0.00 57.88 58.69 3k83 h LEU 302 Cb 0.29 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3k83 h LEU 302 CO -0.28 0.46 -0.51 -0.26 -0.34 0.00 0.00 178.44 177.51 3k83 h PHE 303 N 0.32 0.00 0.12 1.25 0.04 -0.83 -0.72 116.94 117.12 3k83 h PHE 303 Ca 0.10 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.56 3k83 h PHE 303 Cb 0.18 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.32 3k83 h PHE 303 CO -0.01 0.51 -1.52 1.79 -0.60 0.00 0.00 178.31 178.49 3k83 h THR 304 N 0.00 1.17 0.00 -1.55 1.35 -0.97 -3.06 112.91 109.84 3k83 h THR 304 Ca -0.01 -2.81 -0.07 0.00 -0.55 0.00 0.00 66.41 62.98 3k83 h THR 304 Cb 0.96 2.77 -0.01 0.00 -1.73 0.00 0.00 68.15 70.14 3k83 h THR 304 CO 0.07 0.82 -0.32 -0.07 -0.25 0.00 0.00 175.52 175.77 3k83 h LEU 305 N 0.07 0.00 -6.43 3.87 3.38 -0.88 -3.36 115.31 111.96 3k83 h LEU 305 Ca -0.24 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.19 3k83 h LEU 305 Cb 2.01 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 42.39 3k83 h LEU 305 CO 0.16 0.32 -0.86 -0.62 0.09 0.00 0.00 178.44 177.53 3k83 s ASP 306 N -6.74 2.09 0.42 -0.43 3.68 -0.30 -4.99 116.67 110.39 3k83 s ASP 306 Ca -0.02 -2.40 0.28 0.00 2.13 0.00 0.00 52.55 52.53 3k83 s ASP 306 Cb 0.14 -0.23 1.51 0.00 -1.45 0.00 0.00 42.92 42.89 3k83 s ASP 306 CO 0.69 -0.25 1.86 -0.65 0.13 0.00 0.00 175.17 176.96 3k83 h PRO 307 N 6.49 0.00 0.00 4.34 0.11 -1.70 -2.36 132.00 138.89 3k83 h PRO 307 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3k83 h PRO 307 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 3k83 h PRO 307 CO 0.28 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.32 3k83 n THR 308 N -2.49 0.85 -3.14 -1.15 -2.24 -1.26 -4.64 114.28 100.20 3k83 n THR 308 Ca -0.02 0.20 -0.40 0.00 -2.27 0.00 0.00 64.05 61.57 3k83 n THR 308 Cb 0.06 -1.07 -0.06 0.00 -2.10 0.00 0.00 70.33 67.16 3k83 n THR 308 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3k83 s VAL 309 N -3.21 5.06 0.22 2.28 1.01 -0.89 -5.03 120.40 119.85 3k83 s VAL 309 Ca 0.06 1.19 -0.32 0.00 0.00 0.00 0.00 61.98 62.91 3k83 s VAL 309 Cb 0.10 -3.94 -0.12 0.00 0.00 0.00 0.00 36.38 32.42 3k83 s VAL 309 CO 0.37 0.19 1.69 -2.65 0.00 0.00 0.00 175.10 174.69 3k83 n PRO 310 N 4.49 2.71 -1.43 2.72 -0.02 -1.26 -4.83 135.00 137.37 3k83 n PRO 310 Ca -0.02 0.97 -0.39 0.00 -2.02 0.00 0.00 63.50 62.04 3k83 n PRO 310 Cb 0.50 -2.80 -0.02 0.00 -0.02 0.00 0.00 33.50 31.16 3k83 n PRO 310 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3k83 n PRO 311 N 3.57 2.85 -3.03 0.52 -0.04 -1.26 -4.88 135.00 132.73 3k83 n PRO 311 Ca 0.15 -2.27 -0.43 0.00 -0.04 0.00 0.00 63.50 60.90 3k83 n PRO 311 Cb 0.35 -3.02 -0.06 0.00 -0.04 0.00 0.00 33.50 30.73 3k83 n PRO 311 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3k83 s LEU 312 N 1.26 4.56 0.61 1.53 1.43 -1.26 -5.05 118.68 121.76 3k83 s LEU 312 Ca 0.55 -0.58 -0.17 0.00 -1.03 0.00 0.00 54.13 52.89 3k83 s LEU 312 Cb 0.15 -2.65 -0.02 0.00 0.03 0.00 0.00 46.19 43.69 3k83 s LEU 312 CO -0.05 -0.98 1.15 -2.16 0.23 0.00 0.00 176.35 174.54 3k83 s PRO 313 N 3.13 2.94 -0.02 1.29 0.04 -1.26 -4.93 135.00 136.20 3k83 s PRO 313 Ca 0.22 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.57 3k83 s PRO 313 Cb -0.16 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.36 3k83 s PRO 313 CO 0.16 -1.18 1.93 0.12 0.04 0.00 0.00 177.00 178.07 3k83 s PHE 314 N -1.94 1.42 -0.95 0.56 5.36 -1.26 -4.92 117.98 116.25 3k83 s PHE 314 Ca 0.72 -0.20 -0.22 0.00 -0.96 0.00 0.00 56.93 56.27 3k83 s PHE 314 Cb -0.25 -4.15 0.07 0.00 -0.34 0.00 0.00 43.02 38.36 3k83 s PHE 314 CO 0.35 -5.02 1.32 1.03 -1.46 0.00 0.00 175.22 171.44 3k83 s ARG 315 N 4.61 3.53 0.26 10.12 0.52 -1.26 -4.86 118.95 131.87 3k83 s ARG 315 Ca 0.87 -1.22 -0.02 0.00 -0.52 0.00 0.00 55.73 54.84 3k83 s ARG 315 Cb -0.39 -5.07 0.50 0.00 0.52 0.00 0.00 34.95 30.50 3k83 s ARG 315 CO 0.38 -2.06 1.77 1.49 0.02 0.00 0.00 175.30 176.90 3k83 h GLU 316 N 9.53 0.61 -0.49 3.54 4.57 -2.00 -2.11 114.58 128.23 3k83 h GLU 316 Ca 0.12 -0.04 -0.09 0.00 -1.18 0.00 0.00 59.36 58.18 3k83 h GLU 316 Cb 1.02 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.45 3k83 h GLU 316 CO 1.31 0.40 -0.05 1.05 -1.18 0.00 0.00 179.01 180.55 3k83 h GLU 317 N 0.63 0.85 -0.32 1.92 9.09 -1.97 0.43 114.58 125.21 3k83 h GLU 317 Ca 0.45 -0.26 -0.02 0.00 0.05 0.00 0.00 59.36 59.58 3k83 h GLU 317 Cb 0.60 -0.08 -0.01 0.00 -1.65 0.00 0.00 28.75 27.60 3k83 h GLU 317 CO -0.35 0.88 0.14 0.28 0.05 0.00 0.00 179.01 180.01 3k83 h VAL 318 N 0.78 1.18 -0.64 -1.06 2.07 -1.77 -1.88 116.25 114.93 3k83 h VAL 318 Ca 0.14 -0.53 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 3k83 h VAL 318 Cb 0.54 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 3k83 h VAL 318 CO 0.03 0.19 0.37 0.22 0.02 0.00 0.00 177.57 178.39 3k83 h TYR 319 N 0.38 0.85 -0.00 1.57 3.20 -1.04 -2.74 116.97 119.18 3k83 h TYR 319 Ca 0.11 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3k83 h TYR 319 Cb 0.17 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.16 3k83 h TYR 319 CO -0.01 0.58 -0.12 0.54 -1.64 0.00 0.00 178.16 177.51 3k83 n ARG 320 N -4.39 0.54 -1.70 1.82 5.12 0.09 -4.47 116.66 113.68 3k83 n ARG 320 Ca 0.06 -0.17 -0.41 0.00 -1.93 0.00 0.00 57.85 55.40 3k83 n ARG 320 Cb 0.08 -1.50 0.02 0.00 -1.16 0.00 0.00 32.46 29.90 3k83 n ARG 320 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3k83 n SER 321 N -1.08 2.43 -0.20 0.55 2.88 -0.73 -4.93 113.62 112.54 3k83 n SER 321 Ca 0.13 1.08 0.09 0.00 -1.33 0.00 0.00 58.87 58.84 3k83 n SER 321 Cb 0.29 -1.50 0.16 0.00 -0.75 0.00 0.00 64.21 62.41 3k83 n SER 321 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3k83 n SER 322 N 0.05 2.19 -4.79 -3.46 3.41 -1.26 -5.05 113.62 104.71 3k83 n SER 322 Ca 0.07 -3.29 -0.35 0.00 -0.26 0.00 0.00 58.87 55.04 3k83 n SER 322 Cb 0.40 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 63.88 3k83 n SER 322 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3k83 s ARG 323 N -2.96 3.62 0.67 4.33 0.52 -1.26 -4.99 118.95 118.87 3k83 s ARG 323 Ca 0.33 1.50 -0.17 0.00 -0.52 0.00 0.00 55.73 56.87 3k83 s ARG 323 Cb 0.30 -2.09 -0.00 0.00 0.52 0.00 0.00 34.95 33.68 3k83 s ARG 323 CO 0.01 -0.61 1.20 -2.30 0.02 0.00 0.00 175.30 173.62 3k83 n PRO 324 N -1.05 0.92 -4.66 3.54 -0.02 -1.26 -5.01 135.00 127.45 3k83 n PRO 324 Ca 0.10 0.37 -0.31 0.00 -2.02 0.00 0.00 63.50 61.64 3k83 n PRO 324 Cb 0.51 -2.44 -0.13 0.00 -0.02 0.00 0.00 33.50 31.43 3k83 n PRO 324 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3k83 s LEU 325 N -4.04 2.62 -0.40 2.45 1.43 -1.26 -5.00 118.68 114.47 3k83 s LEU 325 Ca 0.80 -0.42 -0.20 0.00 -1.03 0.00 0.00 54.13 53.28 3k83 s LEU 325 Cb -0.37 -1.52 0.01 0.00 0.03 0.00 0.00 46.19 44.34 3k83 s LEU 325 CO 0.43 0.26 0.60 -0.13 0.23 0.00 0.00 176.35 177.74 3k83 s ARG 326 N -1.42 3.43 -0.31 1.70 0.52 -1.26 -0.75 118.95 120.86 3k83 s ARG 326 Ca 0.15 -0.26 -0.05 0.00 -0.52 0.00 0.00 55.73 55.05 3k83 s ARG 326 Cb -0.10 -3.89 0.03 0.00 0.52 0.00 0.00 34.95 31.51 3k83 s ARG 326 CO 0.05 -0.86 0.06 0.08 0.02 0.00 0.00 175.30 174.65 3k83 s VAL 327 N 2.65 3.57 0.61 3.52 1.01 0.13 -0.93 120.40 130.96 3k83 s VAL 327 Ca 0.21 -1.03 -0.16 0.00 0.00 0.00 0.00 61.98 61.01 3k83 s VAL 327 Cb -0.15 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 3k83 s VAL 327 CO 0.16 -0.04 1.07 -0.83 0.00 0.00 0.00 175.10 175.47 3k83 s GLY 328 N 1.39 2.16 0.05 4.51 0.00 -0.08 -0.06 107.32 115.29 3k83 s GLY 328 Ca -0.01 0.45 -0.17 0.00 0.00 0.00 0.00 44.72 44.99 3k83 s GLY 328 CO 0.01 0.78 0.38 -2.52 0.00 0.00 0.00 173.10 171.75 3k83 s TYR 329 N -2.39 -0.22 0.01 1.90 -0.85 0.27 -0.51 117.35 115.56 3k83 s TYR 329 Ca 0.65 0.13 -0.05 0.00 -0.52 0.00 0.00 57.07 57.28 3k83 s TYR 329 Cb -0.17 0.19 -0.01 0.00 0.38 0.00 0.00 41.96 42.35 3k83 s TYR 329 CO 0.38 -0.57 0.08 1.52 -1.52 0.00 0.00 175.55 175.44 3k83 s TYR 330 N -2.62 0.12 -1.52 -3.49 1.13 -0.97 -1.21 117.35 108.81 3k83 s TYR 330 Ca -0.04 -0.29 0.15 0.00 -1.41 0.00 0.00 57.07 55.47 3k83 s TYR 330 Cb -0.01 -0.10 0.03 0.00 -1.10 0.00 0.00 41.96 40.78 3k83 s TYR 330 CO -0.03 -0.27 0.86 -0.85 -2.51 0.00 0.00 175.55 172.75 3k83 n GLU 331 N 1.43 1.61 -3.70 -3.49 -0.00 -1.26 -3.80 120.64 111.44 3k83 n GLU 331 Ca -0.23 -0.94 -0.14 0.00 -0.00 0.00 0.00 57.16 55.86 3k83 n GLU 331 Cb 0.56 -1.25 -0.08 0.00 -0.00 0.00 0.00 31.44 30.67 3k83 n GLU 331 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 3k83 s THR 332 N -1.67 0.05 -2.12 3.84 -1.32 -1.26 -4.80 115.64 108.36 3k83 s THR 332 Ca 0.14 -0.41 0.23 0.00 -1.21 0.00 0.00 61.69 60.43 3k83 s THR 332 Cb 0.12 -0.79 0.59 0.00 -1.51 0.00 0.00 72.50 70.91 3k83 s THR 332 CO 0.33 -0.23 1.50 -0.90 -2.21 0.00 0.00 174.62 173.12 3k83 n ASP 333 N 0.96 3.84 -1.34 8.08 3.85 -1.26 -4.95 116.55 125.72 3k83 n ASP 333 Ca -0.20 -2.00 -0.17 0.00 -0.71 0.00 0.00 54.79 51.71 3k83 n ASP 333 Cb 0.57 -0.42 -0.07 0.00 -1.35 0.00 0.00 41.12 39.85 3k83 n ASP 333 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 3k83 n ASN 334 N 1.62 -5.49 0.06 -1.12 5.03 -1.26 -4.73 115.26 109.37 3k83 n ASN 334 Ca 0.23 0.43 0.00 0.00 0.87 0.00 0.00 54.58 56.11 3k83 n ASN 334 Cb 0.62 -4.57 0.00 0.00 -1.02 0.00 0.00 39.78 34.81 3k83 n ASN 334 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3k83 n TYR 335 N -2.30 -0.29 -3.47 3.10 4.19 -1.26 -4.94 117.16 112.19 3k83 n TYR 335 Ca -0.17 0.05 -0.43 0.00 3.31 0.00 0.00 57.90 60.66 3k83 n TYR 335 Cb 0.65 0.07 -0.10 0.00 0.49 0.00 0.00 39.34 40.44 3k83 n TYR 335 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 3k83 s THR 336 N -2.00 5.20 -0.08 2.97 2.01 -1.26 -4.62 115.64 117.86 3k83 s THR 336 Ca 0.00 -0.70 -0.35 0.00 0.31 0.00 0.00 61.69 60.94 3k83 s THR 336 Cb 0.00 -3.91 -0.13 0.00 0.01 0.00 0.00 72.50 68.47 3k83 s THR 336 CO 0.00 -0.32 1.80 0.80 -0.69 0.00 0.00 174.62 176.21 3k83 n MET 337 N 5.15 1.96 -1.82 4.92 1.56 -1.26 -4.56 117.12 123.07 3k83 n MET 337 Ca -0.11 0.72 -0.34 0.00 -0.27 0.00 0.00 57.70 57.69 3k83 n MET 337 Cb 0.47 -2.52 0.05 0.00 2.15 0.00 0.00 33.22 33.37 3k83 n MET 337 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 3k83 s PRO 338 N 3.44 2.78 0.78 2.12 0.04 -1.26 -4.96 135.00 137.94 3k83 s PRO 338 Ca 0.92 1.58 -0.11 0.00 0.04 0.00 0.00 61.00 63.43 3k83 s PRO 338 Cb -0.77 -1.93 0.06 0.00 0.04 0.00 0.00 34.50 31.90 3k83 s PRO 338 CO 0.52 -1.30 1.09 -1.54 0.04 0.00 0.00 177.00 175.81 3k83 s SER 339 N -2.15 4.48 0.33 6.66 1.04 -1.26 -4.83 113.70 117.97 3k83 s SER 339 Ca 0.71 1.78 0.03 0.00 0.48 0.00 0.00 55.95 58.95 3k83 s SER 339 Cb -0.25 -2.49 0.63 0.00 0.10 0.00 0.00 66.02 64.01 3k83 s SER 339 CO 0.38 -2.04 1.93 -0.65 0.98 0.00 0.00 173.24 173.84 3k83 h PRO 340 N -1.13 0.88 -0.61 4.02 0.11 -1.91 -1.48 132.00 131.87 3k83 h PRO 340 Ca -0.44 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 3k83 h PRO 340 Cb 1.23 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 3k83 h PRO 340 CO 0.52 0.58 0.07 0.00 -0.21 0.00 0.00 178.00 178.95 3k83 h ALA 341 N 1.55 0.81 -0.41 -0.75 0.00 -1.90 -1.77 119.26 116.79 3k83 h ALA 341 Ca 0.35 -0.28 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3k83 h ALA 341 Cb 0.22 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3k83 h ALA 341 CO -0.12 0.60 0.12 0.52 0.00 0.00 0.00 179.25 180.36 3k83 h MET 342 N 0.94 0.26 -0.27 0.00 2.86 -1.64 -0.56 114.93 116.51 3k83 h MET 342 Ca 0.18 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.83 3k83 h MET 342 Cb 0.47 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 3k83 h MET 342 CO 0.02 0.17 0.11 -0.09 1.06 0.00 0.00 176.91 178.17 3k83 h ARG 343 N 0.26 0.23 -0.31 1.72 2.43 -1.08 -1.40 114.38 116.24 3k83 h ARG 343 Ca 0.20 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.30 3k83 h ARG 343 Cb 0.21 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 3k83 h ARG 343 CO -0.23 0.15 -0.02 -0.09 -1.51 0.00 0.00 179.97 178.28 3k83 h ARG 344 N 0.24 0.57 -0.58 0.20 2.43 -1.26 -1.80 114.38 114.18 3k83 h ARG 344 Ca 0.12 -0.19 0.10 0.00 -0.81 0.00 0.00 59.98 59.20 3k83 h ARG 344 Cb 0.07 -0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 29.49 3k83 h ARG 344 CO -0.11 0.72 0.15 0.00 -1.51 0.00 0.00 179.97 179.22 3k83 h ALA 345 N 0.83 0.71 -0.05 2.80 0.00 -0.90 0.33 119.26 122.99 3k83 h ALA 345 Ca 0.09 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3k83 h ALA 345 Cb 0.47 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 3k83 h ALA 345 CO 0.02 -0.27 0.02 1.25 0.00 0.00 0.00 179.25 180.26 3k83 h LEU 346 N 0.30 0.06 -0.43 0.00 7.12 -1.12 -2.22 115.31 119.02 3k83 h LEU 346 Ca 0.30 -0.17 -0.07 0.00 0.13 0.00 0.00 57.88 58.07 3k83 h LEU 346 Cb 0.42 -0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.52 3k83 h LEU 346 CO -0.36 0.21 -0.00 0.40 -0.13 0.00 0.00 178.44 178.56 3k83 h ILE 347 N -0.09 1.26 -0.94 4.05 2.04 -0.90 0.09 117.51 123.03 3k83 h ILE 347 Ca 0.01 -1.03 0.02 0.00 1.00 0.00 0.00 64.86 64.86 3k83 h ILE 347 Cb 0.17 1.07 -0.05 0.00 -0.74 0.00 0.00 36.82 37.27 3k83 h ILE 347 CO -0.00 0.35 0.62 -0.33 0.00 0.00 0.00 178.15 178.79 3k83 h GLU 348 N 0.60 1.19 -0.17 2.37 5.08 -0.98 0.06 114.58 122.74 3k83 h GLU 348 Ca 0.12 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 3k83 h GLU 348 Cb 0.49 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 3k83 h GLU 348 CO 0.02 0.79 -0.09 1.15 -1.00 0.00 0.00 179.01 179.88 3k83 h THR 349 N 1.23 1.32 -0.77 1.13 2.02 -1.09 -1.48 112.91 115.26 3k83 h THR 349 Ca 0.36 -1.16 0.18 0.00 0.77 0.00 0.00 66.41 66.56 3k83 h THR 349 Cb -0.07 1.73 -0.12 0.00 -1.74 0.00 0.00 68.15 67.94 3k83 h THR 349 CO -0.10 0.34 0.13 0.50 0.37 0.00 0.00 175.52 176.77 3k83 h LYS 350 N 0.02 0.19 -0.21 6.66 3.64 -0.77 -1.37 116.57 124.74 3k83 h LYS 350 Ca 0.04 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 3k83 h LYS 350 Cb 0.58 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 3k83 h LYS 350 CO 0.03 0.13 -0.50 1.96 -2.27 0.00 0.00 179.45 178.80 3k83 h GLN 351 N 0.20 0.57 -0.13 1.90 4.20 -0.51 -1.58 115.11 119.76 3k83 h GLN 351 Ca 0.44 -0.33 -0.14 0.00 0.06 0.00 0.00 58.65 58.68 3k83 h GLN 351 Cb 0.80 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 3k83 h GLN 351 CO -0.59 0.94 -0.51 0.00 -0.67 0.00 0.00 178.83 178.00 3k83 h ARG 352 N 0.45 0.35 -0.37 1.46 2.47 -0.88 -0.73 114.38 117.13 3k83 h ARG 352 Ca 0.02 -0.21 -0.06 0.00 -1.26 0.00 0.00 59.98 58.48 3k83 h ARG 352 Cb 1.03 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 29.35 3k83 h ARG 352 CO 0.10 0.78 0.01 -0.07 0.56 0.00 0.00 179.97 181.34 3k83 h LEU 353 N 0.28 0.63 -0.55 3.04 3.38 -1.11 -1.88 115.31 119.10 3k83 h LEU 353 Ca 0.01 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.71 3k83 h LEU 353 Cb 0.99 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 3k83 h LEU 353 CO 0.08 0.78 0.32 -0.33 0.09 0.00 0.00 178.44 179.38 3k83 h GLU 354 N 0.47 0.61 0.00 1.13 5.08 -1.09 -1.78 114.58 118.99 3k83 h GLU 354 Ca 0.11 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 3k83 h GLU 354 Cb 0.45 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 3k83 h GLU 354 CO 0.02 0.40 -0.07 0.00 -1.00 0.00 0.00 179.01 178.36 3k83 h ALA 355 N 1.25 1.13 -0.49 3.43 0.00 -0.94 -1.63 119.26 122.02 3k83 h ALA 355 Ca 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3k83 h ALA 355 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3k83 h ALA 355 CO -0.11 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.22 3k83 n ALA 356 N -2.18 2.42 -0.32 0.00 0.00 -0.73 -4.92 120.51 114.78 3k83 n ALA 356 Ca -0.01 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.51 3k83 n ALA 356 Cb 0.23 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.72 3k83 n ALA 356 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k83 n GLY 357 N 1.36 0.78 3.87 0.00 0.00 -0.61 -5.03 105.19 105.56 3k83 n GLY 357 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 3k83 n GLY 357 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3k83 s HIS 358 N -2.21 3.58 -0.34 1.61 3.76 -0.74 -4.74 115.29 116.21 3k83 s HIS 358 Ca 0.00 1.22 -0.12 0.00 -0.15 0.00 0.00 55.06 56.01 3k83 s HIS 358 Cb 0.00 -2.75 -0.02 0.00 1.11 0.00 0.00 32.58 30.92 3k83 s HIS 358 CO 0.00 -0.75 0.23 0.99 -0.85 0.00 0.00 174.74 174.36 3k83 s THR 359 N -3.18 5.20 -0.27 1.30 2.01 0.07 -4.41 115.64 116.35 3k83 s THR 359 Ca 0.55 -0.24 -0.13 0.00 0.31 0.00 0.00 61.69 62.19 3k83 s THR 359 Cb -0.11 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 3k83 s THR 359 CO 0.53 0.00 0.26 -0.76 -0.69 0.00 0.00 174.62 173.97 3k83 s LEU 360 N 1.71 4.03 -0.12 4.42 2.01 -1.26 0.17 118.68 129.64 3k83 s LEU 360 Ca 0.06 0.11 0.01 0.00 0.01 0.00 0.00 54.13 54.33 3k83 s LEU 360 Cb -0.17 -2.24 0.02 0.00 0.01 0.00 0.00 46.19 43.80 3k83 s LEU 360 CO 0.10 -0.10 -0.15 -0.63 1.01 0.00 0.00 176.35 176.57 3k83 s ILE 361 N 1.87 1.54 0.28 -0.59 1.01 0.91 -4.97 121.20 121.26 3k83 s ILE 361 Ca 0.10 -0.66 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 3k83 s ILE 361 Cb -0.16 -1.41 -0.11 0.00 0.01 0.00 0.00 42.46 40.79 3k83 s ILE 361 CO 0.10 0.45 1.49 -2.84 0.00 0.00 0.00 174.94 174.14 3k83 s PRO 362 N 1.07 4.21 -0.22 2.79 0.02 -1.26 -0.57 135.00 141.04 3k83 s PRO 362 Ca -0.04 2.42 -0.15 0.00 0.02 0.00 0.00 61.00 63.24 3k83 s PRO 362 Cb -0.15 -3.06 0.07 0.00 0.02 0.00 0.00 34.50 31.38 3k83 s PRO 362 CO -0.03 -0.49 0.56 0.12 -0.33 0.00 0.00 177.00 176.83 3k83 s PHE 363 N -0.19 -0.78 -0.04 6.54 2.19 -0.35 -4.75 117.98 120.60 3k83 s PHE 363 Ca 0.59 1.67 -0.01 0.00 0.33 0.00 0.00 56.93 59.51 3k83 s PHE 363 Cb -0.44 0.38 0.03 0.00 -1.31 0.00 0.00 43.02 41.68 3k83 s PHE 363 CO 0.47 -0.40 0.04 -1.17 1.83 0.00 0.00 175.22 176.00 3k83 s LEU 364 N 1.11 0.52 0.31 6.12 2.96 -1.26 -3.83 118.68 124.60 3k83 s LEU 364 Ca -0.06 0.03 -0.28 0.00 -0.22 0.00 0.00 54.13 53.59 3k83 s LEU 364 Cb -0.06 -0.19 -0.13 0.00 0.50 0.00 0.00 46.19 46.31 3k83 s LEU 364 CO -0.11 -0.20 1.18 -2.65 -1.32 0.00 0.00 176.35 173.25 3k83 n PRO 365 N 4.92 1.76 -1.08 0.98 -0.02 -1.26 -4.92 135.00 135.38 3k83 n PRO 365 Ca -0.11 0.62 -0.31 0.00 -2.02 0.00 0.00 63.50 61.68 3k83 n PRO 365 Cb 0.50 -2.12 0.12 0.00 -0.02 0.00 0.00 33.50 31.98 3k83 n PRO 365 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3k83 s ASN 366 N -0.36 3.92 -1.58 2.55 2.20 -1.26 -4.21 114.94 116.20 3k83 s ASN 366 Ca 0.58 1.90 -0.08 0.00 -0.94 0.00 0.00 52.86 54.32 3k83 s ASN 366 Cb -0.64 -2.51 0.08 0.00 -2.00 0.00 0.00 41.25 36.18 3k83 s ASN 366 CO 0.60 -2.42 0.48 0.59 -2.94 0.00 0.00 177.10 173.41 3k83 n ASN 367 N -3.78 -1.24 -0.22 3.54 3.02 -1.26 -4.87 115.26 110.45 3k83 n ASN 367 Ca 0.10 -1.08 -0.04 0.00 -0.03 0.00 0.00 54.58 53.52 3k83 n ASN 367 Cb 0.53 -2.56 0.06 0.00 -0.61 0.00 0.00 39.78 37.20 3k83 n ASN 367 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3k83 h ILE 368 N -1.63 1.09 -0.73 2.41 2.04 -1.94 -1.11 117.51 117.64 3k83 h ILE 368 Ca -0.62 -0.27 0.02 0.00 1.00 0.00 0.00 64.86 64.99 3k83 h ILE 368 Cb 1.38 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 3k83 h ILE 368 CO 0.72 0.14 0.47 -0.65 0.00 0.00 0.00 178.15 178.83 3k83 h PRO 369 N 0.78 0.91 -0.37 2.37 0.11 -1.92 0.15 132.00 134.03 3k83 h PRO 369 Ca 0.25 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.33 3k83 h PRO 369 Cb 0.01 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 30.88 3k83 h PRO 369 CO -0.10 0.60 0.19 -0.92 -0.21 0.00 0.00 178.00 177.56 3k83 h TYR 370 N 0.94 0.35 -0.58 0.65 3.20 -1.88 0.15 116.97 119.80 3k83 h TYR 370 Ca 0.28 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.13 3k83 h TYR 370 Cb -0.05 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.09 3k83 h TYR 370 CO -0.03 0.19 0.22 0.00 -1.64 0.00 0.00 178.16 176.90 3k83 h ALA 371 N 1.19 1.30 0.00 1.82 0.00 -0.16 0.18 119.26 123.60 3k83 h ALA 371 Ca 0.15 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k83 h ALA 371 Cb 0.05 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3k83 h ALA 371 CO -0.10 0.52 -0.00 -0.07 0.00 0.00 0.00 179.25 179.60 3k83 h LEU 372 N 0.83 -0.00 0.20 0.00 3.38 -0.89 0.18 115.31 119.01 3k83 h LEU 372 Ca 0.20 -0.91 -0.30 0.00 0.09 0.00 0.00 57.88 56.96 3k83 h LEU 372 Cb 0.18 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.95 3k83 h LEU 372 CO -0.02 0.91 -1.41 -0.33 0.09 0.00 0.00 178.44 177.69 3k83 h GLU 373 N -0.91 0.41 0.00 1.13 5.08 -0.61 -2.15 114.58 117.53 3k83 h GLU 373 Ca -0.00 -0.71 -0.08 0.00 -1.00 0.00 0.00 59.36 57.58 3k83 h GLU 373 Cb 0.91 0.26 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 3k83 h GLU 373 CO 0.00 1.34 -0.72 0.28 -1.00 0.00 0.00 179.01 178.91 3k83 h VAL 374 N -0.04 0.33 0.06 3.13 2.07 -1.14 -3.35 116.25 117.32 3k83 h VAL 374 Ca -0.26 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 65.84 3k83 h VAL 374 Cb 1.99 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 3k83 h VAL 374 CO 0.19 0.11 -0.03 -0.07 0.02 0.00 0.00 177.57 177.80 3k83 h LEU 375 N -1.00 -0.06 0.27 2.57 3.38 -1.51 -1.73 115.31 117.23 3k83 h LEU 375 Ca -0.12 -0.58 -0.01 0.00 0.09 0.00 0.00 57.88 57.26 3k83 h LEU 375 Cb 0.75 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.52 3k83 h LEU 375 CO -0.07 0.65 -0.13 0.28 0.09 0.00 0.00 178.44 179.26 3k83 h SER 376 N -0.88 -0.31 -0.21 -0.43 0.02 -0.70 -0.18 113.55 110.87 3k83 h SER 376 Ca -0.01 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 3k83 h SER 376 Cb 0.64 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 3k83 h SER 376 CO 0.01 0.16 0.14 0.74 -1.14 0.00 0.00 176.83 176.74 3k83 h THR 377 N -0.90 1.05 -0.27 -2.27 2.02 -1.57 -0.20 112.91 110.77 3k83 h THR 377 Ca -0.04 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 3k83 h THR 377 Cb 0.51 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 3k83 h THR 377 CO 0.06 0.05 0.02 1.23 0.37 0.00 0.00 175.52 177.26 3k83 h GLY 378 N 0.28 0.42 0.63 2.16 0.00 -1.37 0.14 103.07 105.33 3k83 h GLY 378 Ca 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 3k83 h GLY 378 CO -0.02 0.21 -0.08 -1.33 0.00 0.00 0.00 176.54 175.32 3k83 h GLY 379 N 0.67 -0.25 2.00 4.60 0.00 -0.57 -1.07 103.07 108.46 3k83 h GLY 379 Ca 0.09 0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 3k83 h GLY 379 CO 0.00 -0.09 -0.06 1.41 0.00 0.00 0.00 176.54 177.81 3k83 h LEU 380 N -0.61 0.00 -3.39 3.11 3.38 -0.82 -3.29 115.31 113.69 3k83 h LEU 380 Ca -0.02 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.75 3k83 h LEU 380 Cb 0.45 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.00 3k83 h LEU 380 CO 0.04 0.06 -0.70 0.49 0.09 0.00 0.00 178.44 178.41 3k83 n PHE 381 N -4.37 0.90 0.25 1.13 3.72 0.02 -4.84 117.46 114.26 3k83 n PHE 381 Ca -0.03 -1.64 0.10 0.00 -0.05 0.00 0.00 57.45 55.83 3k83 n PHE 381 Cb 0.14 -0.26 0.67 0.00 -0.94 0.00 0.00 39.48 39.09 3k83 n PHE 381 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3k83 h SER 382 N 1.46 0.00 -0.57 4.37 0.02 -1.26 -0.33 113.55 117.24 3k83 h SER 382 Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3k83 h SER 382 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 3k83 h SER 382 CO 0.25 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.04 3k83 n ASP 383 N -4.45 5.42 0.00 3.07 5.75 -1.26 -1.81 116.55 123.27 3k83 n ASP 383 Ca -0.02 -2.82 0.00 0.00 -0.01 0.00 0.00 54.79 51.94 3k83 n ASP 383 Cb 0.12 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 39.55 3k83 n ASP 383 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3k83 n GLY 384 N 0.69 0.32 1.18 6.12 0.00 -0.13 -2.87 105.19 110.51 3k83 n GLY 384 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 3k83 n GLY 384 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k83 n GLY 385 N -1.57 0.74 0.15 -0.02 0.00 -1.26 -4.75 105.19 98.48 3k83 n GLY 385 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3k83 n GLY 385 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3k83 h ARG 386 N 3.70 0.42 -0.28 1.61 2.47 -1.87 0.11 114.38 120.54 3k83 h ARG 386 Ca 0.00 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.67 3k83 h ARG 386 Cb 0.00 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.22 3k83 h ARG 386 CO 0.00 0.33 0.15 0.77 0.56 0.00 0.00 179.97 181.78 3k83 h SER 387 N 0.40 0.36 -0.60 7.04 0.02 -1.94 -2.61 113.55 116.22 3k83 h SER 387 Ca 0.11 -0.09 0.08 0.00 -0.84 0.00 0.00 61.79 61.05 3k83 h SER 387 Cb 0.01 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 62.40 3k83 h SER 387 CO -0.02 0.34 0.26 0.15 -1.14 0.00 0.00 176.83 176.42 3k83 h PHE 388 N 0.34 0.45 0.00 3.45 3.57 -1.75 -2.95 116.94 120.06 3k83 h PHE 388 Ca 0.10 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 3k83 h PHE 388 Cb 0.07 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 3k83 h PHE 388 CO -0.03 0.15 -0.26 -0.07 -2.23 0.00 0.00 178.31 175.87 3k83 h LEU 389 N 0.46 0.00 -1.25 0.59 3.38 -0.42 -2.28 115.31 115.80 3k83 h LEU 389 Ca 0.29 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.44 3k83 h LEU 389 Cb 0.31 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.98 3k83 h LEU 389 CO -0.26 0.26 0.60 1.56 0.09 0.00 0.00 178.44 180.69 3k83 h GLN 390 N 0.00 0.63 -0.12 1.13 1.08 -1.31 -0.10 115.11 116.43 3k83 h GLN 390 Ca -0.00 -0.04 0.03 0.00 -1.45 0.00 0.00 58.65 57.19 3k83 h GLN 390 Cb 0.50 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.78 3k83 h GLN 390 CO 0.03 0.42 0.19 -0.91 -0.95 0.00 0.00 178.83 177.61 3k83 h ASN 391 N 0.65 0.00 -0.02 1.46 2.35 -1.55 -3.00 115.58 115.47 3k83 h ASN 391 Ca 0.50 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.25 3k83 h ASN 391 Cb 0.89 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.26 3k83 h ASN 391 CO -0.25 0.00 -0.23 0.49 -1.65 0.00 0.00 177.43 175.79 3k83 n PHE 392 N -3.50 0.00 -1.65 1.19 3.72 -0.05 -4.70 117.46 112.46 3k83 n PHE 392 Ca 0.00 0.00 -0.46 0.00 -0.05 0.00 0.00 57.45 56.94 3k83 n PHE 392 Cb 0.29 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.79 3k83 n PHE 392 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3k83 n LYS 393 N 0.60 2.30 -0.78 -1.08 5.02 -1.14 -1.10 118.16 121.99 3k83 n LYS 393 Ca 0.11 0.82 0.00 0.00 -2.02 0.00 0.00 58.31 57.21 3k83 n LYS 393 Cb 0.50 -2.81 0.00 0.00 -0.02 0.00 0.00 35.03 32.69 3k83 n LYS 393 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k83 n GLY 394 N 4.74 0.86 3.78 0.72 0.00 -1.26 -4.94 105.19 109.10 3k83 n GLY 394 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 3k83 n GLY 394 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3k83 s ASP 395 N -2.91 5.44 0.58 1.61 -1.08 -0.25 -4.38 116.67 115.67 3k83 s ASP 395 Ca 0.00 -0.16 -0.20 0.00 -0.52 0.00 0.00 52.55 51.67 3k83 s ASP 395 Cb 0.00 -1.39 -0.04 0.00 -1.46 0.00 0.00 42.92 40.03 3k83 s ASP 395 CO 0.00 0.07 1.25 -0.36 0.52 0.00 0.00 175.17 176.64 3k83 s PHE 396 N -1.76 2.37 -0.29 -5.34 0.40 -1.26 -5.02 117.98 107.09 3k83 s PHE 396 Ca 0.31 1.49 -0.09 0.00 -0.60 0.00 0.00 56.93 58.03 3k83 s PHE 396 Cb -0.10 -3.57 -0.02 0.00 0.51 0.00 0.00 43.02 39.85 3k83 s PHE 396 CO 0.23 -2.38 0.13 0.08 0.70 0.00 0.00 175.22 173.97 3k83 s VAL 397 N -1.50 4.58 0.27 -0.44 1.01 -1.26 -4.93 120.40 118.12 3k83 s VAL 397 Ca 0.76 -0.26 -0.31 0.00 0.00 0.00 0.00 61.98 62.17 3k83 s VAL 397 Cb -0.33 -3.25 -0.13 0.00 0.00 0.00 0.00 36.38 32.67 3k83 s VAL 397 CO 0.37 0.18 1.47 -0.67 0.00 0.00 0.00 175.10 176.45 3k83 n ASP 398 N 4.97 3.15 0.05 3.32 -0.08 -1.26 -4.86 116.55 121.85 3k83 n ASP 398 Ca -0.15 1.15 0.21 0.00 -1.51 0.00 0.00 54.79 54.49 3k83 n ASP 398 Cb 0.50 -1.49 0.74 0.00 2.34 0.00 0.00 41.12 43.21 3k83 n ASP 398 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3k83 h PRO 399 N 4.32 0.00 0.00 -0.67 0.11 -1.94 -1.74 132.00 132.08 3k83 h PRO 399 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3k83 h PRO 399 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3k83 h PRO 399 CO 0.76 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.55 3k83 n LEU 401 N -2.16 0.00 0.00 0.00 4.77 -0.65 -3.52 117.00 115.43 3k83 n LEU 401 Ca 0.02 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.41 3k83 n LEU 401 Cb 0.24 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.92 3k83 n LEU 401 CO 0.20 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 3k83 n GLY 402 N 1.12 3.06 1.21 -0.72 0.00 -0.28 -2.34 105.19 107.24 3k83 n GLY 402 Ca 0.09 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 46.01 3k83 n GLY 402 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k83 n ASP 403 N 2.36 3.52 -0.20 1.61 8.00 -1.26 -4.59 116.55 125.99 3k83 n ASP 403 Ca 0.00 -1.99 -0.01 0.00 0.71 0.00 0.00 54.79 53.50 3k83 n ASP 403 Cb 0.00 -0.42 0.06 0.00 -0.02 0.00 0.00 41.12 40.74 3k83 n ASP 403 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3k83 h LEU 404 N 3.92 -0.54 -0.32 0.64 5.85 -1.77 0.38 115.31 123.48 3k83 h LEU 404 Ca 0.00 0.18 -0.09 0.00 0.84 0.00 0.00 57.88 58.81 3k83 h LEU 404 Cb 0.89 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 3k83 h LEU 404 CO 0.00 -0.19 -0.14 0.40 -0.34 0.00 0.00 178.44 178.16 3k83 h ILE 405 N 0.01 1.29 -0.66 4.05 1.08 -1.82 -0.45 117.51 121.01 3k83 h ILE 405 Ca 0.29 -1.24 0.02 0.00 -0.39 0.00 0.00 64.86 63.53 3k83 h ILE 405 Cb 0.44 1.42 -0.04 0.00 -3.07 0.00 0.00 36.82 35.58 3k83 h ILE 405 CO -0.61 0.40 0.42 0.25 -0.69 0.00 0.00 178.15 177.92 3k83 h LEU 406 N 0.42 0.70 -0.26 1.44 6.46 -1.73 -1.60 115.31 120.75 3k83 h LEU 406 Ca 0.07 -0.01 -0.06 0.00 -0.12 0.00 0.00 57.88 57.77 3k83 h LEU 406 Cb 0.67 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.43 3k83 h LEU 406 CO 0.04 0.50 -0.07 0.40 -0.62 0.00 0.00 178.44 178.69 3k83 h ILE 407 N 0.83 1.29 0.00 4.05 2.04 -0.70 -2.96 117.51 122.06 3k83 h ILE 407 Ca 0.25 -1.10 -0.04 0.00 1.00 0.00 0.00 64.86 64.98 3k83 h ILE 407 Cb -0.03 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 3k83 h ILE 407 CO -0.08 0.34 -0.19 -0.07 0.00 0.00 0.00 178.15 178.15 3k83 h LEU 408 N 0.25 0.00 -1.73 1.44 3.38 -0.91 -2.67 115.31 115.08 3k83 h LEU 408 Ca 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3k83 h LEU 408 Cb 0.55 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 3k83 h LEU 408 CO 0.03 0.19 -0.05 0.03 0.09 0.00 0.00 178.44 178.73 3k83 h ARG 409 N 0.00 0.00 -6.87 1.13 3.08 -1.11 -3.45 114.38 107.15 3k83 h ARG 409 Ca -0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 3k83 h ARG 409 Cb 0.34 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.48 3k83 h ARG 409 CO 0.02 0.05 0.80 -0.51 -1.07 0.00 0.00 179.97 179.26 3k83 s LEU 410 N -6.40 4.35 0.41 3.04 1.43 -1.01 -4.96 118.68 115.54 3k83 s LEU 410 Ca -0.00 2.94 -0.25 0.00 -1.03 0.00 0.00 54.13 55.78 3k83 s LEU 410 Cb 0.10 -3.65 -0.10 0.00 0.03 0.00 0.00 46.19 42.57 3k83 s LEU 410 CO 0.54 -0.83 1.22 -2.65 0.23 0.00 0.00 176.35 174.85 3k83 n PRO 411 N 1.24 1.81 -0.26 1.29 -0.02 -1.26 -4.70 135.00 133.10 3k83 n PRO 411 Ca 0.04 0.64 0.05 0.00 -2.02 0.00 0.00 63.50 62.22 3k83 n PRO 411 Cb 0.39 -2.30 0.19 0.00 -0.02 0.00 0.00 33.50 31.76 3k83 n PRO 411 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3k83 h SER 412 N 2.00 0.35 -0.98 2.55 0.87 -1.95 0.38 113.55 116.77 3k83 h SER 412 Ca -0.47 0.10 0.11 0.00 -1.23 0.00 0.00 61.79 60.30 3k83 h SER 412 Cb 1.30 0.06 -0.08 0.00 -0.44 0.00 0.00 62.40 63.24 3k83 h SER 412 CO 0.59 0.14 0.61 4.11 -0.53 0.00 0.00 176.83 181.76 3k83 h TRP 413 N 0.49 1.11 -0.01 2.24 5.08 -1.99 -0.96 115.95 121.92 3k83 h TRP 413 Ca 0.42 0.03 -0.23 0.00 1.08 0.00 0.00 58.89 60.19 3k83 h TRP 413 Cb 0.62 -0.35 0.01 0.00 -3.00 0.00 0.00 29.16 26.43 3k83 h TRP 413 CO -0.14 0.46 -0.95 0.35 -1.28 0.00 0.00 178.44 176.88 3k83 h PHE 414 N 0.99 0.71 -0.64 0.12 3.57 -1.30 -0.86 116.94 119.53 3k83 h PHE 414 Ca 0.47 -0.38 0.09 0.00 3.53 0.00 0.00 57.97 61.68 3k83 h PHE 414 Cb 0.42 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.01 3k83 h PHE 414 CO -0.01 1.20 0.28 0.87 -2.23 0.00 0.00 178.31 178.42 3k83 h LYS 415 N 0.27 0.47 -0.55 1.11 1.57 -1.10 -0.74 116.57 117.61 3k83 h LYS 415 Ca -0.09 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.63 3k83 h LYS 415 Cb 1.59 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.77 3k83 h LYS 415 CO 0.17 0.31 0.20 -0.09 -0.57 0.00 0.00 179.45 179.48 3k83 h ARG 416 N 0.48 0.84 -0.32 3.15 2.43 -0.92 -0.18 114.38 119.86 3k83 h ARG 416 Ca 0.32 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 3k83 h ARG 416 Cb 0.36 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 3k83 h ARG 416 CO -0.28 0.74 0.09 1.25 -1.51 0.00 0.00 179.97 180.26 3k83 h LEU 417 N 0.76 0.47 -1.11 3.80 5.85 -0.94 -1.96 115.31 122.17 3k83 h LEU 417 Ca 0.18 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 3k83 h LEU 417 Cb 0.23 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3k83 h LEU 417 CO -0.01 0.56 0.07 0.25 -0.34 0.00 0.00 178.44 178.96 3k83 h LEU 418 N 0.35 0.65 -0.14 2.25 5.85 -0.95 -1.93 115.31 121.40 3k83 h LEU 418 Ca 0.10 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 3k83 h LEU 418 Cb 0.26 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 3k83 h LEU 418 CO -0.00 0.67 0.08 -1.28 -0.34 0.00 0.00 178.44 177.57 3k83 h SER 419 N 0.67 0.17 -0.49 1.25 0.87 -0.83 -1.69 113.55 113.49 3k83 h SER 419 Ca 0.14 -0.08 0.09 0.00 -1.23 0.00 0.00 61.79 60.72 3k83 h SER 419 Cb 0.31 -0.04 -0.08 0.00 -0.44 0.00 0.00 62.40 62.16 3k83 h SER 419 CO 0.00 0.20 0.05 -0.07 -0.53 0.00 0.00 176.83 176.48 3k83 h LEU 420 N 0.12 -0.11 -0.80 2.23 4.07 -1.03 -1.42 115.31 118.37 3k83 h LEU 420 Ca 0.05 0.10 -0.03 0.00 0.08 0.00 0.00 57.88 58.08 3k83 h LEU 420 Cb 0.07 0.17 -0.04 0.00 1.08 0.00 0.00 40.66 41.94 3k83 h LEU 420 CO -0.01 -0.03 0.37 -0.07 -1.08 0.00 0.00 178.44 177.62 3k83 h LEU 421 N 0.17 1.07 -0.49 1.67 4.07 -0.95 -2.98 115.31 117.86 3k83 h LEU 421 Ca 0.25 -0.15 -0.11 0.00 0.08 0.00 0.00 57.88 57.95 3k83 h LEU 421 Cb 0.36 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.81 3k83 h LEU 421 CO -0.37 0.92 -0.52 -0.07 -1.08 0.00 0.00 178.44 177.31 3k83 h LEU 422 N 1.15 0.00 -0.72 1.67 3.38 -1.11 -3.39 115.31 116.28 3k83 h LEU 422 Ca 0.27 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.41 3k83 h LEU 422 Cb 0.15 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.77 3k83 h LEU 422 CO -0.03 0.52 0.04 0.50 0.09 0.00 0.00 178.44 179.56 3k83 h LYS 423 N 0.00 0.13 -0.53 1.13 3.64 -1.09 0.38 116.57 120.23 3k83 h LYS 423 Ca -0.01 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 3k83 h LYS 423 Cb 1.19 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 3k83 h LYS 423 CO 0.07 0.09 -0.02 -1.35 -2.27 0.00 0.00 179.45 175.97 3k83 h PRO 424 N 0.14 0.92 0.04 1.90 0.11 -1.78 -3.10 132.00 130.24 3k83 h PRO 424 Ca 0.40 -0.28 -0.36 0.00 0.11 0.00 0.00 66.00 65.87 3k83 h PRO 424 Cb 0.69 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 31.66 3k83 h PRO 424 CO -0.61 0.93 -2.17 1.28 -0.21 0.00 0.00 178.00 177.22 3k83 n LEU 425 N -4.19 1.99 -3.27 2.35 4.32 -0.97 -4.76 117.00 112.48 3k83 n LEU 425 Ca 0.03 0.10 -0.25 0.00 -0.02 0.00 0.00 56.01 55.86 3k83 n LEU 425 Cb 0.34 -0.55 -0.07 0.00 -1.62 0.00 0.00 43.42 41.51 3k83 n LEU 425 CO 0.43 0.74 -0.06 0.49 -1.22 0.00 0.00 177.39 177.77 3k83 n PHE 426 N -3.21 2.14 -0.32 -1.77 3.72 0.13 -4.95 117.46 113.20 3k83 n PHE 426 Ca -0.34 -3.92 0.08 0.00 -0.05 0.00 0.00 57.45 53.22 3k83 n PHE 426 Cb 1.05 -0.47 0.28 0.00 -0.94 0.00 0.00 39.48 39.40 3k83 n PHE 426 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 3k83 h PRO 427 N 3.88 0.88 -0.13 -1.08 0.11 -1.68 -1.55 132.00 132.43 3k83 h PRO 427 Ca 0.14 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.19 3k83 h PRO 427 Cb 0.74 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 3k83 h PRO 427 CO 0.69 0.58 0.05 0.00 -0.21 0.00 0.00 178.00 179.12 3k83 h ARG 428 N 0.91 0.19 -0.62 1.05 3.08 -1.92 0.12 114.38 117.18 3k83 h ARG 428 Ca 0.46 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.41 3k83 h ARG 428 Cb 0.49 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.48 3k83 h ARG 428 CO -0.22 0.28 0.14 -0.07 -1.07 0.00 0.00 179.97 179.03 3k83 h LEU 429 N 0.06 0.95 -0.69 3.04 3.38 -1.80 -0.74 115.31 119.50 3k83 h LEU 429 Ca 0.04 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 3k83 h LEU 429 Cb 0.16 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3k83 h LEU 429 CO -0.00 0.94 0.36 0.00 0.09 0.00 0.00 178.44 179.83 3k83 h ALA 430 N 1.04 0.89 -0.28 1.53 0.00 -1.17 -1.48 119.26 119.78 3k83 h ALA 430 Ca 0.19 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3k83 h ALA 430 Cb 0.37 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3k83 h ALA 430 CO 0.00 0.42 0.02 0.00 0.00 0.00 0.00 179.25 179.70 3k83 h ALA 431 N 1.17 0.38 -0.38 0.00 0.00 -0.24 -1.05 119.26 119.14 3k83 h ALA 431 Ca 0.24 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3k83 h ALA 431 Cb 0.07 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3k83 h ALA 431 CO -0.04 0.10 0.23 0.74 0.00 0.00 0.00 179.25 180.28 3k83 h PHE 432 N 0.29 0.51 -0.66 0.00 0.04 -1.02 -2.34 116.94 113.76 3k83 h PHE 432 Ca 0.08 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.85 3k83 h PHE 432 Cb 0.39 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 38.34 3k83 h PHE 432 CO 0.03 0.37 0.40 1.25 -0.60 0.00 0.00 178.31 179.76 3k83 h LEU 433 N 0.50 0.79 -1.11 1.54 5.85 -1.18 -2.28 115.31 119.43 3k83 h LEU 433 Ca 0.14 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 3k83 h LEU 433 Cb 0.01 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 3k83 h LEU 433 CO -0.03 0.61 -0.22 -1.13 -0.34 0.00 0.00 178.44 177.34 3k83 h ASN 434 N 0.89 0.36 -0.16 1.25 -1.24 -1.00 -3.01 115.58 112.67 3k83 h ASN 434 Ca 0.24 -0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.14 3k83 h ASN 434 Cb -0.03 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 38.92 3k83 h ASN 434 CO -0.05 0.59 0.00 0.59 -1.29 0.00 0.00 177.43 177.28 3k83 n ASN 435 N -4.16 1.38 -1.01 1.15 3.02 -0.89 -3.19 115.26 111.56 3k83 n ASN 435 Ca -0.00 -1.71 0.08 0.00 -0.03 0.00 0.00 54.58 52.92 3k83 n ASN 435 Cb 0.36 -0.10 0.26 0.00 -0.61 0.00 0.00 39.78 39.69 3k83 n ASN 435 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 3k83 n MET 436 N 0.15 3.19 -3.19 3.52 2.81 -1.03 -3.63 117.12 118.94 3k83 n MET 436 Ca 0.15 -2.65 -0.32 0.00 -1.81 0.00 0.00 57.70 53.07 3k83 n MET 436 Cb 0.27 -1.72 -0.06 0.00 -0.71 0.00 0.00 33.22 31.01 3k83 n MET 436 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 3k83 s ARG 437 N -2.14 3.92 0.78 0.03 0.52 -1.19 -4.03 118.95 116.83 3k83 s ARG 437 Ca 0.39 0.53 -0.11 0.00 -0.52 0.00 0.00 55.73 56.02 3k83 s ARG 437 Cb 0.28 -2.49 0.06 0.00 0.52 0.00 0.00 34.95 33.32 3k83 s ARG 437 CO 0.14 0.18 1.09 -1.25 0.02 0.00 0.00 175.30 175.47 3k83 s PRO 438 N -3.05 2.22 0.26 3.54 0.04 -1.26 -3.71 135.00 133.04 3k83 s PRO 438 Ca 0.52 1.08 -0.14 0.00 0.04 0.00 0.00 61.00 62.50 3k83 s PRO 438 Cb -0.10 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.54 3k83 s PRO 438 CO 0.20 -1.64 0.53 -0.98 0.04 0.00 0.00 177.00 175.16 3k83 s ARG 439 N -4.94 1.64 0.79 4.56 1.70 -0.75 -4.83 118.95 117.11 3k83 s ARG 439 Ca 0.61 -1.23 -0.12 0.00 -0.47 0.00 0.00 55.73 54.52 3k83 s ARG 439 Cb -0.17 0.50 0.06 0.00 -0.57 0.00 0.00 34.95 34.78 3k83 s ARG 439 CO 0.56 -0.70 1.12 -1.54 -1.08 0.00 0.00 175.30 173.66 3k83 s SER 440 N -3.01 4.67 0.31 -2.89 1.04 -1.26 -4.86 113.70 107.69 3k83 s SER 440 Ca 0.20 1.11 -0.00 0.00 0.48 0.00 0.00 55.95 57.74 3k83 s SER 440 Cb -0.02 -1.80 0.51 0.00 0.10 0.00 0.00 66.02 64.81 3k83 s SER 440 CO 0.09 -1.83 1.95 0.00 0.98 0.00 0.00 173.24 174.43 3k83 h ALA 441 N -1.00 1.48 -0.46 5.32 0.00 -1.99 -1.65 119.26 120.96 3k83 h ALA 441 Ca -0.47 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.45 3k83 h ALA 441 Cb 1.28 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 3k83 h ALA 441 CO 0.62 0.44 0.20 1.49 0.00 0.00 0.00 179.25 182.00 3k83 h GLU 442 N 1.04 0.39 -0.29 0.00 4.81 -2.00 0.06 114.58 118.59 3k83 h GLU 442 Ca 0.33 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.46 3k83 h GLU 442 Cb 0.03 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 3k83 h GLU 442 CO -0.10 0.26 -0.14 0.87 -0.73 0.00 0.00 179.01 179.17 3k83 h LYS 443 N 0.41 0.51 -0.33 1.92 6.56 -1.79 -2.47 116.57 121.38 3k83 h LYS 443 Ca 0.21 -0.16 -0.08 0.00 -1.06 0.00 0.00 60.65 59.57 3k83 h LYS 443 Cb 0.16 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.76 3k83 h LYS 443 CO -0.18 0.65 -0.09 1.25 -2.06 0.00 0.00 179.45 179.02 3k83 h LEU 444 N 0.47 0.65 -0.53 2.94 5.85 -0.69 -1.55 115.31 122.45 3k83 h LEU 444 Ca 0.08 -0.37 0.11 0.00 0.84 0.00 0.00 57.88 58.54 3k83 h LEU 444 Cb 0.53 -0.18 -0.09 0.00 0.37 0.00 0.00 40.66 41.29 3k83 h LEU 444 CO 0.03 0.87 -0.04 -0.50 -0.34 0.00 0.00 178.44 178.47 3k83 h TRP 445 N 0.42 -0.10 -0.43 1.25 4.06 -0.90 0.18 115.95 120.43 3k83 h TRP 445 Ca 0.08 0.04 0.01 0.00 2.06 0.00 0.00 58.89 61.09 3k83 h TRP 445 Cb 0.59 0.13 -0.02 0.00 -1.00 0.00 0.00 29.16 28.86 3k83 h TRP 445 CO 0.05 -0.16 0.27 -0.22 -3.56 0.00 0.00 178.44 174.82 3k83 h LYS 446 N 0.08 0.53 -0.36 0.49 3.64 -1.26 -0.05 116.57 119.64 3k83 h LYS 446 Ca 0.27 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.64 3k83 h LYS 446 Cb 0.42 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 3k83 h LYS 446 CO -0.48 0.35 0.17 1.25 -2.27 0.00 0.00 179.45 178.47 3k83 h LEU 447 N 0.54 0.25 -1.21 5.20 5.85 -0.65 -1.21 115.31 124.08 3k83 h LEU 447 Ca 0.16 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.92 3k83 h LEU 447 Cb -0.03 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 3k83 h LEU 447 CO -0.06 0.19 0.54 1.56 -0.34 0.00 0.00 178.44 180.32 3k83 h GLN 448 N 0.36 1.04 -0.32 1.25 1.08 -0.06 0.26 115.11 118.71 3k83 h GLN 448 Ca 0.15 -0.06 -0.12 0.00 -1.45 0.00 0.00 58.65 57.17 3k83 h GLN 448 Cb 0.07 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.26 3k83 h GLN 448 CO -0.11 0.69 -0.29 1.25 -0.95 0.00 0.00 178.83 179.41 3k83 h HIS 449 N 1.07 0.77 -0.41 2.96 2.76 -0.64 -1.55 115.15 120.12 3k83 h HIS 449 Ca 0.30 -0.19 -0.11 0.00 -2.20 0.00 0.00 60.37 58.18 3k83 h HIS 449 Cb -0.08 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 28.69 3k83 h HIS 449 CO -0.00 0.89 -0.18 0.93 -1.30 0.00 0.00 177.93 178.27 3k83 h GLU 450 N 0.58 0.79 -0.36 5.26 5.08 -0.42 0.43 114.58 125.93 3k83 h GLU 450 Ca 0.07 -0.29 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 3k83 h GLU 450 Cb 0.79 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 3k83 h GLU 450 CO 0.06 0.91 0.24 0.82 -1.00 0.00 0.00 179.01 180.04 3k83 h ILE 451 N 0.70 1.09 -0.29 3.13 2.04 -0.58 0.14 117.51 123.74 3k83 h ILE 451 Ca 0.10 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 3k83 h ILE 451 Cb 0.68 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3k83 h ILE 451 CO 0.05 0.09 0.13 -0.08 0.00 0.00 0.00 178.15 178.34 3k83 h GLU 452 N 0.49 0.42 -0.59 2.37 4.81 -0.91 -1.24 114.58 119.92 3k83 h GLU 452 Ca 0.14 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.27 3k83 h GLU 452 Cb -0.05 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 3k83 h GLU 452 CO -0.03 0.42 0.26 0.52 -0.73 0.00 0.00 179.01 179.44 3k83 h MET 453 N 0.32 0.85 -0.42 1.92 2.86 -0.69 -2.19 114.93 117.58 3k83 h MET 453 Ca 0.10 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 3k83 h MET 453 Cb 0.14 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 3k83 h MET 453 CO -0.01 0.68 -0.05 -0.92 1.06 0.00 0.00 176.91 177.67 3k83 h TYR 454 N 0.84 0.87 -0.66 -0.22 5.03 -0.29 -0.90 116.97 121.64 3k83 h TYR 454 Ca 0.20 -0.17 0.01 0.00 2.58 0.00 0.00 58.73 61.35 3k83 h TYR 454 Cb 0.13 -0.22 -0.03 0.00 1.55 0.00 0.00 36.73 38.16 3k83 h TYR 454 CO 0.01 0.87 0.43 -0.09 -1.32 0.00 0.00 178.16 178.07 3k83 h ARG 455 N 0.61 0.87 -0.09 1.82 2.43 -0.99 -1.60 114.38 117.42 3k83 h ARG 455 Ca 0.11 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 3k83 h ARG 455 Cb 0.56 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 3k83 h ARG 455 CO 0.03 0.57 -0.34 1.96 -1.51 0.00 0.00 179.97 180.69 3k83 h GLN 456 N 0.89 0.18 -0.55 0.20 1.08 -1.15 -2.10 115.11 113.66 3k83 h GLN 456 Ca 0.24 -0.07 -0.11 0.00 -1.45 0.00 0.00 58.65 57.26 3k83 h GLN 456 Cb -0.10 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.30 3k83 h GLN 456 CO -0.05 0.50 -0.10 0.66 -0.95 0.00 0.00 178.83 178.89 3k83 h SER 457 N 0.16 1.04 -0.12 1.46 4.64 -0.26 0.11 113.55 120.57 3k83 h SER 457 Ca 0.02 -0.35 -0.20 0.00 -0.47 0.00 0.00 61.79 60.79 3k83 h SER 457 Cb 0.68 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 3k83 h SER 457 CO 0.05 1.14 -0.67 0.58 -0.87 0.00 0.00 176.83 177.06 3k83 h VAL 458 N 0.91 1.29 -0.41 0.95 2.07 -1.26 -1.90 116.25 117.90 3k83 h VAL 458 Ca 0.14 -1.89 0.07 0.00 0.82 0.00 0.00 66.70 65.84 3k83 h VAL 458 Cb 0.67 1.86 -0.06 0.00 -1.52 0.00 0.00 31.29 32.23 3k83 h VAL 458 CO 0.05 0.60 0.02 0.40 0.02 0.00 0.00 177.57 178.66 3k83 h ILE 459 N 0.54 0.71 -0.41 4.57 2.04 -1.26 -0.81 117.51 122.88 3k83 h ILE 459 Ca -0.02 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 65.82 3k83 h ILE 459 Cb 1.28 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 3k83 h ILE 459 CO 0.14 0.02 0.22 0.00 0.00 0.00 0.00 178.15 178.53 3k83 h ALA 460 N 1.35 0.51 -0.74 1.87 0.00 -0.86 0.63 119.26 122.03 3k83 h ALA 460 Ca 0.20 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.21 3k83 h ALA 460 Cb 0.28 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.92 3k83 h ALA 460 CO -0.32 -0.13 0.39 1.96 0.00 0.00 0.00 179.25 181.15 3k83 h GLN 461 N 0.44 0.66 -0.20 0.00 4.20 -1.03 -0.58 115.11 118.60 3k83 h GLN 461 Ca 0.17 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.79 3k83 h GLN 461 Cb 0.06 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 3k83 h GLN 461 CO -0.11 0.43 -0.08 2.35 -0.67 0.00 0.00 178.83 180.75 3k83 h TRP 462 N 0.67 0.47 -0.74 2.96 2.91 -0.39 -2.74 115.95 119.09 3k83 h TRP 462 Ca 0.36 -0.11 0.07 0.00 1.13 0.00 0.00 58.89 60.34 3k83 h TRP 462 Cb 0.34 -0.11 -0.06 0.00 -0.51 0.00 0.00 29.16 28.82 3k83 h TRP 462 CO -0.09 0.69 0.42 0.87 -1.03 0.00 0.00 178.44 179.30 3k83 h LYS 463 N 0.11 0.72 0.00 2.65 6.56 -0.72 -1.33 116.57 124.57 3k83 h LYS 463 Ca 0.05 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 3k83 h LYS 463 Cb 0.56 -0.16 0.00 0.00 -0.57 0.00 0.00 32.23 32.06 3k83 h LYS 463 CO 0.03 0.48 0.00 0.00 -2.06 0.00 0.00 179.45 177.90 3k83 n ALA 464 N -2.37 1.69 0.44 3.86 0.00 -0.24 -0.92 120.51 122.97 3k83 n ALA 464 Ca 0.10 0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.67 3k83 n ALA 464 Cb 0.21 -1.36 0.09 0.00 0.00 0.00 0.00 19.45 18.39 3k83 n ALA 464 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3k83 n MET 465 N -2.09 1.45 -3.84 0.00 2.81 -0.92 -4.99 117.12 109.53 3k83 n MET 465 Ca 0.03 -1.57 -0.28 0.00 -1.81 0.00 0.00 57.70 54.06 3k83 n MET 465 Cb 0.23 -1.30 0.04 0.00 -0.71 0.00 0.00 33.22 31.47 3k83 n MET 465 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3k83 n ASN 466 N 0.85 -4.66 -4.77 7.83 4.05 -0.10 -4.94 115.26 113.52 3k83 n ASN 466 Ca 0.10 -0.75 -0.36 0.00 0.45 0.00 0.00 54.58 54.03 3k83 n ASN 466 Cb 0.40 -4.09 -0.00 0.00 1.23 0.00 0.00 39.78 37.32 3k83 n ASN 466 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3k83 s LEU 467 N -7.22 3.88 -0.21 1.20 1.43 -0.87 -4.83 118.68 112.06 3k83 s LEU 467 Ca 0.58 2.24 -0.14 0.00 -1.03 0.00 0.00 54.13 55.78 3k83 s LEU 467 Cb -0.29 -4.41 -0.18 0.00 0.03 0.00 0.00 46.19 41.34 3k83 s LEU 467 CO 0.81 -1.06 0.04 0.47 0.23 0.00 0.00 176.35 176.84 3k83 n ASP 468 N -0.89 1.96 -3.86 2.29 10.43 -0.10 -4.90 116.55 121.47 3k83 n ASP 468 Ca 0.09 0.29 -0.14 0.00 2.57 0.00 0.00 54.79 57.60 3k83 n ASP 468 Cb 0.49 -0.84 -0.09 0.00 1.84 0.00 0.00 41.12 42.53 3k83 n ASP 468 CO 0.00 0.00 0.00 0.68 -1.07 0.00 0.00 177.20 176.81 3k83 s VAL 469 N -2.46 0.00 -0.02 2.53 -7.23 -0.99 -4.65 120.40 107.58 3k83 s VAL 469 Ca -0.31 -1.93 0.02 0.00 -1.81 0.00 0.00 61.98 57.95 3k83 s VAL 469 Cb 0.09 -2.49 0.01 0.00 0.56 0.00 0.00 36.38 34.54 3k83 s VAL 469 CO 0.60 0.00 -0.06 -0.22 -0.31 0.00 0.00 175.10 175.12 3k83 s LEU 470 N -3.22 1.75 -0.17 1.32 2.96 -0.01 -0.90 118.68 120.41 3k83 s LEU 470 Ca 0.38 -0.12 -0.02 0.00 -0.22 0.00 0.00 54.13 54.15 3k83 s LEU 470 Cb 0.04 -0.38 -0.01 0.00 0.50 0.00 0.00 46.19 46.34 3k83 s LEU 470 CO 0.17 0.03 -0.10 -0.22 -1.32 0.00 0.00 176.35 174.91 3k83 s LEU 471 N 0.24 2.76 0.15 -0.68 2.96 0.33 -0.72 118.68 123.72 3k83 s LEU 471 Ca -0.03 -0.37 0.02 0.00 -0.22 0.00 0.00 54.13 53.54 3k83 s LEU 471 Cb -0.07 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.92 3k83 s LEU 471 CO -0.00 0.09 -0.03 0.42 -1.32 0.00 0.00 176.35 175.50 3k83 s THR 472 N 0.83 0.73 0.66 3.68 -4.23 -0.51 -2.28 115.64 114.52 3k83 s THR 472 Ca -0.03 -1.97 -0.16 0.00 -1.18 0.00 0.00 61.69 58.34 3k83 s THR 472 Cb -0.15 -1.95 0.00 0.00 1.34 0.00 0.00 72.50 71.75 3k83 s THR 472 CO 0.01 -0.63 1.17 -2.84 -0.54 0.00 0.00 174.62 171.79 3k83 s PRO 473 N -3.87 2.63 -0.05 3.99 0.02 -1.25 -0.70 135.00 135.77 3k83 s PRO 473 Ca 0.19 1.66 0.06 0.00 0.02 0.00 0.00 61.00 62.94 3k83 s PRO 473 Cb 0.05 -1.90 -0.02 0.00 0.02 0.00 0.00 34.50 32.66 3k83 s PRO 473 CO 0.01 -1.44 -0.24 1.41 -0.33 0.00 0.00 177.00 176.41 3k83 s MET 474 N -3.77 2.43 0.13 5.54 1.75 -1.25 -4.37 119.30 119.76 3k83 s MET 474 Ca 0.73 -0.89 -0.34 0.00 -1.25 0.00 0.00 55.69 53.94 3k83 s MET 474 Cb -0.27 -2.16 -0.14 0.00 2.84 0.00 0.00 34.83 35.11 3k83 s MET 474 CO 0.40 0.45 1.61 -0.11 -0.65 0.00 0.00 175.02 176.72 3k83 n LEU 475 N 2.75 3.10 0.00 4.11 7.94 -1.26 -4.67 117.00 128.96 3k83 n LEU 475 Ca -0.17 1.07 0.00 0.00 -1.11 0.00 0.00 56.01 55.80 3k83 n LEU 475 Cb 0.52 -1.41 0.00 0.00 0.53 0.00 0.00 43.42 43.05 3k83 n LEU 475 CO 0.25 -0.28 0.00 0.61 -1.11 0.00 0.00 177.39 176.86 3k83 n GLY 476 N 3.51 0.55 3.67 -3.96 0.00 -1.26 -4.74 105.19 102.96 3k83 n GLY 476 Ca 0.18 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 3k83 n GLY 476 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k83 s PRO 477 N -2.00 -0.36 0.24 1.61 0.04 -1.26 -4.46 135.00 128.82 3k83 s PRO 477 Ca 0.00 0.08 -0.30 0.00 0.04 0.00 0.00 61.00 60.82 3k83 s PRO 477 Cb 0.00 -1.68 -0.15 0.00 0.04 0.00 0.00 34.50 32.71 3k83 s PRO 477 CO 0.00 -3.16 1.08 0.00 0.04 0.00 0.00 177.00 174.95 3k83 n ALA 478 N -4.40 -0.38 -1.81 8.56 0.00 -1.26 -4.86 120.51 116.36 3k83 n ALA 478 Ca 0.10 0.42 -0.34 0.00 0.00 0.00 0.00 53.44 53.63 3k83 n ALA 478 Cb 0.59 -2.03 -0.06 0.00 0.00 0.00 0.00 19.45 17.95 3k83 n ALA 478 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3k83 s LEU 479 N 0.56 3.98 0.67 0.00 1.02 -1.26 -4.67 118.68 118.98 3k83 s LEU 479 Ca 0.64 1.76 -0.17 0.00 0.02 0.00 0.00 54.13 56.38 3k83 s LEU 479 Cb -0.75 -4.47 -0.02 0.00 0.02 0.00 0.00 46.19 40.96 3k83 s LEU 479 CO 0.56 -0.40 0.89 0.47 0.02 0.00 0.00 176.35 177.89 3k83 n ASP 480 N -0.54 0.30 -4.66 2.29 8.00 -0.61 -0.76 116.55 120.57 3k83 n ASP 480 Ca 0.07 0.71 -0.42 0.00 0.71 0.00 0.00 54.79 55.86 3k83 n ASP 480 Cb 0.53 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.27 3k83 n ASP 480 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3k83 n LEU 481 N -1.08 3.31 -0.11 0.64 4.77 -0.53 -2.55 117.00 121.46 3k83 n LEU 481 Ca 0.13 1.12 -0.01 0.00 -0.03 0.00 0.00 56.01 57.21 3k83 n LEU 481 Cb 0.49 -1.43 -0.01 0.00 -2.33 0.00 0.00 43.42 40.14 3k83 n LEU 481 CO 0.49 -0.92 -0.01 0.59 -1.33 0.00 0.00 177.39 176.21 3k83 n ASN 482 N 0.51 -4.16 -0.06 -1.43 3.02 -1.26 -4.88 115.26 107.01 3k83 n ASN 482 Ca 0.07 0.03 -0.03 0.00 -0.03 0.00 0.00 54.58 54.62 3k83 n ASN 482 Cb 0.38 -1.78 -0.12 0.00 -0.61 0.00 0.00 39.78 37.65 3k83 n ASN 482 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3k83 n THR 483 N -2.63 0.77 -0.29 3.41 -2.24 -1.06 -4.58 114.28 107.66 3k83 n THR 483 Ca -0.01 -0.58 0.10 0.00 -2.27 0.00 0.00 64.05 61.29 3k83 n THR 483 Cb 0.21 -0.41 0.33 0.00 -2.10 0.00 0.00 70.33 68.37 3k83 n THR 483 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3k83 h PRO 484 N 0.00 0.77 0.00 -0.78 0.11 -1.89 0.08 132.00 130.29 3k83 h PRO 484 Ca -0.30 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3k83 h PRO 484 Cb 1.63 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.56 3k83 h PRO 484 CO 0.02 0.51 0.00 0.41 -0.21 0.00 0.00 178.00 178.72 3k83 n GLY 485 N -1.41 -0.82 0.48 -0.55 0.00 -1.23 -1.47 105.19 100.20 3k83 n GLY 485 Ca 0.17 0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.28 3k83 n GLY 485 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k83 n ARG 486 N -1.76 2.76 -3.08 1.61 1.74 -0.01 -4.39 116.66 113.53 3k83 n ARG 486 Ca 0.01 -1.88 -0.19 0.00 -0.77 0.00 0.00 57.85 55.03 3k83 n ARG 486 Cb 0.08 -1.20 -0.02 0.00 -1.02 0.00 0.00 32.46 30.29 3k83 n ARG 486 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k83 n ALA 487 N 0.29 2.61 0.23 7.54 0.00 -0.54 -4.40 120.51 126.25 3k83 n ALA 487 Ca 0.09 -3.59 0.07 0.00 0.00 0.00 0.00 53.44 50.01 3k83 n ALA 487 Cb 0.38 -0.89 0.60 0.00 0.00 0.00 0.00 19.45 19.54 3k83 n ALA 487 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3k83 h THR 488 N 1.54 1.03 -0.52 0.00 2.02 -1.84 -2.43 112.91 112.71 3k83 h THR 488 Ca 0.09 -0.09 0.08 0.00 0.77 0.00 0.00 66.41 67.25 3k83 h THR 488 Cb 0.92 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.30 3k83 h THR 488 CO 0.55 0.03 0.35 1.23 0.37 0.00 0.00 175.52 178.05 3k83 h GLY 489 N 0.11 0.49 1.40 2.16 0.00 -1.92 -2.34 103.07 102.97 3k83 h GLY 489 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.19 3k83 h GLY 489 CO 0.00 0.10 0.00 0.00 0.00 0.00 0.00 176.54 176.64 3k83 n ALA 490 N -2.52 1.83 1.37 3.60 0.00 -0.91 -1.86 120.51 122.01 3k83 n ALA 490 Ca 0.08 -0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.57 3k83 n ALA 490 Cb 0.32 -1.21 0.69 0.00 0.00 0.00 0.00 19.45 19.24 3k83 n ALA 490 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3k83 n VAL 491 N -1.20 0.12 -0.11 0.00 0.24 -0.88 -4.20 118.33 112.30 3k83 n VAL 491 Ca 0.07 0.03 -0.05 0.00 -2.04 0.00 0.00 64.34 62.35 3k83 n VAL 491 Cb 0.09 -0.62 0.02 0.00 -1.47 0.00 0.00 33.84 31.86 3k83 n VAL 491 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3k83 h SER 492 N 0.00 -0.05 -0.99 -1.34 4.64 -1.61 0.74 113.55 114.94 3k83 h SER 492 Ca 0.00 0.07 0.12 0.00 -0.47 0.00 0.00 61.79 61.51 3k83 h SER 492 Cb 0.13 0.11 -0.08 0.00 -0.31 0.00 0.00 62.40 62.25 3k83 h SER 492 CO 0.00 0.01 0.63 1.88 -0.87 0.00 0.00 176.83 178.48 3k83 h TYR 493 N 0.16 1.11 0.03 4.77 0.05 -1.87 -3.04 116.97 118.17 3k83 h TYR 493 Ca 0.18 0.03 -0.34 0.00 0.05 0.00 0.00 58.73 58.65 3k83 h TYR 493 Cb 0.22 -0.35 -0.04 0.00 1.01 0.00 0.00 36.73 37.56 3k83 h TYR 493 CO -0.21 0.45 -1.90 0.25 -1.05 0.00 0.00 178.16 175.69 3k83 n THR 494 N -4.60 1.58 0.28 -2.88 -2.24 -0.94 -4.39 114.28 101.09 3k83 n THR 494 Ca 0.19 -0.32 0.13 0.00 -2.27 0.00 0.00 64.05 61.77 3k83 n THR 494 Cb 0.36 -1.86 0.81 0.00 -2.10 0.00 0.00 70.33 67.53 3k83 n THR 494 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 3k83 h MET 495 N -0.65 0.00 -0.71 -0.78 1.85 -0.76 -0.86 114.93 113.03 3k83 h MET 495 Ca -0.48 0.00 0.15 0.00 -0.61 0.00 0.00 59.70 58.75 3k83 h MET 495 Cb 1.62 0.00 -0.04 0.00 0.43 0.00 0.00 31.60 33.60 3k83 h MET 495 CO -0.19 0.03 0.48 1.25 -0.40 0.00 0.00 176.91 178.08 3k83 h LEU 496 N 0.00 0.32 0.00 3.39 5.85 -1.74 -1.23 115.31 121.90 3k83 h LEU 496 Ca -0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3k83 h LEU 496 Cb 0.06 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.04 3k83 h LEU 496 CO 0.00 0.17 -0.52 -1.22 -0.34 0.00 0.00 178.44 176.53 3k83 n TYR 497 N -4.46 0.57 0.10 1.25 4.01 -0.33 -1.57 117.16 116.73 3k83 n TYR 497 Ca 0.13 0.17 -0.20 0.00 -0.16 0.00 0.00 57.90 57.84 3k83 n TYR 497 Cb 0.54 -0.67 -0.12 0.00 -0.31 0.00 0.00 39.34 38.77 3k83 n TYR 497 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 3k83 h ASN 498 N 0.00 0.72 0.10 7.72 4.21 -1.32 0.16 115.58 127.17 3k83 h ASN 498 Ca 0.00 -0.69 -0.00 0.00 1.21 0.00 0.00 56.30 56.82 3k83 h ASN 498 Cb 0.73 -0.23 0.00 0.00 -1.12 0.00 0.00 38.32 37.70 3k83 h ASN 498 CO 0.00 1.51 -0.05 0.00 -1.29 0.00 0.00 177.43 177.60 3k83 h LEU 500 N -0.14 0.00 -2.61 0.00 3.38 -1.38 -3.46 115.31 111.09 3k83 h LEU 500 Ca -0.01 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.51 3k83 h LEU 500 Cb 0.11 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.91 3k83 h LEU 500 CO 0.02 0.00 -0.91 -0.67 0.09 0.00 0.00 178.44 176.97 3k83 n ASP 501 N -2.69 -3.30 -4.81 -0.43 4.64 0.48 -4.96 116.55 105.49 3k83 n ASP 501 Ca 0.03 -0.98 -0.29 0.00 -1.38 0.00 0.00 54.79 52.16 3k83 n ASP 501 Cb 0.35 -3.43 -0.06 0.00 -1.04 0.00 0.00 41.12 36.94 3k83 n ASP 501 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 3k83 s PHE 502 N -3.63 3.24 0.35 -0.67 2.99 -0.72 -4.52 117.98 115.02 3k83 s PHE 502 Ca 0.27 0.08 -0.28 0.00 0.00 0.00 0.00 56.93 57.01 3k83 s PHE 502 Cb -0.09 -1.62 -0.10 0.00 0.00 0.00 0.00 43.02 41.21 3k83 s PHE 502 CO 0.86 0.53 1.26 -1.25 -0.00 0.00 0.00 175.22 176.61 3k83 s PRO 503 N -2.61 4.26 -0.16 0.24 0.04 -1.23 -4.58 135.00 130.97 3k83 s PRO 503 Ca 0.31 2.09 -0.07 0.00 0.04 0.00 0.00 61.00 63.37 3k83 s PRO 503 Cb -0.12 -2.95 0.07 0.00 0.04 0.00 0.00 34.50 31.54 3k83 s PRO 503 CO 0.23 -0.22 0.35 0.00 0.04 0.00 0.00 177.00 177.40 3k83 s ALA 504 N -1.22 -0.89 0.30 8.56 0.00 0.20 -2.33 121.76 126.38 3k83 s ALA 504 Ca 0.51 1.29 0.07 0.00 0.00 0.00 0.00 51.96 53.84 3k83 s ALA 504 Cb -0.37 -1.04 -0.06 0.00 0.00 0.00 0.00 23.12 21.66 3k83 s ALA 504 CO 0.48 -0.51 -0.06 0.20 0.00 0.00 0.00 175.76 175.87 3k83 s GLY 505 N 2.03 1.92 0.12 0.00 0.00 -0.21 -0.14 107.32 111.04 3k83 s GLY 505 Ca -0.04 -1.95 0.07 0.00 0.00 0.00 0.00 44.72 42.80 3k83 s GLY 505 CO -0.11 -1.89 -0.18 -1.34 0.00 0.00 0.00 173.10 169.58 3k83 s VAL 506 N -2.92 1.59 -0.05 1.40 -7.23 -0.41 0.18 120.40 112.95 3k83 s VAL 506 Ca 0.30 -1.64 0.01 0.00 -1.81 0.00 0.00 61.98 58.84 3k83 s VAL 506 Cb 0.04 -1.56 0.02 0.00 0.56 0.00 0.00 36.38 35.44 3k83 s VAL 506 CO 0.13 -0.22 -0.05 -0.69 -0.31 0.00 0.00 175.10 173.96 3k83 s VAL 507 N -1.59 0.60 0.19 1.32 1.01 -1.02 -2.73 120.40 118.17 3k83 s VAL 507 Ca 0.08 -0.14 -0.31 0.00 0.00 0.00 0.00 61.98 61.61 3k83 s VAL 507 Cb -0.08 -0.63 -0.10 0.00 0.00 0.00 0.00 36.38 35.57 3k83 s VAL 507 CO 0.04 0.25 1.55 -2.84 0.00 0.00 0.00 175.10 174.10 3k83 s PRO 508 N 1.05 4.22 0.00 2.72 0.02 -1.26 -2.38 135.00 139.37 3k83 s PRO 508 Ca -0.09 2.37 0.00 0.00 0.02 0.00 0.00 61.00 63.30 3k83 s PRO 508 Cb -0.14 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.24 3k83 s PRO 508 CO -0.01 -0.58 0.00 1.33 -0.33 0.00 0.00 177.00 177.42 3k83 n VAL 509 N 3.58 0.00 -3.75 3.83 0.24 -0.44 -4.86 118.33 116.93 3k83 n VAL 509 Ca 0.12 -0.10 -0.09 0.00 -2.04 0.00 0.00 64.34 62.24 3k83 n VAL 509 Cb 0.39 0.53 0.03 0.00 -1.47 0.00 0.00 33.84 33.31 3k83 n VAL 509 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 3k83 n THR 510 N -0.87 0.00 -4.13 3.34 5.66 -1.06 -4.80 114.28 112.42 3k83 n THR 510 Ca 0.00 -0.95 -0.16 0.00 -3.05 0.00 0.00 64.05 59.89 3k83 n THR 510 Cb 0.00 0.93 -0.12 0.00 -1.55 0.00 0.00 70.33 69.59 3k83 n THR 510 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3k83 s THR 511 N -2.18 0.86 0.17 1.09 -4.23 -1.26 -1.07 115.64 109.02 3k83 s THR 511 Ca 0.15 -1.28 -0.32 0.00 -1.18 0.00 0.00 61.69 59.07 3k83 s THR 511 Cb -0.05 -0.94 -0.11 0.00 1.34 0.00 0.00 72.50 72.75 3k83 s THR 511 CO 0.11 -0.35 1.67 -0.69 -0.54 0.00 0.00 174.62 174.83 3k83 s VAL 512 N -1.52 2.42 0.38 2.29 1.01 -0.09 -4.84 120.40 120.05 3k83 s VAL 512 Ca -0.04 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.19 3k83 s VAL 512 Cb -0.09 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 3k83 s VAL 512 CO 0.01 0.01 0.58 0.42 0.00 0.00 0.00 175.10 176.12 3k83 s THR 513 N 1.52 4.53 0.30 3.92 -4.23 -1.26 -0.48 115.64 119.93 3k83 s THR 513 Ca 0.74 -0.57 0.03 0.00 -1.18 0.00 0.00 61.69 60.70 3k83 s THR 513 Cb -0.46 -3.65 0.29 0.00 1.34 0.00 0.00 72.50 70.03 3k83 s THR 513 CO 0.32 -0.40 1.84 0.00 -0.54 0.00 0.00 174.62 175.84 3k83 h ALA 514 N 0.65 1.58 -0.16 3.99 0.00 -1.97 -0.07 119.26 123.28 3k83 h ALA 514 Ca -0.48 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.47 3k83 h ALA 514 Cb 1.24 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 3k83 h ALA 514 CO 0.59 0.18 0.02 1.49 0.00 0.00 0.00 179.25 181.52 3k83 h GLU 515 N 0.94 0.07 -0.71 0.00 4.81 -1.99 0.83 114.58 118.53 3k83 h GLU 515 Ca 0.49 -0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.73 3k83 h GLU 515 Cb 0.52 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.85 3k83 h GLU 515 CO -0.25 0.05 0.46 -0.44 -0.73 0.00 0.00 179.01 178.09 3k83 h ASP 516 N 0.07 0.77 -0.38 1.04 3.45 -1.77 -2.62 116.42 116.98 3k83 h ASP 516 Ca 0.07 -0.01 -0.11 0.00 0.43 0.00 0.00 57.03 57.41 3k83 h ASP 516 Cb 0.08 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.66 3k83 h ASP 516 CO -0.11 0.54 -0.20 -0.78 -1.57 0.00 0.00 179.24 177.12 3k83 h ASP 517 N 0.91 0.84 0.25 6.45 3.58 -0.56 -2.78 116.42 125.11 3k83 h ASP 517 Ca 0.27 -0.41 -0.06 0.00 0.42 0.00 0.00 57.03 57.25 3k83 h ASP 517 Cb -0.04 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 40.77 3k83 h ASP 517 CO -0.08 1.06 -0.28 0.00 -2.88 0.00 0.00 179.24 177.06 3k83 h ALA 518 N 0.80 1.49 0.00 -0.78 0.00 -0.76 -1.95 119.26 118.06 3k83 h ALA 518 Ca 0.08 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3k83 h ALA 518 Cb 0.76 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3k83 h ALA 518 CO 0.06 0.38 0.00 1.04 0.00 0.00 0.00 179.25 180.73 3k83 n GLN 519 N -4.19 0.17 0.23 0.00 6.02 -1.00 -1.88 117.38 116.74 3k83 n GLN 519 Ca -0.02 0.41 0.17 0.00 -0.01 0.00 0.00 57.00 57.55 3k83 n GLN 519 Cb 0.34 -1.84 0.85 0.00 1.02 0.00 0.00 30.24 30.62 3k83 n GLN 519 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 3k83 h MET 520 N 0.00 0.00 0.00 -1.09 2.86 -1.28 -1.54 114.93 113.88 3k83 h MET 520 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3k83 h MET 520 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.00 3k83 h MET 520 CO 0.00 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.36 3k83 n GLU 521 N -3.80 0.18 -0.04 1.72 -0.58 -0.79 -2.01 120.64 115.32 3k83 n GLU 521 Ca 0.00 0.46 0.10 0.00 -0.42 0.00 0.00 57.16 57.31 3k83 n GLU 521 Cb 0.27 -1.87 0.11 0.00 -0.57 0.00 0.00 31.44 29.37 3k83 n GLU 521 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 3k83 n LEU 522 N -2.21 2.84 -4.69 -4.62 4.77 -0.58 -4.96 117.00 107.55 3k83 n LEU 522 Ca 0.01 -1.13 -0.42 0.00 -0.03 0.00 0.00 56.01 54.44 3k83 n LEU 522 Cb 0.18 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 3k83 n LEU 522 CO 0.17 0.52 0.98 -0.47 -1.33 0.00 0.00 177.39 177.27 3k83 s TYR 523 N -1.62 3.16 -0.04 -1.77 6.14 -0.85 -4.91 117.35 117.47 3k83 s TYR 523 Ca 0.26 1.13 0.05 0.00 0.64 0.00 0.00 57.07 59.16 3k83 s TYR 523 Cb 0.18 -3.49 -0.08 0.00 0.42 0.00 0.00 41.96 38.99 3k83 s TYR 523 CO 0.26 -1.61 0.13 1.63 0.64 0.00 0.00 175.55 176.60 3k83 n LYS 524 N 4.92 0.92 -0.17 4.97 5.02 -1.26 -4.97 118.16 127.58 3k83 n LYS 524 Ca 0.11 -0.04 0.02 0.00 -2.02 0.00 0.00 58.31 56.38 3k83 n LYS 524 Cb 0.45 -1.07 -0.01 0.00 -0.02 0.00 0.00 35.03 34.39 3k83 n LYS 524 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k83 n GLY 525 N 2.05 -2.54 0.16 0.72 0.00 -1.26 -4.06 105.19 100.25 3k83 n GLY 525 Ca -0.01 -1.41 0.12 0.00 0.00 0.00 0.00 46.02 44.72 3k83 n GLY 525 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3k83 h TYR 526 N -0.17 0.00 0.00 1.61 0.05 -1.94 -3.39 116.97 113.13 3k83 h TYR 526 Ca -0.02 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.66 3k83 h TYR 526 Cb 0.17 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.89 3k83 h TYR 526 CO 0.00 0.00 -1.52 1.19 -1.05 0.00 0.00 178.16 176.78 3k83 n PHE 527 N -2.78 0.00 -0.96 4.88 3.01 -1.26 -5.00 117.46 115.34 3k83 n PHE 527 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 3k83 n PHE 527 Cb 0.51 -0.34 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 3k83 n PHE 527 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k83 n GLY 528 N 2.28 0.19 3.92 1.37 0.00 -1.26 -5.01 105.19 106.69 3k83 n GLY 528 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 3k83 n GLY 528 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3k83 s ASP 529 N -2.04 3.39 0.40 1.61 3.84 -1.26 -4.78 116.67 117.83 3k83 s ASP 529 Ca 0.00 0.37 0.12 0.00 -0.00 0.00 0.00 52.55 53.05 3k83 s ASP 529 Cb 0.00 -0.51 0.94 0.00 -1.38 0.00 0.00 42.92 41.97 3k83 s ASP 529 CO 0.00 -2.57 1.91 -0.29 -0.00 0.00 0.00 175.17 174.22 3k83 h ILE 530 N -1.53 0.84 -0.86 2.11 6.09 -1.95 -0.44 117.51 121.76 3k83 h ILE 530 Ca -0.45 -0.19 -0.01 0.00 -1.37 0.00 0.00 64.86 62.85 3k83 h ILE 530 Cb 1.25 0.25 -0.04 0.00 0.47 0.00 0.00 36.82 38.75 3k83 h ILE 530 CO 0.44 0.10 0.51 -0.50 -3.07 0.00 0.00 178.15 175.63 3k83 h TRP 531 N 0.54 1.14 -0.42 2.19 6.55 -1.93 0.28 115.95 124.31 3k83 h TRP 531 Ca 0.38 -0.01 -0.15 0.00 0.95 0.00 0.00 58.89 60.07 3k83 h TRP 531 Cb 0.72 -0.37 -0.01 0.00 -0.86 0.00 0.00 29.16 28.63 3k83 h TRP 531 CO -0.00 0.77 -0.31 -0.44 -1.05 0.00 0.00 178.44 177.41 3k83 h ASP 532 N 1.19 0.98 -0.25 -3.49 3.45 -1.44 -1.73 116.42 115.13 3k83 h ASP 532 Ca 0.31 -0.41 -0.03 0.00 0.43 0.00 0.00 57.03 57.33 3k83 h ASP 532 Cb -0.03 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.45 3k83 h ASP 532 CO -0.06 1.21 0.05 0.40 -1.57 0.00 0.00 179.24 179.27 3k83 h ILE 533 N 0.78 1.22 -0.24 0.35 2.04 -1.12 -1.71 117.51 118.84 3k83 h ILE 533 Ca 0.08 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 3k83 h ILE 533 Cb 0.89 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 38.20 3k83 h ILE 533 CO 0.08 0.24 0.12 0.40 0.00 0.00 0.00 178.15 178.99 3k83 h ILE 534 N 0.23 1.14 -0.52 -0.67 1.08 -0.91 -3.00 117.51 114.85 3k83 h ILE 534 Ca 0.08 -0.38 -0.00 0.00 -0.39 0.00 0.00 64.86 64.16 3k83 h ILE 534 Cb 0.31 0.95 -0.03 0.00 -3.07 0.00 0.00 36.82 34.98 3k83 h ILE 534 CO 0.00 0.13 0.32 0.25 -0.69 0.00 0.00 178.15 178.16 3k83 h LEU 535 N 0.27 0.62 -0.37 1.44 5.85 -1.28 0.08 115.31 121.91 3k83 h LEU 535 Ca 0.08 -0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.82 3k83 h LEU 535 Cb 0.10 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 40.91 3k83 h LEU 535 CO -0.01 0.49 -0.06 0.50 -0.34 0.00 0.00 178.44 179.02 3k83 h LYS 536 N 0.70 0.03 -0.37 1.25 3.64 -1.25 -1.65 116.57 118.92 3k83 h LYS 536 Ca 0.19 -0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.44 3k83 h LYS 536 Cb -0.02 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 3k83 h LYS 536 CO -0.04 0.02 -0.27 -0.22 -2.27 0.00 0.00 179.45 176.68 3k83 h LYS 537 N 0.03 0.83 0.00 1.90 3.64 -1.34 -3.26 116.57 118.37 3k83 h LYS 537 Ca 0.18 -0.40 -0.07 0.00 -1.27 0.00 0.00 60.65 59.08 3k83 h LYS 537 Cb 0.27 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3k83 h LYS 537 CO -0.36 1.04 -0.35 0.00 -2.27 0.00 0.00 179.45 177.51 3k83 h ALA 538 N 0.77 1.23 -0.00 5.00 0.00 -0.65 -2.46 119.26 123.15 3k83 h ALA 538 Ca 0.07 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3k83 h ALA 538 Cb 0.84 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3k83 h ALA 538 CO 0.07 0.44 -0.28 -1.33 0.00 0.00 0.00 179.25 178.16 3k83 n MET 539 N -3.85 0.32 -1.31 0.00 2.81 -0.65 -1.57 117.12 112.87 3k83 n MET 539 Ca -0.01 -0.15 -0.29 0.00 -1.81 0.00 0.00 57.70 55.43 3k83 n MET 539 Cb 0.42 -1.50 0.19 0.00 -0.71 0.00 0.00 33.22 31.63 3k83 n MET 539 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3k83 s LYS 540 N -2.78 0.08 -1.42 0.03 1.02 -0.93 -4.17 119.74 111.57 3k83 s LYS 540 Ca 0.18 0.17 -0.04 0.00 0.02 0.00 0.00 55.97 56.31 3k83 s LYS 540 Cb 0.19 -1.73 0.03 0.00 -0.52 0.00 0.00 37.83 35.80 3k83 s LYS 540 CO 0.58 -2.89 0.62 -1.71 -0.92 0.00 0.00 175.35 171.03 3k83 n ASN 541 N -4.22 -1.46 -0.24 2.83 5.15 -1.26 -4.90 115.26 111.15 3k83 n ASN 541 Ca 0.09 -0.92 0.08 0.00 -0.60 0.00 0.00 54.58 53.23 3k83 n ASN 541 Cb 0.59 -3.44 0.14 0.00 -0.53 0.00 0.00 39.78 36.54 3k83 n ASN 541 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 3k83 n SER 542 N -2.96 2.62 -4.65 1.20 7.64 -1.26 -5.05 113.62 111.16 3k83 n SER 542 Ca -0.22 -2.85 -0.46 0.00 1.01 0.00 0.00 58.87 56.35 3k83 n SER 542 Cb 0.64 -0.37 -0.04 0.00 -1.01 0.00 0.00 64.21 63.43 3k83 n SER 542 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3k83 n VAL 543 N -1.02 0.57 0.00 0.44 0.31 -1.26 -1.37 118.33 116.00 3k83 n VAL 543 Ca 0.14 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3k83 n VAL 543 Cb 0.62 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 32.20 3k83 n VAL 543 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3k83 n GLY 544 N 2.54 2.29 3.79 2.92 0.00 0.37 -4.94 105.19 112.16 3k83 n GLY 544 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 3k83 n GLY 544 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k83 s LEU 545 N 0.00 3.96 0.54 0.99 1.43 -0.47 -4.60 118.68 120.53 3k83 s LEU 545 Ca 0.00 2.04 -0.19 0.00 -1.03 0.00 0.00 54.13 54.95 3k83 s LEU 545 Cb 0.00 -4.39 -0.06 0.00 0.03 0.00 0.00 46.19 41.77 3k83 s LEU 545 CO 0.00 -0.74 1.11 -2.16 0.23 0.00 0.00 176.35 174.79 3k83 s PRO 546 N -2.91 3.39 -0.01 1.29 0.04 -1.26 -0.91 135.00 134.62 3k83 s PRO 546 Ca 0.64 1.53 0.01 0.00 0.04 0.00 0.00 61.00 63.22 3k83 s PRO 546 Cb -0.21 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.32 3k83 s PRO 546 CO 0.25 -0.80 -0.02 0.08 0.04 0.00 0.00 177.00 176.55 3k83 s VAL 547 N -1.88 0.22 0.42 -0.36 1.01 -0.23 -4.57 120.40 115.02 3k83 s VAL 547 Ca 0.71 -0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.69 3k83 s VAL 547 Cb -0.22 -0.23 -0.06 0.00 0.00 0.00 0.00 36.38 35.87 3k83 s VAL 547 CO 0.27 0.09 0.08 0.00 0.00 0.00 0.00 175.10 175.54 3k83 s ALA 548 N 0.24 3.43 0.31 5.51 0.00 -1.26 -1.33 121.76 128.66 3k83 s ALA 548 Ca -0.02 -2.07 0.10 0.00 0.00 0.00 0.00 51.96 49.97 3k83 s ALA 548 Cb -0.05 -0.07 -0.06 0.00 0.00 0.00 0.00 23.12 22.95 3k83 s ALA 548 CO -0.01 -0.14 -0.13 0.14 0.00 0.00 0.00 175.76 175.62 3k83 s VAL 549 N -2.68 2.28 -0.04 0.00 -7.23 -1.00 -3.75 120.40 107.97 3k83 s VAL 549 Ca 0.35 -2.28 0.01 0.00 -1.81 0.00 0.00 61.98 58.25 3k83 s VAL 549 Cb 0.07 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.48 3k83 s VAL 549 CO 0.19 -0.29 -0.03 -1.58 -0.31 0.00 0.00 175.10 173.07 3k83 s GLN 550 N -3.58 2.78 -0.09 4.82 0.74 0.13 -2.44 119.66 122.01 3k83 s GLN 550 Ca 0.31 -0.56 0.04 0.00 0.05 0.00 0.00 55.36 55.20 3k83 s GLN 550 Cb -0.00 -2.65 0.00 0.00 1.10 0.00 0.00 33.01 31.46 3k83 s GLN 550 CO 0.15 0.65 -0.22 0.00 -0.55 0.00 0.00 175.29 175.33 3k83 s VAL 552 N 0.42 1.07 0.36 0.00 1.01 0.10 -1.04 120.40 122.31 3k83 s VAL 552 Ca -0.18 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 60.98 3k83 s VAL 552 Cb -0.18 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 3k83 s VAL 552 CO 0.08 0.07 0.23 0.00 0.00 0.00 0.00 175.10 175.47 3k83 s ALA 553 N -0.72 2.21 0.74 5.51 0.00 -0.98 -0.83 121.76 127.69 3k83 s ALA 553 Ca 0.02 -1.78 -0.11 0.00 0.00 0.00 0.00 51.96 50.09 3k83 s ALA 553 Cb -0.07 1.25 0.03 0.00 0.00 0.00 0.00 23.12 24.33 3k83 s ALA 553 CO 0.01 -0.56 1.07 -0.51 0.00 0.00 0.00 175.76 175.77 3k83 s LEU 554 N -3.45 2.96 0.22 0.00 1.43 -1.26 -3.55 118.68 115.02 3k83 s LEU 554 Ca 0.35 1.56 -0.31 0.00 -1.03 0.00 0.00 54.13 54.70 3k83 s LEU 554 Cb 0.02 -4.34 -0.15 0.00 0.03 0.00 0.00 46.19 41.76 3k83 s LEU 554 CO 0.23 -1.69 1.11 -2.65 0.23 0.00 0.00 176.35 173.58 3k83 n PRO 555 N -3.28 1.25 -0.97 1.29 -0.02 -1.26 -1.16 135.00 130.84 3k83 n PRO 555 Ca 0.08 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 3k83 n PRO 555 Cb 0.54 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 3k83 n PRO 555 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3k83 n TRP 556 N 1.05 0.00 -1.85 6.00 7.02 -1.26 -4.93 117.44 123.48 3k83 n TRP 556 Ca 0.13 0.00 -0.35 0.00 -1.02 0.00 0.00 57.50 56.26 3k83 n TRP 556 Cb 0.28 -0.62 0.04 0.00 -2.42 0.00 0.00 31.31 28.59 3k83 n TRP 556 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 3k83 n GLN 557 N -1.75 2.91 -0.11 -0.99 1.13 -0.31 -4.71 117.38 113.54 3k83 n GLN 557 Ca 0.00 -3.66 0.02 0.00 -1.94 0.00 0.00 57.00 51.42 3k83 n GLN 557 Cb 0.14 -2.27 0.33 0.00 0.11 0.00 0.00 30.24 28.54 3k83 n GLN 557 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 3k83 h GLU 558 N 2.58 0.78 -0.30 -1.09 3.07 -1.92 -0.07 114.58 117.64 3k83 h GLU 558 Ca 0.52 -0.05 -0.15 0.00 -0.50 0.00 0.00 59.36 59.18 3k83 h GLU 558 Cb 0.51 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 3k83 h GLU 558 CO 1.34 0.52 -0.43 0.93 -1.40 0.00 0.00 179.01 179.97 3k83 h GLU 559 N 0.80 0.75 -0.30 2.33 3.07 -1.91 0.17 114.58 119.49 3k83 h GLU 559 Ca 0.22 -0.40 -0.18 0.00 -0.50 0.00 0.00 59.36 58.49 3k83 h GLU 559 Cb -0.08 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.85 3k83 h GLU 559 CO -0.05 1.03 -0.53 1.25 -1.40 0.00 0.00 179.01 179.31 3k83 h LEU 560 N 0.60 0.98 -0.29 1.33 5.85 -1.71 0.11 115.31 122.18 3k83 h LEU 560 Ca 0.04 -0.53 0.01 0.00 0.84 0.00 0.00 57.88 58.24 3k83 h LEU 560 Cb 0.98 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3k83 h LEU 560 CO 0.09 1.32 0.17 0.00 -0.34 0.00 0.00 178.44 179.69 3k83 h LEU 562 N 0.36 0.38 -1.12 0.00 3.38 -0.44 0.30 115.31 118.17 3k83 h LEU 562 Ca 0.11 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3k83 h LEU 562 Cb -0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 3k83 h LEU 562 CO -0.05 0.57 0.52 -0.09 0.09 0.00 0.00 178.44 179.49 3k83 h ARG 563 N 0.36 1.12 -0.05 1.13 1.12 -0.18 0.45 114.38 118.33 3k83 h ARG 563 Ca 0.06 -0.09 -0.13 0.00 -1.11 0.00 0.00 59.98 58.72 3k83 h ARG 563 Cb 0.51 -0.24 0.01 0.00 -0.01 0.00 0.00 29.97 30.24 3k83 h ARG 563 CO 0.03 0.77 -0.47 0.35 -3.11 0.00 0.00 179.97 177.54 3k83 h PHE 564 N 1.14 0.56 -0.72 2.20 -0.00 -0.68 -2.21 116.94 117.25 3k83 h PHE 564 Ca 0.30 -0.27 0.08 0.00 -0.00 0.00 0.00 57.97 58.08 3k83 h PHE 564 Cb -0.08 -0.08 -0.06 0.00 -0.00 0.00 0.00 35.95 35.73 3k83 h PHE 564 CO 0.00 1.06 0.39 0.52 -0.00 0.00 0.00 178.31 180.28 3k83 h MET 565 N -0.09 0.67 -0.97 1.11 2.86 -0.64 0.06 114.93 117.93 3k83 h MET 565 Ca -0.05 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.57 3k83 h MET 565 Cb 1.15 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 32.61 3k83 h MET 565 CO 0.10 0.44 0.64 -0.09 1.06 0.00 0.00 176.91 179.06 3k83 h ARG 566 N 0.69 1.26 0.23 1.72 2.43 -0.89 0.52 114.38 120.34 3k83 h ARG 566 Ca 0.34 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.42 3k83 h ARG 566 Cb 0.28 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3k83 h ARG 566 CO -0.22 0.83 -0.11 1.49 -1.51 0.00 0.00 179.97 180.45 3k83 h GLU 567 N 1.29 -0.30 -0.30 0.20 4.57 -0.47 -0.70 114.58 118.87 3k83 h GLU 567 Ca 0.36 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 58.63 3k83 h GLU 567 Cb -0.12 0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.47 3k83 h GLU 567 CO -0.09 -0.08 -0.16 0.28 -1.18 0.00 0.00 179.01 177.79 3k83 h VAL 568 N -0.47 0.52 -0.49 0.32 2.07 -0.78 -0.58 116.25 116.84 3k83 h VAL 568 Ca -0.03 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.54 3k83 h VAL 568 Cb 0.36 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.60 3k83 h VAL 568 CO 0.05 0.00 0.22 -0.08 0.02 0.00 0.00 177.57 177.78 3k83 h GLU 569 N -0.12 0.42 -0.77 1.57 4.81 -0.80 -0.84 114.58 118.86 3k83 h GLU 569 Ca 0.16 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 3k83 h GLU 569 Cb 0.36 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 3k83 h GLU 569 CO -0.37 0.28 0.32 0.37 -0.73 0.00 0.00 179.01 178.88 3k83 h GLN 570 N 0.43 1.13 0.00 1.92 -0.00 -0.77 -0.61 115.11 117.22 3k83 h GLN 570 Ca 0.23 -0.19 -0.15 0.00 -0.00 0.00 0.00 58.65 58.53 3k83 h GLN 570 Cb 0.18 -0.19 -0.02 0.00 0.00 0.00 0.00 27.48 27.44 3k83 h GLN 570 CO -0.19 0.90 -0.73 -0.07 0.00 0.00 0.00 178.83 178.74 3k83 h LEU 571 N 1.11 0.00 0.00 -2.39 3.38 -0.34 -3.21 115.31 113.86 3k83 h LEU 571 Ca 0.26 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.96 3k83 h LEU 571 Cb 0.19 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.88 3k83 h LEU 571 CO -0.02 0.73 -2.18 0.23 0.09 0.00 0.00 178.44 177.29 3k83 n MET 572 N -3.30 0.93 -3.18 1.13 2.81 -0.39 -4.71 117.12 110.41 3k83 n MET 572 Ca 0.01 -0.04 -0.23 0.00 -1.81 0.00 0.00 57.70 55.63 3k83 n MET 572 Cb 0.83 -1.47 -0.06 0.00 -0.71 0.00 0.00 33.22 31.80 3k83 n MET 572 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3k83 n THR 573 N -2.58 -0.60 -0.15 2.03 -2.24 -0.24 -4.95 114.28 105.54 3k83 n THR 573 Ca -0.24 -4.03 0.21 0.00 -2.27 0.00 0.00 64.05 57.72 3k83 n THR 573 Cb 0.98 -1.62 0.60 0.00 -2.10 0.00 0.00 70.33 68.19 3k83 n THR 573 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3k83 h PRO 574 N 3.85 0.21 -0.01 -0.78 0.11 -1.65 -1.98 132.00 131.76 3k83 h PRO 574 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.17 3k83 h PRO 574 Cb 0.90 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.96 3k83 h PRO 574 CO 0.46 0.14 0.18 1.96 -0.21 0.00 0.00 178.00 180.53 3k83 h GLN 575 N 0.22 0.00 0.00 1.05 7.50 -1.89 -2.06 115.11 119.93 3k83 h GLN 575 Ca 0.38 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.53 3k83 h GLN 575 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.71 3k83 h GLN 575 CO -0.08 0.00 0.00 0.87 -1.50 0.00 0.00 178.83 178.12 3k83 h LYS 576 N 0.00 0.00 0.00 1.46 1.79 -1.68 -3.53 116.57 114.61 3k83 h LYS 576 Ca 0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 3k83 h LYS 576 Cb 0.36 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 3k83 h LYS 576 CO -0.00 0.00 0.00 1.04 -1.08 0.00 0.00 179.45 179.41