#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wss s THR 2 N 0.00 4.75 0.14 0.00 2.01 -1.26 -4.96 115.64 116.31 2wss s THR 2 Ca 0.00 1.07 -0.31 0.00 0.31 0.00 0.00 61.69 62.77 2wss s THR 2 Cb 0.00 -3.83 -0.07 0.00 0.01 0.00 0.00 72.50 68.62 2wss s THR 2 CO 0.00 0.35 1.56 -0.07 -0.69 0.00 0.00 174.62 175.76 2wss h LEU 3 N 3.88 -1.76 -0.99 4.42 3.38 -1.95 0.14 115.31 122.44 2wss h LEU 3 Ca -0.49 0.24 0.35 0.00 0.09 0.00 0.00 57.88 58.08 2wss h LEU 3 Cb 1.20 0.74 -0.17 0.00 0.09 0.00 0.00 40.66 42.52 2wss h LEU 3 CO 0.65 -0.38 0.38 0.50 0.09 0.00 0.00 178.44 179.67 2wss h LYS 4 N -0.35 0.06 0.07 1.13 3.11 -1.99 0.20 116.57 118.81 2wss h LYS 4 Ca 0.10 -0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.94 2wss h LYS 4 Cb 0.58 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 31.80 2wss h LYS 4 CO -0.62 0.04 -0.03 -0.44 -2.81 0.00 0.00 179.45 175.58 2wss h ASP 5 N 0.06 -0.08 -0.95 4.20 5.19 -1.17 -1.32 116.42 122.36 2wss h ASP 5 Ca 0.74 -0.41 0.23 0.00 -0.62 0.00 0.00 57.03 56.98 2wss h ASP 5 Cb 1.80 0.02 -0.18 0.00 0.18 0.00 0.00 39.33 41.16 2wss h ASP 5 CO -0.78 0.58 -0.06 0.40 -3.12 0.00 0.00 179.24 176.25 2wss h ILE 6 N -0.96 0.07 -0.28 0.35 1.08 -0.68 0.39 117.51 117.47 2wss h ILE 6 Ca -0.01 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 2wss h ILE 6 Cb 0.48 0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.27 2wss h ILE 6 CO 0.02 0.00 0.13 0.74 -0.69 0.00 0.00 178.15 178.35 2wss h THR 7 N 0.02 1.15 0.00 -0.27 2.02 -0.85 0.29 112.91 115.27 2wss h THR 7 Ca 0.53 -0.45 0.00 0.00 0.77 0.00 0.00 66.41 67.26 2wss h THR 7 Cb 0.99 0.93 -0.00 0.00 -1.74 0.00 0.00 68.15 68.32 2wss h THR 7 CO -0.91 0.16 -0.00 -0.09 0.37 0.00 0.00 175.52 175.05 2wss h ARG 8 N 0.32 -0.00 -1.05 6.66 2.43 0.79 -1.41 114.38 122.12 2wss h ARG 8 Ca 0.10 0.00 0.28 0.00 -0.81 0.00 0.00 59.98 59.54 2wss h ARG 8 Cb 0.13 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 29.59 2wss h ARG 8 CO -0.01 -0.00 0.69 -0.09 -1.51 0.00 0.00 179.97 179.05 2wss h ARG 9 N -0.00 0.32 0.22 0.20 2.43 -0.42 0.22 114.38 117.35 2wss h ARG 9 Ca -0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2wss h ARG 9 Cb 0.00 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 2wss h ARG 9 CO -0.00 0.21 -0.21 -0.07 -1.51 0.00 0.00 179.97 178.39 2wss h LEU 10 N 0.33 -0.57 -0.30 3.80 3.38 0.13 -1.23 115.31 120.85 2wss h LEU 10 Ca 0.59 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.65 2wss h LEU 10 Cb 1.61 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 42.52 2wss h LEU 10 CO -0.25 -0.32 0.07 0.50 0.09 0.00 0.00 178.44 178.53 2wss h LYS 11 N -0.46 0.18 -0.04 1.13 3.64 0.50 0.52 116.57 122.04 2wss h LYS 11 Ca -0.00 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.40 2wss h LYS 11 Cb 0.43 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.15 2wss h LYS 11 CO -0.05 0.12 -0.42 1.03 -2.27 0.00 0.00 179.45 177.86 2wss h SER 12 N 0.19 -1.30 -0.52 4.20 0.87 -1.24 -2.62 113.55 113.13 2wss h SER 12 Ca 0.14 0.16 -0.05 0.00 -1.23 0.00 0.00 61.79 60.81 2wss h SER 12 Cb 0.13 0.52 -0.03 0.00 -0.44 0.00 0.00 62.40 62.58 2wss h SER 12 CO -0.17 -0.45 0.14 0.40 -0.53 0.00 0.00 176.83 176.22 2wss h ILE 13 N -0.55 1.23 0.00 2.23 2.04 -0.76 -2.37 117.51 119.33 2wss h ILE 13 Ca 0.05 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.08 2wss h ILE 13 Cb 0.65 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2wss h ILE 13 CO -0.34 0.31 -0.00 0.11 0.00 0.00 0.00 178.15 178.22 2wss h LYS 14 N 0.84 0.00 0.00 2.37 1.57 -0.55 -1.10 116.57 119.70 2wss h LYS 14 Ca 0.18 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.89 2wss h LYS 14 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 2wss h LYS 14 CO -0.00 0.00 -0.51 -0.91 -0.57 0.00 0.00 179.45 177.46 2wss h ASN 15 N 0.00 0.00 -1.49 0.86 2.35 -1.10 -3.11 115.58 113.09 2wss h ASN 15 Ca -0.00 -0.43 0.46 0.00 -0.55 0.00 0.00 56.30 55.79 2wss h ASN 15 Cb 0.02 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.28 2wss h ASN 15 CO 0.00 1.00 1.01 0.40 -1.65 0.00 0.00 177.43 178.20 2wss h ILE 16 N -1.00 0.12 -0.17 2.81 2.04 -1.22 0.54 117.51 120.63 2wss h ILE 16 Ca -0.11 -0.02 -0.11 0.00 1.00 0.00 0.00 64.86 65.62 2wss h ILE 16 Cb 0.79 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 2wss h ILE 16 CO -0.07 0.01 -0.34 -0.61 0.00 0.00 0.00 178.15 177.14 2wss h GLN 17 N 0.06 0.53 -0.11 2.37 -0.00 -1.28 -2.07 115.11 114.60 2wss h GLN 17 Ca 0.83 -0.34 -0.06 0.00 -0.00 0.00 0.00 58.65 59.07 2wss h GLN 17 Cb 2.88 0.04 -0.00 0.00 0.00 0.00 0.00 27.48 30.40 2wss h GLN 17 CO -0.26 0.95 -0.18 0.87 0.00 0.00 0.00 178.83 180.22 2wss h LYS 18 N 0.17 0.31 -0.91 1.69 1.57 -0.03 -0.62 116.57 118.76 2wss h LYS 18 Ca 0.01 -0.19 0.06 0.00 -1.87 0.00 0.00 60.65 58.65 2wss h LYS 18 Cb 0.94 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.21 2wss h LYS 18 CO 0.08 0.77 0.59 0.82 -0.57 0.00 0.00 179.45 181.14 2wss h ILE 19 N -0.11 1.08 0.25 1.86 2.04 -0.67 0.51 117.51 122.47 2wss h ILE 19 Ca 0.01 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 2wss h ILE 19 Cb 0.74 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2wss h ILE 19 CO 0.04 0.19 -0.12 0.74 0.00 0.00 0.00 178.15 179.00 2wss h THR 20 N 1.05 0.72 -0.61 -0.27 2.02 -1.33 -0.53 112.91 113.96 2wss h THR 20 Ca 0.39 -0.82 0.12 0.00 0.77 0.00 0.00 66.41 66.86 2wss h THR 20 Cb 0.16 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 2wss h THR 20 CO -0.14 0.15 0.42 0.50 0.37 0.00 0.00 175.52 176.82 2wss h LYS 21 N -0.82 0.32 0.34 6.66 3.64 -0.82 0.27 116.57 126.15 2wss h LYS 21 Ca -0.03 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 2wss h LYS 21 Cb 0.51 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2wss h LYS 21 CO 0.06 0.21 -0.16 1.03 -2.27 0.00 0.00 179.45 178.31 2wss h SER 22 N 0.33 -0.39 -0.32 4.20 0.87 -0.85 -3.08 113.55 114.31 2wss h SER 22 Ca 0.29 -0.12 0.09 0.00 -1.23 0.00 0.00 61.79 60.82 2wss h SER 22 Cb 0.69 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.74 2wss h SER 22 CO -0.07 0.07 0.27 -0.03 -0.53 0.00 0.00 176.83 176.54 2wss h MET 23 N -1.02 0.00 -0.67 2.24 1.85 -0.64 0.20 114.93 116.88 2wss h MET 23 Ca -0.05 0.00 -0.04 0.00 -0.61 0.00 0.00 59.70 59.00 2wss h MET 23 Cb 0.48 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 32.48 2wss h MET 23 CO 0.08 0.00 0.25 -0.22 -0.40 0.00 0.00 176.91 176.61 2wss h LYS 24 N 0.00 1.02 0.00 0.39 3.64 -0.45 -2.42 116.57 118.74 2wss h LYS 24 Ca 0.15 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2wss h LYS 24 Cb 0.68 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2wss h LYS 24 CO -0.00 0.87 -0.28 0.52 -2.27 0.00 0.00 179.45 178.28 2wss h MET 25 N 0.96 0.00 0.20 1.90 2.86 -0.55 0.77 114.93 121.07 2wss h MET 25 Ca 0.22 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.85 2wss h MET 25 Cb 0.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2wss h MET 25 CO -0.01 0.00 -0.10 0.28 1.06 0.00 0.00 176.91 178.14 2wss h VAL 26 N 0.00 0.00 -1.15 -2.22 2.07 -1.26 -3.07 116.25 110.62 2wss h VAL 26 Ca 0.00 -0.10 0.32 0.00 0.82 0.00 0.00 66.70 67.74 2wss h VAL 26 Cb 0.79 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.47 2wss h VAL 26 CO 0.00 0.00 0.77 0.00 0.02 0.00 0.00 177.57 178.36 2wss h ALA 27 N -1.77 2.59 0.25 1.67 0.00 -1.38 -0.62 119.26 119.99 2wss h ALA 27 Ca -0.03 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2wss h ALA 27 Cb 0.20 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2wss h ALA 27 CO 0.04 -1.02 -0.24 0.00 0.00 0.00 0.00 179.25 178.03 2wss h ALA 28 N 1.55 -0.50 -0.18 0.00 0.00 -0.85 0.33 119.26 119.62 2wss h ALA 28 Ca 0.64 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.41 2wss h ALA 28 Cb 1.95 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 20.07 2wss h ALA 28 CO -0.24 -0.81 -0.13 0.00 0.00 0.00 0.00 179.25 178.08 2wss h ALA 29 N 0.15 0.26 -0.98 0.00 0.00 -1.24 -2.27 119.26 115.17 2wss h ALA 29 Ca -0.01 -0.31 0.30 0.00 0.00 0.00 0.00 54.91 54.89 2wss h ALA 29 Cb 0.48 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.06 2wss h ALA 29 CO -0.05 0.12 0.52 0.87 0.00 0.00 0.00 179.25 180.71 2wss h LYS 30 N 0.07 0.33 -0.20 0.00 1.57 -0.79 0.33 116.57 117.88 2wss h LYS 30 Ca 0.03 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.60 2wss h LYS 30 Cb 0.64 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.88 2wss h LYS 30 CO 0.03 0.22 -0.64 -0.92 -0.57 0.00 0.00 179.45 177.57 2wss h TYR 31 N 0.34 0.93 0.00 -1.35 3.20 -0.21 -2.61 116.97 117.26 2wss h TYR 31 Ca 0.70 -0.36 0.00 0.00 3.14 0.00 0.00 58.73 62.20 2wss h TYR 31 Cb 1.54 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.65 2wss h TYR 31 CO -0.05 1.16 0.00 0.00 -1.64 0.00 0.00 178.16 177.64 2wss h ALA 32 N 0.75 1.00 0.00 1.82 0.00 0.24 -1.90 119.26 121.17 2wss h ALA 32 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.65 2wss h ALA 32 Cb 1.24 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 2wss h ALA 32 CO 0.13 0.00 -1.47 -2.13 0.00 0.00 0.00 179.25 175.78 2wss n ARG 33 N -2.41 0.56 0.00 0.00 0.63 -0.79 -3.60 116.66 111.05 2wss n ARG 33 Ca 0.01 0.48 0.00 0.00 -0.92 0.00 0.00 57.85 57.42 2wss n ARG 33 Cb 0.23 -1.67 0.00 0.00 0.45 0.00 0.00 32.46 31.47 2wss n ARG 33 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wss n ALA 34 N -3.69 0.89 -0.11 5.13 0.00 -0.99 -0.44 120.51 121.30 2wss n ALA 34 Ca -0.34 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 52.86 2wss n ALA 34 Cb 0.67 -0.75 -0.11 0.00 0.00 0.00 0.00 19.45 19.27 2wss n ALA 34 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2wss n GLU 35 N -1.18 0.62 0.01 0.00 0.00 -0.74 -3.61 120.64 115.74 2wss n GLU 35 Ca 0.00 0.28 -0.10 0.00 0.00 0.00 0.00 57.16 57.35 2wss n GLU 35 Cb 0.08 -1.57 -0.03 0.00 0.00 0.00 0.00 31.44 29.92 2wss n GLU 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2wss h ARG 36 N -0.59 -0.17 0.00 5.31 3.08 -0.91 0.18 114.38 121.27 2wss h ARG 36 Ca -0.58 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.48 2wss h ARG 36 Cb 1.69 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.78 2wss h ARG 36 CO -0.24 -0.11 0.00 0.39 -1.07 0.00 0.00 179.97 178.94 2wss n GLU 37 N -5.28 0.18 -0.10 0.04 1.02 0.42 -2.59 120.64 114.33 2wss n GLU 37 Ca -0.03 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 56.98 2wss n GLU 37 Cb 0.20 -1.29 -0.11 0.00 -0.02 0.00 0.00 31.44 30.22 2wss n GLU 37 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2wss n LEU 38 N -0.79 2.13 -0.35 -4.62 7.94 0.56 -4.05 117.00 117.82 2wss n LEU 38 Ca 0.02 -0.08 -0.11 0.00 -1.11 0.00 0.00 56.01 54.73 2wss n LEU 38 Cb 0.01 -0.41 -0.10 0.00 0.53 0.00 0.00 43.42 43.45 2wss n LEU 38 CO 0.02 0.73 0.48 0.50 -1.11 0.00 0.00 177.39 178.01 2wss h LYS 39 N 0.00 -0.07 0.00 1.96 1.63 -1.15 0.11 116.57 119.04 2wss h LYS 39 Ca -0.47 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.34 2wss h LYS 39 Cb 1.82 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 33.46 2wss h LYS 39 CO -0.05 -0.05 0.00 -2.30 -3.45 0.00 0.00 179.45 173.61 2wss n PRO 40 N -5.19 0.00 0.14 1.90 -0.02 -1.26 -3.29 135.00 127.28 2wss n PRO 40 Ca 0.01 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2wss n PRO 40 Cb 0.27 -0.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 2wss n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wss n ALA 41 N -1.20 0.00 -0.00 3.55 0.00 -0.68 -0.07 120.51 122.11 2wss n ALA 41 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wss n ALA 41 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wss n ALA 41 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2wss h ARG 42 N 0.00 0.00 -0.68 0.00 2.43 -0.84 -2.06 114.38 113.23 2wss h ARG 42 Ca 0.00 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.26 2wss h ARG 42 Cb 1.08 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 30.53 2wss h ARG 42 CO 0.00 0.00 -0.32 0.28 -1.51 0.00 0.00 179.97 178.42 2wss n VAL 43 N -2.16 -0.40 0.00 0.20 0.31 0.89 0.87 118.33 118.05 2wss n VAL 43 Ca -0.00 1.61 0.00 0.00 -0.01 0.00 0.00 64.34 65.94 2wss n VAL 43 Cb 0.00 -2.07 0.00 0.00 -0.91 0.00 0.00 33.84 30.87 2wss n VAL 43 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wss n TYR 44 N -4.94 0.00 -0.46 3.52 4.19 -1.08 -2.15 117.16 116.24 2wss n TYR 44 Ca 0.05 0.00 0.38 0.00 3.31 0.00 0.00 57.90 61.64 2wss n TYR 44 Cb 0.23 -0.14 0.66 0.00 0.49 0.00 0.00 39.34 40.58 2wss n TYR 44 CO 0.00 0.00 0.00 0.78 0.91 0.00 0.00 176.86 178.55 2wss h GLY 45 N 0.00 1.25 0.80 2.98 0.00 0.03 -0.38 103.07 107.75 2wss h GLY 45 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.20 2wss h GLY 45 CO 0.00 -0.39 -0.24 -2.08 0.00 0.00 0.00 176.54 173.83 2wss h VAL 46 N 0.07 0.44 -0.50 4.60 2.07 0.57 -3.00 116.25 120.51 2wss h VAL 46 Ca 0.83 -0.32 0.14 0.00 0.82 0.00 0.00 66.70 68.18 2wss h VAL 46 Cb 2.65 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.97 2wss h VAL 46 CO -0.41 0.05 0.44 1.23 0.02 0.00 0.00 177.57 178.90 2wss h GLY 47 N -0.88 0.00 2.00 2.17 0.00 -0.55 0.87 103.07 106.69 2wss h GLY 47 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2wss h GLY 47 CO 0.11 0.00 0.00 -1.26 0.00 0.00 0.00 176.54 175.39 2wss n SER 48 N -3.99 0.57 -0.01 0.19 2.88 -1.07 -0.95 113.62 111.24 2wss n SER 48 Ca 0.09 0.76 0.09 0.00 -1.33 0.00 0.00 58.87 58.48 2wss n SER 48 Cb 0.64 -0.84 -0.14 0.00 -0.75 0.00 0.00 64.21 63.13 2wss n SER 48 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2wss n LEU 49 N -2.27 0.03 -0.33 2.46 4.77 0.30 -4.52 117.00 117.45 2wss n LEU 49 Ca -0.01 -0.02 0.25 0.00 -0.03 0.00 0.00 56.01 56.20 2wss n LEU 49 Cb 0.05 0.00 0.48 0.00 -2.33 0.00 0.00 43.42 41.61 2wss n LEU 49 CO 0.10 0.01 0.98 0.00 -1.33 0.00 0.00 177.39 177.15 2wss h ALA 50 N 1.64 1.81 -3.00 -1.18 0.00 -0.78 -1.31 119.26 116.45 2wss h ALA 50 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2wss h ALA 50 Cb 0.79 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2wss h ALA 50 CO 0.00 -0.80 0.00 -0.11 0.00 0.00 0.00 179.25 178.34 2wss n LEU 51 N -5.32 0.00 -0.05 0.00 7.94 -1.26 -3.94 117.00 114.37 2wss n LEU 51 Ca 0.32 0.00 0.02 0.00 -1.11 0.00 0.00 56.01 55.24 2wss n LEU 51 Cb 1.08 0.00 0.03 0.00 0.53 0.00 0.00 43.42 45.07 2wss n LEU 51 CO -0.01 0.00 0.10 -1.22 -1.11 0.00 0.00 177.39 175.15 2wss n TYR 52 N 0.00 0.07 -1.29 1.96 4.02 -1.11 -0.26 117.16 120.55 2wss n TYR 52 Ca 0.00 0.16 -0.21 0.00 -0.01 0.00 0.00 57.90 57.84 2wss n TYR 52 Cb 0.00 -0.59 -0.09 0.00 -0.02 0.00 0.00 39.34 38.63 2wss n TYR 52 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2wss n GLU 53 N -3.99 2.23 -2.24 -0.72 1.02 -0.51 -2.97 120.64 113.46 2wss n GLU 53 Ca 0.03 -1.82 -0.03 0.00 -0.02 0.00 0.00 57.16 55.32 2wss n GLU 53 Cb 0.09 -2.07 0.08 0.00 -0.02 0.00 0.00 31.44 29.53 2wss n GLU 53 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2wss n LYS 54 N 1.44 0.99 0.00 3.49 5.02 0.64 -4.91 118.16 124.83 2wss n LYS 54 Ca 0.46 -1.03 0.00 0.00 -2.02 0.00 0.00 58.31 55.72 2wss n LYS 54 Cb 0.68 0.40 0.00 0.00 -0.02 0.00 0.00 35.03 36.09 2wss n LYS 54 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wss n ALA 55 N -1.12 0.00 -0.84 7.82 0.00 -1.16 -5.07 120.51 120.15 2wss n ALA 55 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.92 2wss n ALA 55 Cb 0.80 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.35 2wss n ALA 55 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wss n ASP 56 N 0.00 -3.18 -3.63 0.00 8.00 -1.25 -4.88 116.55 111.61 2wss n ASP 56 Ca 0.00 0.16 -0.10 0.00 0.71 0.00 0.00 54.79 55.57 2wss n ASP 56 Cb 0.00 -0.98 -0.10 0.00 -0.02 0.00 0.00 41.12 40.02 2wss n ASP 56 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2wss s ILE 57 N -2.23 -0.60 0.00 0.53 -1.09 -1.26 -4.91 121.20 111.65 2wss s ILE 57 Ca 0.51 0.17 0.00 0.00 -2.23 0.00 0.00 60.65 59.09 2wss s ILE 57 Cb -0.15 -0.63 0.00 0.00 -1.58 0.00 0.00 42.46 40.09 2wss s ILE 57 CO 0.71 0.06 0.00 0.29 -1.23 0.00 0.00 174.94 174.77 2wss n LYS 58 N 5.38 1.90 -3.15 2.79 5.02 -1.26 -5.12 118.16 123.72 2wss n LYS 58 Ca -0.07 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.27 2wss n LYS 58 Cb 0.50 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.50 2wss n LYS 58 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2wss s THR 59 N 0.37 -0.47 0.41 -0.18 2.01 -1.26 -5.02 115.64 111.51 2wss s THR 59 Ca 0.00 0.00 0.23 0.00 0.31 0.00 0.00 61.69 62.23 2wss s THR 59 Cb 0.00 -0.67 0.43 0.00 0.01 0.00 0.00 72.50 72.27 2wss s THR 59 CO 0.00 0.00 1.71 -0.65 -0.69 0.00 0.00 174.62 174.99 2wss h PRO 60 N 7.67 0.25 0.00 4.92 0.11 -2.00 -3.53 132.00 139.41 2wss h PRO 60 Ca -0.10 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.99 2wss h PRO 60 Cb 1.18 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2wss h PRO 60 CO -0.02 0.16 0.00 -1.91 -0.21 0.00 0.00 178.00 176.02 2wss n GLU 61 N -4.67 0.00 0.00 1.05 0.00 -1.26 -5.22 120.64 110.54 2wss n GLU 61 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.46 2wss n GLU 61 Cb 1.12 -0.06 0.00 0.00 0.00 0.00 0.00 31.44 32.49 2wss n GLU 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2wss n GLY 70 N 1.37 0.39 2.88 8.31 0.00 -1.25 -4.88 105.19 112.01 2wss n GLY 70 Ca 0.00 0.67 -0.20 0.00 0.00 0.00 0.00 46.02 46.48 2wss n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wss s VAL 71 N 0.00 0.52 0.00 1.61 1.01 -0.87 -0.57 120.40 122.11 2wss s VAL 71 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.87 2wss s VAL 71 Cb 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.82 2wss s VAL 71 CO 0.00 0.23 0.00 -1.54 0.00 0.00 0.00 175.10 173.79 2wss n SER 72 N 4.13 0.00 -1.02 3.32 3.41 -1.24 -4.60 113.62 117.61 2wss n SER 72 Ca -0.24 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 2wss n SER 72 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2wss n SER 72 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2wss n SER 73 N 0.00 -0.01 -0.06 4.04 3.41 -1.26 -4.72 113.62 115.02 2wss n SER 73 Ca 0.00 -1.00 -0.09 0.00 -0.26 0.00 0.00 58.87 57.52 2wss n SER 73 Cb 0.00 0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 2wss n SER 73 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2wss n ASP 74 N -0.33 3.04 -4.66 4.04 9.92 -1.13 -2.61 116.55 124.82 2wss n ASP 74 Ca 0.00 -0.07 -0.43 0.00 -0.53 0.00 0.00 54.79 53.77 2wss n ASP 74 Cb 0.00 -0.19 -0.02 0.00 -0.64 0.00 0.00 41.12 40.27 2wss n ASP 74 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 2wss s ARG 75 N -2.25 4.22 0.00 -1.24 3.52 -1.26 -4.52 118.95 117.42 2wss s ARG 75 Ca -0.17 1.89 0.00 0.00 -0.13 0.00 0.00 55.73 57.32 2wss s ARG 75 Cb 0.04 -3.83 0.00 0.00 -1.56 0.00 0.00 34.95 29.60 2wss s ARG 75 CO 0.29 -0.74 0.00 0.41 -0.81 0.00 0.00 175.30 174.44 2wss n GLY 76 N 3.81 0.83 3.94 8.12 0.00 -1.26 -4.77 105.19 115.86 2wss n GLY 76 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2wss n GLY 76 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wss n LEU 77 N 0.00 -1.69 0.00 0.99 4.77 -1.26 -4.70 117.00 115.11 2wss n LEU 77 Ca 0.00 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 55.18 2wss n LEU 77 Cb 0.00 -2.11 0.00 0.00 -2.33 0.00 0.00 43.42 38.98 2wss n LEU 77 CO 0.00 0.26 0.19 0.00 -1.33 0.00 0.00 177.39 176.52 2wss n GLY 79 N -0.07 1.53 0.30 0.00 0.00 -1.26 -4.10 105.19 101.59 2wss n GLY 79 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2wss n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wss h ALA 80 N -0.32 1.41 -0.81 4.61 0.00 -1.99 -3.34 119.26 118.82 2wss h ALA 80 Ca 0.00 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.85 2wss h ALA 80 Cb 0.00 -0.20 -0.11 0.00 0.00 0.00 0.00 17.79 17.48 2wss h ALA 80 CO 0.00 0.45 -0.58 0.82 0.00 0.00 0.00 179.25 179.94 2wss h ILE 81 N 0.71 0.00 0.00 0.00 1.08 -1.91 -2.98 117.51 114.40 2wss h ILE 81 Ca 0.17 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.58 2wss h ILE 81 Cb 0.15 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.89 2wss h ILE 81 CO -0.02 0.00 -0.27 0.45 -0.69 0.00 0.00 178.15 177.63 2wss h HIS 82 N -0.12 0.00 -0.20 1.37 3.86 -1.93 -3.04 115.15 115.09 2wss h HIS 82 Ca 0.13 0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.23 2wss h HIS 82 Cb 0.46 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.93 2wss h HIS 82 CO -0.94 0.27 -0.30 0.66 0.86 0.00 0.00 177.93 178.48 2wss h SER 83 N 0.00 0.61 0.17 2.45 4.64 -1.74 -3.32 113.55 116.36 2wss h SER 83 Ca -0.00 -0.52 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 2wss h SER 83 Cb 1.02 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2wss h SER 83 CO 0.03 1.01 0.00 -1.20 -0.87 0.00 0.00 176.83 175.80 2wss n SER 84 N -4.34 0.20 -1.45 4.97 7.64 -1.15 0.12 113.62 119.62 2wss n SER 84 Ca -0.05 0.58 0.09 0.00 1.01 0.00 0.00 58.87 60.50 2wss n SER 84 Cb 0.47 -0.61 0.33 0.00 -1.01 0.00 0.00 64.21 63.39 2wss n SER 84 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2wss n VAL 85 N -1.76 1.83 -0.02 0.44 0.24 -1.25 -4.10 118.33 113.72 2wss n VAL 85 Ca 0.01 -1.25 -0.00 0.00 -2.04 0.00 0.00 64.34 61.05 2wss n VAL 85 Cb 0.06 0.12 -0.04 0.00 -1.47 0.00 0.00 33.84 32.51 2wss n VAL 85 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wss n ALA 86 N 0.91 2.02 0.85 2.33 0.00 0.33 -3.89 120.51 123.06 2wss n ALA 86 Ca 0.24 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2wss n ALA 86 Cb 0.86 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.30 2wss n ALA 86 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wss n LYS 87 N -1.97 0.85 -0.37 0.00 4.81 -0.61 -2.14 118.16 118.73 2wss n LYS 87 Ca -0.05 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.38 2wss n LYS 87 Cb 0.44 -1.14 -0.01 0.00 0.02 0.00 0.00 35.03 34.34 2wss n LYS 87 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2wss n GLN 88 N 0.49 0.00 0.00 1.64 -0.06 -1.26 -4.83 117.38 113.35 2wss n GLN 88 Ca 0.00 -0.13 0.00 0.00 -2.00 0.00 0.00 57.00 54.87 2wss n GLN 88 Cb 0.39 0.15 0.00 0.00 -4.06 0.00 0.00 30.24 26.72 2wss n GLN 88 CO 0.00 0.00 0.00 -1.33 -0.20 0.00 0.00 177.06 175.53 2wss n MET 89 N 0.00 0.00 0.18 3.69 2.81 -0.91 -4.42 117.12 118.47 2wss n MET 89 Ca -0.04 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 55.98 2wss n MET 89 Cb 0.29 -0.31 0.27 0.00 -0.71 0.00 0.00 33.22 32.77 2wss n MET 89 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 2wss h LYS 90 N 0.00 0.00 -0.02 0.03 2.10 -1.77 -1.11 116.57 115.80 2wss h LYS 90 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2wss h LYS 90 Cb 0.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.44 2wss h LYS 90 CO 0.00 0.00 -0.15 0.45 -2.00 0.00 0.00 179.45 177.75 2wss n SER 91 N -2.78 1.81 -0.01 7.07 2.88 -1.25 -3.68 113.62 117.67 2wss n SER 91 Ca 0.04 -1.46 0.00 0.00 -1.33 0.00 0.00 58.87 56.13 2wss n SER 91 Cb 0.48 0.12 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 2wss n SER 91 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2wss n GLU 92 N 0.20 2.07 0.00 -1.46 -0.58 -1.17 -4.29 120.64 115.41 2wss n GLU 92 Ca 0.14 -1.23 0.10 0.00 -0.42 0.00 0.00 57.16 55.75 2wss n GLU 92 Cb 0.43 -0.86 -0.08 0.00 -0.57 0.00 0.00 31.44 30.35 2wss n GLU 92 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wss n ALA 93 N -0.37 4.38 0.03 0.62 0.00 -0.43 -3.69 120.51 121.04 2wss n ALA 93 Ca 0.00 -0.56 0.05 0.00 0.00 0.00 0.00 53.44 52.94 2wss n ALA 93 Cb 0.34 -0.81 -0.08 0.00 0.00 0.00 0.00 19.45 18.89 2wss n ALA 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wss n ALA 94 N -1.60 2.46 -0.03 0.00 0.00 -1.25 -4.58 120.51 115.52 2wss n ALA 94 Ca 0.03 -0.26 -0.15 0.00 0.00 0.00 0.00 53.44 53.06 2wss n ALA 94 Cb 0.36 -0.37 -0.11 0.00 0.00 0.00 0.00 19.45 19.33 2wss n ALA 94 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2wss h ASN 95 N 0.00 0.23 -4.04 0.00 4.21 -1.75 -3.52 115.58 110.71 2wss h ASN 95 Ca 0.00 -0.76 -0.49 0.00 1.21 0.00 0.00 56.30 56.26 2wss h ASN 95 Cb 0.48 -0.07 0.03 0.00 -1.12 0.00 0.00 38.32 37.65 2wss h ASN 95 CO 0.00 0.95 0.29 -0.76 -1.29 0.00 0.00 177.43 176.62 2wss s LEU 96 N -8.55 3.52 0.00 1.61 1.43 -1.24 -5.11 118.68 110.33 2wss s LEU 96 Ca -0.16 1.31 0.00 0.00 -1.03 0.00 0.00 54.13 54.25 2wss s LEU 96 Cb 0.01 -4.28 0.00 0.00 0.03 0.00 0.00 46.19 41.95 2wss s LEU 96 CO 0.74 -0.65 0.00 0.29 0.23 0.00 0.00 176.35 176.96 2wss n LYS 101 N -2.08 0.00 -2.98 1.70 4.01 -1.26 -4.79 118.16 112.76 2wss n LYS 101 Ca 0.04 0.00 0.01 0.00 -0.51 0.00 0.00 58.31 57.85 2wss n LYS 101 Cb 0.54 0.00 -0.00 0.00 -0.51 0.00 0.00 35.03 35.06 2wss n LYS 101 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 2wss s GLU 102 N 0.00 0.53 0.28 1.97 2.12 -1.26 -5.15 118.70 117.18 2wss s GLU 102 Ca 0.00 -0.20 -0.12 0.00 0.36 0.00 0.00 54.97 55.01 2wss s GLU 102 Cb 0.00 0.05 -0.08 0.00 0.26 0.00 0.00 34.13 34.37 2wss s GLU 102 CO 0.00 -0.75 0.64 0.08 -0.54 0.00 0.00 175.26 174.69 2wss s VAL 103 N 1.83 4.82 0.37 3.70 1.01 -1.26 -5.10 120.40 125.76 2wss s VAL 103 Ca 0.16 0.67 0.07 0.00 0.00 0.00 0.00 61.98 62.89 2wss s VAL 103 Cb -0.00 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 2wss s VAL 103 CO -0.11 -0.14 0.39 -0.54 0.00 0.00 0.00 175.10 174.71 2wss s LYS 104 N -2.94 2.79 -0.43 2.72 1.02 -1.26 -5.03 119.74 116.60 2wss s LYS 104 Ca 0.50 -1.28 -0.27 0.00 0.02 0.00 0.00 55.97 54.95 2wss s LYS 104 Cb -0.11 -2.58 -0.03 0.00 -0.52 0.00 0.00 37.83 34.59 2wss s LYS 104 CO 0.20 -0.03 2.01 0.42 -0.92 0.00 0.00 175.35 177.03 2wss s ILE 105 N -2.32 3.27 -0.28 2.17 1.01 0.13 -4.87 121.20 120.31 2wss s ILE 105 Ca 0.46 0.23 -0.01 0.00 0.00 0.00 0.00 60.65 61.33 2wss s ILE 105 Cb -0.07 -3.51 0.09 0.00 0.01 0.00 0.00 42.46 38.98 2wss s ILE 105 CO 0.29 -0.42 0.07 -0.63 0.00 0.00 0.00 174.94 174.25 2wss s ILE 106 N 8.90 0.86 0.00 2.92 1.01 -1.26 -1.39 121.20 132.23 2wss s ILE 106 Ca 0.83 -1.22 -0.12 0.00 0.00 0.00 0.00 60.65 60.13 2wss s ILE 106 Cb -0.20 -1.55 0.01 0.00 0.01 0.00 0.00 42.46 40.73 2wss s ILE 106 CO 0.28 -0.55 0.25 -0.83 0.00 0.00 0.00 174.94 174.10 2wss s GLY 107 N 1.65 -0.08 0.13 6.18 0.00 -1.25 -4.02 107.32 109.93 2wss s GLY 107 Ca 0.07 0.10 -0.03 0.00 0.00 0.00 0.00 44.72 44.85 2wss s GLY 107 CO -0.21 -0.08 0.35 0.54 0.00 0.00 0.00 173.10 173.70 2wss s VAL 108 N -1.60 5.21 0.00 1.40 0.11 0.27 -4.02 120.40 121.77 2wss s VAL 108 Ca -0.12 -0.09 0.00 0.00 -2.93 0.00 0.00 61.98 58.84 2wss s VAL 108 Cb -0.05 -3.64 0.00 0.00 -1.53 0.00 0.00 36.38 31.16 2wss s VAL 108 CO 0.02 0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.43 2wss n GLY 109 N 0.04 1.24 0.50 6.54 0.00 -1.25 -3.70 105.19 108.56 2wss n GLY 109 Ca -0.03 -0.77 0.33 0.00 0.00 0.00 0.00 46.02 45.55 2wss n GLY 109 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2wss h ASP 110 N 0.00 0.14 0.10 1.61 3.58 -1.49 0.58 116.42 120.94 2wss h ASP 110 Ca 0.00 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.48 2wss h ASP 110 Cb 0.00 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2wss h ASP 110 CO 0.00 0.01 0.00 1.17 -2.88 0.00 0.00 179.24 177.54 2wss n LYS 111 N -4.33 0.10 -0.03 0.28 3.00 -1.07 0.39 118.16 116.49 2wss n LYS 111 Ca 0.27 0.20 -0.12 0.00 -0.00 0.00 0.00 58.31 58.66 2wss n LYS 111 Cb 1.18 -1.50 -0.14 0.00 0.00 0.00 0.00 35.03 34.57 2wss n LYS 111 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2wss n ILE 112 N -1.25 1.62 -0.15 3.15 2.08 0.20 -2.71 119.36 122.29 2wss n ILE 112 Ca 0.03 -0.77 0.07 0.00 0.56 0.00 0.00 62.75 62.64 2wss n ILE 112 Cb 0.04 -1.14 0.38 0.00 -0.75 0.00 0.00 39.64 38.17 2wss n ILE 112 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 2wss h ARG 113 N 0.02 0.68 0.25 0.38 1.12 -0.15 0.86 114.38 117.53 2wss h ARG 113 Ca -0.35 -0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 58.46 2wss h ARG 113 Cb 2.04 -0.15 0.00 0.00 -0.01 0.00 0.00 29.97 31.85 2wss h ARG 113 CO 0.07 0.45 -0.12 0.77 -3.11 0.00 0.00 179.97 178.03 2wss h SER 114 N 0.70 -0.29 -0.15 -3.80 0.02 -1.52 -3.22 113.55 105.30 2wss h SER 114 Ca 0.29 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 2wss h SER 114 Cb 0.26 0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.87 2wss h SER 114 CO -0.09 0.22 0.00 -0.38 -1.14 0.00 0.00 176.83 175.43 2wss n ILE 115 N -5.00 0.54 -2.74 3.27 5.41 -1.10 -4.11 119.36 115.62 2wss n ILE 115 Ca -0.07 -0.31 -0.08 0.00 1.00 0.00 0.00 62.75 63.29 2wss n ILE 115 Cb 0.23 -0.28 0.06 0.00 -0.71 0.00 0.00 39.64 38.95 2wss n ILE 115 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 2wss n LEU 116 N 0.11 -2.70 0.00 1.39 7.94 0.29 -4.95 117.00 119.08 2wss n LEU 116 Ca 0.06 -3.27 0.00 0.00 -1.11 0.00 0.00 56.01 51.70 2wss n LEU 116 Cb 0.38 0.84 0.00 0.00 0.53 0.00 0.00 43.42 45.17 2wss n LEU 116 CO 0.07 1.98 0.00 1.57 -1.11 0.00 0.00 177.39 179.90 2wss n HIS 117 N 1.41 0.00 0.90 1.96 -0.00 -1.22 -4.58 115.22 113.70 2wss n HIS 117 Ca 0.08 0.00 0.13 0.00 0.46 0.00 0.00 57.72 58.39 2wss n HIS 117 Cb 0.65 0.00 0.36 0.00 -0.12 0.00 0.00 29.99 30.88 2wss n HIS 117 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2wss n ARG 118 N -0.31 0.07 0.00 1.57 3.00 -1.26 -3.69 116.66 116.04 2wss n ARG 118 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 57.85 57.87 2wss n ARG 118 Cb 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 32.46 30.91 2wss n ARG 118 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 2wss n THR 119 N -1.65 0.00 -3.19 0.55 5.66 -1.26 -4.85 114.28 109.53 2wss n THR 119 Ca 0.06 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.84 2wss n THR 119 Cb 0.36 -0.28 -0.05 0.00 -1.55 0.00 0.00 70.33 68.81 2wss n THR 119 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2wss n HIS 120 N -1.52 -0.03 1.16 1.09 8.25 -1.26 -4.97 115.22 117.94 2wss n HIS 120 Ca 0.00 -3.69 0.13 0.00 -0.26 0.00 0.00 57.72 53.91 2wss n HIS 120 Cb 0.23 -0.38 0.49 0.00 1.12 0.00 0.00 29.99 31.44 2wss n HIS 120 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2wss n SER 121 N 0.89 0.38 -0.08 0.41 2.88 -1.24 -4.41 113.62 112.46 2wss n SER 121 Ca 0.23 -0.19 -0.06 0.00 -1.33 0.00 0.00 58.87 57.51 2wss n SER 121 Cb 0.58 -0.08 -0.02 0.00 -0.75 0.00 0.00 64.21 63.95 2wss n SER 121 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2wss n ASP 122 N -1.26 1.84 0.00 -3.46 8.00 -1.26 -4.38 116.55 116.03 2wss n ASP 122 Ca 0.09 0.51 0.00 0.00 0.71 0.00 0.00 54.79 56.11 2wss n ASP 122 Cb 0.32 -0.82 0.00 0.00 -0.02 0.00 0.00 41.12 40.60 2wss n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wss n GLN 123 N -4.53 0.00 -1.39 -1.24 3.00 -1.26 -4.78 117.38 107.18 2wss n GLN 123 Ca -0.10 0.04 -0.46 0.00 -0.01 0.00 0.00 57.00 56.47 2wss n GLN 123 Cb 0.36 -1.51 -0.02 0.00 0.00 0.00 0.00 30.24 29.07 2wss n GLN 123 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 2wss n PHE 124 N -0.97 -0.79 0.03 1.08 3.01 -1.26 0.18 117.46 118.74 2wss n PHE 124 Ca 0.00 0.87 0.00 0.00 1.01 0.00 0.00 57.45 59.33 2wss n PHE 124 Cb 0.01 -1.93 0.00 0.00 -0.01 0.00 0.00 39.48 37.55 2wss n PHE 124 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 2wss n LEU 125 N 2.03 0.08 -3.50 4.37 -0.00 -0.49 -4.62 117.00 114.87 2wss n LEU 125 Ca 0.16 0.08 -0.06 0.00 -0.00 0.00 0.00 56.01 56.20 2wss n LEU 125 Cb 0.29 0.03 -0.07 0.00 -0.00 0.00 0.00 43.42 43.67 2wss n LEU 125 CO 0.56 -0.57 0.06 0.68 -0.00 0.00 0.00 177.39 178.12 2wss s VAL 126 N -1.24 -0.74 0.33 1.96 -7.23 -1.16 -5.06 120.40 107.27 2wss s VAL 126 Ca 0.00 0.05 0.07 0.00 -1.81 0.00 0.00 61.98 60.30 2wss s VAL 126 Cb 0.00 -0.80 -0.03 0.00 0.56 0.00 0.00 36.38 36.11 2wss s VAL 126 CO 0.00 -0.00 0.30 -0.89 -0.31 0.00 0.00 175.10 174.20 2wss s THR 127 N 2.67 3.57 0.30 5.32 2.01 -1.26 -3.87 115.64 124.37 2wss s THR 127 Ca 0.05 -1.36 0.03 0.00 0.31 0.00 0.00 61.69 60.72 2wss s THR 127 Cb -0.13 -3.20 -0.06 0.00 0.01 0.00 0.00 72.50 69.12 2wss s THR 127 CO -0.16 -0.18 0.07 -0.36 -0.69 0.00 0.00 174.62 173.31 2wss s PHE 128 N -2.30 1.80 0.28 4.92 0.40 -1.26 -4.99 117.98 116.83 2wss s PHE 128 Ca 0.41 -1.05 -0.01 0.00 -0.60 0.00 0.00 56.93 55.68 2wss s PHE 128 Cb -0.06 -1.13 -0.02 0.00 0.51 0.00 0.00 43.02 42.32 2wss s PHE 128 CO 0.27 -0.13 0.31 0.21 0.70 0.00 0.00 175.22 176.58 2wss s LYS 129 N -3.95 1.57 -1.79 0.44 2.20 -1.26 -2.23 119.74 114.72 2wss s LYS 129 Ca 0.37 -1.71 0.00 0.00 -0.36 0.00 0.00 55.97 54.28 2wss s LYS 129 Cb 0.08 0.36 0.00 0.00 -1.51 0.00 0.00 37.83 36.76 2wss s LYS 129 CO 0.15 -0.60 0.00 0.39 -0.36 0.00 0.00 175.35 174.93 2wss n GLU 130 N -0.45 -1.68 -3.07 4.03 4.71 -1.26 -4.96 120.64 117.96 2wss n GLU 130 Ca 0.03 1.01 -0.40 0.00 -0.01 0.00 0.00 57.16 57.78 2wss n GLU 130 Cb 0.63 -5.60 -0.05 0.00 -1.01 0.00 0.00 31.44 25.41 2wss n GLU 130 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2wss s VAL 131 N -2.91 4.99 0.00 2.62 1.01 -1.26 -4.22 120.40 120.64 2wss s VAL 131 Ca 0.00 1.28 0.00 0.00 0.00 0.00 0.00 61.98 63.26 2wss s VAL 131 Cb 0.00 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.40 2wss s VAL 131 CO 0.00 0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.81 2wss n GLY 132 N 3.71 2.61 0.26 4.51 0.00 -1.26 -2.82 105.19 112.20 2wss n GLY 132 Ca -0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 46.02 45.57 2wss n GLY 132 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2wss h ARG 133 N 0.00 -0.42 -5.59 1.61 2.47 -2.00 -3.41 114.38 107.05 2wss h ARG 133 Ca 0.00 0.03 -0.65 0.00 -1.26 0.00 0.00 59.98 58.10 2wss h ARG 133 Cb 0.00 0.10 -0.12 0.00 -1.65 0.00 0.00 29.97 28.29 2wss h ARG 133 CO 0.00 -0.28 -0.54 1.03 0.56 0.00 0.00 179.97 180.74 2wss s ARG 134 N -4.48 3.54 -0.29 0.04 1.81 -1.26 -5.04 118.95 113.26 2wss s ARG 134 Ca -0.09 -0.27 -0.35 0.00 -1.72 0.00 0.00 55.73 53.30 2wss s ARG 134 Cb 0.03 -3.11 -0.11 0.00 -0.45 0.00 0.00 34.95 31.30 2wss s ARG 134 CO 0.32 0.57 2.11 -2.30 -0.68 0.00 0.00 175.30 175.32 2wss n PRO 135 N 2.60 1.31 -1.87 3.54 -0.02 -1.26 -4.87 135.00 134.43 2wss n PRO 135 Ca -0.18 0.39 -0.41 0.00 -2.02 0.00 0.00 63.50 61.28 2wss n PRO 135 Cb 0.54 -2.52 -0.02 0.00 -0.02 0.00 0.00 33.50 31.47 2wss n PRO 135 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2wss s PRO 136 N 5.68 4.18 0.34 0.52 0.02 -1.26 -5.01 135.00 139.47 2wss s PRO 136 Ca 1.05 2.47 0.04 0.00 0.02 0.00 0.00 61.00 64.58 2wss s PRO 136 Cb -0.81 -3.06 -0.06 0.00 0.02 0.00 0.00 34.50 30.59 2wss s PRO 136 CO 0.50 -0.56 0.06 0.95 -0.33 0.00 0.00 177.00 177.62 2wss s THR 137 N 0.07 1.14 0.13 0.99 -4.23 -1.26 -4.81 115.64 107.68 2wss s THR 137 Ca 0.62 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.97 2wss s THR 137 Cb -0.46 -2.74 0.06 0.00 1.34 0.00 0.00 72.50 70.70 2wss s THR 137 CO 0.45 0.00 1.03 0.33 -0.54 0.00 0.00 174.62 175.89 2wss n PHE 138 N -0.72 -0.13 -0.32 3.99 -0.00 -1.26 0.10 117.46 119.11 2wss n PHE 138 Ca -0.03 0.83 0.08 0.00 -0.00 0.00 0.00 57.45 58.32 2wss n PHE 138 Cb 0.66 -0.65 0.18 0.00 -0.00 0.00 0.00 39.48 39.67 2wss n PHE 138 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 2wss h GLY 139 N 0.00 0.86 -0.42 7.13 0.00 -1.99 1.21 103.07 109.86 2wss h GLY 139 Ca 0.17 0.24 0.19 0.00 0.00 0.00 0.00 47.33 47.93 2wss h GLY 139 CO -0.65 -0.39 0.07 -0.55 0.00 0.00 0.00 176.54 175.02 2wss h ASP 140 N 0.02 -0.27 0.43 0.19 3.32 0.27 -0.12 116.42 120.26 2wss h ASP 140 Ca 0.48 0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.71 2wss h ASP 140 Cb 0.84 0.33 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2wss h ASP 140 CO -0.91 -0.18 -0.21 0.00 -1.72 0.00 0.00 179.24 176.22 2wss h ALA 141 N 1.74 -0.87 -0.84 3.45 0.00 0.14 -3.24 119.26 119.65 2wss h ALA 141 Ca 0.46 -0.13 0.20 0.00 0.00 0.00 0.00 54.91 55.44 2wss h ALA 141 Cb 0.85 0.23 -0.15 0.00 0.00 0.00 0.00 17.79 18.72 2wss h ALA 141 CO -0.68 -0.82 0.02 0.66 0.00 0.00 0.00 179.25 178.43 2wss h SER 142 N -0.76 -0.38 0.00 0.00 4.64 -0.92 0.38 113.55 116.50 2wss h SER 142 Ca -0.06 0.22 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2wss h SER 142 Cb 0.45 0.39 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2wss h SER 142 CO 0.10 -0.23 0.00 0.52 -0.87 0.00 0.00 176.83 176.35 2wss n VAL 143 N -5.38 0.86 -0.11 0.95 0.31 -0.10 0.14 118.33 115.00 2wss n VAL 143 Ca 0.17 0.22 -0.14 0.00 -0.01 0.00 0.00 64.34 64.57 2wss n VAL 143 Cb 0.56 -1.22 -0.13 0.00 -0.91 0.00 0.00 33.84 32.15 2wss n VAL 143 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2wss n ILE 144 N -1.22 1.40 -0.04 2.52 5.41 0.13 -3.95 119.36 123.61 2wss n ILE 144 Ca 0.00 -0.66 -0.16 0.00 1.00 0.00 0.00 62.75 62.93 2wss n ILE 144 Cb 0.00 -1.03 -0.07 0.00 -0.71 0.00 0.00 39.64 37.84 2wss n ILE 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2wss h ALA 145 N 0.38 0.32 0.00 -1.39 0.00 0.38 -2.48 119.26 116.47 2wss h ALA 145 Ca -0.55 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 53.83 2wss h ALA 145 Cb 2.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.76 2wss h ALA 145 CO -0.04 0.56 0.07 1.25 0.00 0.00 0.00 179.25 181.09 2wss h LEU 146 N 0.43 0.00 -2.14 0.00 6.46 0.10 -0.28 115.31 119.89 2wss h LEU 146 Ca -0.02 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 2wss h LEU 146 Cb 1.22 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.15 2wss h LEU 146 CO 0.13 0.00 0.00 1.21 -0.62 0.00 0.00 178.44 179.16 2wss n GLU 147 N -2.94 1.78 0.00 1.25 4.07 -1.06 -3.02 120.64 120.72 2wss n GLU 147 Ca -0.03 -1.70 0.10 0.00 -0.06 0.00 0.00 57.16 55.47 2wss n GLU 147 Cb 0.13 -1.29 -0.07 0.00 -0.06 0.00 0.00 31.44 30.15 2wss n GLU 147 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 2wss n LEU 148 N 0.74 1.32 -0.10 4.31 7.94 -0.13 -3.60 117.00 127.48 2wss n LEU 148 Ca 0.11 -0.60 -0.17 0.00 -1.11 0.00 0.00 56.01 54.24 2wss n LEU 148 Cb 0.39 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.29 2wss n LEU 148 CO 0.09 0.28 -0.98 0.18 -1.11 0.00 0.00 177.39 175.85 2wss n LEU 149 N -0.94 1.77 0.00 -1.96 4.77 -1.11 -4.22 117.00 115.31 2wss n LEU 149 Ca 0.06 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2wss n LEU 149 Cb 0.36 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 2wss n LEU 149 CO 0.35 0.10 0.44 0.59 -1.33 0.00 0.00 177.39 177.55 2wss n ASN 150 N -4.21 0.00 -4.52 -1.43 4.13 -1.17 -2.30 115.26 105.76 2wss n ASN 150 Ca -0.31 0.89 -0.21 0.00 1.68 0.00 0.00 54.58 56.63 2wss n ASN 150 Cb 0.65 -0.39 -0.10 0.00 -1.54 0.00 0.00 39.78 38.41 2wss n ASN 150 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2wss n SER 151 N -2.43 1.97 -4.53 6.41 3.41 -1.24 -4.83 113.62 112.39 2wss n SER 151 Ca 0.00 -2.57 -0.35 0.00 -0.26 0.00 0.00 58.87 55.69 2wss n SER 151 Cb 0.00 -1.68 -0.08 0.00 -0.26 0.00 0.00 64.21 62.19 2wss n SER 151 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wss n GLY 152 N 5.93 -0.08 3.79 5.00 0.00 -0.97 -4.71 105.19 114.15 2wss n GLY 152 Ca 0.43 0.75 -0.34 0.00 0.00 0.00 0.00 46.02 46.86 2wss n GLY 152 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2wss s TYR 153 N 10.97 3.35 -0.67 1.61 5.04 -1.26 -5.04 117.35 131.35 2wss s TYR 153 Ca 1.11 0.28 -0.26 0.00 -2.44 0.00 0.00 57.07 55.76 2wss s TYR 153 Cb -0.53 -1.80 -0.04 0.00 0.35 0.00 0.00 41.96 39.95 2wss s TYR 153 CO 0.33 0.58 1.95 -1.21 -1.34 0.00 0.00 175.55 175.86 2wss s GLU 154 N -1.46 2.52 0.26 4.97 0.41 -1.26 -4.95 118.70 119.18 2wss s GLU 154 Ca 0.20 0.50 -0.29 0.00 -0.41 0.00 0.00 54.97 54.97 2wss s GLU 154 Cb -0.12 -4.56 -0.09 0.00 -1.78 0.00 0.00 34.13 27.58 2wss s GLU 154 CO 0.10 -2.98 0.95 -0.06 -0.49 0.00 0.00 175.26 172.78 2wss s PHE 155 N 9.81 3.92 0.14 1.61 0.40 -1.26 -4.97 117.98 127.63 2wss s PHE 155 Ca 0.72 1.89 0.00 0.00 -0.60 0.00 0.00 56.93 58.93 2wss s PHE 155 Cb -0.12 -2.99 0.00 0.00 0.51 0.00 0.00 43.02 40.42 2wss s PHE 155 CO 0.16 0.36 0.00 -0.25 0.70 0.00 0.00 175.22 176.19 2wss n ASP 156 N 1.33 0.29 -3.93 1.36 9.92 -1.26 -4.27 116.55 120.00 2wss n ASP 156 Ca -0.01 0.23 -0.09 0.00 -0.53 0.00 0.00 54.79 54.38 2wss n ASP 156 Cb 0.47 0.05 -0.07 0.00 -0.64 0.00 0.00 41.12 40.93 2wss n ASP 156 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2wss s GLU 157 N -1.69 1.09 -0.11 -1.24 2.12 -1.26 -3.05 118.70 114.56 2wss s GLU 157 Ca 0.00 -1.11 -0.02 0.00 0.36 0.00 0.00 54.97 54.20 2wss s GLU 157 Cb 0.00 0.37 -0.03 0.00 0.26 0.00 0.00 34.13 34.74 2wss s GLU 157 CO 0.00 -0.39 -0.05 0.20 -0.54 0.00 0.00 175.26 174.48 2wss s GLY 158 N -2.94 1.72 -0.38 -1.50 0.00 0.42 -4.59 107.32 100.05 2wss s GLY 158 Ca 0.14 -0.84 0.01 0.00 0.00 0.00 0.00 44.72 44.03 2wss s GLY 158 CO -0.03 -0.37 0.17 -1.35 0.00 0.00 0.00 173.10 171.52 2wss s SER 159 N -0.26 3.92 -0.17 1.64 1.04 -1.26 -3.60 113.70 115.02 2wss s SER 159 Ca 0.04 -2.22 -0.01 0.00 0.48 0.00 0.00 55.95 54.25 2wss s SER 159 Cb -0.13 -1.05 0.04 0.00 0.10 0.00 0.00 66.02 64.99 2wss s SER 159 CO 0.02 -0.33 -0.04 -0.51 0.98 0.00 0.00 173.24 173.36 2wss s ILE 160 N 0.87 1.03 0.17 -1.02 1.10 -1.13 -4.44 121.20 117.77 2wss s ILE 160 Ca 0.14 -0.60 0.07 0.00 -0.51 0.00 0.00 60.65 59.75 2wss s ILE 160 Cb -0.21 -1.24 -0.04 0.00 0.15 0.00 0.00 42.46 41.12 2wss s ILE 160 CO -0.10 0.09 0.01 0.27 -2.11 0.00 0.00 174.94 173.10 2wss s ILE 161 N 1.66 3.78 0.20 2.00 -4.36 -1.26 -3.14 121.20 120.08 2wss s ILE 161 Ca 0.00 -1.38 -0.23 0.00 -0.26 0.00 0.00 60.65 58.78 2wss s ILE 161 Cb -0.15 -2.90 0.07 0.00 1.25 0.00 0.00 42.46 40.72 2wss s ILE 161 CO -0.07 -0.10 0.96 0.72 0.24 0.00 0.00 174.94 176.69 2wss s PHE 162 N -1.72 -0.02 -0.53 1.37 -0.71 -1.05 -2.05 117.98 113.27 2wss s PHE 162 Ca 0.28 -0.37 -0.09 0.00 -1.04 0.00 0.00 56.93 55.71 2wss s PHE 162 Cb -0.09 0.69 0.14 0.00 -1.21 0.00 0.00 43.02 42.54 2wss s PHE 162 CO 0.19 -0.97 0.40 -0.80 -1.34 0.00 0.00 175.22 172.70 2wss s ASN 163 N -3.14 5.73 0.49 1.98 0.01 -1.26 -1.08 114.94 117.67 2wss s ASN 163 Ca 0.16 -2.14 -0.23 0.00 -0.71 0.00 0.00 52.86 49.94 2wss s ASN 163 Cb -0.02 -2.00 -0.08 0.00 0.41 0.00 0.00 41.25 39.56 2wss s ASN 163 CO 0.05 -0.63 1.25 -1.14 -1.51 0.00 0.00 177.10 175.12 2wss n ARG 164 N 4.59 1.71 -3.43 -0.60 0.63 -0.45 -3.62 116.66 115.49 2wss n ARG 164 Ca -0.03 0.62 -0.39 0.00 -0.92 0.00 0.00 57.85 57.13 2wss n ARG 164 Cb 0.41 -2.41 -0.10 0.00 0.45 0.00 0.00 32.46 30.81 2wss n ARG 164 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 2wss s PHE 165 N -1.27 3.24 -0.12 -0.14 5.36 -1.26 -3.03 117.98 120.76 2wss s PHE 165 Ca 0.66 0.30 -0.11 0.00 -0.96 0.00 0.00 56.93 56.82 2wss s PHE 165 Cb -0.47 -2.54 -0.04 0.00 -0.34 0.00 0.00 43.02 39.63 2wss s PHE 165 CO 0.54 -0.24 -0.21 0.54 -1.46 0.00 0.00 175.22 174.39 2wss n ARG 166 N 5.28 0.35 -4.29 10.12 1.74 -1.12 -4.99 116.66 123.75 2wss n ARG 166 Ca -0.10 0.22 -0.15 0.00 -0.77 0.00 0.00 57.85 57.05 2wss n ARG 166 Cb 0.51 -1.21 -0.10 0.00 -1.02 0.00 0.00 32.46 30.64 2wss n ARG 166 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2wss s SER 167 N -5.24 1.32 0.42 0.55 1.04 0.54 -4.99 113.70 107.33 2wss s SER 167 Ca -0.17 -1.26 0.13 0.00 0.48 0.00 0.00 55.95 55.12 2wss s SER 167 Cb 0.02 0.11 0.98 0.00 0.10 0.00 0.00 66.02 67.23 2wss s SER 167 CO 0.26 -0.62 1.96 -0.37 0.98 0.00 0.00 173.24 175.45 2wss h VAL 168 N 2.54 0.89 -0.01 5.02 -1.51 -1.96 -1.83 116.25 119.38 2wss h VAL 168 Ca -0.38 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 64.93 2wss h VAL 168 Cb 1.22 0.37 0.00 0.00 -2.13 0.00 0.00 31.29 30.75 2wss h VAL 168 CO 0.62 0.09 -0.23 2.30 -1.23 0.00 0.00 177.57 179.12 2wss n ILE 169 N -4.48 0.00 -3.55 7.19 -6.64 -1.26 -4.35 119.36 106.27 2wss n ILE 169 Ca 0.11 -0.23 -0.15 0.00 -1.77 0.00 0.00 62.75 60.71 2wss n ILE 169 Cb 0.38 0.77 -0.06 0.00 -1.44 0.00 0.00 39.64 39.30 2wss n ILE 169 CO 0.00 0.00 0.00 -0.55 -1.77 0.00 0.00 176.55 174.23 2wss s SER 170 N -2.34 -0.58 0.00 7.28 0.15 -0.69 -5.10 113.70 112.42 2wss s SER 170 Ca 0.26 0.69 0.00 0.00 0.70 0.00 0.00 55.95 57.60 2wss s SER 170 Cb 0.19 0.56 0.00 0.00 -1.71 0.00 0.00 66.02 65.06 2wss s SER 170 CO 0.47 -0.50 0.00 0.00 1.20 0.00 0.00 173.24 174.42 2wss n TYR 171 N 1.04 0.00 0.00 3.44 0.18 -1.26 0.20 117.16 120.76 2wss n TYR 171 Ca -0.16 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.62 2wss n TYR 171 Cb 0.57 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.53 2wss n TYR 171 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 2wss n LYS 172 N -0.31 0.00 -0.66 -3.48 3.00 -1.17 -3.45 118.16 112.08 2wss n LYS 172 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.00 2wss n LYS 172 Cb 0.00 0.00 0.17 0.00 0.00 0.00 0.00 35.03 35.20 2wss n LYS 172 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 2wss n THR 173 N 0.00 0.00 -3.69 3.15 -1.04 -1.26 -1.34 114.28 110.10 2wss n THR 173 Ca 0.00 -0.09 -0.11 0.00 -2.04 0.00 0.00 64.05 61.81 2wss n THR 173 Cb 0.00 -0.93 -0.10 0.00 -1.82 0.00 0.00 70.33 67.48 2wss n THR 173 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2wss s GLU 174 N -4.43 0.51 -0.27 -2.82 2.12 -0.24 -4.71 118.70 108.85 2wss s GLU 174 Ca 0.65 0.80 -0.10 0.00 0.36 0.00 0.00 54.97 56.68 2wss s GLU 174 Cb -0.23 0.12 -0.05 0.00 0.26 0.00 0.00 34.13 34.24 2wss s GLU 174 CO 0.60 -0.12 0.17 -2.00 -0.54 0.00 0.00 175.26 173.38 2wss s GLU 175 N 0.96 3.91 0.08 4.30 2.12 -1.26 -2.52 118.70 126.29 2wss s GLU 175 Ca -0.06 -0.34 0.10 0.00 0.36 0.00 0.00 54.97 55.03 2wss s GLU 175 Cb -0.06 -3.60 -0.03 0.00 0.26 0.00 0.00 34.13 30.69 2wss s GLU 175 CO -0.08 -0.17 -0.26 0.15 -0.54 0.00 0.00 175.26 174.36 2wss s LYS 176 N 1.70 1.67 -0.16 4.30 -0.14 -1.19 -5.05 119.74 120.88 2wss s LYS 176 Ca 0.07 -1.19 -0.03 0.00 -1.36 0.00 0.00 55.97 53.45 2wss s LYS 176 Cb -0.16 -1.96 -0.03 0.00 -1.68 0.00 0.00 37.83 34.00 2wss s LYS 176 CO 0.10 0.49 -0.04 -1.25 -0.76 0.00 0.00 175.35 173.89 2wss s PRO 177 N -1.55 3.63 -0.05 -1.68 0.05 -1.26 -2.85 135.00 131.29 2wss s PRO 177 Ca 0.13 -0.54 0.06 0.00 0.05 0.00 0.00 61.00 60.69 2wss s PRO 177 Cb -0.10 -2.91 -0.01 0.00 0.05 0.00 0.00 34.50 31.53 2wss s PRO 177 CO 0.04 0.20 -0.22 0.42 0.05 0.00 0.00 177.00 177.48 2wss s ILE 178 N 0.47 1.81 -0.74 0.56 -1.09 -1.24 -4.95 121.20 116.02 2wss s ILE 178 Ca -0.04 -0.93 -0.24 0.00 -2.23 0.00 0.00 60.65 57.21 2wss s ILE 178 Cb -0.14 -1.54 0.06 0.00 -1.58 0.00 0.00 42.46 39.26 2wss s ILE 178 CO 0.03 0.51 1.12 -0.36 -1.23 0.00 0.00 174.94 175.01 2wss s PHE 179 N -0.12 2.58 0.39 3.97 0.08 -1.26 -0.44 117.98 123.19 2wss s PHE 179 Ca -0.03 -0.50 0.24 0.00 0.12 0.00 0.00 56.93 56.76 2wss s PHE 179 Cb -0.13 -4.43 1.28 0.00 -0.57 0.00 0.00 43.02 39.17 2wss s PHE 179 CO 0.03 -1.79 2.02 1.03 -0.10 0.00 0.00 175.22 176.40 2wss h SER 180 N 9.66 0.00 -3.53 1.36 0.87 -1.81 -3.40 113.55 116.70 2wss h SER 180 Ca -0.20 0.00 -0.64 0.00 -1.23 0.00 0.00 61.79 59.72 2wss h SER 180 Cb 1.05 0.00 -0.22 0.00 -0.44 0.00 0.00 62.40 62.80 2wss h SER 180 CO 1.23 0.16 -0.63 -0.22 -0.53 0.00 0.00 176.83 176.84 2wss s LEU 181 N -7.51 3.42 0.63 2.23 2.96 -1.17 -4.68 118.68 114.56 2wss s LEU 181 Ca -0.03 -0.17 0.34 0.00 -0.22 0.00 0.00 54.13 54.05 2wss s LEU 181 Cb 0.13 -1.89 1.94 0.00 0.50 0.00 0.00 46.19 46.87 2wss s LEU 181 CO 0.62 0.02 2.20 -0.78 -1.32 0.00 0.00 176.35 177.09 2wss h ASP 182 N 7.79 0.00 0.54 3.68 1.82 -1.92 -0.28 116.42 128.06 2wss h ASP 182 Ca -0.37 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.25 2wss h ASP 182 Cb 1.18 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 41.17 2wss h ASP 182 CO 0.60 0.00 -0.46 0.74 -1.61 0.00 0.00 179.24 178.51 2wss h THR 183 N 0.00 0.00 0.00 2.25 2.02 -1.93 0.26 112.91 115.51 2wss h THR 183 Ca 0.03 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.17 2wss h THR 183 Cb 0.25 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 2wss h THR 183 CO -0.00 0.00 -0.17 -0.29 0.37 0.00 0.00 175.52 175.43 2wss h ILE 184 N -0.98 1.04 0.34 3.11 -0.00 -1.49 -3.14 117.51 116.39 2wss h ILE 184 Ca -0.07 -0.60 -0.02 0.00 -0.00 0.00 0.00 64.86 64.17 2wss h ILE 184 Cb 0.83 1.33 0.00 0.00 -0.00 0.00 0.00 36.82 38.99 2wss h ILE 184 CO -0.02 0.17 -0.16 0.28 -0.00 0.00 0.00 178.15 178.42 2wss h SER 185 N 0.00 -0.39 0.00 2.19 0.02 -0.55 -3.04 113.55 111.78 2wss h SER 185 Ca -0.00 -0.10 -0.46 0.00 -0.84 0.00 0.00 61.79 60.39 2wss h SER 185 Cb 0.32 0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.96 2wss h SER 185 CO 0.02 -0.12 2.32 -1.20 -1.14 0.00 0.00 176.83 176.71 2wss n SER 186 N -5.21 6.80 -3.40 3.07 7.64 0.03 -4.87 113.62 117.68 2wss n SER 186 Ca -0.10 -2.46 0.00 0.00 1.01 0.00 0.00 58.87 57.32 2wss n SER 186 Cb 0.25 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.06 2wss n SER 186 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wss n ALA 187 N 3.36 0.00 0.02 -0.43 0.00 -1.15 -4.97 120.51 117.34 2wss n ALA 187 Ca 0.60 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 54.03 2wss n ALA 187 Cb 0.40 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.85 2wss n ALA 187 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2wss h GLU 188 N 0.00 -0.07 0.00 0.00 5.08 -1.90 -3.33 114.58 114.36 2wss h GLU 188 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wss h GLU 188 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2wss h GLU 188 CO 0.00 -0.04 0.42 0.77 -1.00 0.00 0.00 179.01 179.16 2wss h SER 189 N -0.30 0.00 -2.24 1.42 0.02 -1.95 -2.75 113.55 107.74 2wss h SER 189 Ca -0.01 0.00 -0.77 0.00 -0.84 0.00 0.00 61.79 60.18 2wss h SER 189 Cb 0.05 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.39 2wss h SER 189 CO 0.01 0.00 1.35 0.80 -1.14 0.00 0.00 176.83 177.85 2wss n MET 190 N -2.05 3.67 0.00 3.45 0.00 -1.25 -4.10 117.12 116.83 2wss n MET 190 Ca -0.01 -3.95 0.00 0.00 -0.00 0.00 0.00 57.70 53.74 2wss n MET 190 Cb 0.44 -2.84 0.00 0.00 0.00 0.00 0.00 33.22 30.82 2wss n MET 190 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 2wss n SER 191 N 3.86 0.13 0.00 6.12 3.41 -1.04 -4.70 113.62 121.40 2wss n SER 191 Ca 0.34 -0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 2wss n SER 191 Cb 0.38 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2wss n SER 191 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2wss n ILE 192 N -0.13 0.73 -4.41 -1.33 5.41 -1.26 -4.64 119.36 113.73 2wss n ILE 192 Ca 0.00 0.21 -0.26 0.00 1.00 0.00 0.00 62.75 63.70 2wss n ILE 192 Cb 0.00 -1.21 -0.12 0.00 -0.71 0.00 0.00 39.64 37.60 2wss n ILE 192 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2wss s TYR 193 N -2.30 2.25 0.22 1.39 1.51 -1.26 -5.15 117.35 114.00 2wss s TYR 193 Ca 0.00 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 55.70 2wss s TYR 193 Cb 0.00 -1.12 0.04 0.00 -0.11 0.00 0.00 41.96 40.77 2wss s TYR 193 CO 0.00 0.48 0.30 -0.25 -1.11 0.00 0.00 175.55 174.96 2wss n ASP 194 N 0.29 0.56 -3.62 2.29 8.00 -1.26 -4.67 116.55 118.14 2wss n ASP 194 Ca -0.13 -1.43 -0.19 0.00 0.71 0.00 0.00 54.79 53.75 2wss n ASP 194 Cb 0.56 -0.18 -0.06 0.00 -0.02 0.00 0.00 41.12 41.42 2wss n ASP 194 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2wss n ASP 195 N -2.88 0.49 -2.20 -2.24 8.00 -1.26 -4.71 116.55 111.74 2wss n ASP 195 Ca 0.05 -0.78 -0.11 0.00 0.71 0.00 0.00 54.79 54.67 2wss n ASP 195 Cb 0.20 -0.97 -0.12 0.00 -0.02 0.00 0.00 41.12 40.20 2wss n ASP 195 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2wss n ILE 196 N -3.19 2.41 -1.90 0.53 5.41 -1.26 -4.88 119.36 116.49 2wss n ILE 196 Ca -0.20 -1.23 -0.42 0.00 1.00 0.00 0.00 62.75 61.90 2wss n ILE 196 Cb 0.42 -1.93 -0.03 0.00 -0.71 0.00 0.00 39.64 37.40 2wss n ILE 196 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 2wss s ASP 197 N 2.27 6.56 0.00 4.38 1.01 -1.26 -4.83 116.67 124.79 2wss s ASP 197 Ca 0.52 2.63 0.01 0.00 0.71 0.00 0.00 52.55 56.42 2wss s ASP 197 Cb 0.24 -2.59 0.05 0.00 1.01 0.00 0.00 42.92 41.64 2wss s ASP 197 CO -0.00 -0.86 0.47 0.00 0.21 0.00 0.00 175.17 174.99 2wss n ALA 198 N 4.32 1.54 -0.01 5.23 0.00 -1.26 -1.50 120.51 128.82 2wss n ALA 198 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2wss n ALA 198 Cb 0.38 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.82 2wss n ALA 198 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wss n ASP 199 N -0.92 0.14 -0.45 0.00 8.00 -1.26 -3.38 116.55 118.68 2wss n ASP 199 Ca 0.01 -0.55 0.10 0.00 0.71 0.00 0.00 54.79 55.06 2wss n ASP 199 Cb 0.00 0.81 -0.01 0.00 -0.02 0.00 0.00 41.12 41.90 2wss n ASP 199 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 2wss n VAL 200 N -0.81 0.00 -0.11 2.53 3.14 -0.57 -3.75 118.33 118.78 2wss n VAL 200 Ca 0.00 -0.28 -0.17 0.00 -2.96 0.00 0.00 64.34 60.94 2wss n VAL 200 Cb 0.00 1.24 -0.13 0.00 -1.06 0.00 0.00 33.84 33.89 2wss n VAL 200 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2wss n LEU 201 N -0.07 2.35 0.25 6.55 4.77 -0.95 -3.91 117.00 125.98 2wss n LEU 201 Ca 0.08 -0.06 0.18 0.00 -0.03 0.00 0.00 56.01 56.18 2wss n LEU 201 Cb 0.43 -0.65 0.85 0.00 -2.33 0.00 0.00 43.42 41.71 2wss n LEU 201 CO 0.26 0.84 1.15 -0.09 -1.33 0.00 0.00 177.39 178.22 2wss h ARG 202 N 0.01 0.00 -1.88 3.23 9.65 -1.73 0.63 114.38 124.29 2wss h ARG 202 Ca -0.55 0.00 -0.66 0.00 -1.10 0.00 0.00 59.98 57.67 2wss h ARG 202 Cb 1.98 0.00 -0.36 0.00 -1.39 0.00 0.00 29.97 30.20 2wss h ARG 202 CO -0.04 0.00 -0.03 0.09 2.80 0.00 0.00 179.97 182.79 2wss n ASN 203 N -3.28 5.72 0.00 -3.80 3.02 -1.25 -3.97 115.26 111.71 2wss n ASN 203 Ca 0.01 -3.74 0.00 0.00 -0.03 0.00 0.00 54.58 50.82 2wss n ASN 203 Cb 0.40 -0.72 0.00 0.00 -0.61 0.00 0.00 39.78 38.84 2wss n ASN 203 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wss n TYR 204 N -0.40 0.00 0.22 3.10 9.36 -0.54 -4.76 117.16 124.14 2wss n TYR 204 Ca 0.42 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.76 2wss n TYR 204 Cb 0.45 0.00 0.35 0.00 -0.63 0.00 0.00 39.34 39.51 2wss n TYR 204 CO 0.00 0.00 0.00 0.37 0.22 0.00 0.00 176.86 177.45 2wss h GLN 205 N 0.00 0.00 0.09 2.98 -0.00 -1.16 -1.52 115.11 115.50 2wss h GLN 205 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 58.65 58.37 2wss h GLN 205 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.47 2wss h GLN 205 CO 0.00 0.12 -1.38 0.93 0.00 0.00 0.00 178.83 178.51 2wss h GLU 206 N 0.00 0.19 -0.00 1.69 5.08 -1.72 -3.18 114.58 116.65 2wss h GLU 206 Ca -0.00 -0.33 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 2wss h GLU 206 Cb 0.87 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2wss h GLU 206 CO 0.02 1.07 -0.48 0.98 -1.00 0.00 0.00 179.01 179.60 2wss n TYR 207 N -3.42 0.00 0.05 4.33 9.36 -1.20 -3.39 117.16 122.89 2wss n TYR 207 Ca -0.11 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.10 2wss n TYR 207 Cb 1.02 -0.20 -0.07 0.00 -0.63 0.00 0.00 39.34 39.46 2wss n TYR 207 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2wss h SER 208 N 0.30 0.00 0.45 2.98 4.64 -1.39 -3.28 113.55 117.25 2wss h SER 208 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2wss h SER 208 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2wss h SER 208 CO 0.00 0.62 -0.22 0.25 -0.87 0.00 0.00 176.83 176.61 2wss h LEU 209 N 0.00 -0.52 -3.20 5.97 5.85 -1.56 0.13 115.31 121.99 2wss h LEU 209 Ca -0.13 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.48 2wss h LEU 209 Cb 1.59 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.75 2wss h LEU 209 CO 0.06 -0.14 -0.03 0.00 -0.34 0.00 0.00 178.44 177.99 2wss n ALA 210 N -2.57 4.00 0.00 1.25 0.00 -1.22 -1.42 120.51 120.53 2wss n ALA 210 Ca -0.10 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.16 2wss n ALA 210 Cb 0.30 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.53 2wss n ALA 210 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wss n ASN 211 N 1.65 0.00 -0.05 0.00 5.15 -0.81 -4.58 115.26 116.62 2wss n ASN 211 Ca 0.04 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 54.00 2wss n ASN 211 Cb 0.50 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.74 2wss n ASN 211 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 2wss h ILE 212 N 0.00 0.00 -0.99 -1.44 6.09 0.21 -3.18 117.51 118.20 2wss h ILE 212 Ca 0.00 -0.86 0.27 0.00 -1.37 0.00 0.00 64.86 62.90 2wss h ILE 212 Cb 0.00 0.00 -0.19 0.00 0.47 0.00 0.00 36.82 37.10 2wss h ILE 212 CO 0.00 0.00 0.01 -0.38 -3.07 0.00 0.00 178.15 174.71 2wss n ILE 213 N -4.35 -0.42 -0.25 2.19 5.41 -0.51 0.13 119.36 121.57 2wss n ILE 213 Ca -0.03 2.19 -0.07 0.00 1.00 0.00 0.00 62.75 65.84 2wss n ILE 213 Cb 0.12 -3.19 0.05 0.00 -0.71 0.00 0.00 39.64 35.90 2wss n ILE 213 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 176.55 176.77 2wss h TYR 214 N 0.00 1.07 -0.57 1.39 3.20 -1.78 -0.94 116.97 119.34 2wss h TYR 214 Ca 0.60 -0.08 -0.10 0.00 3.14 0.00 0.00 58.73 62.28 2wss h TYR 214 Cb 1.23 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 2wss h TYR 214 CO -0.51 0.83 -0.05 -0.92 -1.64 0.00 0.00 178.16 175.87 2wss h TYR 215 N 0.99 1.15 -0.20 -3.82 3.20 0.11 -2.36 116.97 116.05 2wss h TYR 215 Ca 0.23 -0.22 0.01 0.00 3.14 0.00 0.00 58.73 61.89 2wss h TYR 215 Cb 0.22 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 2wss h TYR 215 CO 0.02 1.04 0.12 0.66 -1.64 0.00 0.00 178.16 178.35 2wss h SER 216 N 0.93 0.19 0.69 -2.11 4.64 0.36 -2.83 113.55 115.43 2wss h SER 216 Ca 0.16 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.45 2wss h SER 216 Cb 0.61 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 2wss h SER 216 CO 0.04 0.14 -0.45 -0.07 -0.87 0.00 0.00 176.83 175.62 2wss h LEU 217 N 0.24 -1.15 0.00 5.97 4.07 -1.13 -1.47 115.31 121.84 2wss h LEU 217 Ca 0.08 0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.10 2wss h LEU 217 Cb -0.01 0.34 0.00 0.00 1.08 0.00 0.00 40.66 42.07 2wss h LEU 217 CO -0.03 -0.68 0.02 0.29 -1.08 0.00 0.00 178.44 176.96 2wss n LYS 218 N -5.26 0.00 -0.02 1.13 4.76 -0.89 -1.55 118.16 116.33 2wss n LYS 218 Ca -0.13 0.32 -0.01 0.00 -2.87 0.00 0.00 58.31 55.61 2wss n LYS 218 Cb 0.45 -1.52 -0.00 0.00 -1.84 0.00 0.00 35.03 32.12 2wss n LYS 218 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2wss n GLU 219 N -1.31 0.10 -0.20 1.97 -0.58 -1.07 -4.35 120.64 115.20 2wss n GLU 219 Ca 0.00 0.30 0.13 0.00 -0.42 0.00 0.00 57.16 57.16 2wss n GLU 219 Cb 0.02 -0.94 0.24 0.00 -0.57 0.00 0.00 31.44 30.18 2wss n GLU 219 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2wss n SER 220 N -2.79 0.04 -1.51 1.62 2.88 -0.57 0.15 113.62 113.44 2wss n SER 220 Ca -0.02 0.98 0.07 0.00 -1.33 0.00 0.00 58.87 58.57 2wss n SER 220 Cb 0.06 -0.40 0.32 0.00 -0.75 0.00 0.00 64.21 63.44 2wss n SER 220 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2wss n THR 221 N -4.57 1.87 -0.11 2.46 -2.24 -0.88 -1.63 114.28 109.18 2wss n THR 221 Ca 0.17 -1.06 -0.15 0.00 -2.27 0.00 0.00 64.05 60.73 2wss n THR 221 Cb 0.56 -0.10 -0.10 0.00 -2.10 0.00 0.00 70.33 68.59 2wss n THR 221 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2wss n THR 222 N 0.75 1.28 1.64 4.28 -1.04 0.40 -3.85 114.28 117.74 2wss n THR 222 Ca 0.22 -0.49 0.11 0.00 -2.04 0.00 0.00 64.05 61.85 2wss n THR 222 Cb 0.89 -1.28 0.66 0.00 -1.82 0.00 0.00 70.33 68.77 2wss n THR 222 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2wss n SER 223 N -3.15 0.00 -0.06 8.00 7.64 -0.50 -1.28 113.62 124.27 2wss n SER 223 Ca -0.39 -0.95 -0.08 0.00 1.01 0.00 0.00 58.87 58.45 2wss n SER 223 Cb 0.92 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 64.07 2wss n SER 223 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2wss n GLU 224 N -0.92 0.29 0.41 1.43 2.13 -0.65 -3.81 120.64 119.53 2wss n GLU 224 Ca 0.17 0.07 -0.16 0.00 0.66 0.00 0.00 57.16 57.89 2wss n GLU 224 Cb 0.08 -1.21 -0.08 0.00 0.27 0.00 0.00 31.44 30.50 2wss n GLU 224 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 2wss h GLN 225 N -0.03 -1.02 -1.06 5.31 7.50 -1.64 -1.42 115.11 122.76 2wss h GLN 225 Ca -0.26 0.07 0.29 0.00 0.50 0.00 0.00 58.65 59.25 2wss h GLN 225 Cb 1.39 0.23 -0.11 0.00 0.05 0.00 0.00 27.48 29.04 2wss h GLN 225 CO -0.05 -0.68 0.66 0.66 -1.50 0.00 0.00 178.83 177.92 2wss h SER 226 N -1.13 0.50 -0.11 1.46 4.64 -1.45 -0.42 113.55 117.03 2wss h SER 226 Ca -0.11 0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 61.32 2wss h SER 226 Cb 0.81 0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2wss h SER 226 CO 0.18 0.03 0.03 0.00 -0.87 0.00 0.00 176.83 176.20 2wss h ALA 227 N 1.68 0.14 0.00 5.18 0.00 -1.54 -2.88 119.26 121.84 2wss h ALA 227 Ca 0.66 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 55.32 2wss h ALA 227 Cb 1.58 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 2wss h ALA 227 CO -0.40 -0.24 -0.78 -0.09 0.00 0.00 0.00 179.25 177.73 2wss h ARG 228 N -0.02 0.00 -0.82 0.00 2.43 -0.55 -1.88 114.38 113.54 2wss h ARG 228 Ca 0.03 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.32 2wss h ARG 228 Cb 0.23 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.72 2wss h ARG 228 CO -0.00 0.42 0.54 1.98 -1.51 0.00 0.00 179.97 181.39 2wss h MET 229 N 0.00 0.65 0.00 0.20 4.05 -1.12 -0.24 114.93 118.49 2wss h MET 229 Ca -0.05 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2wss h MET 229 Cb 1.42 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 32.08 2wss h MET 229 CO 0.06 0.43 -0.00 1.15 0.23 0.00 0.00 176.91 178.78 2wss h THR 230 N 0.67 1.61 -0.82 -0.77 2.02 -1.26 -2.40 112.91 111.97 2wss h THR 230 Ca 0.40 -2.14 0.18 0.00 0.77 0.00 0.00 66.41 65.62 2wss h THR 230 Cb 0.60 3.01 -0.06 0.00 -1.74 0.00 0.00 68.15 69.96 2wss h THR 230 CO -0.16 0.53 0.55 0.00 0.37 0.00 0.00 175.52 176.81 2wss h ALA 231 N -0.05 2.21 0.18 6.16 0.00 -1.20 -0.58 119.26 125.98 2wss h ALA 231 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2wss h ALA 231 Cb 0.88 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2wss h ALA 231 CO 0.00 -0.45 -0.09 0.52 0.00 0.00 0.00 179.25 179.23 2wss h MET 232 N 0.37 -0.24 -0.89 0.00 2.86 -1.12 0.24 114.93 116.16 2wss h MET 232 Ca 0.41 0.02 0.14 0.00 -2.06 0.00 0.00 59.70 58.20 2wss h MET 232 Cb 1.05 0.05 -0.14 0.00 0.06 0.00 0.00 31.60 32.62 2wss h MET 232 CO -0.13 0.15 -0.35 -3.47 1.06 0.00 0.00 176.91 174.17 2wss n ASP 233 N -4.94 -0.58 0.25 1.22 2.03 -0.80 -0.87 116.55 112.86 2wss n ASP 233 Ca -0.07 1.55 -0.12 0.00 0.52 0.00 0.00 54.79 56.67 2wss n ASP 233 Cb 0.25 -0.35 -0.06 0.00 -0.72 0.00 0.00 41.12 40.24 2wss n ASP 233 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 2wss h ASN 234 N 0.00 -0.79 -0.95 1.67 -0.26 -1.10 -1.94 115.58 112.22 2wss h ASN 234 Ca 0.31 0.05 0.33 0.00 -0.56 0.00 0.00 56.30 56.42 2wss h ASN 234 Cb 0.53 0.24 -0.17 0.00 -1.06 0.00 0.00 38.32 37.85 2wss h ASN 234 CO -0.88 -0.46 0.27 0.00 -1.06 0.00 0.00 177.43 175.30 2wss n ALA 235 N -2.51 0.73 0.09 -0.83 0.00 0.07 0.21 120.51 118.27 2wss n ALA 235 Ca -0.09 0.99 -0.08 0.00 0.00 0.00 0.00 53.44 54.26 2wss n ALA 235 Cb 0.31 -0.85 -0.02 0.00 0.00 0.00 0.00 19.45 18.89 2wss n ALA 235 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2wss h SER 236 N 0.00 0.18 0.04 0.00 4.64 -0.72 -0.05 113.55 117.64 2wss h SER 236 Ca 0.69 -0.15 -0.00 0.00 -0.47 0.00 0.00 61.79 61.86 2wss h SER 236 Cb 1.66 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.70 2wss h SER 236 CO -0.81 0.98 -0.02 0.11 -0.87 0.00 0.00 176.83 176.22 2wss h LYS 237 N 0.07 -0.05 -0.46 4.77 1.57 0.56 0.21 116.57 123.24 2wss h LYS 237 Ca -0.04 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.84 2wss h LYS 237 Cb 1.53 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 33.76 2wss h LYS 237 CO 0.13 0.11 -0.15 -0.91 -0.57 0.00 0.00 179.45 178.06 2wss h ASN 238 N -0.19 -0.52 -0.47 0.86 2.35 -1.05 -0.76 115.58 115.79 2wss h ASN 238 Ca -0.00 0.15 0.09 0.00 -0.55 0.00 0.00 56.30 55.98 2wss h ASN 238 Cb 0.18 0.32 -0.07 0.00 0.05 0.00 0.00 38.32 38.80 2wss h ASN 238 CO 0.01 -0.18 0.03 0.00 -1.65 0.00 0.00 177.43 175.64 2wss h ALA 239 N 1.38 0.47 0.00 -0.83 0.00 -0.57 -0.31 119.26 119.40 2wss h ALA 239 Ca 0.22 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 2wss h ALA 239 Cb 0.38 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2wss h ALA 239 CO -0.50 -0.36 -0.03 1.03 0.00 0.00 0.00 179.25 179.39 2wss h SER 240 N 0.15 0.00 0.00 0.00 0.87 0.76 -0.88 113.55 114.46 2wss h SER 240 Ca 0.24 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.69 2wss h SER 240 Cb 0.34 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 2wss h SER 240 CO -0.36 0.03 -0.64 -0.08 -0.53 0.00 0.00 176.83 175.25 2wss h GLU 241 N 0.00 0.00 -0.86 2.24 4.81 0.19 -2.99 114.58 117.97 2wss h GLU 241 Ca -0.00 0.00 0.16 0.00 -0.13 0.00 0.00 59.36 59.39 2wss h GLU 241 Cb 0.28 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.51 2wss h GLU 241 CO 0.00 0.84 -0.25 -0.12 -0.73 0.00 0.00 179.01 178.75 2wss n MET 242 N -4.54 -0.11 -0.08 1.92 1.56 -0.49 -0.42 117.12 114.96 2wss n MET 242 Ca -0.19 1.33 -0.06 0.00 -0.27 0.00 0.00 57.70 58.51 2wss n MET 242 Cb 0.52 -1.99 -0.00 0.00 2.15 0.00 0.00 33.22 33.90 2wss n MET 242 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 2wss h ILE 243 N 0.00 0.53 -0.18 1.12 1.08 -1.20 0.37 117.51 119.22 2wss h ILE 243 Ca 0.38 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.82 2wss h ILE 243 Cb 0.59 0.53 -0.01 0.00 -3.07 0.00 0.00 36.82 34.86 2wss h ILE 243 CO -0.88 0.00 0.02 0.44 -0.69 0.00 0.00 178.15 177.05 2wss h ASP 244 N -0.11 0.30 -0.47 1.72 3.32 -0.65 0.25 116.42 120.79 2wss h ASP 244 Ca 0.16 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 2wss h ASP 244 Cb 0.35 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 2wss h ASP 244 CO -0.38 0.50 0.27 0.50 -1.72 0.00 0.00 179.24 178.40 2wss h LYS 245 N 0.09 0.67 0.08 3.56 3.64 -0.23 -1.99 116.57 122.40 2wss h LYS 245 Ca 0.05 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.23 2wss h LYS 245 Cb 0.33 -0.14 0.02 0.00 -0.41 0.00 0.00 32.23 32.03 2wss h LYS 245 CO 0.01 0.50 -0.59 1.25 -2.27 0.00 0.00 179.45 178.35 2wss h LEU 246 N 0.68 0.37 -1.85 5.20 6.46 -0.06 -2.71 115.31 123.40 2wss h LEU 246 Ca 0.18 -0.92 0.11 0.00 -0.12 0.00 0.00 57.88 57.13 2wss h LEU 246 Cb 0.03 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 39.82 2wss h LEU 246 CO -0.03 1.26 0.50 0.74 -0.62 0.00 0.00 178.44 180.29 2wss h THR 247 N -0.45 0.25 0.08 1.05 2.02 -0.40 0.10 112.91 115.56 2wss h THR 247 Ca -0.10 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 66.95 2wss h THR 247 Cb 1.42 0.58 0.01 0.00 -1.74 0.00 0.00 68.15 68.42 2wss h THR 247 CO 0.11 0.00 -0.55 -0.07 0.37 0.00 0.00 175.52 175.38 2wss h LEU 248 N 0.00 0.35 -1.10 2.58 3.38 -1.04 -2.76 115.31 116.72 2wss h LEU 248 Ca 0.17 -0.91 -0.09 0.00 0.09 0.00 0.00 57.88 57.14 2wss h LEU 248 Cb 1.17 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2wss h LEU 248 CO -0.00 1.24 -0.42 0.71 0.09 0.00 0.00 178.44 180.05 2wss h THR 249 N -0.47 1.19 0.00 0.22 1.35 -1.22 -1.62 112.91 112.36 2wss h THR 249 Ca -0.09 -1.51 0.03 0.00 -0.55 0.00 0.00 66.41 64.29 2wss h THR 249 Cb 1.39 1.84 -0.04 0.00 -1.73 0.00 0.00 68.15 69.61 2wss h THR 249 CO 0.10 0.41 -0.22 0.15 -0.25 0.00 0.00 175.52 175.72 2wss h PHE 250 N 0.00 -0.59 -0.60 4.73 3.04 -0.73 0.33 116.94 123.12 2wss h PHE 250 Ca -0.00 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.96 2wss h PHE 250 Cb 0.81 0.26 -0.03 0.00 2.56 0.00 0.00 35.95 39.55 2wss h PHE 250 CO 0.00 -0.31 0.37 -0.91 -2.02 0.00 0.00 178.31 175.44 2wss h ASN 251 N -0.36 0.71 0.17 0.41 2.35 -1.20 0.37 115.58 118.03 2wss h ASN 251 Ca 0.06 -0.05 0.02 0.00 -0.55 0.00 0.00 56.30 55.78 2wss h ASN 251 Cb 0.43 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.59 2wss h ASN 251 CO -0.20 0.55 -0.34 0.03 -1.65 0.00 0.00 177.43 175.81 2wss h ARG 252 N 0.81 -0.58 -0.91 0.81 3.08 -0.57 -0.53 114.38 116.48 2wss h ARG 252 Ca 0.21 0.04 0.19 0.00 0.07 0.00 0.00 59.98 60.50 2wss h ARG 252 Cb -0.04 0.13 -0.11 0.00 0.08 0.00 0.00 29.97 30.03 2wss h ARG 252 CO -0.04 -0.39 0.47 1.15 -1.07 0.00 0.00 179.97 180.09 2wss h THR 253 N -0.61 0.61 0.31 2.04 2.02 0.04 -1.19 112.91 116.13 2wss h THR 253 Ca 0.02 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2wss h THR 253 Cb 0.61 -0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 2wss h THR 253 CO -0.17 0.10 -0.46 -0.09 0.37 0.00 0.00 175.52 175.27 2wss h ARG 254 N 0.57 -0.80 -0.78 6.66 2.43 0.77 -1.56 114.38 121.66 2wss h ARG 254 Ca 0.54 0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.80 2wss h ARG 254 Cb 0.92 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.60 2wss h ARG 254 CO -0.44 -0.53 0.49 1.96 -1.51 0.00 0.00 179.97 179.94 2wss h GLN 255 N -0.83 0.93 -0.42 0.20 4.20 -0.55 -2.28 115.11 116.36 2wss h GLN 255 Ca -0.02 -0.06 0.04 0.00 0.06 0.00 0.00 58.65 58.67 2wss h GLN 255 Cb 0.77 -0.21 -0.04 0.00 0.30 0.00 0.00 27.48 28.30 2wss h GLN 255 CO -0.15 0.61 0.18 0.00 -0.67 0.00 0.00 178.83 178.80 2wss h ALA 256 N 1.33 0.51 -0.40 3.87 0.00 -0.99 -1.83 119.26 121.75 2wss h ALA 256 Ca 0.32 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.18 2wss h ALA 256 Cb 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2wss h ALA 256 CO -0.12 -0.19 -0.03 0.28 0.00 0.00 0.00 179.25 179.19 2wss h VAL 257 N 0.37 1.27 -0.45 0.00 2.07 -0.91 0.32 116.25 118.93 2wss h VAL 257 Ca 0.19 -1.07 0.09 0.00 0.82 0.00 0.00 66.70 66.72 2wss h VAL 257 Cb 0.13 1.16 -0.08 0.00 -1.52 0.00 0.00 31.29 30.98 2wss h VAL 257 CO -0.16 0.36 -0.02 0.40 0.02 0.00 0.00 177.57 178.17 2wss h ILE 258 N 0.55 0.63 0.45 4.57 1.08 -0.85 -2.28 117.51 121.66 2wss h ILE 258 Ca 0.11 -0.03 -0.02 0.00 -0.39 0.00 0.00 64.86 64.53 2wss h ILE 258 Cb 0.52 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.82 2wss h ILE 258 CO 0.03 0.02 -0.22 0.74 -0.69 0.00 0.00 178.15 178.02 2wss h THR 259 N 0.08 0.40 -1.27 -0.27 2.02 -1.00 -2.47 112.91 110.41 2wss h THR 259 Ca 0.22 -0.50 0.38 0.00 0.77 0.00 0.00 66.41 67.28 2wss h THR 259 Cb 0.33 0.58 -0.10 0.00 -1.74 0.00 0.00 68.15 67.22 2wss h THR 259 CO -0.39 0.07 0.84 0.50 0.37 0.00 0.00 175.52 176.91 2wss h LYS 260 N -0.96 0.16 0.07 6.66 3.64 -0.83 0.80 116.57 126.10 2wss h LYS 260 Ca -0.06 -0.01 -0.25 0.00 -1.27 0.00 0.00 60.65 59.06 2wss h LYS 260 Cb 0.58 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.37 2wss h LYS 260 CO 0.10 0.10 -1.09 1.49 -2.27 0.00 0.00 179.45 177.78 2wss h GLU 261 N 0.16 0.37 -0.00 1.90 4.81 -1.36 -2.86 114.58 117.60 2wss h GLU 261 Ca 0.72 -0.49 -0.18 0.00 -0.13 0.00 0.00 59.36 59.28 2wss h GLU 261 Cb 2.29 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 31.81 2wss h GLU 261 CO -0.28 1.17 -0.82 1.25 -0.73 0.00 0.00 179.01 179.60 2wss h LEU 262 N 0.17 0.11 -0.65 1.64 5.85 0.52 -2.38 115.31 120.57 2wss h LEU 262 Ca -0.11 -0.09 -0.14 0.00 0.84 0.00 0.00 57.88 58.38 2wss h LEU 262 Cb 1.77 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.75 2wss h LEU 262 CO 0.19 0.88 -0.42 0.40 -0.34 0.00 0.00 178.44 179.15 2wss h ILE 263 N 0.05 1.30 -0.46 4.05 5.03 0.26 -1.74 117.51 126.00 2wss h ILE 263 Ca -0.02 -1.60 -0.12 0.00 -0.12 0.00 0.00 64.86 63.00 2wss h ILE 263 Cb 1.44 1.57 -0.01 0.00 -3.03 0.00 0.00 36.82 36.79 2wss h ILE 263 CO 0.12 0.50 -0.20 -0.33 -0.68 0.00 0.00 178.15 177.55 2wss h GLU 264 N 0.47 0.93 0.21 2.37 5.08 -1.33 -1.63 114.58 120.69 2wss h GLU 264 Ca 0.04 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 2wss h GLU 264 Cb 0.93 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2wss h GLU 264 CO 0.08 1.05 -0.10 0.82 -1.00 0.00 0.00 179.01 179.85 2wss h ILE 265 N 0.81 0.00 -0.97 3.13 2.04 -1.33 -2.65 117.51 118.54 2wss h ILE 265 Ca 0.11 -0.02 0.32 0.00 1.00 0.00 0.00 64.86 66.26 2wss h ILE 265 Cb 0.76 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.67 2wss h ILE 265 CO 0.06 0.00 0.31 0.40 0.00 0.00 0.00 178.15 178.92 2wss h ILE 266 N -0.31 0.12 0.62 -0.67 1.08 -1.35 -1.87 117.51 115.13 2wss h ILE 266 Ca -0.03 -0.03 -0.03 0.00 -0.39 0.00 0.00 64.86 64.38 2wss h ILE 266 Cb 0.22 0.02 0.01 0.00 -3.07 0.00 0.00 36.82 33.99 2wss h ILE 266 CO 0.05 0.02 -0.30 -1.28 -0.69 0.00 0.00 178.15 175.95 2wss h SER 267 N 0.10 -0.71 0.19 1.72 0.87 -1.29 -1.16 113.55 113.26 2wss h SER 267 Ca 0.68 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 61.22 2wss h SER 267 Cb 1.58 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.72 2wss h SER 267 CO -0.77 -0.39 0.00 0.61 -0.53 0.00 0.00 176.83 175.75 2wss n GLY 268 N -0.93 -0.61 0.05 5.77 0.00 -0.78 -2.12 105.19 106.57 2wss n GLY 268 Ca -0.12 -0.04 0.02 0.00 0.00 0.00 0.00 46.02 45.87 2wss n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wss n ALA 269 N -1.30 2.23 0.12 4.61 0.00 -0.78 -3.74 120.51 121.65 2wss n ALA 269 Ca 0.04 -0.88 -0.02 0.00 0.00 0.00 0.00 53.44 52.58 2wss n ALA 269 Cb 0.08 -0.49 0.09 0.00 0.00 0.00 0.00 19.45 19.13 2wss n ALA 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wss h ALA 270 N 1.55 0.79 -0.00 0.00 0.00 -0.69 -3.32 119.26 117.60 2wss h ALA 270 Ca -0.24 -0.64 -0.00 0.00 0.00 0.00 0.00 54.91 54.02 2wss h ALA 270 Cb 1.55 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 2wss h ALA 270 CO 0.01 0.88 0.00 0.00 0.00 0.00 0.00 179.25 180.15 2wss n ALA 271 N -2.39 2.50 0.42 0.00 0.00 -1.10 -5.12 120.51 114.83 2wss n ALA 271 Ca -0.01 -0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.48 2wss n ALA 271 Cb 0.70 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 19.20 2wss n ALA 271 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78