#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2abk s ASN 2 N 0.00 0.54 0.20 6.12 2.20 -1.26 -5.05 114.94 117.69 2abk s ASN 2 Ca 0.00 -1.32 -0.12 0.00 -0.94 0.00 0.00 52.86 50.48 2abk s ASN 2 Cb 0.00 0.62 0.24 0.00 -2.00 0.00 0.00 41.25 40.10 2abk s ASN 2 CO 0.00 -1.22 1.69 0.50 -2.94 0.00 0.00 177.10 175.13 2abk h LYS 3 N 2.20 0.16 -0.68 3.55 3.64 -1.99 -0.86 116.57 122.60 2abk h LYS 3 Ca -0.29 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.03 2abk h LYS 3 Cb 1.24 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 33.00 2abk h LYS 3 CO 0.39 0.11 0.22 0.00 -2.27 0.00 0.00 179.45 177.90 2abk h ALA 4 N 1.47 0.89 -0.47 5.00 0.00 -1.99 -1.71 119.26 122.44 2abk h ALA 4 Ca 0.28 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2abk h ALA 4 Cb 0.43 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2abk h ALA 4 CO -0.42 0.56 -0.13 -0.22 0.00 0.00 0.00 179.25 179.03 2abk h LYS 5 N 0.99 0.93 -0.69 0.00 3.64 -1.87 -1.67 116.57 117.91 2abk h LYS 5 Ca 0.22 -0.36 0.01 0.00 -1.27 0.00 0.00 60.65 59.24 2abk h LYS 5 Cb 0.29 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2abk h LYS 5 CO -0.01 1.02 0.45 0.00 -2.27 0.00 0.00 179.45 178.65 2abk h ARG 6 N 0.78 0.90 -0.53 1.90 3.08 -1.12 -1.28 114.38 118.12 2abk h ARG 6 Ca 0.12 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.03 2abk h ARG 6 Cb 0.69 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 2abk h ARG 6 CO 0.05 0.60 -0.00 1.25 -1.07 0.00 0.00 179.97 180.79 2abk h LEU 7 N 0.93 0.87 -0.66 3.04 5.85 -1.11 -2.01 115.31 122.21 2abk h LEU 7 Ca 0.25 -0.23 -0.13 0.00 0.84 0.00 0.00 57.88 58.62 2abk h LEU 7 Cb -0.10 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.68 2abk h LEU 7 CO -0.06 0.93 -0.30 -0.08 -0.34 0.00 0.00 178.44 178.59 2abk h GLU 8 N 0.83 0.71 -0.18 1.25 4.57 -0.87 -1.08 114.58 119.81 2abk h GLU 8 Ca 0.15 -0.32 0.04 0.00 -1.18 0.00 0.00 59.36 58.05 2abk h GLU 8 Cb 0.50 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.04 2abk h GLU 8 CO 0.02 0.93 -0.05 0.82 -1.18 0.00 0.00 179.01 179.55 2abk h ILE 9 N 0.61 0.80 -0.73 2.32 2.04 -0.99 -1.50 117.51 120.05 2abk h ILE 9 Ca 0.07 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.90 2abk h ILE 9 Cb 0.82 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 2abk h ILE 9 CO 0.07 0.00 0.33 -0.07 0.00 0.00 0.00 178.15 178.48 2abk h LEU 10 N -0.01 0.96 -0.64 1.44 3.38 -1.25 -1.40 115.31 117.79 2abk h LEU 10 Ca 0.09 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2abk h LEU 10 Cb 0.15 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2abk h LEU 10 CO -0.20 0.83 0.43 0.74 0.09 0.00 0.00 178.44 180.33 2abk h THR 11 N 1.05 1.16 -0.33 0.22 2.02 -1.02 -0.90 112.91 115.11 2abk h THR 11 Ca 0.25 -0.30 -0.09 0.00 0.77 0.00 0.00 66.41 67.05 2abk h THR 11 Cb 0.14 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 2abk h THR 11 CO -0.03 0.16 -0.12 0.03 0.37 0.00 0.00 175.52 175.93 2abk h ARG 12 N 0.87 0.67 -0.92 6.66 3.08 -0.89 -1.56 114.38 122.29 2abk h ARG 12 Ca 0.24 -0.28 0.05 0.00 0.07 0.00 0.00 59.98 60.06 2abk h ARG 12 Cb -0.10 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 29.86 2abk h ARG 12 CO -0.05 0.86 0.59 -0.07 -1.07 0.00 0.00 179.97 180.23 2abk h LEU 13 N 0.45 0.95 -0.29 3.04 3.38 -1.16 -1.41 115.31 120.26 2abk h LEU 13 Ca 0.08 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2abk h LEU 13 Cb 0.64 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2abk h LEU 13 CO 0.04 0.62 0.06 -0.09 0.09 0.00 0.00 178.44 179.16 2abk h ARG 14 N 1.09 0.48 -0.67 1.13 2.43 -1.06 -1.67 114.38 116.11 2abk h ARG 14 Ca 0.39 -0.12 0.10 0.00 -0.81 0.00 0.00 59.98 59.54 2abk h ARG 14 Cb 0.11 -0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 29.53 2abk h ARG 14 CO -0.15 0.57 0.28 0.93 -1.51 0.00 0.00 179.97 180.08 2abk h GLU 15 N 0.31 0.46 -0.63 0.20 4.39 -1.11 -1.22 114.58 116.98 2abk h GLU 15 Ca 0.09 -0.03 -0.07 0.00 0.34 0.00 0.00 59.36 59.70 2abk h GLU 15 Cb 0.31 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.83 2abk h GLU 15 CO 0.00 0.30 0.13 -0.97 -1.16 0.00 0.00 179.01 177.31 2abk h ASN 16 N 0.47 0.98 -1.80 1.42 -1.24 -1.13 -3.40 115.58 110.88 2abk h ASN 16 Ca 0.34 -0.25 -0.32 0.00 0.71 0.00 0.00 56.30 56.79 2abk h ASN 16 Cb 0.42 -0.26 -0.29 0.00 0.73 0.00 0.00 38.32 38.92 2abk h ASN 16 CO -0.31 0.98 -0.65 0.21 -1.29 0.00 0.00 177.43 176.36 2abk s ASN 17 N -6.38 0.74 0.45 1.15 3.04 -0.64 -5.03 114.94 108.27 2abk s ASN 17 Ca -0.12 -1.43 0.13 0.00 0.04 0.00 0.00 52.86 51.47 2abk s ASN 17 Cb 0.14 0.78 1.05 0.00 -1.54 0.00 0.00 41.25 41.68 2abk s ASN 17 CO 0.83 -0.25 2.05 -0.65 -3.04 0.00 0.00 177.10 176.05 2abk h PRO 18 N 7.08 0.33 -2.62 0.43 0.11 -1.45 -3.32 132.00 132.55 2abk h PRO 18 Ca 0.05 -0.02 -0.60 0.00 0.11 0.00 0.00 66.00 65.53 2abk h PRO 18 Cb 1.08 -0.07 -0.40 0.00 0.11 0.00 0.00 31.00 31.71 2abk h PRO 18 CO 0.19 0.22 -0.81 0.72 -0.21 0.00 0.00 178.00 178.11 2abk n HIS 19 N -4.48 0.97 -2.19 0.65 8.25 -1.26 -4.99 115.22 112.18 2abk n HIS 19 Ca 0.04 -3.76 -0.38 0.00 -0.26 0.00 0.00 57.72 53.37 2abk n HIS 19 Cb 0.20 -0.16 -0.00 0.00 1.12 0.00 0.00 29.99 31.15 2abk n HIS 19 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2abk s PRO 20 N -0.73 3.74 0.33 -0.41 0.04 -1.25 -5.06 135.00 131.66 2abk s PRO 20 Ca 0.30 1.87 -0.05 0.00 0.04 0.00 0.00 61.00 63.16 2abk s PRO 20 Cb 0.02 -2.45 0.01 0.00 0.04 0.00 0.00 34.50 32.11 2abk s PRO 20 CO -0.18 -0.60 0.51 -0.08 0.04 0.00 0.00 177.00 176.69 2abk s THR 21 N -1.47 0.00 0.74 1.26 -1.32 -1.26 -4.91 115.64 108.68 2abk s THR 21 Ca 0.63 -1.51 -0.15 0.00 -1.21 0.00 0.00 61.69 59.45 2abk s THR 21 Cb -0.31 -2.61 0.03 0.00 -1.51 0.00 0.00 72.50 68.10 2abk s THR 21 CO 0.38 0.00 1.15 1.07 -2.21 0.00 0.00 174.62 175.00 2abk n THR 22 N -0.53 3.10 1.38 5.08 5.66 -1.26 -4.95 114.28 122.76 2abk n THR 22 Ca -0.00 -0.34 0.13 0.00 -3.05 0.00 0.00 64.05 60.79 2abk n THR 22 Cb 0.61 -1.24 0.44 0.00 -1.55 0.00 0.00 70.33 68.59 2abk n THR 22 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2abk n GLU 23 N -2.41 1.44 -2.49 1.09 1.02 -1.26 -4.87 120.64 113.16 2abk n GLU 23 Ca 0.14 -0.88 -0.42 0.00 -0.02 0.00 0.00 57.16 55.98 2abk n GLU 23 Cb 0.49 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.40 2abk n GLU 23 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2abk s LEU 24 N -2.17 4.42 0.10 -4.62 1.43 -1.26 -4.91 118.68 111.67 2abk s LEU 24 Ca 0.33 2.02 -0.30 0.00 -1.03 0.00 0.00 54.13 55.14 2abk s LEU 24 Cb 0.20 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.78 2abk s LEU 24 CO 0.40 -0.34 1.06 0.20 0.23 0.00 0.00 176.35 177.90 2abk s ASN 25 N 0.52 7.31 0.05 2.29 0.01 -1.26 -5.04 114.94 118.81 2abk s ASN 25 Ca 0.54 1.90 -0.26 0.00 -0.71 0.00 0.00 52.86 54.33 2abk s ASN 25 Cb -0.29 -2.59 0.06 0.00 0.41 0.00 0.00 41.25 38.85 2abk s ASN 25 CO 0.32 -0.24 0.60 0.72 -1.51 0.00 0.00 177.10 176.99 2abk s PHE 26 N 0.37 -0.54 0.00 2.20 -0.71 -1.26 -4.79 117.98 113.24 2abk s PHE 26 Ca 0.51 0.67 0.00 0.00 -1.04 0.00 0.00 56.93 57.07 2abk s PHE 26 Cb -0.26 0.43 0.00 0.00 -1.21 0.00 0.00 43.02 41.98 2abk s PHE 26 CO 0.31 -0.69 0.57 -1.13 -1.34 0.00 0.00 175.22 172.94 2abk n SER 27 N 0.36 0.95 -3.58 1.98 3.41 -1.26 -4.99 113.62 110.48 2abk n SER 27 Ca -0.18 -1.33 -0.11 0.00 -0.26 0.00 0.00 58.87 56.99 2abk n SER 27 Cb 0.60 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.51 2abk n SER 27 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2abk s SER 28 N -0.33 -0.33 0.30 4.04 1.04 -1.26 -5.01 113.70 112.15 2abk s SER 28 Ca 0.00 -0.19 0.05 0.00 0.48 0.00 0.00 55.95 56.28 2abk s SER 28 Cb 0.00 0.50 0.71 0.00 0.10 0.00 0.00 66.02 67.33 2abk s SER 28 CO 0.00 -0.86 1.77 -0.65 0.98 0.00 0.00 173.24 174.49 2abk h PRO 29 N 2.35 0.72 -0.12 4.02 0.11 -1.98 -1.53 132.00 135.57 2abk h PRO 29 Ca -0.34 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 2abk h PRO 29 Cb 1.26 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2abk h PRO 29 CO 0.44 0.48 0.03 0.35 -0.21 0.00 0.00 178.00 179.09 2abk h PHE 30 N 0.74 0.21 -0.38 0.65 3.57 -1.96 0.43 116.94 120.21 2abk h PHE 30 Ca 0.56 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 62.03 2abk h PHE 30 Cb 0.86 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.53 2abk h PHE 30 CO -0.02 0.37 0.18 0.93 -2.23 0.00 0.00 178.31 177.54 2abk h GLU 31 N -0.01 0.52 -0.29 1.11 5.08 -1.76 -1.40 114.58 117.82 2abk h GLU 31 Ca 0.04 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 2abk h GLU 31 Cb 0.26 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2abk h GLU 31 CO 0.00 0.40 -0.13 1.25 -1.00 0.00 0.00 179.01 179.53 2abk h LEU 32 N 0.52 0.62 -0.56 1.33 5.85 -1.00 -2.25 115.31 119.82 2abk h LEU 32 Ca 0.13 -0.40 0.04 0.00 0.84 0.00 0.00 57.88 58.49 2abk h LEU 32 Cb 0.05 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 2abk h LEU 32 CO -0.02 0.88 0.32 0.25 -0.34 0.00 0.00 178.44 179.53 2abk h LEU 33 N 0.36 0.49 -0.38 2.25 5.85 -0.35 -0.23 115.31 123.30 2abk h LEU 33 Ca 0.07 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 2abk h LEU 33 Cb 0.64 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 2abk h LEU 33 CO 0.04 0.34 0.01 0.40 -0.34 0.00 0.00 178.44 178.89 2abk h ILE 34 N 0.62 1.26 -0.93 4.05 1.08 -1.34 -0.47 117.51 121.79 2abk h ILE 34 Ca 0.24 -0.98 0.01 0.00 -0.39 0.00 0.00 64.86 63.74 2abk h ILE 34 Cb 0.08 1.14 -0.05 0.00 -3.07 0.00 0.00 36.82 34.93 2abk h ILE 34 CO -0.13 0.33 0.61 0.00 -0.69 0.00 0.00 178.15 178.27 2abk h ALA 35 N 0.88 1.33 -0.43 1.87 0.00 -0.96 -0.01 119.26 121.94 2abk h ALA 35 Ca 0.11 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 2abk h ALA 35 Cb 0.45 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2abk h ALA 35 CO 0.02 0.62 -0.30 0.28 0.00 0.00 0.00 179.25 179.87 2abk h VAL 36 N 1.26 1.27 -0.19 0.00 2.07 -0.85 -1.34 116.25 118.47 2abk h VAL 36 Ca 0.34 -1.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.36 2abk h VAL 36 Cb -0.14 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2abk h VAL 36 CO -0.07 0.50 -0.03 0.25 0.02 0.00 0.00 177.57 178.24 2abk h LEU 37 N 0.81 0.26 -0.57 2.57 5.85 -0.52 -2.32 115.31 121.39 2abk h LEU 37 Ca 0.09 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 2abk h LEU 37 Cb 0.88 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.85 2abk h LEU 37 CO 0.08 0.34 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.43 2abk h LEU 38 N 0.28 0.00 -2.09 2.25 3.38 -0.47 -3.34 115.31 115.32 2abk h LEU 38 Ca 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2abk h LEU 38 Cb 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 2abk h LEU 38 CO 0.01 0.02 -0.02 0.28 0.09 0.00 0.00 178.44 178.82 2abk h SER 39 N 0.00 0.00 -2.03 -0.43 0.02 -0.67 -3.43 113.55 107.01 2abk h SER 39 Ca -0.00 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 60.33 2abk h SER 39 Cb 0.82 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.38 2abk h SER 39 CO 0.00 0.02 1.07 0.00 -1.14 0.00 0.00 176.83 176.78 2abk n ALA 40 N -2.48 0.86 -2.84 3.77 0.00 -1.26 -1.76 120.51 116.81 2abk n ALA 40 Ca -0.03 0.30 -0.20 0.00 0.00 0.00 0.00 53.44 53.51 2abk n ALA 40 Cb 0.10 -2.48 0.01 0.00 0.00 0.00 0.00 19.45 17.08 2abk n ALA 40 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2abk n GLN 41 N 6.40 -3.28 -4.05 0.00 6.02 -1.26 -4.83 117.38 116.38 2abk n GLN 41 Ca 0.22 0.75 -0.09 0.00 -0.01 0.00 0.00 57.00 57.87 2abk n GLN 41 Cb 0.29 -5.48 -0.11 0.00 1.02 0.00 0.00 30.24 25.96 2abk n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2abk s ALA 42 N -2.96 0.43 0.52 -1.58 0.00 -0.72 -4.61 121.76 112.84 2abk s ALA 42 Ca 0.19 -0.92 -0.13 0.00 0.00 0.00 0.00 51.96 51.10 2abk s ALA 42 Cb -0.09 0.17 -0.06 0.00 0.00 0.00 0.00 23.12 23.14 2abk s ALA 42 CO 0.24 -0.22 0.94 0.95 0.00 0.00 0.00 175.76 177.67 2abk s THR 43 N -2.54 4.66 0.29 0.00 -4.23 -1.26 -4.90 115.64 107.66 2abk s THR 43 Ca -0.04 0.93 -0.01 0.00 -1.18 0.00 0.00 61.69 61.39 2abk s THR 43 Cb -0.02 -3.78 0.27 0.00 1.34 0.00 0.00 72.50 70.32 2abk s THR 43 CO -0.04 -0.80 1.91 0.44 -0.54 0.00 0.00 174.62 175.59 2abk h ASP 44 N 0.58 0.96 -0.73 3.99 3.32 -1.95 -1.70 116.42 120.89 2abk h ASP 44 Ca -0.46 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.54 2abk h ASP 44 Cb 1.19 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.50 2abk h ASP 44 CO 0.62 0.63 0.27 -0.37 -1.72 0.00 0.00 179.24 178.67 2abk h VAL 45 N 1.10 1.25 -0.36 -1.35 -1.51 -1.93 0.34 116.25 113.80 2abk h VAL 45 Ca 0.39 -0.82 0.02 0.00 -1.23 0.00 0.00 66.70 65.05 2abk h VAL 45 Cb 0.13 0.43 -0.02 0.00 -2.13 0.00 0.00 31.29 29.69 2abk h VAL 45 CO -0.14 0.33 0.20 0.28 -1.23 0.00 0.00 177.57 177.01 2abk h SER 46 N 1.05 0.32 -0.34 4.19 0.02 -1.82 -2.00 113.55 114.98 2abk h SER 46 Ca 0.24 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 2abk h SER 46 Cb 0.24 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 2abk h SER 46 CO -0.02 0.23 0.18 0.58 -1.14 0.00 0.00 176.83 176.67 2abk h VAL 47 N 0.41 1.14 -0.35 2.27 2.07 -0.95 -2.38 116.25 118.46 2abk h VAL 47 Ca 0.14 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 2abk h VAL 47 Cb 0.01 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2abk h VAL 47 CO -0.07 0.14 0.10 0.78 0.02 0.00 0.00 177.57 178.55 2abk h ASN 48 N 0.42 0.46 -0.25 0.57 2.35 -0.81 -0.29 115.58 118.03 2abk h ASN 48 Ca 0.12 -0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 2abk h ASN 48 Cb 0.07 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 2abk h ASN 48 CO -0.02 0.45 0.08 0.11 -1.65 0.00 0.00 177.43 176.40 2abk h LYS 49 N 0.50 0.39 -0.51 0.81 1.57 -1.21 -0.89 116.57 117.22 2abk h LYS 49 Ca 0.12 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 2abk h LYS 49 Cb 0.16 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 2abk h LYS 49 CO -0.01 0.47 0.10 0.00 -0.57 0.00 0.00 179.45 179.44 2abk h ALA 50 N 0.91 0.68 0.00 3.86 0.00 -0.86 -3.12 119.26 120.73 2abk h ALA 50 Ca 0.08 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 2abk h ALA 50 Cb 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2abk h ALA 50 CO -0.00 0.40 -0.22 1.79 0.00 0.00 0.00 179.25 181.22 2abk h THR 51 N 0.73 0.46 -0.02 0.00 1.35 -1.05 -1.75 112.91 112.62 2abk h THR 51 Ca 0.16 -1.24 -0.03 0.00 -0.55 0.00 0.00 66.41 64.75 2abk h THR 51 Cb 0.38 1.90 -0.00 0.00 -1.73 0.00 0.00 68.15 68.69 2abk h THR 51 CO 0.01 0.21 -0.12 0.00 -0.25 0.00 0.00 175.52 175.37 2abk h ALA 52 N 1.78 1.77 0.04 6.62 0.00 -1.10 -0.58 119.26 127.79 2abk h ALA 52 Ca -0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2abk h ALA 52 Cb 0.88 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2abk h ALA 52 CO 0.03 0.18 -0.38 0.87 0.00 0.00 0.00 179.25 179.95 2abk h LYS 53 N 0.03 0.09 0.03 0.00 1.57 -1.42 -3.41 116.57 113.45 2abk h LYS 53 Ca 0.01 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2abk h LYS 53 Cb 0.23 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2abk h LYS 53 CO 0.02 1.07 -0.01 1.25 -0.57 0.00 0.00 179.45 181.20 2abk h LEU 54 N -0.81 -0.03 -1.55 2.94 5.85 -1.25 -3.38 115.31 117.08 2abk h LEU 54 Ca -0.08 -0.54 -0.05 0.00 0.84 0.00 0.00 57.88 58.05 2abk h LEU 54 Cb 1.22 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 2abk h LEU 54 CO 0.02 0.54 -0.23 1.88 -0.34 0.00 0.00 178.44 180.31 2abk h TYR 55 N -0.61 0.00 0.00 1.25 0.05 -1.26 0.12 116.97 116.52 2abk h TYR 55 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2abk h TYR 55 Cb 0.57 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.31 2abk h TYR 55 CO 0.12 0.23 0.00 -1.35 -1.05 0.00 0.00 178.16 176.11 2abk h PRO 56 N 0.00 0.00 0.00 4.88 0.11 -1.78 -3.25 132.00 131.96 2abk h PRO 56 Ca -0.00 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.99 2abk h PRO 56 Cb 0.42 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 2abk h PRO 56 CO 0.03 0.00 -1.82 1.33 -0.21 0.00 0.00 178.00 177.33 2abk n VAL 57 N -2.98 0.43 -3.27 3.15 0.24 -0.12 -4.95 118.33 110.82 2abk n VAL 57 Ca -0.02 -0.46 -0.04 0.00 -2.04 0.00 0.00 64.34 61.78 2abk n VAL 57 Cb 0.14 -0.19 -0.05 0.00 -1.47 0.00 0.00 33.84 32.27 2abk n VAL 57 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2abk s ALA 58 N -2.75 -1.53 -0.10 2.33 0.00 -0.33 -4.98 121.76 114.40 2abk s ALA 58 Ca -0.06 1.16 0.21 0.00 0.00 0.00 0.00 51.96 53.27 2abk s ALA 58 Cb 0.07 -1.90 0.44 0.00 0.00 0.00 0.00 23.12 21.74 2abk s ALA 58 CO 0.61 -1.34 1.17 0.27 0.00 0.00 0.00 175.76 176.47 2abk n ASN 59 N 5.39 1.46 -4.18 0.00 6.94 -1.25 -4.16 115.26 119.47 2abk n ASN 59 Ca -0.02 -2.53 -0.13 0.00 -0.02 0.00 0.00 54.58 51.88 2abk n ASN 59 Cb 0.50 -0.38 -0.10 0.00 -2.36 0.00 0.00 39.78 37.44 2abk n ASN 59 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2abk s THR 60 N -1.54 0.86 0.31 5.53 -4.23 -1.26 -4.75 115.64 110.56 2abk s THR 60 Ca 0.35 -1.77 0.04 0.00 -1.18 0.00 0.00 61.69 59.13 2abk s THR 60 Cb 0.38 -1.49 0.30 0.00 1.34 0.00 0.00 72.50 73.02 2abk s THR 60 CO -0.12 -0.68 1.85 -0.65 -0.54 0.00 0.00 174.62 174.48 2abk h PRO 61 N 3.30 0.88 -0.43 3.99 0.11 -1.91 -1.78 132.00 136.16 2abk h PRO 61 Ca -0.36 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.62 2abk h PRO 61 Cb 1.18 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 2abk h PRO 61 CO 0.58 0.58 -0.02 0.00 -0.21 0.00 0.00 178.00 178.92 2abk h ALA 62 N 1.56 0.58 -0.29 -0.75 0.00 -1.96 -0.44 119.26 117.95 2abk h ALA 62 Ca 0.48 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 2abk h ALA 62 Cb 0.54 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2abk h ALA 62 CO -0.24 0.39 -0.41 0.00 0.00 0.00 0.00 179.25 178.99 2abk h ALA 63 N 0.89 0.72 -0.35 0.00 0.00 -1.93 -2.38 119.26 116.20 2abk h ALA 63 Ca 0.12 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2abk h ALA 63 Cb 0.52 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2abk h ALA 63 CO 0.03 0.66 0.17 1.98 0.00 0.00 0.00 179.25 182.09 2abk h MET 64 N 0.58 0.51 -0.66 0.00 -1.53 -1.26 -1.67 114.93 110.90 2abk h MET 64 Ca 0.05 -0.07 -0.03 0.00 -3.44 0.00 0.00 59.70 56.20 2abk h MET 64 Cb 0.96 -0.09 -0.03 0.00 -0.55 0.00 0.00 31.60 31.88 2abk h MET 64 CO 0.09 0.45 0.29 -0.07 0.14 0.00 0.00 176.91 177.81 2abk h LEU 65 N 0.44 0.86 -1.72 3.39 3.38 -1.05 -2.45 115.31 118.15 2abk h LEU 65 Ca 0.12 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2abk h LEU 65 Cb 0.11 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2abk h LEU 65 CO -0.02 0.75 -0.17 -0.08 0.09 0.00 0.00 178.44 179.01 2abk h GLU 66 N 0.94 0.00 -0.07 1.13 4.81 -1.12 -2.26 114.58 118.01 2abk h GLU 66 Ca 0.23 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.29 2abk h GLU 66 Cb 0.14 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2abk h GLU 66 CO -0.02 0.17 -0.69 1.25 -0.73 0.00 0.00 179.01 178.99 2abk h LEU 67 N 0.00 0.36 -0.03 1.64 5.85 -0.84 -3.50 115.31 118.78 2abk h LEU 67 Ca -0.00 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.51 2abk h LEU 67 Cb 0.36 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2abk h LEU 67 CO 0.02 0.94 -0.06 0.61 -0.34 0.00 0.00 178.44 179.61 2abk n GLY 68 N 0.47 -2.49 0.27 3.75 0.00 -0.85 -2.94 105.19 103.39 2abk n GLY 68 Ca -0.03 -1.44 -0.05 0.00 0.00 0.00 0.00 46.02 44.50 2abk n GLY 68 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2abk h VAL 69 N -0.08 0.37 -0.25 1.61 2.07 -1.88 -0.95 116.25 117.15 2abk h VAL 69 Ca -0.01 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.40 2abk h VAL 69 Cb 0.07 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 2abk h VAL 69 CO 0.00 0.00 -0.31 -0.33 0.02 0.00 0.00 177.57 176.96 2abk h GLU 70 N -0.13 0.50 -0.57 1.57 4.39 -1.96 -1.67 114.58 116.71 2abk h GLU 70 Ca 0.21 -0.21 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 2abk h GLU 70 Cb 0.46 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 2abk h GLU 70 CO -0.52 0.76 0.16 0.78 -1.16 0.00 0.00 179.01 179.03 2abk h GLY 71 N 1.05 0.96 0.82 -3.84 0.00 -1.27 -2.83 103.07 97.96 2abk h GLY 71 Ca 0.06 -0.58 0.02 0.00 0.00 0.00 0.00 47.33 46.82 2abk h GLY 71 CO 0.06 0.54 -0.02 -2.08 0.00 0.00 0.00 176.54 175.04 2abk h VAL 72 N 0.80 0.91 -0.91 4.60 2.07 -1.07 -2.78 116.25 119.87 2abk h VAL 72 Ca 0.18 -0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.84 2abk h VAL 72 Cb 0.30 0.90 -0.07 0.00 -1.52 0.00 0.00 31.29 30.90 2abk h VAL 72 CO -0.00 0.00 0.58 0.11 0.02 0.00 0.00 177.57 178.28 2abk h LYS 73 N 0.01 0.71 -0.69 1.57 1.57 -1.23 -1.24 116.57 117.27 2abk h LYS 73 Ca 0.05 -0.04 0.11 0.00 -1.87 0.00 0.00 60.65 58.90 2abk h LYS 73 Cb 0.07 -0.16 -0.08 0.00 0.08 0.00 0.00 32.23 32.13 2abk h LYS 73 CO -0.09 0.47 0.29 1.15 -0.57 0.00 0.00 179.45 180.70 2abk h THR 74 N 0.74 0.75 0.00 -0.16 2.02 -1.24 0.38 112.91 115.40 2abk h THR 74 Ca 0.46 -0.16 -0.13 0.00 0.77 0.00 0.00 66.41 67.34 2abk h THR 74 Cb 0.69 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 2abk h THR 74 CO -0.22 0.09 -0.65 1.88 0.37 0.00 0.00 175.52 176.99 2abk h TYR 75 N 0.48 0.00 -0.29 3.16 -1.99 -1.25 -3.37 116.97 113.71 2abk h TYR 75 Ca 0.36 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.09 2abk h TYR 75 Cb 0.47 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.20 2abk h TYR 75 CO -0.15 0.64 0.00 0.44 -0.00 0.00 0.00 178.16 179.09 2abk n ILE 76 N -3.26 0.86 0.15 -2.88 -5.35 -0.78 -4.73 119.36 103.36 2abk n ILE 76 Ca 0.01 -0.93 0.07 0.00 -0.27 0.00 0.00 62.75 61.64 2abk n ILE 76 Cb 0.79 0.60 0.40 0.00 -1.74 0.00 0.00 39.64 39.70 2abk n ILE 76 CO 0.00 0.00 0.00 2.29 -1.76 0.00 0.00 176.55 177.08 2abk n LYS 77 N 0.49 0.10 0.13 6.28 2.85 0.10 -1.40 118.16 126.71 2abk n LYS 77 Ca 0.10 0.57 0.13 0.00 -1.05 0.00 0.00 58.31 58.07 2abk n LYS 77 Cb 0.40 -2.00 0.40 0.00 -0.65 0.00 0.00 35.03 33.18 2abk n LYS 77 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 2abk h THR 78 N 0.00 0.00 -3.23 0.58 1.35 -1.87 -3.46 112.91 106.28 2abk h THR 78 Ca 0.00 -0.50 -0.57 0.00 -0.55 0.00 0.00 66.41 64.79 2abk h THR 78 Cb 0.36 1.46 -0.04 0.00 -1.73 0.00 0.00 68.15 68.20 2abk h THR 78 CO 0.00 0.00 -0.11 -0.63 -0.25 0.00 0.00 175.52 174.53 2abk s ILE 79 N -3.17 4.88 0.43 6.82 1.01 -0.49 -5.06 121.20 125.62 2abk s ILE 79 Ca 0.09 0.87 -0.25 0.00 0.00 0.00 0.00 60.65 61.36 2abk s ILE 79 Cb 0.11 -3.76 -0.10 0.00 0.01 0.00 0.00 42.46 38.73 2abk s ILE 79 CO 0.57 0.37 1.20 0.61 0.00 0.00 0.00 174.94 177.69 2abk n GLY 80 N 1.17 0.34 2.43 6.18 0.00 -1.26 -2.72 105.19 111.33 2abk n GLY 80 Ca -0.08 0.16 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 2abk n GLY 80 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2abk n LEU 81 N 0.18 -1.55 0.30 0.99 4.77 -1.26 -4.88 117.00 115.55 2abk n LEU 81 Ca 0.08 0.27 0.19 0.00 -0.03 0.00 0.00 56.01 56.52 2abk n LEU 81 Cb 0.40 -2.70 1.00 0.00 -2.33 0.00 0.00 43.42 39.79 2abk n LEU 81 CO 0.58 -0.64 1.16 0.10 -1.33 0.00 0.00 177.39 177.26 2abk h TYR 82 N 0.00 0.00 -0.20 -1.77 -0.00 -1.82 -1.58 116.97 111.61 2abk h TYR 82 Ca -0.42 0.00 -0.08 0.00 -0.00 0.00 0.00 58.73 58.23 2abk h TYR 82 Cb 1.28 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 38.01 2abk h TYR 82 CO 0.56 0.00 -0.20 -0.91 -0.00 0.00 0.00 178.16 177.61 2abk h ASN 83 N 0.00 0.52 0.26 0.10 4.21 -1.89 0.03 115.58 118.80 2abk h ASN 83 Ca 0.02 -0.47 -0.19 0.00 1.21 0.00 0.00 56.30 56.87 2abk h ASN 83 Cb 0.24 -0.15 -0.00 0.00 -1.12 0.00 0.00 38.32 37.29 2abk h ASN 83 CO -0.00 0.89 -0.74 0.77 -1.29 0.00 0.00 177.43 177.06 2abk h SER 84 N 0.16 0.49 -0.22 5.81 4.64 -1.85 -2.83 113.55 119.75 2abk h SER 84 Ca 0.03 -0.32 0.03 0.00 -0.47 0.00 0.00 61.79 61.06 2abk h SER 84 Cb 0.74 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 62.66 2abk h SER 84 CO 0.05 1.06 0.02 0.11 -0.87 0.00 0.00 176.83 177.20 2abk h LYS 85 N 0.28 0.09 -0.98 4.77 1.57 -1.29 -0.43 116.57 120.57 2abk h LYS 85 Ca -0.03 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.80 2abk h LYS 85 Cb 1.31 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.54 2abk h LYS 85 CO 0.13 0.06 0.63 0.00 -0.57 0.00 0.00 179.45 179.69 2abk h ALA 86 N 1.17 1.34 0.42 3.86 0.00 -0.96 0.64 119.26 125.73 2abk h ALA 86 Ca 0.10 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2abk h ALA 86 Cb 0.12 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2abk h ALA 86 CO -0.16 0.44 -0.20 0.93 0.00 0.00 0.00 179.25 180.26 2abk h GLU 87 N 1.16 -0.54 -0.89 0.00 4.39 -1.23 -2.13 114.58 115.34 2abk h GLU 87 Ca 0.41 0.04 0.10 0.00 0.34 0.00 0.00 59.36 60.25 2abk h GLU 87 Cb 0.12 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 28.82 2abk h GLU 87 CO -0.16 -0.33 0.54 -0.91 -1.16 0.00 0.00 179.01 176.98 2abk h ASN 88 N -0.61 0.78 0.21 1.42 -0.26 -0.76 -1.62 115.58 114.74 2abk h ASN 88 Ca -0.06 0.05 -0.00 0.00 -0.56 0.00 0.00 56.30 55.72 2abk h ASN 88 Cb 0.46 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.60 2abk h ASN 88 CO 0.09 0.44 -0.15 0.40 -1.06 0.00 0.00 177.43 177.15 2abk h ILE 89 N 0.88 0.68 -0.64 2.81 2.04 -0.76 0.09 117.51 122.62 2abk h ILE 89 Ca 0.43 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.29 2abk h ILE 89 Cb 0.39 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2abk h ILE 89 CO -0.25 0.00 0.38 0.40 0.00 0.00 0.00 178.15 178.68 2abk h ILE 90 N -0.36 1.19 -0.37 -0.67 1.08 -1.02 -0.98 117.51 116.38 2abk h ILE 90 Ca -0.01 -0.42 0.00 0.00 -0.39 0.00 0.00 64.86 64.04 2abk h ILE 90 Cb 0.32 0.32 -0.02 0.00 -3.07 0.00 0.00 36.82 34.36 2abk h ILE 90 CO 0.00 0.19 0.23 0.11 -0.69 0.00 0.00 178.15 178.00 2abk h LYS 91 N 0.86 0.49 -0.71 2.37 1.57 -1.25 -1.70 116.57 118.21 2abk h LYS 91 Ca 0.23 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2abk h LYS 91 Cb -0.02 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 2abk h LYS 91 CO -0.04 0.35 0.43 1.15 -0.57 0.00 0.00 179.45 180.77 2abk h THR 92 N 0.49 1.20 -0.71 -0.16 2.02 -0.54 -1.98 112.91 113.24 2abk h THR 92 Ca 0.13 -0.44 0.01 0.00 0.77 0.00 0.00 66.41 66.88 2abk h THR 92 Cb -0.03 0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 66.56 2abk h THR 92 CO -0.03 0.21 0.47 0.00 0.37 0.00 0.00 175.52 176.54 2abk h ARG 94 N 0.96 -0.15 -0.73 0.00 2.43 -0.65 -1.07 114.38 115.16 2abk h ARG 94 Ca 0.26 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.54 2abk h ARG 94 Cb -0.11 0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 29.40 2abk h ARG 94 CO -0.06 0.11 0.35 0.82 -1.51 0.00 0.00 179.97 179.69 2abk h ILE 95 N -0.42 0.82 -0.67 1.20 2.04 -1.20 0.10 117.51 119.38 2abk h ILE 95 Ca -0.02 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 2abk h ILE 95 Cb 0.34 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.57 2abk h ILE 95 CO 0.03 0.11 0.28 -0.07 0.00 0.00 0.00 178.15 178.49 2abk h LEU 96 N 0.59 0.89 -0.15 1.44 3.38 -1.16 0.11 115.31 120.40 2abk h LEU 96 Ca 0.37 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 58.16 2abk h LEU 96 Cb 0.42 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2abk h LEU 96 CO -0.29 0.78 -0.16 -0.07 0.09 0.00 0.00 178.44 178.79 2abk h LEU 97 N 0.96 0.41 0.00 1.67 3.38 0.10 0.56 115.31 122.38 2abk h LEU 97 Ca 0.23 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2abk h LEU 97 Cb 0.16 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2abk h LEU 97 CO -0.02 0.81 0.00 -0.62 0.09 0.00 0.00 178.44 178.70 2abk n GLU 98 N -4.53 0.00 0.18 1.13 1.02 -0.10 -3.58 120.64 114.76 2abk n GLU 98 Ca -0.06 0.23 0.05 0.00 -0.02 0.00 0.00 57.16 57.37 2abk n GLU 98 Cb 0.37 -0.97 0.32 0.00 -0.02 0.00 0.00 31.44 31.15 2abk n GLU 98 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 2abk h GLN 99 N 0.00 0.00 0.00 3.49 4.20 -1.16 -3.31 115.11 118.33 2abk h GLN 99 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2abk h GLN 99 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2abk h GLN 99 CO 0.00 0.39 -0.00 0.72 -0.67 0.00 0.00 178.83 179.27 2abk n HIS 100 N -3.56 0.00 -3.80 2.96 8.25 -1.00 -5.02 115.22 113.05 2abk n HIS 100 Ca -0.00 -0.45 -0.26 0.00 -0.26 0.00 0.00 57.72 56.74 2abk n HIS 100 Cb 0.51 -0.05 0.01 0.00 1.12 0.00 0.00 29.99 31.59 2abk n HIS 100 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2abk n ASN 101 N -0.46 -2.12 0.00 0.41 5.03 0.30 -2.23 115.26 116.18 2abk n ASN 101 Ca 0.00 -0.97 0.00 0.00 0.87 0.00 0.00 54.58 54.49 2abk n ASN 101 Cb 0.28 -3.40 0.00 0.00 -1.02 0.00 0.00 39.78 35.64 2abk n ASN 101 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2abk n GLY 102 N -1.79 0.24 3.80 7.41 0.00 0.17 -4.94 105.19 110.09 2abk n GLY 102 Ca -0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 2abk n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2abk s GLU 103 N -1.07 2.99 -0.26 1.61 2.02 -0.95 -4.79 118.70 118.26 2abk s GLU 103 Ca 0.00 -0.63 -0.29 0.00 0.02 0.00 0.00 54.97 54.07 2abk s GLU 103 Cb 0.00 -2.79 0.01 0.00 0.10 0.00 0.00 34.13 31.44 2abk s GLU 103 CO 0.00 0.58 1.14 0.08 0.02 0.00 0.00 175.26 177.08 2abk s VAL 104 N -1.39 4.46 0.12 2.63 1.01 -1.26 -4.80 120.40 121.17 2abk s VAL 104 Ca 0.30 1.72 -0.31 0.00 0.00 0.00 0.00 61.98 63.69 2abk s VAL 104 Cb -0.12 -4.26 -0.08 0.00 0.00 0.00 0.00 36.38 31.92 2abk s VAL 104 CO 0.22 -0.32 1.34 -2.16 0.00 0.00 0.00 175.10 174.19 2abk s PRO 105 N 3.56 4.35 -1.28 2.72 0.04 -1.26 -4.94 135.00 138.19 2abk s PRO 105 Ca 0.48 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 63.43 2abk s PRO 105 Cb -0.16 -3.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.07 2abk s PRO 105 CO 0.13 -0.37 2.44 0.39 0.04 0.00 0.00 177.00 179.63 2abk n GLU 106 N 3.74 2.78 -3.67 4.56 1.02 -1.26 -4.73 120.64 123.08 2abk n GLU 106 Ca 0.10 -2.02 -0.10 0.00 -0.02 0.00 0.00 57.16 55.12 2abk n GLU 106 Cb 0.43 -2.82 -0.10 0.00 -0.02 0.00 0.00 31.44 28.93 2abk n GLU 106 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2abk s ASP 107 N 3.10 -0.20 0.13 1.62 2.15 -1.26 -5.07 116.67 117.14 2abk s ASP 107 Ca 0.55 0.91 -0.25 0.00 0.43 0.00 0.00 52.55 54.19 2abk s ASP 107 Cb 0.14 1.15 -0.03 0.00 -0.30 0.00 0.00 42.92 43.88 2abk s ASP 107 CO -0.04 -0.23 1.64 -0.09 -0.17 0.00 0.00 175.17 176.28 2abk h ARG 108 N 8.02 -0.34 -0.88 4.34 2.43 -1.94 -1.05 114.38 124.97 2abk h ARG 108 Ca -0.19 0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.02 2abk h ARG 108 Cb 1.12 0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 30.70 2abk h ARG 108 CO 0.15 -0.23 0.58 0.00 -1.51 0.00 0.00 179.97 178.97 2abk h ALA 109 N 0.53 1.12 -0.44 2.80 0.00 -1.98 -0.19 119.26 121.10 2abk h ALA 109 Ca 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2abk h ALA 109 Cb 0.47 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2abk h ALA 109 CO -0.26 0.51 0.24 0.00 0.00 0.00 0.00 179.25 179.74 2abk h ALA 110 N 1.33 0.56 -0.61 0.00 0.00 -1.87 -1.86 119.26 116.80 2abk h ALA 110 Ca 0.32 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 2abk h ALA 110 Cb -0.13 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2abk h ALA 110 CO -0.07 0.08 0.07 -0.07 0.00 0.00 0.00 179.25 179.25 2abk h LEU 111 N 0.57 1.00 -2.14 0.00 3.38 -0.82 -2.89 115.31 114.42 2abk h LEU 111 Ca 0.15 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2abk h LEU 111 Cb 0.05 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 2abk h LEU 111 CO -0.03 1.03 -0.07 -0.33 0.09 0.00 0.00 178.44 179.13 2abk h GLU 112 N 0.94 0.00 0.00 1.13 5.08 -0.86 -1.66 114.58 119.21 2abk h GLU 112 Ca 0.18 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 2abk h GLU 112 Cb 0.47 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 2abk h GLU 112 CO 0.02 0.07 -0.16 0.00 -1.00 0.00 0.00 179.01 177.94 2abk h ALA 113 N 1.93 1.09 -2.81 3.43 0.00 -1.11 -3.44 119.26 118.34 2abk h ALA 113 Ca -0.00 -0.14 -0.51 0.00 0.00 0.00 0.00 54.91 54.26 2abk h ALA 113 Cb 0.20 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.00 2abk h ALA 113 CO 0.01 0.20 0.52 -0.51 0.00 0.00 0.00 179.25 179.47 2abk s LEU 114 N -6.81 4.47 -0.02 0.00 1.43 -0.63 -4.95 118.68 112.18 2abk s LEU 114 Ca -0.00 2.38 -0.33 0.00 -1.03 0.00 0.00 54.13 55.14 2abk s LEU 114 Cb 0.11 -3.69 -0.11 0.00 0.03 0.00 0.00 46.19 42.53 2abk s LEU 114 CO 0.60 -0.30 1.87 -2.65 0.23 0.00 0.00 176.35 176.10 2abk n PRO 115 N 0.95 2.37 0.00 1.29 -0.02 -1.26 -2.06 135.00 136.26 2abk n PRO 115 Ca -0.00 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 2abk n PRO 115 Cb 0.44 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.19 2abk n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2abk n GLY 116 N 4.32 2.74 3.46 -1.23 0.00 -1.26 -4.80 105.19 108.43 2abk n GLY 116 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 2abk n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2abk s VAL 117 N -2.31 4.20 0.00 1.61 0.11 -0.88 -4.95 120.40 118.18 2abk s VAL 117 Ca 0.00 -0.22 0.00 0.00 -2.93 0.00 0.00 61.98 58.83 2abk s VAL 117 Cb 0.00 -2.93 0.00 0.00 -1.53 0.00 0.00 36.38 31.92 2abk s VAL 117 CO 0.00 0.39 0.00 0.61 -3.33 0.00 0.00 175.10 172.77 2abk n GLY 118 N 4.51 2.65 0.17 6.54 0.00 -1.26 -4.48 105.19 113.31 2abk n GLY 118 Ca -0.17 -2.11 -0.05 0.00 0.00 0.00 0.00 46.02 43.70 2abk n GLY 118 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2abk h ARG 119 N 0.00 0.16 -0.71 1.61 2.43 -1.97 -0.11 114.38 115.79 2abk h ARG 119 Ca 0.00 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 2abk h ARG 119 Cb 0.00 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 2abk h ARG 119 CO 0.00 0.11 0.20 -0.22 -1.51 0.00 0.00 179.97 178.55 2abk h LYS 120 N 0.16 1.11 -0.13 0.20 3.64 -1.98 -1.15 116.57 118.43 2abk h LYS 120 Ca 0.19 -0.25 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 2abk h LYS 120 Cb 0.25 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2abk h LYS 120 CO -0.28 0.97 -0.01 1.15 -2.27 0.00 0.00 179.45 179.01 2abk h THR 121 N 1.05 1.26 -0.61 1.00 2.02 -1.87 0.48 112.91 116.24 2abk h THR 121 Ca 0.23 -0.87 0.10 0.00 0.77 0.00 0.00 66.41 66.64 2abk h THR 121 Cb 0.33 1.59 -0.08 0.00 -1.74 0.00 0.00 68.15 68.26 2abk h THR 121 CO -0.00 0.25 0.21 0.00 0.37 0.00 0.00 175.52 176.35 2abk h ALA 122 N 0.74 0.78 -0.73 6.16 0.00 -0.94 0.22 119.26 125.48 2abk h ALA 122 Ca 0.04 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2abk h ALA 122 Cb 0.39 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2abk h ALA 122 CO 0.01 -0.21 0.33 -0.91 0.00 0.00 0.00 179.25 178.46 2abk h ASN 123 N 0.38 0.98 -0.38 0.00 2.35 -1.12 0.02 115.58 117.82 2abk h ASN 123 Ca 0.31 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.87 2abk h ASN 123 Cb 0.40 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 2abk h ASN 123 CO -0.33 0.86 0.07 0.58 -1.65 0.00 0.00 177.43 176.96 2abk h VAL 124 N 1.04 1.24 -0.39 2.81 2.07 -0.31 -1.74 116.25 120.96 2abk h VAL 124 Ca 0.25 -0.83 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 2abk h VAL 124 Cb 0.16 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2abk h VAL 124 CO -0.03 0.28 0.14 0.58 0.02 0.00 0.00 177.57 178.57 2abk h VAL 125 N 0.46 1.20 -0.54 2.57 2.07 -0.69 0.69 116.25 122.02 2abk h VAL 125 Ca 0.11 -0.65 0.01 0.00 0.82 0.00 0.00 66.70 66.99 2abk h VAL 125 Cb 0.35 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 2abk h VAL 125 CO 0.01 0.23 0.36 -0.07 0.02 0.00 0.00 177.57 178.12 2abk h LEU 126 N 0.49 0.62 -0.19 2.57 3.38 -0.99 0.37 115.31 121.57 2abk h LEU 126 Ca 0.13 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2abk h LEU 126 Cb 0.22 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2abk h LEU 126 CO -0.01 0.45 0.04 -1.13 0.09 0.00 0.00 178.44 177.89 2abk h ASN 127 N 0.73 0.28 0.14 -0.43 -0.00 -1.19 -1.80 115.58 113.32 2abk h ASN 127 Ca 0.20 -0.24 -0.27 0.00 -0.00 0.00 0.00 56.30 56.00 2abk h ASN 127 Cb -0.08 -0.07 0.01 0.00 -0.00 0.00 0.00 38.32 38.17 2abk h ASN 127 CO -0.04 0.45 -1.31 0.74 -0.00 0.00 0.00 177.43 177.26 2abk h THR 128 N 0.11 1.16 0.08 -3.57 2.02 -0.67 -2.19 112.91 109.84 2abk h THR 128 Ca 0.06 -2.47 -0.29 0.00 0.77 0.00 0.00 66.41 64.48 2abk h THR 128 Cb 0.27 2.87 -0.02 0.00 -1.74 0.00 0.00 68.15 69.53 2abk h THR 128 CO 0.00 0.73 -1.47 0.00 0.37 0.00 0.00 175.52 175.16 2abk h ALA 129 N 0.02 0.37 -0.03 6.16 0.00 -1.10 -3.40 119.26 121.27 2abk h ALA 129 Ca -0.27 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.51 2abk h ALA 129 Cb 1.80 0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.83 2abk h ALA 129 CO 0.11 1.23 0.00 1.19 0.00 0.00 0.00 179.25 181.79 2abk n PHE 130 N -3.37 0.03 -1.38 0.00 3.72 -1.00 -4.92 117.46 110.55 2abk n PHE 130 Ca -0.14 -0.07 -0.06 0.00 -0.05 0.00 0.00 57.45 57.13 2abk n PHE 130 Cb 1.03 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 39.54 2abk n PHE 130 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2abk n GLY 131 N 0.26 0.68 3.77 1.37 0.00 -0.77 -4.94 105.19 105.55 2abk n GLY 131 Ca 0.03 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 44.93 2abk n GLY 131 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2abk s TRP 132 N -2.23 2.82 0.00 1.61 0.52 -0.75 -4.92 118.94 115.99 2abk s TRP 132 Ca 0.00 1.54 -0.03 0.00 0.02 0.00 0.00 56.10 57.63 2abk s TRP 132 Cb 0.00 -3.34 -0.13 0.00 -1.15 0.00 0.00 33.47 28.85 2abk s TRP 132 CO 0.00 -1.51 2.59 -0.35 0.02 0.00 0.00 176.95 177.71 2abk n PRO 133 N -0.74 1.37 -3.77 4.98 -0.04 -1.26 -4.31 135.00 131.23 2abk n PRO 133 Ca 0.09 -0.48 -0.35 0.00 -0.04 0.00 0.00 63.50 62.72 2abk n PRO 133 Cb 0.49 -1.53 -0.05 0.00 -0.04 0.00 0.00 33.50 32.36 2abk n PRO 133 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2abk s THR 134 N 0.76 5.31 -0.54 0.52 -4.23 -1.26 -4.87 115.64 111.34 2abk s THR 134 Ca 0.32 0.17 0.04 0.00 -1.18 0.00 0.00 61.69 61.04 2abk s THR 134 Cb 0.15 -3.56 0.16 0.00 1.34 0.00 0.00 72.50 70.59 2abk s THR 134 CO 0.00 0.38 0.36 -0.63 -0.54 0.00 0.00 174.62 174.19 2abk s ILE 135 N -1.28 1.75 0.19 2.99 1.01 -1.26 -4.74 121.20 119.86 2abk s ILE 135 Ca 0.27 -3.26 -0.30 0.00 0.00 0.00 0.00 60.65 57.35 2abk s ILE 135 Cb -0.13 -2.18 -0.09 0.00 0.01 0.00 0.00 42.46 40.07 2abk s ILE 135 CO 0.16 -1.02 1.35 0.00 0.00 0.00 0.00 174.94 175.43 2abk s ALA 136 N -0.43 3.56 -0.25 9.38 0.00 -1.26 -4.88 121.76 127.88 2abk s ALA 136 Ca 0.24 1.16 -0.07 0.00 0.00 0.00 0.00 51.96 53.29 2abk s ALA 136 Cb -0.10 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 2abk s ALA 136 CO -0.11 -0.59 0.07 0.08 0.00 0.00 0.00 175.76 175.20 2abk s VAL 137 N 0.26 4.25 0.18 0.00 1.01 -1.26 -4.94 120.40 119.90 2abk s VAL 137 Ca 0.59 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.37 2abk s VAL 137 Cb -0.38 -3.00 0.02 0.00 0.00 0.00 0.00 36.38 33.03 2abk s VAL 137 CO 0.38 0.33 0.18 -0.90 0.00 0.00 0.00 175.10 175.09 2abk n ASP 138 N 4.92 1.13 -0.25 3.32 5.75 -1.26 -4.92 116.55 125.24 2abk n ASP 138 Ca -0.16 -1.54 -0.03 0.00 -0.01 0.00 0.00 54.79 53.05 2abk n ASP 138 Cb 0.51 -0.07 0.08 0.00 -1.03 0.00 0.00 41.12 40.61 2abk n ASP 138 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 2abk h THR 139 N 0.31 1.09 -0.24 2.12 1.35 -1.98 -0.03 112.91 115.53 2abk h THR 139 Ca -0.10 -0.29 0.01 0.00 -0.55 0.00 0.00 66.41 65.48 2abk h THR 139 Cb 0.39 0.17 -0.02 0.00 -1.73 0.00 0.00 68.15 66.96 2abk h THR 139 CO 0.15 0.15 0.13 0.45 -0.25 0.00 0.00 175.52 176.15 2abk h HIS 140 N 0.85 0.24 -0.37 4.73 3.86 -1.96 -0.56 115.15 121.94 2abk h HIS 140 Ca 0.28 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.36 2abk h HIS 140 Cb 0.03 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 2abk h HIS 140 CO -0.04 0.14 -0.33 0.82 0.86 0.00 0.00 177.93 179.38 2abk h ILE 141 N 0.27 1.28 -0.10 2.45 2.04 -1.80 -1.33 117.51 120.32 2abk h ILE 141 Ca 0.09 -1.49 0.02 0.00 1.00 0.00 0.00 64.86 64.48 2abk h ILE 141 Cb 0.01 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 2abk h ILE 141 CO -0.05 0.49 -0.01 0.15 0.00 0.00 0.00 178.15 178.73 2abk h PHE 142 N 0.69 -0.02 -0.59 1.37 3.57 -0.74 -0.79 116.94 120.44 2abk h PHE 142 Ca 0.07 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2abk h PHE 142 Cb 0.88 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.62 2abk h PHE 142 CO 0.05 -0.02 0.37 -0.09 -2.23 0.00 0.00 178.31 176.39 2abk h ARG 143 N 0.03 0.80 -0.19 1.11 2.43 -0.92 -2.36 114.38 115.27 2abk h ARG 143 Ca 0.05 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2abk h ARG 143 Cb 0.06 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 2abk h ARG 143 CO -0.08 0.56 0.10 0.28 -1.51 0.00 0.00 179.97 179.32 2abk h VAL 144 N 0.80 1.11 -0.53 0.20 2.07 -1.10 0.56 116.25 119.36 2abk h VAL 144 Ca 0.21 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 2abk h VAL 144 Cb -0.04 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 2abk h VAL 144 CO -0.04 0.10 0.11 0.00 0.02 0.00 0.00 177.57 177.76 2abk h ASN 146 N 0.79 0.60 -0.02 0.00 2.35 -1.30 -2.48 115.58 115.51 2abk h ASN 146 Ca 0.17 -0.83 0.01 0.00 -0.55 0.00 0.00 56.30 55.09 2abk h ASN 146 Cb 0.31 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 2abk h ASN 146 CO 0.00 1.37 -0.02 0.03 -1.65 0.00 0.00 177.43 177.16 2abk h ARG 147 N -0.09 -0.02 0.00 0.81 3.08 -0.75 -3.05 114.38 114.35 2abk h ARG 147 Ca -0.12 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 2abk h ARG 147 Cb 1.56 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.61 2abk h ARG 147 CO 0.16 -0.01 -0.01 1.79 -1.07 0.00 0.00 179.97 180.82 2abk h THR 148 N -0.02 0.04 -0.27 2.04 1.35 -1.40 -2.81 112.91 111.84 2abk h THR 148 Ca 0.01 -0.63 -0.11 0.00 -0.55 0.00 0.00 66.41 65.13 2abk h THR 148 Cb 0.04 1.61 -0.05 0.00 -1.73 0.00 0.00 68.15 68.02 2abk h THR 148 CO -0.03 0.01 -0.10 0.00 -0.25 0.00 0.00 175.52 175.15 2abk n GLN 149 N -3.11 -0.88 -0.19 4.72 1.13 -0.96 -2.18 117.38 115.91 2abk n GLN 149 Ca 0.01 0.58 -0.04 0.00 -1.94 0.00 0.00 57.00 55.61 2abk n GLN 149 Cb 0.35 -4.44 0.06 0.00 0.11 0.00 0.00 30.24 26.31 2abk n GLN 149 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 2abk h PHE 150 N 0.00 0.62 -1.14 1.08 3.57 -1.77 -3.39 116.94 115.89 2abk h PHE 150 Ca -0.11 0.02 -0.29 0.00 3.53 0.00 0.00 57.97 61.11 2abk h PHE 150 Cb 0.61 -0.20 -0.22 0.00 2.79 0.00 0.00 35.95 38.93 2abk h PHE 150 CO 0.31 0.34 -0.65 0.00 -2.23 0.00 0.00 178.31 176.08 2abk n ALA 151 N -2.30 -0.43 -1.65 2.41 0.00 -1.15 -4.99 120.51 112.40 2abk n ALA 151 Ca 0.05 -1.75 -0.34 0.00 0.00 0.00 0.00 53.44 51.40 2abk n ALA 151 Cb 0.10 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.33 2abk n ALA 151 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2abk s PRO 152 N 0.48 3.10 -0.07 0.00 0.04 -1.24 -4.41 135.00 132.89 2abk s PRO 152 Ca 0.32 1.49 -0.31 0.00 0.04 0.00 0.00 61.00 62.54 2abk s PRO 152 Cb 0.08 -1.98 0.12 0.00 0.04 0.00 0.00 34.50 32.75 2abk s PRO 152 CO -0.13 -1.03 1.00 0.20 0.04 0.00 0.00 177.00 177.08 2abk s GLY 153 N -2.18 -0.40 0.31 0.56 0.00 -1.26 -4.63 107.32 99.70 2abk s GLY 153 Ca 0.70 1.23 0.21 0.00 0.00 0.00 0.00 44.72 46.85 2abk s GLY 153 CO 0.34 0.41 1.33 0.50 0.00 0.00 0.00 173.10 175.68 2abk h LYS 154 N 2.00 0.00 -4.12 2.90 1.79 -1.96 -3.46 116.57 113.72 2abk h LYS 154 Ca -0.18 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 58.04 2abk h LYS 154 Cb 1.21 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.78 2abk h LYS 154 CO 0.28 0.11 -0.22 0.54 -1.08 0.00 0.00 179.45 179.08 2abk s ASN 155 N -5.94 0.77 0.18 0.86 2.20 -1.26 -5.07 114.94 106.67 2abk s ASN 155 Ca 0.03 -1.42 -0.14 0.00 -0.94 0.00 0.00 52.86 50.39 2abk s ASN 155 Cb 0.07 0.63 0.14 0.00 -2.00 0.00 0.00 41.25 40.09 2abk s ASN 155 CO 0.73 -1.24 1.75 0.58 -2.94 0.00 0.00 177.10 175.98 2abk h VAL 156 N 2.16 0.85 -0.89 3.54 2.07 -1.94 -2.94 116.25 119.10 2abk h VAL 156 Ca -0.28 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 2abk h VAL 156 Cb 1.24 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 2abk h VAL 156 CO 0.39 0.06 0.49 -0.33 0.02 0.00 0.00 177.57 178.20 2abk h GLU 157 N 0.33 1.24 -0.82 1.57 5.08 -1.97 -0.97 114.58 119.03 2abk h GLU 157 Ca 0.22 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.39 2abk h GLU 157 Cb 0.22 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 2abk h GLU 157 CO -0.22 0.90 0.36 1.96 -1.00 0.00 0.00 179.01 181.01 2abk h GLN 158 N 1.24 1.21 -0.26 2.33 4.20 -1.94 -0.31 115.11 121.57 2abk h GLN 158 Ca 0.31 -0.20 -0.15 0.00 0.06 0.00 0.00 58.65 58.67 2abk h GLN 158 Cb 0.03 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.60 2abk h GLN 158 CO -0.05 0.95 -0.43 0.28 -0.67 0.00 0.00 178.83 178.92 2abk h VAL 159 N 1.18 1.30 -0.54 -0.54 2.07 -1.30 -0.31 116.25 118.10 2abk h VAL 159 Ca 0.28 -1.62 0.02 0.00 0.82 0.00 0.00 66.70 66.19 2abk h VAL 159 Cb 0.17 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 2abk h VAL 159 CO -0.03 0.52 0.34 -0.08 0.02 0.00 0.00 177.57 178.34 2abk h GLU 160 N 0.50 0.67 -0.30 1.57 4.81 -0.99 0.01 114.58 120.85 2abk h GLU 160 Ca 0.02 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 2abk h GLU 160 Cb 1.02 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 2abk h GLU 160 CO 0.10 0.44 -0.08 1.49 -0.73 0.00 0.00 179.01 180.23 2abk h GLU 161 N 0.69 0.58 -0.73 1.92 4.81 -1.02 -1.90 114.58 118.93 2abk h GLU 161 Ca 0.21 -0.23 0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2abk h GLU 161 Cb -0.02 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 2abk h GLU 161 CO -0.07 0.78 0.47 -0.22 -0.73 0.00 0.00 179.01 179.24 2abk h LYS 162 N 0.35 0.92 -0.80 1.92 1.63 -0.76 -2.59 116.57 117.24 2abk h LYS 162 Ca 0.07 -0.06 0.01 0.00 -0.85 0.00 0.00 60.65 59.83 2abk h LYS 162 Cb 0.57 -0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 31.96 2abk h LYS 162 CO 0.03 0.61 0.52 -0.07 -3.45 0.00 0.00 179.45 177.09 2abk h LEU 163 N 0.95 0.92 -1.75 5.20 3.38 -0.90 0.64 115.31 123.74 2abk h LEU 163 Ca 0.28 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 2abk h LEU 163 Cb -0.05 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 2abk h LEU 163 CO -0.08 0.67 -0.12 -0.07 0.09 0.00 0.00 178.44 178.93 2abk h LEU 164 N 1.08 0.00 0.15 1.67 3.38 -1.05 -2.00 115.31 118.55 2abk h LEU 164 Ca 0.29 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.94 2abk h LEU 164 Cb -0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2abk h LEU 164 CO -0.06 0.12 -1.56 0.11 0.09 0.00 0.00 178.44 177.14 2abk h LYS 165 N 0.00 0.33 0.00 1.13 6.56 -0.99 -3.41 116.57 120.19 2abk h LYS 165 Ca -0.00 -0.56 0.00 0.00 -1.06 0.00 0.00 60.65 59.03 2abk h LYS 165 Cb 0.43 0.21 0.00 0.00 -0.57 0.00 0.00 32.23 32.30 2abk h LYS 165 CO 0.02 1.21 -1.29 1.33 -2.06 0.00 0.00 179.45 178.66 2abk n VAL 166 N -3.53 0.27 -2.90 0.50 0.24 0.14 -4.87 118.33 108.18 2abk n VAL 166 Ca -0.18 -0.41 -0.41 0.00 -2.04 0.00 0.00 64.34 61.30 2abk n VAL 166 Cb 1.06 -0.01 -0.04 0.00 -1.47 0.00 0.00 33.84 33.37 2abk n VAL 166 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2abk s VAL 167 N -3.34 4.88 0.50 3.34 1.01 -0.76 -4.99 120.40 121.05 2abk s VAL 167 Ca -0.01 1.59 -0.22 0.00 0.00 0.00 0.00 61.98 63.35 2abk s VAL 167 Cb 0.13 -4.12 -0.08 0.00 0.00 0.00 0.00 36.38 32.31 2abk s VAL 167 CO 0.83 0.01 1.01 -2.65 0.00 0.00 0.00 175.10 174.31 2abk n PRO 168 N 5.37 1.22 -0.33 2.72 -0.02 -1.26 -4.76 135.00 137.94 2abk n PRO 168 Ca 0.04 0.45 0.21 0.00 -2.02 0.00 0.00 63.50 62.18 2abk n PRO 168 Cb 0.49 -2.14 0.47 0.00 -0.02 0.00 0.00 33.50 32.30 2abk n PRO 168 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2abk h ALA 169 N 1.14 2.10 -0.49 3.55 0.00 -1.97 0.21 119.26 123.81 2abk h ALA 169 Ca -0.47 0.07 0.13 0.00 0.00 0.00 0.00 54.91 54.65 2abk h ALA 169 Cb 1.34 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 2abk h ALA 169 CO 0.54 -0.52 0.35 1.49 0.00 0.00 0.00 179.25 181.12 2abk h GLU 170 N 0.46 0.07 -0.00 0.00 4.81 -2.04 -2.78 114.58 115.10 2abk h GLU 170 Ca 0.60 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.83 2abk h GLU 170 Cb 1.40 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.76 2abk h GLU 170 CO -0.33 0.05 -0.71 1.19 -0.73 0.00 0.00 179.01 178.47 2abk n PHE 171 N -4.41 0.00 0.25 0.92 3.72 0.03 -4.67 117.46 113.30 2abk n PHE 171 Ca 0.09 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.60 2abk n PHE 171 Cb 0.51 0.00 0.68 0.00 -0.94 0.00 0.00 39.48 39.73 2abk n PHE 171 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2abk h LYS 172 N 0.13 0.00 -0.01 -1.08 1.57 -1.17 -2.36 116.57 113.66 2abk h LYS 172 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 2abk h LYS 172 Cb 0.38 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 2abk h LYS 172 CO 0.00 0.14 -0.79 0.28 -0.57 0.00 0.00 179.45 178.50 2abk h VAL 173 N 0.00 1.51 -0.02 0.50 2.07 -1.83 -3.28 116.25 115.20 2abk h VAL 173 Ca -0.00 -2.54 0.00 0.00 0.82 0.00 0.00 66.70 64.98 2abk h VAL 173 Cb 0.33 2.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.48 2abk h VAL 173 CO 0.02 0.74 -0.33 0.47 0.02 0.00 0.00 177.57 178.48 2abk n ASP 174 N -3.67 2.02 -0.03 0.57 8.00 -1.14 -4.62 116.55 117.67 2abk n ASP 174 Ca -0.02 -1.50 -0.09 0.00 0.71 0.00 0.00 54.79 53.88 2abk n ASP 174 Cb 0.75 0.31 -0.03 0.00 -0.02 0.00 0.00 41.12 42.14 2abk n ASP 174 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2abk h HIS 176 N 0.13 -0.70 -0.44 0.00 -0.00 -1.82 -1.55 115.15 110.77 2abk h HIS 176 Ca 0.08 0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.38 2abk h HIS 176 Cb 0.05 0.31 -0.02 0.00 -0.00 0.00 0.00 27.41 27.76 2abk h HIS 176 CO -0.12 -0.35 -0.09 0.45 -0.00 0.00 0.00 177.93 177.82 2abk h HIS 177 N -0.39 0.86 -0.47 5.26 -0.00 -1.86 -1.27 115.15 117.28 2abk h HIS 177 Ca 0.07 -0.15 0.01 0.00 -0.00 0.00 0.00 60.37 60.30 2abk h HIS 177 Cb 0.48 -0.22 -0.03 0.00 -0.00 0.00 0.00 27.41 27.64 2abk h HIS 177 CO -0.31 0.84 0.30 -1.49 -0.00 0.00 0.00 177.93 177.27 2abk h TRP 178 N 0.71 0.56 -0.03 2.45 6.55 -1.21 -2.04 115.95 122.94 2abk h TRP 178 Ca 0.12 0.01 -0.18 0.00 0.95 0.00 0.00 58.89 59.79 2abk h TRP 178 Cb 0.57 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 28.67 2abk h TRP 178 CO 0.03 0.34 -0.79 -0.07 -1.05 0.00 0.00 178.44 176.90 2abk h LEU 179 N 0.60 0.33 -0.29 -4.49 3.38 -0.96 -2.29 115.31 111.60 2abk h LEU 179 Ca 0.18 -0.24 -0.20 0.00 0.09 0.00 0.00 57.88 57.71 2abk h LEU 179 Cb -0.03 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2abk h LEU 179 CO -0.06 0.99 -0.67 -0.29 0.09 0.00 0.00 178.44 178.50 2abk h ILE 180 N 0.17 1.30 -0.23 1.22 2.10 -1.16 -0.62 117.51 120.28 2abk h ILE 180 Ca -0.04 -1.90 -0.11 0.00 1.08 0.00 0.00 64.86 63.90 2abk h ILE 180 Cb 1.37 1.86 -0.01 0.00 -1.09 0.00 0.00 36.82 38.95 2abk h ILE 180 CO 0.12 0.60 -0.31 -0.07 -1.08 0.00 0.00 178.15 177.42 2abk h LEU 181 N 0.53 0.48 -0.44 2.19 3.38 -1.39 -0.15 115.31 119.92 2abk h LEU 181 Ca -0.02 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.70 2abk h LEU 181 Cb 1.28 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 2abk h LEU 181 CO 0.14 0.77 0.02 -0.74 0.09 0.00 0.00 178.44 178.72 2abk h HIS 182 N 0.41 0.83 -0.44 1.13 2.76 -1.26 -2.11 115.15 116.47 2abk h HIS 182 Ca 0.05 -0.14 -0.13 0.00 -2.20 0.00 0.00 60.37 57.95 2abk h HIS 182 Cb 0.75 -0.22 -0.01 0.00 1.55 0.00 0.00 27.41 29.48 2abk h HIS 182 CO 0.02 0.81 -0.25 0.78 -1.30 0.00 0.00 177.93 177.99 2abk h GLY 183 N 0.61 1.02 1.09 5.26 0.00 -0.69 0.39 103.07 110.74 2abk h GLY 183 Ca 0.13 -0.94 -0.13 0.00 0.00 0.00 0.00 47.33 46.39 2abk h GLY 183 CO 0.02 0.85 -0.20 -0.09 0.00 0.00 0.00 176.54 177.12 2abk h ARG 184 N 0.77 0.97 0.00 4.80 2.43 -0.98 -3.16 114.38 119.20 2abk h ARG 184 Ca 0.09 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2abk h ARG 184 Cb 0.82 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 2abk h ARG 184 CO 0.07 1.08 -1.18 0.66 -1.51 0.00 0.00 179.97 179.10 2abk n TYR 185 N -4.14 0.00 0.04 2.20 4.01 -0.80 -4.78 117.16 113.68 2abk n TYR 185 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2abk n TYR 185 Cb 0.45 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 39.31 2abk n TYR 185 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2abk n THR 186 N -1.68 0.70 -1.81 -0.72 -1.04 -0.46 -4.85 114.28 104.42 2abk n THR 186 Ca -0.01 0.23 -0.36 0.00 -2.04 0.00 0.00 64.05 61.88 2abk n THR 186 Cb 0.26 -1.44 -0.02 0.00 -1.82 0.00 0.00 70.33 67.31 2abk n THR 186 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2abk s ILE 188 N -1.27 3.79 0.07 0.00 -4.36 -1.19 -4.66 121.20 113.58 2abk s ILE 188 Ca 0.56 0.69 -0.37 0.00 -0.26 0.00 0.00 60.65 61.28 2abk s ILE 188 Cb 0.24 -3.30 -0.19 0.00 1.25 0.00 0.00 42.46 40.46 2abk s ILE 188 CO -0.13 -0.66 1.56 0.00 0.24 0.00 0.00 174.94 175.96 2abk h ALA 189 N -0.33 -1.25 -2.30 2.27 0.00 -1.93 -3.27 119.26 112.45 2abk h ALA 189 Ca -0.45 -0.24 -0.62 0.00 0.00 0.00 0.00 54.91 53.60 2abk h ALA 189 Cb 1.22 0.64 -0.12 0.00 0.00 0.00 0.00 17.79 19.53 2abk h ALA 189 CO 0.56 -1.22 0.21 1.03 0.00 0.00 0.00 179.25 179.83 2abk s ARG 190 N -5.89 3.77 -0.45 0.00 0.52 -1.26 -4.57 118.95 111.06 2abk s ARG 190 Ca -0.19 0.21 -0.16 0.00 -0.52 0.00 0.00 55.73 55.07 2abk s ARG 190 Cb 0.03 -3.78 0.02 0.00 0.52 0.00 0.00 34.95 31.74 2abk s ARG 190 CO 0.60 -0.72 0.61 1.17 0.02 0.00 0.00 175.30 176.98 2abk n LYS 191 N 6.10 -2.29 -1.54 3.54 4.81 -1.26 -4.98 118.16 122.53 2abk n LYS 191 Ca 0.00 2.05 -0.40 0.00 -0.87 0.00 0.00 58.31 59.10 2abk n LYS 191 Cb 0.49 -5.54 0.03 0.00 0.02 0.00 0.00 35.03 30.02 2abk n LYS 191 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2abk n PRO 192 N -0.41 0.85 -1.81 1.64 -0.04 -1.23 -4.71 135.00 129.30 2abk n PRO 192 Ca 0.10 0.32 -0.35 0.00 -0.04 0.00 0.00 63.50 63.53 2abk n PRO 192 Cb 0.47 -1.86 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 2abk n PRO 192 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2abk n ARG 193 N -0.07 3.71 -0.24 0.54 1.74 0.15 -4.68 116.66 117.81 2abk n ARG 193 Ca 0.11 -3.05 0.07 0.00 -0.77 0.00 0.00 57.85 54.21 2abk n ARG 193 Cb 0.43 -2.42 0.33 0.00 -1.02 0.00 0.00 32.46 29.78 2abk n ARG 193 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2abk n GLY 195 N -1.43 -1.14 0.10 0.00 0.00 -1.26 -2.26 105.19 99.20 2abk n GLY 195 Ca 0.13 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.29 2abk n GLY 195 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2abk n SER 196 N -2.05 2.03 -4.71 1.61 3.41 -0.72 -5.03 113.62 108.16 2abk n SER 196 Ca 0.02 -2.79 -0.39 0.00 -0.26 0.00 0.00 58.87 55.44 2abk n SER 196 Cb 0.19 -0.34 -0.05 0.00 -0.26 0.00 0.00 64.21 63.75 2abk n SER 196 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2abk h ILE 198 N 4.78 0.00 -0.14 0.00 3.07 -1.92 -2.51 117.51 120.80 2abk h ILE 198 Ca -0.40 -0.27 -0.02 0.00 1.55 0.00 0.00 64.86 65.73 2abk h ILE 198 Cb 1.19 1.08 -0.01 0.00 -0.27 0.00 0.00 36.82 38.81 2abk h ILE 198 CO 0.76 0.00 -0.03 2.30 -1.05 0.00 0.00 178.15 180.13 2abk n ILE 199 N -2.60 2.13 -0.20 0.16 -5.35 -1.26 -4.81 119.36 107.44 2abk n ILE 199 Ca 0.01 -2.19 -0.01 0.00 -0.27 0.00 0.00 62.75 60.28 2abk n ILE 199 Cb 0.21 -0.25 0.10 0.00 -1.74 0.00 0.00 39.64 37.95 2abk n ILE 199 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2abk h GLU 200 N 0.91 0.46 0.00 6.28 4.22 -1.75 -0.54 114.58 124.16 2abk h GLU 200 Ca 0.02 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.43 2abk h GLU 200 Cb 1.25 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2abk h GLU 200 CO 0.13 0.30 0.00 -0.40 -2.18 0.00 0.00 179.01 176.86 2abk n ASP 201 N -4.94 0.00 -0.01 1.04 5.75 -1.26 -2.39 116.55 114.75 2abk n ASP 201 Ca 0.08 0.36 0.11 0.00 -0.01 0.00 0.00 54.79 55.33 2abk n ASP 201 Cb 0.23 -0.44 -0.16 0.00 -1.03 0.00 0.00 41.12 39.72 2abk n ASP 201 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2abk n LEU 202 N -1.44 0.09 -4.72 -2.12 4.77 -0.35 -4.98 117.00 108.25 2abk n LEU 202 Ca 0.06 -0.05 -0.42 0.00 -0.03 0.00 0.00 56.01 55.57 2abk n LEU 202 Cb 0.20 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 2abk n LEU 202 CO 0.16 0.02 0.97 0.00 -1.33 0.00 0.00 177.39 177.21 2abk n GLU 204 N 3.58 3.79 -2.02 0.00 1.02 -0.92 -4.96 120.64 121.12 2abk n GLU 204 Ca 0.09 -2.26 -0.42 0.00 -0.02 0.00 0.00 57.16 54.55 2abk n GLU 204 Cb 0.44 -2.05 -0.03 0.00 -0.02 0.00 0.00 31.44 29.79 2abk n GLU 204 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2abk s TYR 205 N -2.25 2.70 -1.06 -0.32 5.04 -1.06 -4.87 117.35 115.53 2abk s TYR 205 Ca 0.39 0.54 0.28 0.00 -2.44 0.00 0.00 57.07 55.85 2abk s TYR 205 Cb 0.30 -3.86 1.14 0.00 0.35 0.00 0.00 41.96 39.89 2abk s TYR 205 CO 0.12 -3.33 1.86 1.63 -1.34 0.00 0.00 175.55 174.48 2abk n LYS 206 N 5.14 0.06 -1.60 4.97 5.02 -1.26 -4.01 118.16 126.48 2abk n LYS 206 Ca 0.14 -0.01 -0.20 0.00 -2.02 0.00 0.00 58.31 56.23 2abk n LYS 206 Cb 0.41 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.99 2abk n LYS 206 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2abk n GLU 207 N -1.46 3.02 -1.62 1.97 -0.58 -1.26 -5.06 120.64 115.64 2abk n GLU 207 Ca 0.08 -3.81 -0.40 0.00 -0.42 0.00 0.00 57.16 52.60 2abk n GLU 207 Cb 0.33 -2.15 0.02 0.00 -0.57 0.00 0.00 31.44 29.07 2abk n GLU 207 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2abk n LYS 208 N -0.84 1.28 -0.04 3.49 5.02 -1.26 -5.01 118.16 120.80 2abk n LYS 208 Ca 0.43 0.46 -0.04 0.00 -2.02 0.00 0.00 58.31 57.15 2abk n LYS 208 Cb 0.90 -2.11 -0.01 0.00 -0.02 0.00 0.00 35.03 33.79 2abk n LYS 208 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2abk n VAL 209 N -0.83 0.65 -1.03 -0.18 0.24 -1.26 -4.64 118.33 111.28 2abk n VAL 209 Ca 0.10 0.35 -0.24 0.00 -2.04 0.00 0.00 64.34 62.51 2abk n VAL 209 Cb 0.42 -1.88 0.07 0.00 -1.47 0.00 0.00 33.84 30.98 2abk n VAL 209 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2abk n ASP 210 N -3.34 6.45 0.00 -1.34 5.75 -1.26 -4.98 116.55 117.82 2abk n ASP 210 Ca -0.06 -3.39 0.00 0.00 -0.01 0.00 0.00 54.79 51.34 2abk n ASP 210 Cb 0.21 -0.97 0.00 0.00 -1.03 0.00 0.00 41.12 39.33 2abk n ASP 210 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71