#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a6v s ALA 2 N 0.00 2.80 -0.05 0.00 0.00 -1.26 -5.07 121.76 118.18 1a6v s ALA 2 Ca 0.00 0.16 0.02 0.00 0.00 0.00 0.00 51.96 52.14 1a6v s ALA 2 Cb 0.00 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.96 1a6v s ALA 2 CO 0.00 -0.92 -0.10 0.08 0.00 0.00 0.00 175.76 174.82 1a6v s VAL 3 N -2.85 0.93 -0.21 0.00 1.01 -1.26 -5.01 120.40 113.01 1a6v s VAL 3 Ca 0.59 -0.39 -0.04 0.00 0.00 0.00 0.00 61.98 62.14 1a6v s VAL 3 Cb -0.14 -0.85 -0.01 0.00 0.00 0.00 0.00 36.38 35.38 1a6v s VAL 3 CO 0.47 0.30 -0.04 -0.69 0.00 0.00 0.00 175.10 175.14 1a6v s VAL 4 N 0.51 3.46 -0.13 2.92 1.01 -1.26 -1.84 120.40 125.07 1a6v s VAL 4 Ca -0.09 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 1a6v s VAL 4 Cb -0.13 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 1a6v s VAL 4 CO 0.02 0.43 -0.10 -0.89 0.00 0.00 0.00 175.10 174.56 1a6v s THR 5 N 1.33 3.35 0.24 3.92 2.01 0.13 -3.49 115.64 123.13 1a6v s THR 5 Ca 0.04 -0.56 0.04 0.00 0.31 0.00 0.00 61.69 61.52 1a6v s THR 5 Cb -0.14 -2.42 -0.05 0.00 0.01 0.00 0.00 72.50 69.89 1a6v s THR 5 CO -0.02 0.52 -0.02 -1.10 -0.69 0.00 0.00 174.62 173.31 1a6v s GLN 6 N 0.20 1.38 0.39 4.92 -0.21 -1.26 -1.06 119.66 124.02 1a6v s GLN 6 Ca -0.06 -1.69 -0.27 0.00 0.02 0.00 0.00 55.36 53.37 1a6v s GLN 6 Cb -0.15 -0.76 -0.09 0.00 1.00 0.00 0.00 33.01 33.01 1a6v s GLN 6 CO 0.04 -0.05 1.30 -1.21 -2.12 0.00 0.00 175.29 173.25 1a6v s GLU 7 N -3.82 4.06 0.17 2.91 8.01 -1.26 -4.85 118.70 123.92 1a6v s GLU 7 Ca 0.28 2.15 -0.10 0.00 0.01 0.00 0.00 54.97 57.31 1a6v s GLU 7 Cb 0.05 -2.82 0.04 0.00 -4.31 0.00 0.00 34.13 27.09 1a6v s GLU 7 CO 0.09 -0.42 1.61 0.66 0.01 0.00 0.00 175.26 177.21 1a6v h SER 8 N 2.83 1.03 -3.99 -0.19 4.64 -1.95 -3.33 113.55 112.58 1a6v h SER 8 Ca -0.49 -0.33 -0.03 0.00 -0.47 0.00 0.00 61.79 60.46 1a6v h SER 8 Cb 1.24 -0.28 -0.21 0.00 -0.31 0.00 0.00 62.40 62.84 1a6v h SER 8 CO 0.63 1.12 0.15 0.00 -0.87 0.00 0.00 176.83 177.87 1a6v s ALA 9 N -4.92 -1.79 0.03 5.18 0.00 -1.26 -1.56 121.76 117.43 1a6v s ALA 9 Ca -0.12 1.99 0.07 0.00 0.00 0.00 0.00 51.96 53.90 1a6v s ALA 9 Cb 0.13 -1.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.08 1a6v s ALA 9 CO 0.86 -0.33 -0.20 -0.51 0.00 0.00 0.00 175.76 175.57 1a6v s LEU 10 N 0.30 2.13 -0.04 0.00 1.43 -0.17 -4.92 118.68 117.41 1a6v s LEU 10 Ca -0.00 -0.48 0.05 0.00 -1.03 0.00 0.00 54.13 52.67 1a6v s LEU 10 Cb -0.05 -0.96 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 1a6v s LEU 10 CO 0.01 0.17 -0.19 -0.89 0.23 0.00 0.00 176.35 175.68 1a6v s THR 11 N -0.72 2.63 0.21 5.49 2.01 -1.26 -1.90 115.64 122.11 1a6v s THR 11 Ca 0.07 -0.88 0.05 0.00 0.31 0.00 0.00 61.69 61.24 1a6v s THR 11 Cb -0.08 -1.99 -0.02 0.00 0.01 0.00 0.00 72.50 70.41 1a6v s THR 11 CO 0.01 0.58 0.17 1.07 -0.69 0.00 0.00 174.62 175.77 1a6v n THR 12 N 2.45 0.00 -3.96 -0.82 5.66 -0.58 -4.97 114.28 112.06 1a6v n THR 12 Ca -0.17 -1.53 -0.09 0.00 -3.05 0.00 0.00 64.05 59.21 1a6v n THR 12 Cb 0.52 0.75 -0.11 0.00 -1.55 0.00 0.00 70.33 69.93 1a6v n THR 12 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1a6v s SER 13 N -2.47 0.20 0.38 1.09 0.15 -1.26 0.66 113.70 112.46 1a6v s SER 13 Ca 0.24 -0.43 -0.27 0.00 0.70 0.00 0.00 55.95 56.19 1a6v s SER 13 Cb 0.01 0.09 -0.11 0.00 -1.71 0.00 0.00 66.02 64.31 1a6v s SER 13 CO 0.17 -0.27 1.42 -0.81 1.20 0.00 0.00 173.24 174.95 1a6v n PRO 14 N 1.77 2.43 -0.91 5.44 -0.04 -1.26 -2.56 135.00 139.88 1a6v n PRO 14 Ca -0.23 0.85 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 1a6v n PRO 14 Cb 0.56 -2.56 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 1a6v n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1a6v n GLY 15 N 0.57 0.92 3.95 0.55 0.00 -0.85 -4.92 105.19 105.41 1a6v n GLY 15 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1a6v n GLY 15 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1a6v n GLU 16 N -2.00 0.14 -4.79 1.61 4.07 -1.06 -4.40 120.64 114.21 1a6v n GLU 16 Ca 0.00 -2.91 -0.30 0.00 -0.06 0.00 0.00 57.16 53.89 1a6v n GLU 16 Cb 0.00 -0.52 -0.14 0.00 -0.06 0.00 0.00 31.44 30.72 1a6v n GLU 16 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 1a6v s THR 17 N -2.96 2.16 -0.03 6.31 2.01 -1.26 0.03 115.64 121.91 1a6v s THR 17 Ca 0.65 -1.47 -0.07 0.00 0.31 0.00 0.00 61.69 61.10 1a6v s THR 17 Cb -0.04 -1.87 0.01 0.00 0.01 0.00 0.00 72.50 70.61 1a6v s THR 17 CO 0.43 0.30 0.16 0.54 -0.69 0.00 0.00 174.62 175.36 1a6v s VAL 18 N -0.86 0.05 -0.05 3.82 0.11 0.01 -4.99 120.40 118.48 1a6v s VAL 18 Ca 0.12 -0.40 0.04 0.00 -2.93 0.00 0.00 61.98 58.81 1a6v s VAL 18 Cb -0.10 -0.37 -0.00 0.00 -1.53 0.00 0.00 36.38 34.37 1a6v s VAL 18 CO 0.03 -0.22 -0.18 -0.89 -3.33 0.00 0.00 175.10 170.51 1a6v s THR 19 N -0.79 1.50 0.01 5.04 2.01 -1.26 -0.67 115.64 121.49 1a6v s THR 19 Ca -0.09 -0.75 0.05 0.00 0.31 0.00 0.00 61.69 61.22 1a6v s THR 19 Cb -0.05 -1.29 -0.03 0.00 0.01 0.00 0.00 72.50 71.14 1a6v s THR 19 CO 0.01 0.43 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.47 1a6v s LEU 20 N 0.07 2.79 0.18 4.42 1.02 0.03 -4.97 118.68 122.23 1a6v s LEU 20 Ca -0.05 -0.30 0.08 0.00 0.02 0.00 0.00 54.13 53.87 1a6v s LEU 20 Cb -0.12 -1.62 -0.04 0.00 0.02 0.00 0.00 46.19 44.43 1a6v s LEU 20 CO 0.03 0.28 -0.15 0.42 0.02 0.00 0.00 176.35 176.94 1a6v s THR 21 N -0.91 1.71 -0.14 5.49 -4.23 -1.26 -0.31 115.64 115.98 1a6v s THR 21 Ca 0.15 -2.07 -0.01 0.00 -1.18 0.00 0.00 61.69 58.58 1a6v s THR 21 Cb -0.11 -1.92 0.04 0.00 1.34 0.00 0.00 72.50 71.85 1a6v s THR 21 CO 0.05 -0.50 -0.01 0.00 -0.54 0.00 0.00 174.62 173.62 1a6v s ARG 23 N 1.80 2.86 -0.08 0.00 3.00 -0.22 -1.60 118.95 124.71 1a6v s ARG 23 Ca 0.02 -0.51 -0.00 0.00 0.00 0.00 0.00 55.73 55.24 1a6v s ARG 23 Cb -0.15 -2.71 -0.03 0.00 0.00 0.00 0.00 34.95 32.07 1a6v s ARG 23 CO -0.07 0.67 -0.05 -1.12 0.00 0.00 0.00 175.30 174.72 1a6v s SER 24 N -1.12 4.76 0.00 0.23 0.01 -1.26 -0.69 113.70 115.63 1a6v s SER 24 Ca 0.15 -0.00 0.20 0.00 1.31 0.00 0.00 55.95 57.61 1a6v s SER 24 Cb -0.11 -1.29 0.88 0.00 0.21 0.00 0.00 66.02 65.72 1a6v s SER 24 CO 0.05 0.35 1.63 -1.54 0.41 0.00 0.00 173.24 174.14 1a6v n SER 25 N 2.34 0.00 0.00 2.44 3.41 -0.77 -3.80 113.62 117.24 1a6v n SER 25 Ca -0.18 0.38 -0.01 0.00 -0.26 0.00 0.00 58.87 58.80 1a6v n SER 25 Cb 0.53 -0.45 -0.00 0.00 -0.26 0.00 0.00 64.21 64.03 1a6v n SER 25 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1a6v h THR 26 N 0.00 0.00 -0.13 6.66 1.35 -1.95 -3.48 112.91 115.36 1a6v h THR 26 Ca 0.00 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1a6v h THR 26 Cb 0.30 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.72 1a6v h THR 26 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1a6v n GLY 27 N 1.64 1.14 3.58 5.82 0.00 -1.25 -5.14 105.19 110.98 1a6v n GLY 27 Ca -0.01 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 1a6v n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6v n ALA 28 N -3.00 -1.02 -2.73 4.61 0.00 -1.26 -4.43 120.51 112.69 1a6v n ALA 28 Ca 0.00 -0.41 -0.35 0.00 0.00 0.00 0.00 53.44 52.68 1a6v n ALA 28 Cb 0.00 -2.06 -0.09 0.00 0.00 0.00 0.00 19.45 17.30 1a6v n ALA 28 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1a6v s VAL 29 N -2.21 4.47 0.24 0.00 1.01 -0.12 -4.98 120.40 118.81 1a6v s VAL 29 Ca 0.67 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.48 1a6v s VAL 29 Cb -0.28 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 1a6v s VAL 29 CO 0.57 0.60 0.18 0.28 0.00 0.00 0.00 175.10 176.72 1a6v s THR 30 N -0.79 0.00 0.62 3.92 -1.32 -1.26 -4.35 115.64 112.46 1a6v s THR 30 Ca 0.12 -1.99 0.24 0.00 -1.21 0.00 0.00 61.69 58.85 1a6v s THR 30 Cb -0.12 -2.50 0.31 0.00 -1.51 0.00 0.00 72.50 68.69 1a6v s THR 30 CO 0.02 0.00 1.57 0.74 -2.21 0.00 0.00 174.62 174.74 1a6v h THR 31 N 2.47 0.12 0.00 5.08 2.02 -1.99 -0.17 112.91 120.45 1a6v h THR 31 Ca -0.33 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.85 1a6v h THR 31 Cb 1.24 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1a6v h THR 31 CO 0.48 0.00 0.00 0.77 0.37 0.00 0.00 175.52 177.14 1a6v h SER 32 N 0.00 0.00 1.06 4.18 4.64 -1.98 -3.28 113.55 118.16 1a6v h SER 32 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1a6v h SER 32 Cb 1.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.88 1a6v h SER 32 CO -0.00 0.00 -0.58 0.78 -0.87 0.00 0.00 176.83 176.15 1a6v h ASN 33 N 0.00 0.00 -4.96 4.97 4.21 -1.27 -3.48 115.58 115.05 1a6v h ASN 33 Ca 0.00 -0.13 -0.20 0.00 1.21 0.00 0.00 56.30 57.18 1a6v h ASN 33 Cb 0.64 0.00 0.16 0.00 -1.12 0.00 0.00 38.32 38.00 1a6v h ASN 33 CO 0.00 0.06 -0.68 -1.22 -1.29 0.00 0.00 177.43 174.30 1a6v n TYR 34 N -2.33 -1.96 -1.66 1.19 4.01 -1.24 -0.18 117.16 114.99 1a6v n TYR 34 Ca 0.03 0.69 -0.44 0.00 -0.16 0.00 0.00 57.90 58.02 1a6v n TYR 34 Cb 0.47 -3.85 -0.04 0.00 -0.31 0.00 0.00 39.34 35.61 1a6v n TYR 34 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1a6v n ALA 35 N -2.93 1.39 -2.92 -0.72 0.00 -1.26 -4.63 120.51 109.44 1a6v n ALA 35 Ca -0.07 0.18 -0.30 0.00 0.00 0.00 0.00 53.44 53.25 1a6v n ALA 35 Cb 0.60 -2.65 -0.16 0.00 0.00 0.00 0.00 19.45 17.23 1a6v n ALA 35 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1a6v s ASN 36 N 4.81 2.76 -0.20 0.00 3.04 -0.95 -1.78 114.94 122.62 1a6v s ASN 36 Ca 0.92 -0.47 -0.05 0.00 0.04 0.00 0.00 52.86 53.30 1a6v s ASN 36 Cb -0.51 -0.89 -0.03 0.00 -1.54 0.00 0.00 41.25 38.29 1a6v s ASN 36 CO 0.44 0.19 0.01 0.26 -3.04 0.00 0.00 177.10 174.97 1a6v s TRP 37 N 0.04 3.07 -0.06 0.43 0.52 -1.16 -1.21 118.94 120.56 1a6v s TRP 37 Ca -0.07 -0.37 0.02 0.00 0.02 0.00 0.00 56.10 55.70 1a6v s TRP 37 Cb -0.14 -2.09 -0.03 0.00 -1.15 0.00 0.00 33.47 30.06 1a6v s TRP 37 CO 0.04 -0.19 -0.11 0.08 0.02 0.00 0.00 176.95 176.80 1a6v s VAL 38 N 0.94 3.34 -0.19 4.03 1.01 0.22 -1.30 120.40 128.45 1a6v s VAL 38 Ca 0.02 -0.61 -0.05 0.00 0.00 0.00 0.00 61.98 61.33 1a6v s VAL 38 Cb -0.14 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 1a6v s VAL 38 CO 0.02 0.59 -0.00 -1.58 0.00 0.00 0.00 175.10 174.13 1a6v s GLN 39 N -0.69 3.64 -0.21 2.72 0.74 0.04 0.48 119.66 126.38 1a6v s GLN 39 Ca 0.10 -0.51 -0.04 0.00 0.05 0.00 0.00 55.36 54.96 1a6v s GLN 39 Cb -0.11 -3.07 -0.01 0.00 1.10 0.00 0.00 33.01 30.92 1a6v s GLN 39 CO 0.01 0.05 -0.03 -2.00 -0.55 0.00 0.00 175.29 172.77 1a6v s GLU 40 N 0.89 3.44 0.08 1.67 2.12 -0.27 -0.61 118.70 126.03 1a6v s GLU 40 Ca 0.01 -0.60 0.01 0.00 0.36 0.00 0.00 54.97 54.75 1a6v s GLU 40 Cb -0.14 -3.01 -0.04 0.00 0.26 0.00 0.00 34.13 31.19 1a6v s GLU 40 CO 0.02 -0.12 0.18 0.15 -0.54 0.00 0.00 175.26 174.95 1a6v s LYS 41 N 1.30 3.27 0.07 4.30 -0.14 0.11 -1.10 119.74 127.57 1a6v s LYS 41 Ca 0.04 -0.54 -0.37 0.00 -1.36 0.00 0.00 55.97 53.74 1a6v s LYS 41 Cb -0.14 -2.94 -0.18 0.00 -1.68 0.00 0.00 37.83 32.89 1a6v s LYS 41 CO -0.01 0.58 1.07 -2.30 -0.76 0.00 0.00 175.35 173.93 1a6v n PRO 42 N 0.23 0.43 -2.05 -1.68 -0.02 -1.26 -2.69 135.00 127.96 1a6v n PRO 42 Ca -0.06 0.15 -0.01 0.00 -2.02 0.00 0.00 63.50 61.56 1a6v n PRO 42 Cb 0.52 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 1a6v n PRO 42 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1a6v n ASP 43 N 1.86 -4.16 -2.39 2.55 5.75 -1.26 -4.59 116.55 114.31 1a6v n ASP 43 Ca 0.19 0.05 -0.01 0.00 -0.01 0.00 0.00 54.79 55.00 1a6v n ASP 43 Cb 0.15 -2.60 -0.00 0.00 -1.03 0.00 0.00 41.12 37.64 1a6v n ASP 43 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1a6v n HIS 44 N -1.01 -1.87 -3.06 2.11 8.25 -1.23 -4.97 115.22 113.43 1a6v n HIS 44 Ca 0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.07 1a6v n HIS 44 Cb 0.39 -1.16 -0.06 0.00 1.12 0.00 0.00 29.99 30.28 1a6v n HIS 44 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1a6v s LEU 45 N -4.85 4.09 0.19 2.41 1.43 -1.09 -4.96 118.68 115.90 1a6v s LEU 45 Ca 0.00 0.82 0.09 0.00 -1.03 0.00 0.00 54.13 54.01 1a6v s LEU 45 Cb 0.00 -2.94 -0.04 0.00 0.03 0.00 0.00 46.19 43.24 1a6v s LEU 45 CO 0.00 -0.37 -0.09 -0.36 0.23 0.00 0.00 176.35 175.76 1a6v s PHE 46 N 2.40 2.63 -0.29 0.29 0.40 -1.26 0.09 117.98 122.25 1a6v s PHE 46 Ca 0.29 -0.22 -0.14 0.00 -0.60 0.00 0.00 56.93 56.25 1a6v s PHE 46 Cb -0.16 -1.27 0.12 0.00 0.51 0.00 0.00 43.02 42.23 1a6v s PHE 46 CO 0.09 0.53 0.78 -0.08 0.70 0.00 0.00 175.22 177.24 1a6v s THR 47 N -1.80 -0.37 0.44 0.64 -1.32 0.22 -4.98 115.64 108.48 1a6v s THR 47 Ca 0.26 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.49 1a6v s THR 47 Cb -0.08 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.83 1a6v s THR 47 CO 0.16 0.00 1.26 -0.83 -2.21 0.00 0.00 174.62 173.00 1a6v s GLY 48 N 2.07 2.87 -0.12 6.08 0.00 -1.26 -0.78 107.32 116.18 1a6v s GLY 48 Ca -0.07 1.14 -0.04 0.00 0.00 0.00 0.00 44.72 45.75 1a6v s GLY 48 CO -0.18 1.68 -0.14 1.04 0.00 0.00 0.00 173.10 175.49 1a6v n LEU 49 N -0.22 1.46 -4.41 0.66 4.77 -0.42 -4.69 117.00 114.16 1a6v n LEU 49 Ca 0.06 0.09 -0.20 0.00 -0.03 0.00 0.00 56.01 55.93 1a6v n LEU 49 Cb 0.45 -0.37 -0.10 0.00 -2.33 0.00 0.00 43.42 41.06 1a6v n LEU 49 CO 0.53 0.38 -0.36 -0.63 -1.33 0.00 0.00 177.39 175.98 1a6v s ILE 50 N -2.23 1.52 -0.11 -0.08 -1.09 -1.22 0.15 121.20 118.13 1a6v s ILE 50 Ca -0.17 -2.11 -0.30 0.00 -2.23 0.00 0.00 60.65 55.84 1a6v s ILE 50 Cb 0.06 -2.42 0.11 0.00 -1.58 0.00 0.00 42.46 38.63 1a6v s ILE 50 CO 0.23 -0.31 0.90 -0.83 -1.23 0.00 0.00 174.94 173.70 1a6v s GLY 51 N -3.41 -0.37 -1.12 6.18 0.00 -0.56 -3.00 107.32 105.04 1a6v s GLY 51 Ca 0.29 1.73 -0.07 0.00 0.00 0.00 0.00 44.72 46.67 1a6v s GLY 51 CO 0.11 0.93 0.97 0.61 0.00 0.00 0.00 173.10 175.72 1a6v n GLY 52 N 0.66 -0.28 5.00 0.20 0.00 -1.16 -1.83 105.19 107.77 1a6v n GLY 52 Ca -0.12 0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1a6v n GLY 52 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1a6v n THR 53 N -4.51 0.00 -0.79 2.61 -1.04 -0.73 -3.88 114.28 105.94 1a6v n THR 53 Ca -0.01 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.04 1a6v n THR 53 Cb 0.56 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 69.13 1a6v n THR 53 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1a6v n ASN 54 N 0.22 1.70 -4.51 8.00 6.94 -1.25 -2.93 115.26 123.43 1a6v n ASN 54 Ca 0.00 -2.35 -0.43 0.00 -0.02 0.00 0.00 54.58 51.78 1a6v n ASN 54 Cb 0.00 -0.20 -0.08 0.00 -2.36 0.00 0.00 39.78 37.14 1a6v n ASN 54 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1a6v s ASN 55 N -1.68 6.28 0.37 0.53 0.01 -0.76 -4.70 114.94 114.98 1a6v s ASN 55 Ca 0.13 -0.39 -0.25 0.00 -0.71 0.00 0.00 52.86 51.64 1a6v s ASN 55 Cb 0.12 -2.27 -0.09 0.00 0.41 0.00 0.00 41.25 39.41 1a6v s ASN 55 CO 0.01 -0.64 1.07 -0.13 -1.51 0.00 0.00 177.10 175.90 1a6v s ARG 56 N 2.49 4.24 0.34 -0.60 0.52 -1.26 -1.50 118.95 123.18 1a6v s ARG 56 Ca 0.18 1.61 -0.26 0.00 -0.52 0.00 0.00 55.73 56.74 1a6v s ARG 56 Cb -0.15 -2.69 -0.09 0.00 0.52 0.00 0.00 34.95 32.53 1a6v s ARG 56 CO 0.16 -0.09 1.01 0.00 0.02 0.00 0.00 175.30 176.39 1a6v s ALA 57 N -1.52 3.21 0.31 2.13 0.00 0.39 -4.92 121.76 121.35 1a6v s ALA 57 Ca 0.55 0.66 -0.29 0.00 0.00 0.00 0.00 51.96 52.88 1a6v s ALA 57 Cb -0.25 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.52 1a6v s ALA 57 CO 0.32 -0.02 1.42 -2.14 0.00 0.00 0.00 175.76 175.34 1a6v s PRO 58 N -2.04 4.25 0.00 0.00 0.02 -1.26 -2.79 135.00 133.18 1a6v s PRO 58 Ca 0.51 2.36 0.00 0.00 0.02 0.00 0.00 61.00 63.89 1a6v s PRO 58 Cb -0.23 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.24 1a6v s PRO 58 CO 0.29 -0.39 0.00 0.41 -0.33 0.00 0.00 177.00 176.98 1a6v n GLY 59 N 1.32 3.00 3.63 0.52 0.00 -1.26 -5.03 105.19 107.37 1a6v n GLY 59 Ca 0.03 -0.81 -0.56 0.00 0.00 0.00 0.00 46.02 44.68 1a6v n GLY 59 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1a6v n VAL 60 N 0.00 0.09 -1.69 1.61 0.31 -1.12 -4.83 118.33 112.71 1a6v n VAL 60 Ca 0.00 -0.02 -0.44 0.00 -0.01 0.00 0.00 64.34 63.87 1a6v n VAL 60 Cb 0.00 -0.78 -0.04 0.00 -0.91 0.00 0.00 33.84 32.11 1a6v n VAL 60 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1a6v n PRO 61 N 3.39 2.45 -0.30 5.55 -0.04 -1.26 -4.85 135.00 139.93 1a6v n PRO 61 Ca 0.22 0.89 0.34 0.00 -0.04 0.00 0.00 63.50 64.91 1a6v n PRO 61 Cb 0.13 -2.71 0.58 0.00 -0.04 0.00 0.00 33.50 31.47 1a6v n PRO 61 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a6v h ALA 62 N 6.85 3.10 0.00 0.55 0.00 -1.99 -1.50 119.26 126.26 1a6v h ALA 62 Ca -0.45 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1a6v h ALA 62 Cb 1.23 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1a6v h ALA 62 CO 0.92 -1.77 0.04 2.89 0.00 0.00 0.00 179.25 181.33 1a6v n ARG 63 N -3.52 0.02 -4.09 0.00 1.85 -1.26 -4.59 116.66 105.06 1a6v n ARG 63 Ca 0.27 0.49 -0.35 0.00 -1.00 0.00 0.00 57.85 57.25 1a6v n ARG 63 Cb 1.52 -1.61 -0.08 0.00 -1.05 0.00 0.00 32.46 31.24 1a6v n ARG 63 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1a6v s PHE 64 N -3.01 3.34 -0.23 2.89 0.40 -0.57 -0.47 117.98 120.33 1a6v s PHE 64 Ca -0.00 0.28 -0.26 0.00 -0.60 0.00 0.00 56.93 56.35 1a6v s PHE 64 Cb 0.01 -1.93 0.07 0.00 0.51 0.00 0.00 43.02 41.68 1a6v s PHE 64 CO 0.03 0.47 0.70 -1.54 0.70 0.00 0.00 175.22 175.58 1a6v s SER 65 N -0.57 -0.72 0.47 1.36 1.04 -0.44 -4.98 113.70 109.86 1a6v s SER 65 Ca 0.11 1.29 0.08 0.00 0.48 0.00 0.00 55.95 57.92 1a6v s SER 65 Cb -0.12 1.28 0.03 0.00 0.10 0.00 0.00 66.02 67.31 1a6v s SER 65 CO 0.02 -0.31 0.62 -0.83 0.98 0.00 0.00 173.24 173.72 1a6v s GLY 66 N 0.09 1.90 0.00 7.32 0.00 -1.26 0.42 107.32 115.80 1a6v s GLY 66 Ca -0.02 -1.81 0.00 0.00 0.00 0.00 0.00 44.72 42.89 1a6v s GLY 66 CO 0.03 -1.57 0.00 -1.14 0.00 0.00 0.00 173.10 170.42 1a6v n SER 67 N -1.94 0.00 -4.19 1.64 3.41 -0.98 -4.59 113.62 106.97 1a6v n SER 67 Ca 0.10 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.43 1a6v n SER 67 Cb 0.60 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.39 1a6v n SER 67 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1a6v s LEU 68 N 0.00 1.98 -0.40 1.04 1.43 -1.26 -1.12 118.68 120.35 1a6v s LEU 68 Ca 0.00 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.73 1a6v s LEU 68 Cb 0.00 -1.10 0.11 0.00 0.03 0.00 0.00 46.19 45.23 1a6v s LEU 68 CO 0.00 0.20 0.14 -0.63 0.23 0.00 0.00 176.35 176.29 1a6v s ILE 69 N -0.13 2.16 0.00 -0.59 1.01 -0.66 -4.95 121.20 118.04 1a6v s ILE 69 Ca -0.01 -2.59 0.00 0.00 0.00 0.00 0.00 60.65 58.05 1a6v s ILE 69 Cb -0.11 -2.56 0.00 0.00 0.01 0.00 0.00 42.46 39.80 1a6v s ILE 69 CO 0.02 -0.70 0.00 0.61 0.00 0.00 0.00 174.94 174.87 1a6v n GLY 70 N 3.88 1.93 0.90 6.18 0.00 -1.26 -2.61 105.19 114.20 1a6v n GLY 70 Ca 0.04 -0.41 0.05 0.00 0.00 0.00 0.00 46.02 45.70 1a6v n GLY 70 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1a6v n ASN 71 N 7.00 2.57 -4.19 1.61 6.94 -1.26 -4.73 115.26 123.19 1a6v n ASN 71 Ca 0.00 -2.17 -0.15 0.00 -0.02 0.00 0.00 54.58 52.24 1a6v n ASN 71 Cb 0.00 -0.38 -0.11 0.00 -2.36 0.00 0.00 39.78 36.93 1a6v n ASN 71 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1a6v s LYS 72 N -1.64 0.88 0.27 -3.83 1.02 -1.07 -0.95 119.74 114.42 1a6v s LYS 72 Ca 0.27 -1.18 -0.24 0.00 0.02 0.00 0.00 55.97 54.84 1a6v s LYS 72 Cb 0.16 -0.60 -0.09 0.00 -0.52 0.00 0.00 37.83 36.79 1a6v s LYS 72 CO 0.14 0.10 0.85 0.00 -0.92 0.00 0.00 175.35 175.52 1a6v s ALA 73 N -2.44 3.31 -0.01 5.17 0.00 -0.63 -1.65 121.76 125.52 1a6v s ALA 73 Ca 0.06 0.38 -0.05 0.00 0.00 0.00 0.00 51.96 52.36 1a6v s ALA 73 Cb -0.03 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 20.06 1a6v s ALA 73 CO 0.01 0.24 0.11 0.00 0.00 0.00 0.00 175.76 176.11 1a6v s ALA 74 N -1.52 -0.25 -0.18 0.00 0.00 -0.28 0.03 121.76 119.55 1a6v s ALA 74 Ca 0.46 -0.06 -0.01 0.00 0.00 0.00 0.00 51.96 52.36 1a6v s ALA 74 Cb -0.19 0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.96 1a6v s ALA 74 CO 0.23 -0.16 -0.14 -1.17 0.00 0.00 0.00 175.76 174.53 1a6v s LEU 75 N -0.96 2.46 -0.14 0.00 2.96 0.58 -2.32 118.68 121.26 1a6v s LEU 75 Ca -0.10 -0.51 -0.02 0.00 -0.22 0.00 0.00 54.13 53.27 1a6v s LEU 75 Cb -0.06 -1.58 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 1a6v s LEU 75 CO 0.01 0.03 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.12 1a6v s THR 76 N 1.15 3.70 -0.17 3.68 2.01 0.17 -0.79 115.64 125.39 1a6v s THR 76 Ca 0.01 -0.43 0.01 0.00 0.31 0.00 0.00 61.69 61.58 1a6v s THR 76 Cb -0.14 -2.60 0.01 0.00 0.01 0.00 0.00 72.50 69.78 1a6v s THR 76 CO -0.05 0.51 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.58 1a6v s ILE 77 N 0.23 2.35 -0.37 1.82 1.01 0.16 -1.33 121.20 125.06 1a6v s ILE 77 Ca -0.04 -0.86 -0.05 0.00 0.00 0.00 0.00 60.65 59.70 1a6v s ILE 77 Cb -0.14 -1.99 0.08 0.00 0.01 0.00 0.00 42.46 40.42 1a6v s ILE 77 CO 0.03 0.52 0.15 0.42 0.00 0.00 0.00 174.94 176.07 1a6v s THR 78 N 1.06 3.55 0.00 2.92 -4.23 0.38 -0.81 115.64 118.50 1a6v s THR 78 Ca -0.01 -1.58 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 1a6v s THR 78 Cb -0.14 -3.20 0.00 0.00 1.34 0.00 0.00 72.50 70.50 1a6v s THR 78 CO -0.06 -0.42 0.00 0.61 -0.54 0.00 0.00 174.62 174.21 1a6v n GLY 79 N 4.72 0.88 3.66 3.99 0.00 0.10 -4.72 105.19 113.83 1a6v n GLY 79 Ca -0.09 -0.47 -0.66 0.00 0.00 0.00 0.00 46.02 44.81 1a6v n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6v n ALA 80 N -1.64 -1.71 -2.85 4.61 0.00 -0.55 -4.13 120.51 114.24 1a6v n ALA 80 Ca 0.00 0.51 -0.28 0.00 0.00 0.00 0.00 53.44 53.67 1a6v n ALA 80 Cb 0.37 -1.87 -0.05 0.00 0.00 0.00 0.00 19.45 17.90 1a6v n ALA 80 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1a6v s GLN 81 N 2.49 3.13 0.55 0.00 -1.52 -1.26 -2.01 119.66 121.04 1a6v s GLN 81 Ca 1.01 -0.67 0.37 0.00 -1.95 0.00 0.00 55.36 54.12 1a6v s GLN 81 Cb -1.44 -2.82 1.55 0.00 -0.22 0.00 0.00 33.01 30.07 1a6v s GLN 81 CO 0.77 0.54 1.80 1.79 -0.25 0.00 0.00 175.29 179.94 1a6v h THR 82 N 2.09 0.40 0.00 -0.19 1.35 -1.92 0.15 112.91 114.79 1a6v h THR 82 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 1a6v h THR 82 Cb 1.18 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 1a6v h THR 82 CO 0.68 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 175.33 1a6v n GLU 83 N -4.15 0.67 -0.14 4.72 4.71 -1.26 -2.28 120.64 122.92 1a6v n GLU 83 Ca 0.25 0.00 0.07 0.00 -0.01 0.00 0.00 57.16 57.48 1a6v n GLU 83 Cb 1.25 -1.06 0.14 0.00 -1.01 0.00 0.00 31.44 30.76 1a6v n GLU 83 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1a6v n ASP 84 N -0.56 2.80 -4.70 1.62 8.00 0.52 -4.94 116.55 119.30 1a6v n ASP 84 Ca 0.02 -1.84 -0.42 0.00 0.71 0.00 0.00 54.79 53.26 1a6v n ASP 84 Cb 0.01 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 40.90 1a6v n ASP 84 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1a6v s GLU 85 N -1.08 4.28 0.00 -1.24 2.12 -0.96 -4.72 118.70 117.10 1a6v s GLU 85 Ca 0.25 2.07 0.00 0.00 0.36 0.00 0.00 54.97 57.65 1a6v s GLU 85 Cb 0.14 -3.46 0.00 0.00 0.26 0.00 0.00 34.13 31.07 1a6v s GLU 85 CO 0.20 -0.56 0.00 0.00 -0.54 0.00 0.00 175.26 174.36 1a6v n ALA 86 N 4.92 0.00 -3.02 6.30 0.00 -0.75 -4.78 120.51 123.17 1a6v n ALA 86 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.20 1a6v n ALA 86 Cb 0.43 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.75 1a6v n ALA 86 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1a6v s ILE 87 N -2.00 4.40 -0.26 0.00 1.01 -0.26 0.18 121.20 124.28 1a6v s ILE 87 Ca 0.00 -0.15 -0.10 0.00 0.00 0.00 0.00 60.65 60.41 1a6v s ILE 87 Cb 0.00 -3.06 -0.04 0.00 0.01 0.00 0.00 42.46 39.36 1a6v s ILE 87 CO 0.00 0.33 0.14 -0.31 0.00 0.00 0.00 174.94 175.10 1a6v s TYR 88 N 1.63 3.21 0.19 3.97 1.51 0.27 -1.12 117.35 127.01 1a6v s TYR 88 Ca 0.06 0.00 0.06 0.00 -1.01 0.00 0.00 57.07 56.18 1a6v s TYR 88 Cb -0.15 -2.30 -0.04 0.00 -0.11 0.00 0.00 41.96 39.36 1a6v s TYR 88 CO 0.04 -0.14 0.14 -0.06 -1.11 0.00 0.00 175.55 174.42 1a6v s PHE 89 N 1.49 3.11 0.16 2.71 0.08 0.18 -0.14 117.98 125.56 1a6v s PHE 89 Ca 0.07 -0.06 0.06 0.00 0.12 0.00 0.00 56.93 57.12 1a6v s PHE 89 Cb -0.15 -1.46 -0.04 0.00 -0.57 0.00 0.00 43.02 40.80 1a6v s PHE 89 CO 0.07 0.52 -0.14 0.00 -0.10 0.00 0.00 175.22 175.58 1a6v s ALA 91 N -2.66 -0.85 -0.03 0.00 0.00 -0.35 -1.53 121.76 116.33 1a6v s ALA 91 Ca 0.15 0.53 0.02 0.00 0.00 0.00 0.00 51.96 52.66 1a6v s ALA 91 Cb -0.02 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.04 1a6v s ALA 91 CO 0.04 -0.25 -0.06 -0.51 0.00 0.00 0.00 175.76 174.99 1a6v s LEU 92 N -0.98 1.55 -0.50 0.00 1.43 -0.59 -2.24 118.68 117.34 1a6v s LEU 92 Ca -0.10 -0.14 -0.20 0.00 -1.03 0.00 0.00 54.13 52.66 1a6v s LEU 92 Cb -0.04 -0.45 0.05 0.00 0.03 0.00 0.00 46.19 45.78 1a6v s LEU 92 CO 0.04 -0.01 0.66 0.86 0.23 0.00 0.00 176.35 178.13 1a6v s TRP 93 N 0.57 3.02 -0.21 0.29 -0.11 0.75 0.06 118.94 123.31 1a6v s TRP 93 Ca -0.08 -0.42 -0.02 0.00 1.22 0.00 0.00 56.10 56.80 1a6v s TRP 93 Cb -0.11 -3.57 0.00 0.00 -1.50 0.00 0.00 33.47 28.29 1a6v s TRP 93 CO 0.00 -1.05 -0.09 0.71 -4.62 0.00 0.00 176.95 171.91 1a6v s TYR 94 N 2.80 2.92 0.00 5.86 1.51 -0.07 -4.59 117.35 125.78 1a6v s TYR 94 Ca 0.18 -1.16 0.00 0.00 -1.01 0.00 0.00 57.07 55.08 1a6v s TYR 94 Cb -0.18 -2.05 0.00 0.00 -0.11 0.00 0.00 41.96 39.62 1a6v s TYR 94 CO 0.14 -0.63 0.00 0.43 -1.11 0.00 0.00 175.55 174.38 1a6v n SER 95 N 4.74 0.00 -1.64 2.29 7.64 -1.26 -0.39 113.62 125.00 1a6v n SER 95 Ca -0.19 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.71 1a6v n SER 95 Cb 0.50 0.00 0.29 0.00 -1.01 0.00 0.00 64.21 63.99 1a6v n SER 95 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1a6v n ASN 96 N 2.04 4.49 -3.59 6.43 6.94 -1.26 -4.97 115.26 125.34 1a6v n ASN 96 Ca 0.00 -2.80 -0.05 0.00 -0.02 0.00 0.00 54.58 51.71 1a6v n ASN 96 Cb 0.00 -0.66 -0.02 0.00 -2.36 0.00 0.00 39.78 36.74 1a6v n ASN 96 CO 0.00 0.00 0.00 -1.38 -1.03 0.00 0.00 177.26 174.85 1a6v s HIS 97 N -2.39 -0.15 0.02 -2.53 -3.43 0.48 -5.15 115.29 102.14 1a6v s HIS 97 Ca 0.42 0.09 -0.05 0.00 -0.80 0.00 0.00 55.06 54.72 1a6v s HIS 97 Cb 0.33 0.52 -0.05 0.00 -1.43 0.00 0.00 32.58 31.95 1a6v s HIS 97 CO 0.12 -0.24 0.27 -1.58 -2.00 0.00 0.00 174.74 171.31 1a6v s TRP 98 N -2.47 3.56 -0.06 0.38 0.52 -1.26 -0.90 118.94 118.72 1a6v s TRP 98 Ca 0.09 0.53 0.03 0.00 0.02 0.00 0.00 56.10 56.76 1a6v s TRP 98 Cb -0.01 -1.96 0.01 0.00 -1.15 0.00 0.00 33.47 30.36 1a6v s TRP 98 CO -0.05 0.59 -0.12 0.08 0.02 0.00 0.00 176.95 177.47 1a6v s VAL 99 N -1.36 1.11 0.06 4.03 1.01 0.11 -4.95 120.40 120.41 1a6v s VAL 99 Ca 0.29 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1a6v s VAL 99 Cb -0.13 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 1a6v s VAL 99 CO 0.18 0.34 0.20 -0.36 0.00 0.00 0.00 175.10 175.47 1a6v s PHE 100 N 0.52 3.50 0.85 5.22 0.40 -1.26 -1.55 117.98 125.65 1a6v s PHE 100 Ca -0.11 0.24 -0.12 0.00 -0.60 0.00 0.00 56.93 56.33 1a6v s PHE 100 Cb -0.14 -1.75 0.10 0.00 0.51 0.00 0.00 43.02 41.74 1a6v s PHE 100 CO 0.03 0.58 1.13 0.20 0.70 0.00 0.00 175.22 177.87 1a6v s GLY 101 N -2.51 1.59 0.37 4.36 0.00 -0.58 -4.52 107.32 106.04 1a6v s GLY 101 Ca 0.35 -0.47 0.08 0.00 0.00 0.00 0.00 44.72 44.68 1a6v s GLY 101 CO 0.28 0.03 1.90 -1.33 0.00 0.00 0.00 173.10 173.98 1a6v h GLY 102 N -1.24 0.34 0.00 0.20 0.00 -1.89 -3.44 103.07 97.03 1a6v h GLY 102 Ca -0.48 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 46.64 1a6v h GLY 102 CO 0.62 0.19 0.00 0.61 0.00 0.00 0.00 176.54 177.97 1a6v n GLY 103 N -0.86 2.61 3.16 4.60 0.00 -1.26 -5.04 105.19 108.39 1a6v n GLY 103 Ca -0.00 -1.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 1a6v n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a6v s THR 104 N -1.58 2.37 -0.10 2.61 2.01 0.80 -4.48 115.64 117.28 1a6v s THR 104 Ca 0.00 -0.84 -0.29 0.00 0.31 0.00 0.00 61.69 60.88 1a6v s THR 104 Cb 0.00 -2.02 -0.02 0.00 0.01 0.00 0.00 72.50 70.47 1a6v s THR 104 CO 0.00 0.51 0.96 -1.59 -0.69 0.00 0.00 174.62 173.81 1a6v s LYS 105 N 1.33 4.43 -0.38 4.92 0.00 -0.60 0.95 119.74 130.39 1a6v s LYS 105 Ca 0.05 1.32 -0.05 0.00 0.00 0.00 0.00 55.97 57.28 1a6v s LYS 105 Cb -0.13 -3.53 0.08 0.00 0.00 0.00 0.00 37.83 34.25 1a6v s LYS 105 CO -0.11 -0.25 0.17 -1.17 0.00 0.00 0.00 175.35 173.99 1a6v s LEU 106 N 1.81 4.83 -0.70 2.77 2.96 0.13 -1.00 118.68 129.48 1a6v s LEU 106 Ca 0.47 -1.57 -0.21 0.00 -0.22 0.00 0.00 54.13 52.60 1a6v s LEU 106 Cb -0.18 -1.87 0.09 0.00 0.50 0.00 0.00 46.19 44.73 1a6v s LEU 106 CO 0.19 -0.46 0.94 -0.89 -1.32 0.00 0.00 176.35 174.81 1a6v s THR 107 N 1.30 4.51 0.26 3.68 2.01 -0.80 -1.82 115.64 124.78 1a6v s THR 107 Ca 0.02 -0.74 -0.30 0.00 0.31 0.00 0.00 61.69 60.99 1a6v s THR 107 Cb -0.22 -4.66 -0.09 0.00 0.01 0.00 0.00 72.50 67.54 1a6v s THR 107 CO -0.00 -1.40 1.00 0.54 -0.69 0.00 0.00 174.62 174.07 1a6v s VAL 108 N 3.50 3.86 -0.32 3.82 0.11 -1.26 -1.52 120.40 128.58 1a6v s VAL 108 Ca 0.22 1.86 -0.03 0.00 -2.93 0.00 0.00 61.98 61.10 1a6v s VAL 108 Cb -0.16 -4.18 0.00 0.00 -1.53 0.00 0.00 36.38 30.51 1a6v s VAL 108 CO 0.05 0.44 0.11 -0.11 -3.33 0.00 0.00 175.10 172.27 1a6v n LEU 109 N 1.35 -7.79 0.00 2.54 0.00 -1.02 -4.89 117.00 107.19 1a6v n LEU 109 Ca -0.02 1.21 0.00 0.00 0.00 0.00 0.00 56.01 57.21 1a6v n LEU 109 Cb 0.46 -3.28 0.00 0.00 0.00 0.00 0.00 43.42 40.61 1a6v n LEU 109 CO 0.51 -2.94 0.25 -0.62 0.00 0.00 0.00 177.39 174.59