#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vvd s LYS 2 N 0.00 3.04 -0.50 5.55 1.02 -1.26 -4.05 119.74 123.55 1vvd s LYS 2 Ca 0.00 -0.53 0.03 0.00 0.02 0.00 0.00 55.97 55.50 1vvd s LYS 2 Cb 0.00 -2.57 0.16 0.00 -0.52 0.00 0.00 37.83 34.90 1vvd s LYS 2 CO 0.00 -0.28 0.34 0.00 -0.92 0.00 0.00 175.35 174.49 1vvd s GLN 4 N -0.20 -2.77 0.38 0.00 0.00 -1.26 0.16 119.66 115.97 1vvd s GLN 4 Ca 0.25 0.00 -0.23 0.00 -0.00 0.00 0.00 55.36 55.38 1vvd s GLN 4 Cb -0.09 -1.41 -0.14 0.00 0.00 0.00 0.00 33.01 31.38 1vvd s GLN 4 CO -0.12 -4.74 0.52 -1.13 0.00 0.00 0.00 175.29 169.83 1vvd n SER 5 N -5.51 -0.99 -4.77 12.60 3.41 0.19 -4.61 113.62 113.94 1vvd n SER 5 Ca 0.14 0.95 -0.31 0.00 -0.26 0.00 0.00 58.87 59.39 1vvd n SER 5 Cb 0.60 -1.08 0.09 0.00 -0.26 0.00 0.00 64.21 63.56 1vvd n SER 5 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1vvd s PRO 6 N -1.42 2.32 0.94 4.33 0.04 -1.26 -5.03 135.00 134.91 1vvd s PRO 6 Ca 0.62 1.16 -0.13 0.00 0.04 0.00 0.00 61.00 62.69 1vvd s PRO 6 Cb -0.66 -1.90 0.16 0.00 0.04 0.00 0.00 34.50 32.13 1vvd s PRO 6 CO 0.59 -1.60 1.15 -1.25 0.04 0.00 0.00 177.00 175.93 1vvd s PRO 7 N -4.89 0.89 1.14 0.56 0.04 -1.26 -4.84 135.00 126.64 1vvd s PRO 7 Ca 0.61 0.22 -0.19 0.00 0.04 0.00 0.00 61.00 61.68 1vvd s PRO 7 Cb -0.17 -1.82 0.27 0.00 0.04 0.00 0.00 34.50 32.82 1vvd s PRO 7 CO 0.56 -2.35 1.20 -1.54 0.04 0.00 0.00 177.00 174.90 1vvd s SER 8 N -4.06 1.49 0.00 6.66 1.04 -1.26 -4.78 113.70 112.79 1vvd s SER 8 Ca 0.65 0.41 0.00 0.00 0.48 0.00 0.00 55.95 57.49 1vvd s SER 8 Cb -0.14 -0.51 0.00 0.00 0.10 0.00 0.00 66.02 65.48 1vvd s SER 8 CO 0.54 -3.75 0.00 2.30 0.98 0.00 0.00 173.24 173.30 1vvd n ILE 9 N -4.48 0.00 -1.52 -1.02 -5.35 -1.26 -5.05 119.36 100.68 1vvd n ILE 9 Ca 0.15 0.00 -0.39 0.00 -0.27 0.00 0.00 62.75 62.25 1vvd n ILE 9 Cb 0.60 0.00 -0.09 0.00 -1.74 0.00 0.00 39.64 38.41 1vvd n ILE 9 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1vvd n SER 10 N -2.36 1.35 -4.03 7.28 2.88 -1.26 -2.89 113.62 114.58 1vvd n SER 10 Ca 0.00 -0.17 -0.34 0.00 -1.33 0.00 0.00 58.87 57.04 1vvd n SER 10 Cb 0.00 -1.26 -0.03 0.00 -0.75 0.00 0.00 64.21 62.17 1vvd n SER 10 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1vvd n ASN 11 N 13.25 -1.52 -0.33 -3.46 4.13 -1.26 -3.13 115.26 122.94 1vvd n ASN 11 Ca 0.51 -1.09 0.00 0.00 1.68 0.00 0.00 54.58 55.68 1vvd n ASN 11 Cb 0.30 -1.32 0.00 0.00 -1.54 0.00 0.00 39.78 37.21 1vvd n ASN 11 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vvd n GLY 12 N -2.11 3.71 3.48 7.41 0.00 -1.14 -3.63 105.19 112.92 1vvd n GLY 12 Ca -0.17 -1.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 1vvd n GLY 12 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1vvd s ARG 13 N -0.00 1.72 0.00 1.61 3.03 -0.66 -4.32 118.95 120.32 1vvd s ARG 13 Ca 0.00 -1.59 0.00 0.00 2.03 0.00 0.00 55.73 56.17 1vvd s ARG 13 Cb 0.00 0.43 0.00 0.00 -1.03 0.00 0.00 34.95 34.35 1vvd s ARG 13 CO 0.00 -0.70 0.00 -2.39 -1.13 0.00 0.00 175.30 171.08 1vvd n HIS 14 N -0.47 0.00 -1.78 5.89 1.44 -1.26 0.25 115.22 119.29 1vvd n HIS 14 Ca 0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 1vvd n HIS 14 Cb 0.62 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.72 1vvd n HIS 14 CO 0.00 0.00 0.00 -1.71 -2.81 0.00 0.00 176.34 171.82 1vvd n ASN 15 N 0.00 -4.25 -2.56 4.39 5.15 -1.26 -4.73 115.26 111.99 1vvd n ASN 15 Ca 0.00 0.83 -0.04 0.00 -0.60 0.00 0.00 54.58 54.77 1vvd n ASN 15 Cb 0.00 -3.08 0.08 0.00 -0.53 0.00 0.00 39.78 36.25 1vvd n ASN 15 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1vvd n GLY 16 N 0.88 0.72 0.00 8.20 0.00 -1.26 -4.97 105.19 108.76 1vvd n GLY 16 Ca -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1vvd n GLY 16 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1vvd n TYR 17 N -0.72 0.00 -3.85 1.61 4.01 -1.26 -4.92 117.16 112.02 1vvd n TYR 17 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 1vvd n TYR 17 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.80 1vvd n TYR 17 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 1vvd n GLU 18 N 0.00 0.00 -0.04 -0.72 0.28 -1.26 -5.06 120.64 113.85 1vvd n GLU 18 Ca 0.00 0.00 -0.06 0.00 -0.16 0.00 0.00 57.16 56.94 1vvd n GLU 18 Cb 0.00 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.84 1vvd n GLU 18 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1vvd n ASP 19 N -0.01 2.94 -4.73 -1.84 -0.08 -1.26 -4.78 116.55 106.79 1vvd n ASP 19 Ca 0.00 -0.02 -0.37 0.00 -1.51 0.00 0.00 54.79 52.90 1vvd n ASP 19 Cb 0.00 -0.14 -0.07 0.00 2.34 0.00 0.00 41.12 43.26 1vvd n ASP 19 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 1vvd s PHE 20 N -2.15 3.47 0.00 -0.67 0.08 -1.26 0.56 117.98 118.01 1vvd s PHE 20 Ca -0.10 0.63 0.00 0.00 0.12 0.00 0.00 56.93 57.58 1vvd s PHE 20 Cb 0.03 -2.37 0.00 0.00 -0.57 0.00 0.00 43.02 40.11 1vvd s PHE 20 CO 0.16 0.23 0.15 0.66 -0.10 0.00 0.00 175.22 176.33 1vvd n TYR 21 N 3.58 0.00 0.00 0.36 4.01 0.43 -4.94 117.16 120.59 1vvd n TYR 21 Ca -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 1vvd n TYR 21 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 1vvd n TYR 21 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1vvd n THR 22 N -0.57 0.00 -3.67 -0.72 -2.24 -1.21 -4.40 114.28 101.47 1vvd n THR 22 Ca 0.00 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.64 1vvd n THR 22 Cb 0.01 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.16 1vvd n THR 22 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vvd s ASP 23 N -4.00 -0.49 0.00 3.42 -1.08 -1.26 -2.98 116.67 110.28 1vvd s ASP 23 Ca 0.00 0.74 0.00 0.00 -0.52 0.00 0.00 52.55 52.77 1vvd s ASP 23 Cb 0.00 0.76 0.00 0.00 -1.46 0.00 0.00 42.92 42.22 1vvd s ASP 23 CO 0.00 -0.35 0.00 0.61 0.52 0.00 0.00 175.17 175.95 1vvd n GLY 24 N 1.97 0.63 3.61 2.66 0.00 0.13 -4.84 105.19 109.35 1vvd n GLY 24 Ca -0.17 -0.75 -0.28 0.00 0.00 0.00 0.00 46.02 44.82 1vvd n GLY 24 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vvd s SER 25 N -2.89 3.58 0.03 1.61 0.01 -1.03 -4.97 113.70 110.03 1vvd s SER 25 Ca 0.00 -1.45 -0.05 0.00 1.31 0.00 0.00 55.95 55.76 1vvd s SER 25 Cb 0.00 -0.09 -0.01 0.00 0.21 0.00 0.00 66.02 66.13 1vvd s SER 25 CO 0.00 -0.59 0.07 -0.69 0.41 0.00 0.00 173.24 172.44 1vvd s VAL 26 N -2.89 0.12 -0.10 3.43 1.01 -1.25 -1.18 120.40 119.54 1vvd s VAL 26 Ca 0.28 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1vvd s VAL 26 Cb 0.08 -0.68 0.02 0.00 0.00 0.00 0.00 36.38 35.80 1vvd s VAL 26 CO 0.14 -0.55 -0.08 -0.69 0.00 0.00 0.00 175.10 173.92 1vvd s VAL 27 N -2.13 1.00 -0.62 2.92 1.01 -0.97 -4.70 120.40 116.91 1vvd s VAL 27 Ca -0.09 -0.30 -0.27 0.00 0.00 0.00 0.00 61.98 61.32 1vvd s VAL 27 Cb -0.04 -1.01 0.01 0.00 0.00 0.00 0.00 36.38 35.34 1vvd s VAL 27 CO -0.03 0.36 1.51 -0.89 0.00 0.00 0.00 175.10 176.05 1vvd s THR 28 N 1.51 3.64 -0.06 3.92 2.01 -1.26 0.18 115.64 125.58 1vvd s THR 28 Ca 0.01 0.46 -0.30 0.00 0.31 0.00 0.00 61.69 62.17 1vvd s THR 28 Cb -0.13 -4.43 -0.05 0.00 0.01 0.00 0.00 72.50 67.90 1vvd s THR 28 CO -0.06 -1.29 1.58 -0.31 -0.69 0.00 0.00 174.62 173.85 1vvd s TYR 29 N 6.81 2.19 0.90 4.92 1.51 -1.26 -4.59 117.35 127.82 1vvd s TYR 29 Ca 0.52 0.36 -0.15 0.00 -1.01 0.00 0.00 57.07 56.79 1vvd s TYR 29 Cb -0.11 -3.84 0.22 0.00 -0.11 0.00 0.00 41.96 38.12 1vvd s TYR 29 CO 0.21 -3.43 0.92 0.45 -1.11 0.00 0.00 175.55 172.58 1vvd n SER 30 N 6.84 -1.22 -3.82 2.29 2.88 0.70 -4.80 113.62 116.49 1vvd n SER 30 Ca 0.16 -1.14 -0.10 0.00 -1.33 0.00 0.00 58.87 56.47 1vvd n SER 30 Cb 0.43 -0.79 -0.05 0.00 -0.75 0.00 0.00 64.21 63.05 1vvd n SER 30 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vvd n ASN 32 N -0.25 1.88 -4.49 0.00 5.15 -1.24 -4.76 115.26 111.54 1vvd n ASN 32 Ca -0.10 0.98 -0.49 0.00 -0.60 0.00 0.00 54.58 54.36 1vvd n ASN 32 Cb 0.63 -1.46 -0.06 0.00 -0.53 0.00 0.00 39.78 38.35 1vvd n ASN 32 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1vvd n SER 33 N -0.30 2.40 0.00 1.20 3.41 -1.26 0.21 113.62 119.29 1vvd n SER 33 Ca 0.10 0.43 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 1vvd n SER 33 Cb 0.43 -1.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.06 1vvd n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vvd n GLY 34 N 6.23 2.81 3.72 5.00 0.00 -1.26 -5.07 105.19 116.61 1vvd n GLY 34 Ca 0.38 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 1vvd n GLY 34 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vvd s TYR 35 N -2.48 3.70 0.20 1.61 1.51 0.13 -4.73 117.35 117.30 1vvd s TYR 35 Ca 0.00 1.70 -0.29 0.00 -1.01 0.00 0.00 57.07 57.47 1vvd s TYR 35 Cb 0.00 -3.13 -0.08 0.00 -0.11 0.00 0.00 41.96 38.64 1vvd s TYR 35 CO 0.00 -0.06 0.91 0.45 -1.11 0.00 0.00 175.55 175.74 1vvd s SER 36 N 0.55 7.57 -0.74 2.29 0.15 0.85 -4.68 113.70 119.68 1vvd s SER 36 Ca 0.50 1.86 -0.23 0.00 0.70 0.00 0.00 55.95 58.78 1vvd s SER 36 Cb -0.23 -2.58 0.07 0.00 -1.71 0.00 0.00 66.02 61.56 1vvd s SER 36 CO 0.29 0.12 1.09 -0.22 1.20 0.00 0.00 173.24 175.73 1vvd s LEU 37 N -0.93 4.13 0.24 3.45 2.96 -1.25 -1.89 118.68 125.39 1vvd s LEU 37 Ca 0.41 -1.04 -0.12 0.00 -0.22 0.00 0.00 54.13 53.16 1vvd s LEU 37 Cb -0.25 -2.46 -0.08 0.00 0.50 0.00 0.00 46.19 43.91 1vvd s LEU 37 CO 0.30 -1.49 0.61 -0.63 -1.32 0.00 0.00 176.35 173.82 1vvd s ILE 38 N 4.33 4.84 0.00 6.68 -1.09 0.27 -4.79 121.20 131.44 1vvd s ILE 38 Ca 0.28 0.70 0.00 0.00 -2.23 0.00 0.00 60.65 59.40 1vvd s ILE 38 Cb -0.12 -3.65 0.00 0.00 -1.58 0.00 0.00 42.46 37.11 1vvd s ILE 38 CO 0.07 -0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.36 1vvd n GLY 39 N 0.01 0.06 3.77 6.18 0.00 -1.26 0.27 105.19 114.21 1vvd n GLY 39 Ca 0.00 -1.93 -0.39 0.00 0.00 0.00 0.00 46.02 43.70 1vvd n GLY 39 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vvd s ASN 40 N -4.00 7.20 -0.72 1.61 0.01 -1.26 -4.93 114.94 112.85 1vvd s ASN 40 Ca 0.00 1.43 -0.07 0.00 -0.71 0.00 0.00 52.86 53.51 1vvd s ASN 40 Cb 0.00 -2.44 -0.15 0.00 0.41 0.00 0.00 41.25 39.07 1vvd s ASN 40 CO 0.00 0.14 2.86 -1.54 -1.51 0.00 0.00 177.10 177.06 1vvd n SER 41 N 2.19 5.94 0.00 -1.22 3.41 -1.26 -4.39 113.62 118.29 1vvd n SER 41 Ca -0.06 -2.40 0.00 0.00 -0.26 0.00 0.00 58.87 56.15 1vvd n SER 41 Cb 0.50 -1.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.16 1vvd n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vvd n GLY 42 N 3.15 2.92 2.95 5.00 0.00 -1.25 -4.61 105.19 113.34 1vvd n GLY 42 Ca 0.52 0.04 -0.25 0.00 0.00 0.00 0.00 46.02 46.32 1vvd n GLY 42 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1vvd n VAL 43 N 0.00 0.00 -3.45 1.61 0.31 0.49 -4.50 118.33 112.79 1vvd n VAL 43 Ca 0.00 -0.38 -0.23 0.00 -0.01 0.00 0.00 64.34 63.72 1vvd n VAL 43 Cb 0.00 -1.18 -0.12 0.00 -0.91 0.00 0.00 33.84 31.63 1vvd n VAL 43 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1vvd s LEU 44 N 0.00 0.20 -0.36 7.52 2.96 -0.80 -2.28 118.68 125.92 1vvd s LEU 44 Ca 0.60 -1.22 -0.24 0.00 -0.22 0.00 0.00 54.13 53.04 1vvd s LEU 44 Cb -0.06 0.11 0.01 0.00 0.50 0.00 0.00 46.19 46.75 1vvd s LEU 44 CO 0.46 -0.38 0.84 0.00 -1.32 0.00 0.00 176.35 175.95 1vvd s SER 46 N 1.83 4.19 -0.07 0.00 0.15 -1.21 0.17 113.70 118.76 1vvd s SER 46 Ca 0.34 -2.73 -0.00 0.00 0.70 0.00 0.00 55.95 54.26 1vvd s SER 46 Cb -0.13 -1.45 -0.00 0.00 -1.71 0.00 0.00 66.02 62.73 1vvd s SER 46 CO 0.17 -0.27 0.06 0.61 1.20 0.00 0.00 173.24 175.01 1vvd n GLY 47 N 3.47 0.37 3.96 9.45 0.00 -1.23 -4.06 105.19 117.13 1vvd n GLY 47 Ca 0.05 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1vvd n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vvd n GLY 48 N -1.33 -0.43 2.69 -0.02 0.00 -1.21 -4.77 105.19 100.11 1vvd n GLY 48 Ca -0.00 0.24 -0.09 0.00 0.00 0.00 0.00 46.02 46.16 1vvd n GLY 48 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vvd n GLU 49 N -4.45 0.68 -1.69 1.61 1.02 -1.26 -5.02 120.64 111.52 1vvd n GLU 49 Ca -0.25 -2.02 -0.43 0.00 -0.02 0.00 0.00 57.16 54.44 1vvd n GLU 49 Cb 0.66 -1.46 -0.01 0.00 -0.02 0.00 0.00 31.44 30.61 1vvd n GLU 49 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22 1vvd n TRP 50 N 2.06 2.29 -3.94 -0.32 7.02 -1.26 -3.28 117.44 120.00 1vvd n TRP 50 Ca 0.14 0.49 -0.09 0.00 -1.02 0.00 0.00 57.50 57.01 1vvd n TRP 50 Cb 0.59 -2.45 -0.07 0.00 -2.42 0.00 0.00 31.31 26.96 1vvd n TRP 50 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1vvd s SER 51 N -0.03 0.08 -0.78 -0.99 0.15 -0.75 -4.93 113.70 106.45 1vvd s SER 51 Ca 0.61 -0.83 -0.02 0.00 0.70 0.00 0.00 55.95 56.40 1vvd s SER 51 Cb -0.59 0.40 -0.03 0.00 -1.71 0.00 0.00 66.02 64.09 1vvd s SER 51 CO 0.57 -0.84 0.71 0.47 1.20 0.00 0.00 173.24 175.35 1vvd n ASP 52 N -0.16 -6.76 -4.71 5.45 8.00 -1.26 -1.90 116.55 115.20 1vvd n ASP 52 Ca -0.09 -0.30 -0.38 0.00 0.71 0.00 0.00 54.79 54.72 1vvd n ASP 52 Cb 0.63 -4.80 -0.06 0.00 -0.02 0.00 0.00 41.12 36.86 1vvd n ASP 52 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1vvd s PRO 53 N -3.53 4.33 0.77 -0.24 0.04 -1.26 -4.42 135.00 130.69 1vvd s PRO 53 Ca 0.17 0.47 -0.12 0.00 0.04 0.00 0.00 61.00 61.57 1vvd s PRO 53 Cb -0.02 -3.45 0.06 0.00 0.04 0.00 0.00 34.50 31.12 1vvd s PRO 53 CO 0.67 0.11 1.15 -1.25 0.04 0.00 0.00 177.00 177.71 1vvd s PRO 54 N 0.77 2.26 0.05 0.56 0.04 -1.26 -4.77 135.00 132.66 1vvd s PRO 54 Ca 0.26 0.21 0.03 0.00 0.04 0.00 0.00 61.00 61.55 1vvd s PRO 54 Cb -0.15 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 1vvd s PRO 54 CO 0.11 -1.40 0.01 0.95 0.04 0.00 0.00 177.00 176.71 1vvd s THR 55 N -3.50 4.16 -0.92 1.26 -4.23 0.75 -4.66 115.64 108.51 1vvd s THR 55 Ca 0.61 -0.80 -0.02 0.00 -1.18 0.00 0.00 61.69 60.29 1vvd s THR 55 Cb -0.11 -2.94 0.24 0.00 1.34 0.00 0.00 72.50 71.03 1vvd s THR 55 CO 0.50 0.22 0.90 0.00 -0.54 0.00 0.00 174.62 175.69 1vvd n GLN 57 N 2.07 2.16 -4.14 0.00 10.64 -0.79 -4.66 117.38 122.65 1vvd n GLN 57 Ca 0.23 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 55.05 1vvd n GLN 57 Cb 0.37 0.00 -0.09 0.00 -0.86 0.00 0.00 30.24 29.66 1vvd n GLN 57 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 1vvd s ILE 58 N 0.01 4.66 -0.34 -0.39 1.09 -1.26 0.29 121.20 125.27 1vvd s ILE 58 Ca 0.00 -0.10 0.08 0.00 -1.10 0.00 0.00 60.65 59.54 1vvd s ILE 58 Cb 0.00 -3.04 0.45 0.00 -1.06 0.00 0.00 42.46 38.81 1vvd s ILE 58 CO 0.00 0.53 1.15 1.33 -0.10 0.00 0.00 174.94 177.85 1vvd n VAL 59 N 2.85 2.29 -2.67 2.92 0.24 -1.26 -3.25 118.33 119.45 1vvd n VAL 59 Ca -0.18 -4.28 -0.42 0.00 -2.04 0.00 0.00 64.34 57.42 1vvd n VAL 59 Cb 0.53 -0.88 -0.03 0.00 -1.47 0.00 0.00 33.84 31.99 1vvd n VAL 59 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1vvd s LYS 60 N -3.57 3.30 0.83 7.34 1.02 -1.26 -1.41 119.74 125.98 1vvd s LYS 60 Ca 0.47 -0.74 -0.11 0.00 0.02 0.00 0.00 55.97 55.61 1vvd s LYS 60 Cb 0.40 -4.54 0.09 0.00 -0.52 0.00 0.00 37.83 33.26 1vvd s LYS 60 CO -0.04 -2.04 1.09 0.00 -0.92 0.00 0.00 175.35 173.44 1vvd n PRO 62 N -3.68 0.00 -3.64 0.00 -0.04 -1.26 -4.20 135.00 122.18 1vvd n PRO 62 Ca 0.08 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.46 1vvd n PRO 62 Cb 0.54 -0.18 -0.07 0.00 -0.04 0.00 0.00 33.50 33.75 1vvd n PRO 62 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1vvd s HIS 63 N 0.00 -0.91 -1.43 0.54 3.76 -1.26 -4.77 115.29 111.22 1vvd s HIS 63 Ca 0.00 1.91 -0.13 0.00 -0.15 0.00 0.00 55.06 56.69 1vvd s HIS 63 Cb 0.00 0.50 -0.03 0.00 1.11 0.00 0.00 32.58 34.16 1vvd s HIS 63 CO 0.00 -0.45 2.47 -0.35 -0.85 0.00 0.00 174.74 175.56 1vvd n PRO 64 N 3.76 3.01 -2.09 8.40 -0.04 -1.26 -4.92 135.00 141.86 1vvd n PRO 64 Ca -0.18 -2.32 -0.28 0.00 -0.04 0.00 0.00 63.50 60.68 1vvd n PRO 64 Cb 0.58 -3.03 0.15 0.00 -0.04 0.00 0.00 33.50 31.15 1vvd n PRO 64 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1vvd s THR 65 N 2.98 2.06 -0.16 0.52 -4.23 -1.26 -4.59 115.64 110.96 1vvd s THR 65 Ca 0.56 -0.15 -0.35 0.00 -1.18 0.00 0.00 61.69 60.57 1vvd s THR 65 Cb 0.15 -2.91 0.14 0.00 1.34 0.00 0.00 72.50 71.22 1vvd s THR 65 CO -0.06 0.00 1.29 -0.51 -0.54 0.00 0.00 174.62 174.80 1vvd s ILE 66 N -3.63 0.00 -0.49 2.99 2.07 -1.26 -4.74 121.20 116.14 1vvd s ILE 66 Ca 0.69 -0.06 -0.28 0.00 -1.41 0.00 0.00 60.65 59.59 1vvd s ILE 66 Cb -0.06 -1.34 0.01 0.00 0.13 0.00 0.00 42.46 41.21 1vvd s ILE 66 CO 0.50 0.00 1.40 -0.44 -1.91 0.00 0.00 174.94 174.49 1vvd s SER 67 N -2.42 6.24 -1.49 4.50 0.01 -1.26 -3.87 113.70 115.42 1vvd s SER 67 Ca 0.12 0.54 -0.17 0.00 1.31 0.00 0.00 55.95 57.75 1vvd s SER 67 Cb 0.01 -2.54 0.16 0.00 0.21 0.00 0.00 66.02 63.86 1vvd s SER 67 CO -0.04 -1.56 0.55 0.59 0.41 0.00 0.00 173.24 173.19 1vvd n ASN 68 N 9.16 -2.44 -1.09 2.44 4.13 -1.26 -2.72 115.26 123.48 1vvd n ASN 68 Ca 0.14 -0.81 0.01 0.00 1.68 0.00 0.00 54.58 55.61 1vvd n ASN 68 Cb 0.49 -2.07 -0.00 0.00 -1.54 0.00 0.00 39.78 36.65 1vvd n ASN 68 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vvd n GLY 69 N -1.09 0.79 2.55 7.41 0.00 -1.25 0.25 105.19 113.85 1vvd n GLY 69 Ca 0.07 -0.43 -0.05 0.00 0.00 0.00 0.00 46.02 45.61 1vvd n GLY 69 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1vvd n TYR 70 N 0.25 -1.64 -4.19 1.61 4.11 -1.26 -3.31 117.16 112.74 1vvd n TYR 70 Ca -0.02 0.35 -0.25 0.00 -0.00 0.00 0.00 57.90 57.97 1vvd n TYR 70 Cb 0.91 -1.22 -0.07 0.00 -0.00 0.00 0.00 39.34 38.96 1vvd n TYR 70 CO 0.00 0.00 0.00 -0.48 -0.00 0.00 0.00 176.86 176.38 1vvd s LEU 71 N 0.00 3.45 -0.01 -3.48 -0.00 -1.26 0.31 118.68 117.69 1vvd s LEU 71 Ca 0.12 -0.37 0.01 0.00 -0.00 0.00 0.00 54.13 53.89 1vvd s LEU 71 Cb -0.02 -2.05 0.02 0.00 -0.00 0.00 0.00 46.19 44.13 1vvd s LEU 71 CO 0.10 0.05 0.74 -0.24 -0.00 0.00 0.00 176.35 177.00 1vvd n SER 72 N -0.43 0.71 0.00 1.48 2.88 -0.96 -4.74 113.62 112.56 1vvd n SER 72 Ca -0.09 -1.53 0.00 0.00 -1.33 0.00 0.00 58.87 55.92 1vvd n SER 72 Cb 0.56 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.97 1vvd n SER 72 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1vvd n SER 73 N -0.23 0.00 -3.38 -3.46 7.64 -1.26 -4.91 113.62 108.02 1vvd n SER 73 Ca 0.01 0.01 -0.26 0.00 1.01 0.00 0.00 58.87 59.64 1vvd n SER 73 Cb 0.46 -0.02 -0.10 0.00 -1.01 0.00 0.00 64.21 63.54 1vvd n SER 73 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1vvd s GLY 74 N -1.04 0.88 0.28 0.23 0.00 -1.26 -5.02 107.32 101.39 1vvd s GLY 74 Ca 0.00 -2.06 0.04 0.00 0.00 0.00 0.00 44.72 42.70 1vvd s GLY 74 CO 0.00 2.23 0.41 -0.12 0.00 0.00 0.00 173.10 175.62 1vvd s PHE 75 N 0.53 3.40 0.08 1.90 2.19 -1.26 -4.73 117.98 120.08 1vvd s PHE 75 Ca 0.27 0.01 -0.17 0.00 0.33 0.00 0.00 56.93 57.37 1vvd s PHE 75 Cb -0.07 -1.71 0.04 0.00 -1.31 0.00 0.00 43.02 39.97 1vvd s PHE 75 CO -0.11 0.30 0.41 0.21 1.83 0.00 0.00 175.22 177.86 1vvd s LYS 76 N -4.08 0.98 0.53 10.12 2.20 -1.26 -5.01 119.74 123.22 1vvd s LYS 76 Ca 0.37 -0.50 0.27 0.00 -0.36 0.00 0.00 55.97 55.76 1vvd s LYS 76 Cb -0.09 0.44 1.42 0.00 -1.51 0.00 0.00 37.83 38.08 1vvd s LYS 76 CO 0.31 -0.36 1.96 0.00 -0.36 0.00 0.00 175.35 176.89 1vvd h ARG 77 N 2.75 0.01 -4.50 4.03 3.08 -2.00 -3.43 114.38 114.33 1vvd h ARG 77 Ca -0.32 -0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.48 1vvd h ARG 77 Cb 1.23 -0.00 -0.14 0.00 0.08 0.00 0.00 29.97 31.13 1vvd h ARG 77 CO 0.45 0.01 -0.52 -1.54 -1.07 0.00 0.00 179.97 177.29 1vvd s SER 78 N -6.00 0.35 0.32 7.04 1.04 -1.26 -4.97 113.70 110.23 1vvd s SER 78 Ca -0.05 -1.39 0.01 0.00 0.48 0.00 0.00 55.95 55.01 1vvd s SER 78 Cb 0.20 0.44 -0.02 0.00 0.10 0.00 0.00 66.02 66.75 1vvd s SER 78 CO 0.75 -0.92 0.36 -0.31 0.98 0.00 0.00 173.24 174.09 1vvd s TYR 79 N -4.00 1.34 -0.37 5.02 1.51 -1.26 -5.01 117.35 114.57 1vvd s TYR 79 Ca 0.37 -1.44 0.04 0.00 -1.01 0.00 0.00 57.07 55.04 1vvd s TYR 79 Cb 0.05 -0.38 0.19 0.00 -0.11 0.00 0.00 41.96 41.71 1vvd s TYR 79 CO 0.14 -0.97 0.70 -1.54 -1.11 0.00 0.00 175.55 172.76 1vvd s SER 80 N -3.28 -1.34 0.43 2.29 1.04 -1.23 -3.59 113.70 108.02 1vvd s SER 80 Ca 0.35 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.31 1vvd s SER 80 Cb 0.01 1.74 0.00 0.00 0.10 0.00 0.00 66.02 67.87 1vvd s SER 80 CO 0.22 -0.17 0.00 0.00 0.98 0.00 0.00 173.24 174.27 1vvd n TYR 81 N 4.54 -4.14 0.00 5.02 9.36 -0.50 -4.70 117.16 126.74 1vvd n TYR 81 Ca 0.09 2.18 0.00 0.00 3.32 0.00 0.00 57.90 63.49 1vvd n TYR 81 Cb 0.57 -3.26 0.00 0.00 -0.63 0.00 0.00 39.34 36.02 1vvd n TYR 81 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1vvd n ASN 82 N -0.36 0.00 -3.25 2.98 2.85 0.79 -4.79 115.26 113.47 1vvd n ASN 82 Ca 0.00 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.38 1vvd n ASN 82 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1vvd n ASN 82 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1vvd n ASP 83 N 7.16 -6.96 -4.74 1.20 -0.08 -1.26 0.30 116.55 112.16 1vvd n ASP 83 Ca 0.00 -0.26 -0.41 0.00 -1.51 0.00 0.00 54.79 52.61 1vvd n ASP 83 Cb 0.00 -4.23 -0.04 0.00 2.34 0.00 0.00 41.12 39.19 1vvd n ASP 83 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 1vvd s ASN 84 N -2.91 7.16 -0.18 1.67 2.47 -1.26 -1.53 114.94 120.36 1vvd s ASN 84 Ca 0.03 2.23 0.01 0.00 0.42 0.00 0.00 52.86 55.55 1vvd s ASN 84 Cb -0.01 -2.61 0.03 0.00 -1.45 0.00 0.00 41.25 37.21 1vvd s ASN 84 CO 0.80 -0.29 -0.13 0.68 -3.72 0.00 0.00 177.10 174.44 1vvd s VAL 85 N -0.42 1.65 0.16 -5.21 -7.23 0.18 -4.49 120.40 105.03 1vvd s VAL 85 Ca 0.50 -0.86 -0.30 0.00 -1.81 0.00 0.00 61.98 59.51 1vvd s VAL 85 Cb -0.32 -1.64 -0.07 0.00 0.56 0.00 0.00 36.38 34.91 1vvd s VAL 85 CO 0.38 0.32 1.01 -0.62 -0.31 0.00 0.00 175.10 175.87 1vvd s ASP 86 N 1.42 7.44 -0.15 4.85 -1.08 -1.26 -1.87 116.67 126.02 1vvd s ASP 86 Ca 0.02 1.93 -0.16 0.00 -0.52 0.00 0.00 52.55 53.82 1vvd s ASP 86 Cb -0.15 -2.60 -0.04 0.00 -1.46 0.00 0.00 42.92 38.67 1vvd s ASP 86 CO -0.10 -0.08 0.38 -0.36 0.52 0.00 0.00 175.17 175.53 1vvd s PHE 87 N -0.30 3.47 -0.83 -5.34 0.08 0.73 -2.26 117.98 113.53 1vvd s PHE 87 Ca 0.47 0.72 -0.14 0.00 0.12 0.00 0.00 56.93 58.09 1vvd s PHE 87 Cb -0.26 -2.44 0.22 0.00 -0.57 0.00 0.00 43.02 39.96 1vvd s PHE 87 CO 0.32 0.19 0.79 0.21 -0.10 0.00 0.00 175.22 176.63 1vvd s LYS 88 N 0.60 3.61 -0.01 0.44 2.47 0.90 -4.88 119.74 122.86 1vvd s LYS 88 Ca 0.21 -2.43 -0.39 0.00 -1.56 0.00 0.00 55.97 51.79 1vvd s LYS 88 Cb -0.14 -4.45 -0.18 0.00 -1.46 0.00 0.00 37.83 31.60 1vvd s LYS 88 CO 0.07 -1.31 1.27 0.00 0.16 0.00 0.00 175.35 175.54 1vvd n LYS 90 N 2.38 0.00 -3.63 0.00 4.76 0.69 -4.83 118.16 117.53 1vvd n LYS 90 Ca 0.20 0.57 -0.09 0.00 -2.87 0.00 0.00 58.31 56.12 1vvd n LYS 90 Cb 0.13 -1.04 -0.07 0.00 -1.84 0.00 0.00 35.03 32.21 1vvd n LYS 90 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1vvd s TYR 91 N -1.40 -0.45 -1.29 2.13 6.14 -1.26 -4.97 117.35 116.25 1vvd s TYR 91 Ca 0.00 1.06 -0.08 0.00 0.64 0.00 0.00 57.07 58.69 1vvd s TYR 91 Cb 0.00 0.38 -0.00 0.00 0.42 0.00 0.00 41.96 42.75 1vvd s TYR 91 CO 0.00 -0.24 0.61 0.41 0.64 0.00 0.00 175.55 176.96 1vvd n GLY 92 N 1.98 -0.52 3.46 8.97 0.00 -1.26 -4.96 105.19 112.85 1vvd n GLY 92 Ca -0.12 0.26 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 1vvd n GLY 92 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vvd s TYR 93 N -3.73 -0.56 -0.12 1.61 2.02 -1.26 -4.77 117.35 110.54 1vvd s TYR 93 Ca 0.18 0.89 -0.02 0.00 -0.37 0.00 0.00 57.07 57.75 1vvd s TYR 93 Cb -0.07 0.37 -0.03 0.00 -0.40 0.00 0.00 41.96 41.84 1vvd s TYR 93 CO 0.87 -0.60 -0.04 0.15 -1.57 0.00 0.00 175.55 174.35 1vvd s LYS 94 N -1.53 3.28 -0.55 -0.62 1.02 0.58 -4.76 119.74 117.15 1vvd s LYS 94 Ca -0.10 -0.51 -0.27 0.00 0.02 0.00 0.00 55.97 55.11 1vvd s LYS 94 Cb -0.01 -2.79 -0.01 0.00 -0.52 0.00 0.00 37.83 34.50 1vvd s LYS 94 CO 0.06 0.45 1.67 -0.51 -0.92 0.00 0.00 175.35 176.10 1vvd s LEU 95 N -0.20 3.36 -0.40 3.17 1.43 -1.20 0.14 118.68 124.98 1vvd s LEU 95 Ca 0.04 0.46 -0.25 0.00 -1.03 0.00 0.00 54.13 53.34 1vvd s LEU 95 Cb -0.13 -2.89 0.02 0.00 0.03 0.00 0.00 46.19 43.22 1vvd s LEU 95 CO 0.02 -2.01 0.91 -0.94 0.23 0.00 0.00 176.35 174.56 1vvd s SER 96 N 6.30 6.60 0.00 2.29 1.04 0.66 -4.33 113.70 126.26 1vvd s SER 96 Ca 0.63 0.39 0.00 0.00 0.48 0.00 0.00 55.95 57.45 1vvd s SER 96 Cb -0.14 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.53 1vvd s SER 96 CO 0.24 -0.91 0.00 0.61 0.98 0.00 0.00 173.24 174.16 1vvd n GLY 97 N 4.60 1.86 3.21 7.32 0.00 -1.26 0.03 105.19 120.95 1vvd n GLY 97 Ca 0.06 -0.48 0.04 0.00 0.00 0.00 0.00 46.02 45.64 1vvd n GLY 97 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1vvd s SER 98 N -3.09 -0.82 0.00 1.61 0.15 -1.26 -4.88 113.70 105.40 1vvd s SER 98 Ca 0.00 0.63 0.15 0.00 0.70 0.00 0.00 55.95 57.43 1vvd s SER 98 Cb 0.00 1.74 0.72 0.00 -1.71 0.00 0.00 66.02 66.76 1vvd s SER 98 CO 0.00 -0.15 1.43 -0.24 1.20 0.00 0.00 173.24 175.48 1vvd n SER 99 N 5.38 0.00 -3.54 5.45 2.88 -1.26 -3.37 113.62 119.16 1vvd n SER 99 Ca -0.06 0.21 -0.29 0.00 -1.33 0.00 0.00 58.87 57.40 1vvd n SER 99 Cb 0.52 -0.35 -0.15 0.00 -0.75 0.00 0.00 64.21 63.48 1vvd n SER 99 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1vvd s SER 100 N -2.71 3.49 0.27 -3.46 1.04 -1.26 0.26 113.70 111.33 1vvd s SER 100 Ca 0.12 -1.41 0.03 0.00 0.48 0.00 0.00 55.95 55.17 1vvd s SER 100 Cb 0.10 -0.38 0.03 0.00 0.10 0.00 0.00 66.02 65.87 1vvd s SER 100 CO 0.24 -0.42 0.26 -1.20 0.98 0.00 0.00 173.24 173.10 1vvd n SER 101 N 5.09 1.56 -3.65 7.02 7.64 -0.78 -4.62 113.62 125.87 1vvd n SER 101 Ca -0.04 -1.86 -0.11 0.00 1.01 0.00 0.00 58.87 57.88 1vvd n SER 101 Cb 0.41 -0.08 -0.08 0.00 -1.01 0.00 0.00 64.21 63.45 1vvd n SER 101 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1vvd s THR 102 N -1.12 -0.00 -0.89 0.44 2.01 -0.40 0.47 115.64 116.15 1vvd s THR 102 Ca 0.20 0.01 -0.26 0.00 0.31 0.00 0.00 61.69 61.95 1vvd s THR 102 Cb -0.02 -0.90 -0.14 0.00 0.01 0.00 0.00 72.50 71.45 1vvd s THR 102 CO 0.13 0.00 2.25 0.00 -0.69 0.00 0.00 174.62 176.31 1vvd s SER 104 N 9.72 2.97 0.25 0.00 0.01 -1.16 0.28 113.70 125.77 1vvd s SER 104 Ca 0.86 0.38 -0.30 0.00 1.31 0.00 0.00 55.95 58.20 1vvd s SER 104 Cb -0.10 -0.50 -0.09 0.00 0.21 0.00 0.00 66.02 65.54 1vvd s SER 104 CO 0.09 -2.83 1.14 -2.16 0.41 0.00 0.00 173.24 169.89 1vvd s PRO 105 N -5.79 4.58 0.00 12.44 0.04 -1.26 -3.55 135.00 141.46 1vvd s PRO 105 Ca 0.72 1.84 0.00 0.00 0.04 0.00 0.00 61.00 63.60 1vvd s PRO 105 Cb -0.05 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.28 1vvd s PRO 105 CO 0.53 0.09 0.00 0.41 0.04 0.00 0.00 177.00 178.07 1vvd n GLY 106 N 1.51 1.27 1.42 0.56 0.00 -1.20 -4.80 105.19 103.95 1vvd n GLY 106 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1vvd n GLY 106 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vvd n ASN 107 N 0.00 -1.89 -2.34 1.61 3.02 -1.23 -4.90 115.26 109.53 1vvd n ASN 107 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1vvd n ASN 107 Cb 0.00 -0.94 0.01 0.00 -0.61 0.00 0.00 39.78 38.23 1vvd n ASN 107 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1vvd n THR 108 N -0.58 0.00 -3.84 3.41 -2.24 -1.26 -4.44 114.28 105.34 1vvd n THR 108 Ca 0.00 -0.16 -0.30 0.00 -2.27 0.00 0.00 64.05 61.33 1vvd n THR 108 Cb 0.11 0.33 -0.13 0.00 -2.10 0.00 0.00 70.33 68.54 1vvd n THR 108 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1vvd s TRP 109 N -3.10 2.68 -0.14 4.78 0.52 -1.26 -2.96 118.94 119.46 1vvd s TRP 109 Ca 0.14 -2.87 -0.07 0.00 0.02 0.00 0.00 56.10 53.32 1vvd s TRP 109 Cb -0.01 -2.39 -0.04 0.00 -1.15 0.00 0.00 33.47 29.88 1vvd s TRP 109 CO 0.01 -0.74 0.10 0.15 0.02 0.00 0.00 176.95 176.48 1vvd s LYS 110 N -0.11 3.62 0.88 4.98 1.02 -0.79 -2.40 119.74 126.94 1vvd s LYS 110 Ca 0.18 -0.23 -0.11 0.00 0.02 0.00 0.00 55.97 55.82 1vvd s LYS 110 Cb -0.23 -3.17 0.12 0.00 -0.52 0.00 0.00 37.83 34.03 1vvd s LYS 110 CO -0.02 0.57 1.09 -1.25 -0.92 0.00 0.00 175.35 174.83 1vvd s PRO 111 N -0.46 1.34 0.78 -1.68 0.04 -1.26 -1.27 135.00 132.49 1vvd s PRO 111 Ca 0.11 0.96 -0.17 0.00 0.04 0.00 0.00 61.00 61.94 1vvd s PRO 111 Cb -0.12 -1.81 -0.15 0.00 0.04 0.00 0.00 34.50 32.47 1vvd s PRO 111 CO 0.02 -2.22 -0.50 -1.91 0.04 0.00 0.00 177.00 172.42 1vvd n GLU 112 N -3.89 0.00 -1.90 4.56 2.13 -1.01 -4.63 120.64 115.90 1vvd n GLU 112 Ca 0.08 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.52 1vvd n GLU 112 Cb 0.54 -1.00 0.03 0.00 0.27 0.00 0.00 31.44 31.28 1vvd n GLU 112 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1vvd s LEU 113 N 6.65 3.90 1.08 4.31 1.02 -1.25 -4.16 118.68 130.23 1vvd s LEU 113 Ca 0.48 2.65 -0.17 0.00 0.02 0.00 0.00 54.13 57.11 1vvd s LEU 113 Cb -0.32 -4.26 0.23 0.00 0.02 0.00 0.00 46.19 41.87 1vvd s LEU 113 CO 0.75 -1.39 1.15 -2.16 0.02 0.00 0.00 176.35 174.72 1vvd s PRO 114 N -2.84 -0.28 -0.15 1.29 0.04 -1.22 -4.49 135.00 127.36 1vvd s PRO 114 Ca 0.69 0.01 -0.02 0.00 0.04 0.00 0.00 61.00 61.72 1vvd s PRO 114 Cb -0.37 -1.70 0.05 0.00 0.04 0.00 0.00 34.50 32.51 1vvd s PRO 114 CO 0.45 -3.10 0.01 0.21 0.04 0.00 0.00 177.00 174.60 1vvd s LYS 115 N -5.41 0.80 -0.98 4.56 2.20 0.10 -4.45 119.74 116.56 1vvd s LYS 115 Ca 0.69 -0.26 -0.20 0.00 -0.36 0.00 0.00 55.97 55.84 1vvd s LYS 115 Cb -0.11 -1.72 -0.10 0.00 -1.51 0.00 0.00 37.83 34.40 1vvd s LYS 115 CO 0.55 -0.49 1.99 0.00 -0.36 0.00 0.00 175.35 177.04 1vvd n VAL 117 N 5.96 0.00 -0.40 0.00 0.24 0.12 -4.53 118.33 119.72 1vvd n VAL 117 Ca 0.50 -0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.75 1vvd n VAL 117 Cb 0.41 -1.64 0.00 0.00 -1.47 0.00 0.00 33.84 31.14 1vvd n VAL 117 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58