#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 1.85 -0.03 1.45 2.20 -1.26 -4.84 119.74 119.11 1vvd s LYS 2 Ca 0.00 -2.11 -0.01 0.00 -0.36 0.00 0.00 55.97 53.49 1vvd s LYS 2 Cb 0.00 -0.23 0.03 0.00 -1.51 0.00 0.00 37.83 36.11 1vvd s LYS 2 CO 0.00 -0.55 0.06 0.00 -0.36 0.00 0.00 175.35 174.51 1vvd s GLN 4 N 0.81 2.23 0.23 0.00 -0.21 -1.26 0.33 119.66 121.79 1vvd s GLN 4 Ca -0.07 -2.25 -0.27 0.00 0.02 0.00 0.00 55.36 52.80 1vvd s GLN 4 Cb -0.09 -1.79 -0.17 0.00 1.00 0.00 0.00 33.01 31.96 1vvd s GLN 4 CO -0.03 -0.52 0.46 0.43 -2.12 0.00 0.00 175.29 173.52 1vvd n SER 5 N -1.53 -1.44 -4.77 5.90 7.64 -1.20 -4.58 113.62 113.63 1vvd n SER 5 Ca -0.12 1.08 -0.33 0.00 1.01 0.00 0.00 58.87 60.51 1vvd n SER 5 Cb 0.66 -0.95 0.04 0.00 -1.01 0.00 0.00 64.21 62.95 1vvd n SER 5 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1vvd s PRO 6 N -1.01 2.88 0.99 1.43 0.04 -1.26 -5.04 135.00 133.02 1vvd s PRO 6 Ca 0.63 1.37 -0.15 0.00 0.04 0.00 0.00 61.00 62.90 1vvd s PRO 6 Cb -0.88 -1.96 0.18 0.00 0.04 0.00 0.00 34.50 31.88 1vvd s PRO 6 CO 0.57 -1.19 1.17 -1.25 0.04 0.00 0.00 177.00 176.35 1vvd s PRO 7 N -4.08 0.51 1.20 0.56 0.04 -1.26 -4.83 135.00 127.14 1vvd s PRO 7 Ca 0.67 0.05 -0.19 0.00 0.04 0.00 0.00 61.00 61.56 1vvd s PRO 7 Cb -0.20 -1.79 0.29 0.00 0.04 0.00 0.00 34.50 32.84 1vvd s PRO 7 CO 0.41 -2.58 1.13 -1.54 0.04 0.00 0.00 177.00 174.45 1vvd s SER 8 N -4.20 0.95 0.00 6.66 1.04 -1.26 -4.73 113.70 112.16 1vvd s SER 8 Ca 0.68 0.56 0.00 0.00 0.48 0.00 0.00 55.95 57.67 1vvd s SER 8 Cb -0.11 -0.76 -0.00 0.00 0.10 0.00 0.00 66.02 65.25 1vvd s SER 8 CO 0.54 -4.10 0.00 2.30 0.98 0.00 0.00 173.24 172.96 1vvd n ILE 9 N -4.73 0.00 -1.51 -1.02 -5.35 -0.60 -5.00 119.36 101.15 1vvd n ILE 9 Ca 0.14 -0.02 -0.25 0.00 -0.27 0.00 0.00 62.75 62.35 1vvd n ILE 9 Cb 0.60 0.01 -0.18 0.00 -1.74 0.00 0.00 39.64 38.33 1vvd n ILE 9 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1vvd n SER 10 N -2.58 -0.42 -4.07 7.28 7.64 -1.26 -1.81 113.62 118.40 1vvd n SER 10 Ca 0.00 -0.54 -0.34 0.00 1.01 0.00 0.00 58.87 59.00 1vvd n SER 10 Cb 0.01 -0.84 -0.03 0.00 -1.01 0.00 0.00 64.21 62.34 1vvd n SER 10 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1vvd n ASN 11 N 9.10 -1.59 -3.60 6.43 3.02 -1.26 -4.03 115.26 123.33 1vvd n ASN 11 Ca 0.63 -1.18 -0.16 0.00 -0.03 0.00 0.00 54.58 53.84 1vvd n ASN 11 Cb 0.18 -2.23 -0.07 0.00 -0.61 0.00 0.00 39.78 37.05 1vvd n ASN 11 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1vvd s GLY 12 N -4.03 -0.48 0.45 7.41 0.00 -0.75 -2.50 107.32 107.41 1vvd s GLY 12 Ca 0.20 1.31 0.05 0.00 0.00 0.00 0.00 44.72 46.28 1vvd s GLY 12 CO 0.95 1.01 0.62 -0.96 0.00 0.00 0.00 173.10 174.71 1vvd n ARG 13 N 1.52 0.51 -4.07 2.90 0.00 0.70 -1.55 116.66 116.66 1vvd n ARG 13 Ca -0.18 -2.13 -0.07 0.00 -0.00 0.00 0.00 57.85 55.47 1vvd n ARG 13 Cb 0.56 -0.27 -0.10 0.00 -0.00 0.00 0.00 32.46 32.65 1vvd n ARG 13 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1vvd s HIS 14 N -1.75 0.48 1.00 2.89 -3.43 -1.26 0.13 115.29 113.35 1vvd s HIS 14 Ca 0.45 -1.00 -0.16 0.00 -0.80 0.00 0.00 55.06 53.54 1vvd s HIS 14 Cb -0.03 -0.36 -0.03 0.00 -1.43 0.00 0.00 32.58 30.73 1vvd s HIS 14 CO 0.29 -0.36 -0.20 0.09 -2.00 0.00 0.00 174.74 172.56 1vvd n ASN 15 N 0.27 -3.32 -0.86 7.38 4.13 -1.22 -4.84 115.26 116.80 1vvd n ASN 15 Ca -0.15 0.17 -0.03 0.00 1.68 0.00 0.00 54.58 56.25 1vvd n ASN 15 Cb 0.60 -0.97 -0.03 0.00 -1.54 0.00 0.00 39.78 37.84 1vvd n ASN 15 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vvd n GLY 16 N 2.34 0.71 0.72 7.41 0.00 -1.26 -4.70 105.19 110.42 1vvd n GLY 16 Ca 0.02 -0.09 0.03 0.00 0.00 0.00 0.00 46.02 45.99 1vvd n GLY 16 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1vvd n TYR 17 N 0.05 0.53 -2.03 1.61 9.36 -1.26 -4.86 117.16 120.57 1vvd n TYR 17 Ca -0.14 -0.21 0.00 0.00 3.32 0.00 0.00 57.90 60.87 1vvd n TYR 17 Cb 0.68 -0.11 0.00 0.00 -0.63 0.00 0.00 39.34 39.28 1vvd n TYR 17 CO 0.00 0.00 0.00 -0.85 0.22 0.00 0.00 176.86 176.23 1vvd n GLU 18 N 0.26 0.99 0.00 2.98 0.00 -1.26 -5.10 120.64 118.51 1vvd n GLU 18 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.25 1vvd n GLU 18 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.83 1vvd n GLU 18 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 1vvd n ASP 19 N 0.00 0.00 -3.52 -1.84 2.03 -1.26 -4.86 116.55 107.10 1vvd n ASP 19 Ca 0.00 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.03 1vvd n ASP 19 Cb 0.00 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.29 1vvd n ASP 19 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1vvd s PHE 20 N -0.94 1.60 0.61 -0.67 -0.71 -1.25 -3.23 117.98 113.38 1vvd s PHE 20 Ca 0.00 -2.47 0.33 0.00 -1.04 0.00 0.00 56.93 53.75 1vvd s PHE 20 Cb 0.00 -1.33 1.94 0.00 -1.21 0.00 0.00 43.02 42.43 1vvd s PHE 20 CO 0.00 -0.77 2.25 1.88 -1.34 0.00 0.00 175.22 177.24 1vvd h TYR 21 N 5.77 0.00 0.00 3.49 0.05 0.50 -3.44 116.97 123.35 1vvd h TYR 21 Ca 0.21 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.99 1vvd h TYR 21 Cb 0.89 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.63 1vvd h TYR 21 CO 0.37 0.00 0.00 2.41 -1.05 0.00 0.00 178.16 179.89 1vvd n THR 22 N -3.62 0.00 -3.81 -2.88 -1.04 0.10 -4.37 114.28 98.66 1vvd n THR 22 Ca -0.02 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.86 1vvd n THR 22 Cb 0.13 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.55 1vvd n THR 22 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1vvd s ASP 23 N -4.00 -0.10 -0.29 8.00 -1.08 -1.26 -2.98 116.67 114.97 1vvd s ASP 23 Ca 0.00 -0.05 0.00 0.00 -0.52 0.00 0.00 52.55 51.98 1vvd s ASP 23 Cb 0.00 0.27 0.00 0.00 -1.46 0.00 0.00 42.92 41.73 1vvd s ASP 23 CO 0.00 -0.43 0.00 0.61 0.52 0.00 0.00 175.17 175.87 1vvd n GLY 24 N 1.30 0.59 3.89 2.66 0.00 0.25 -4.91 105.19 108.97 1vvd n GLY 24 Ca -0.22 -0.84 -0.21 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.86 5.85 0.04 1.61 0.01 -0.98 -4.92 113.70 112.45 1vvd s SER 25 Ca 0.00 -0.13 -0.02 0.00 1.31 0.00 0.00 55.95 57.11 1vvd s SER 25 Cb 0.00 -1.57 -0.03 0.00 0.21 0.00 0.00 66.02 64.63 1vvd s SER 25 CO 0.00 -0.06 0.01 -0.69 0.41 0.00 0.00 173.24 172.90 1vvd s VAL 26 N -2.08 0.18 -0.05 3.43 1.01 -1.25 0.21 120.40 121.85 1vvd s VAL 26 Ca 0.34 -1.45 -0.01 0.00 0.00 0.00 0.00 61.98 60.85 1vvd s VAL 26 Cb -0.08 -1.12 0.03 0.00 0.00 0.00 0.00 36.38 35.20 1vvd s VAL 26 CO 0.27 -0.80 0.03 -0.69 0.00 0.00 0.00 175.10 173.90 1vvd s VAL 27 N -3.15 0.12 -0.60 2.92 1.01 -0.99 -4.75 120.40 114.95 1vvd s VAL 27 Ca -0.00 0.24 -0.28 0.00 0.00 0.00 0.00 61.98 61.95 1vvd s VAL 27 Cb 0.02 -0.30 0.01 0.00 0.00 0.00 0.00 36.38 36.12 1vvd s VAL 27 CO -0.07 0.20 1.44 -0.89 0.00 0.00 0.00 175.10 175.77 1vvd s THR 28 N 1.81 3.73 0.03 3.92 2.01 -1.26 0.80 115.64 126.68 1vvd s THR 28 Ca 0.01 0.57 -0.30 0.00 0.31 0.00 0.00 61.69 62.28 1vvd s THR 28 Cb -0.12 -4.48 -0.07 0.00 0.01 0.00 0.00 72.50 67.84 1vvd s THR 28 CO -0.03 -1.28 1.48 -0.31 -0.69 0.00 0.00 174.62 173.79 1vvd s TYR 29 N 6.32 2.76 0.14 4.92 1.51 -1.26 -3.43 117.35 128.30 1vvd s TYR 29 Ca 0.50 0.68 -0.10 0.00 -1.01 0.00 0.00 57.07 57.14 1vvd s TYR 29 Cb -0.10 -3.76 -0.06 0.00 -0.11 0.00 0.00 41.96 37.92 1vvd s TYR 29 CO 0.23 -2.89 0.46 -1.54 -1.11 0.00 0.00 175.55 170.70 1vvd s SER 30 N 1.96 6.64 0.25 2.29 1.04 0.36 -4.88 113.70 121.37 1vvd s SER 30 Ca 0.67 0.84 0.07 0.00 0.48 0.00 0.00 55.95 58.01 1vvd s SER 30 Cb -0.35 -2.19 -0.04 0.00 0.10 0.00 0.00 66.02 63.55 1vvd s SER 30 CO 0.29 0.08 0.17 0.00 0.98 0.00 0.00 173.24 174.76 1vvd n ASN 32 N -1.12 -2.21 -4.48 0.00 5.15 -1.04 -4.65 115.26 106.90 1vvd n ASN 32 Ca -0.08 0.29 -0.20 0.00 -0.60 0.00 0.00 54.58 54.00 1vvd n ASN 32 Cb 0.58 -1.18 -0.11 0.00 -0.53 0.00 0.00 39.78 38.55 1vvd n ASN 32 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1vvd n SER 33 N -1.22 1.69 0.00 1.20 7.64 -1.26 -1.24 113.62 120.42 1vvd n SER 33 Ca 0.06 -2.54 0.00 0.00 1.01 0.00 0.00 58.87 57.40 1vvd n SER 33 Cb 0.54 -1.64 0.00 0.00 -1.01 0.00 0.00 64.21 62.10 1vvd n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vvd n GLY 34 N 5.95 0.39 3.83 0.23 0.00 -1.26 -5.13 105.19 109.20 1vvd n GLY 34 Ca 0.42 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 3.61 0.29 1.61 1.51 -0.37 -4.75 117.35 119.25 1vvd s TYR 35 Ca 0.00 0.69 -0.22 0.00 -1.01 0.00 0.00 57.07 56.53 1vvd s TYR 35 Cb 0.00 -2.14 -0.09 0.00 -0.11 0.00 0.00 41.96 39.61 1vvd s TYR 35 CO 0.00 0.59 0.84 -1.12 -1.11 0.00 0.00 175.55 174.75 1vvd s SER 36 N -0.70 7.15 -0.47 2.29 0.01 0.77 -4.60 113.70 118.15 1vvd s SER 36 Ca 0.18 1.62 -0.16 0.00 1.31 0.00 0.00 55.95 58.89 1vvd s SER 36 Cb -0.14 -2.50 0.06 0.00 0.21 0.00 0.00 66.02 63.65 1vvd s SER 36 CO 0.07 -0.07 0.44 -0.22 0.41 0.00 0.00 173.24 173.87 1vvd s LEU 37 N -2.20 5.33 0.30 2.44 2.96 -1.25 -1.19 118.68 125.07 1vvd s LEU 37 Ca 0.49 -1.11 0.06 0.00 -0.22 0.00 0.00 54.13 53.35 1vvd s LEU 37 Cb -0.16 -2.26 -0.02 0.00 0.50 0.00 0.00 46.19 44.25 1vvd s LEU 37 CO 0.21 -0.67 0.39 -0.63 -1.32 0.00 0.00 176.35 174.34 1vvd s ILE 38 N 1.91 4.37 0.00 6.68 -1.09 0.40 -4.82 121.20 128.65 1vvd s ILE 38 Ca 0.07 -1.08 0.00 0.00 -2.23 0.00 0.00 60.65 57.42 1vvd s ILE 38 Cb -0.22 -3.51 0.00 0.00 -1.58 0.00 0.00 42.46 37.16 1vvd s ILE 38 CO 0.09 -0.22 0.00 0.61 -1.23 0.00 0.00 174.94 174.19 1vvd n GLY 39 N -1.50 -0.37 3.68 6.18 0.00 -1.26 0.24 105.19 112.16 1vvd n GLY 39 Ca -0.03 -1.81 -0.45 0.00 0.00 0.00 0.00 46.02 43.73 1vvd n GLY 39 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1vvd n ASN 40 N -0.71 3.04 -2.55 1.61 0.23 -1.26 -4.80 115.26 110.81 1vvd n ASN 40 Ca 0.00 1.12 -0.19 0.00 -0.53 0.00 0.00 54.58 54.98 1vvd n ASN 40 Cb 0.00 -1.45 -0.10 0.00 -2.08 0.00 0.00 39.78 36.15 1vvd n ASN 40 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1vvd n SER 41 N 2.62 5.62 0.00 0.53 3.41 -1.26 -4.03 113.62 120.52 1vvd n SER 41 Ca 0.13 -2.39 0.00 0.00 -0.26 0.00 0.00 58.87 56.35 1vvd n SER 41 Cb 0.31 -1.28 0.00 0.00 -0.26 0.00 0.00 64.21 62.99 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 3.01 0.69 3.25 5.00 0.00 -1.24 -4.29 105.19 111.60 1vvd n GLY 42 Ca 0.48 0.59 -0.29 0.00 0.00 0.00 0.00 46.02 46.81 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 -3.50 1.61 0.31 0.24 -4.41 118.33 112.57 1vvd n VAL 43 Ca 0.00 -0.13 -0.26 0.00 -0.01 0.00 0.00 64.34 63.94 1vvd n VAL 43 Cb 0.00 -0.93 -0.14 0.00 -0.91 0.00 0.00 33.84 31.86 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 -6.79 0.35 -0.42 7.52 2.96 -0.79 -2.35 118.68 119.16 1vvd s LEU 44 Ca 0.64 -1.17 -0.26 0.00 -0.22 0.00 0.00 54.13 53.12 1vvd s LEU 44 Cb -0.15 -0.13 0.02 0.00 0.50 0.00 0.00 46.19 46.44 1vvd s LEU 44 CO 0.57 -0.42 0.93 0.00 -1.32 0.00 0.00 176.35 176.10 1vvd s SER 46 N 2.11 4.00 0.00 0.00 0.15 -1.13 0.86 113.70 119.69 1vvd s SER 46 Ca 0.38 -3.45 0.00 0.00 0.70 0.00 0.00 55.95 53.57 1vvd s SER 46 Cb -0.11 -1.34 0.00 0.00 -1.71 0.00 0.00 66.02 62.86 1vvd s SER 46 CO 0.23 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.14 1vvd n GLY 47 N 2.47 0.76 2.69 9.45 0.00 -1.24 -4.28 105.19 115.04 1vvd n GLY 47 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 0.96 2.85 -0.02 0.00 -1.16 -4.92 105.19 102.90 1vvd n GLY 48 Ca 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1vvd n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vvd s GLU 49 N -2.67 1.19 0.28 1.61 2.02 -1.26 -4.95 118.70 114.93 1vvd s GLU 49 Ca 0.00 -1.65 -0.29 0.00 0.02 0.00 0.00 54.97 53.04 1vvd s GLU 49 Cb 0.00 -2.60 -0.10 0.00 0.10 0.00 0.00 34.13 31.53 1vvd s GLU 49 CO 0.00 -1.01 1.36 -1.58 0.02 0.00 0.00 175.26 174.05 1vvd s TRP 50 N 0.98 3.06 0.11 1.61 0.52 -1.26 -2.82 118.94 121.13 1vvd s TRP 50 Ca 0.12 1.25 -0.05 0.00 0.02 0.00 0.00 56.10 57.44 1vvd s TRP 50 Cb -0.20 -3.73 -0.02 0.00 -1.15 0.00 0.00 33.47 28.37 1vvd s TRP 50 CO -0.13 -2.17 0.12 0.45 0.02 0.00 0.00 176.95 175.24 1vvd s SER 51 N -0.06 0.25 -0.91 2.95 0.15 -0.74 -4.95 113.70 110.39 1vvd s SER 51 Ca 0.54 -0.96 -0.06 0.00 0.70 0.00 0.00 55.95 56.17 1vvd s SER 51 Cb -0.40 0.32 -0.02 0.00 -1.71 0.00 0.00 66.02 64.20 1vvd s SER 51 CO 0.48 -0.74 0.78 0.47 1.20 0.00 0.00 173.24 175.43 1vvd n ASP 52 N -0.07 -6.75 -4.78 5.45 8.00 -1.26 -1.88 116.55 115.26 1vvd n ASP 52 Ca -0.10 -0.52 -0.38 0.00 0.71 0.00 0.00 54.79 54.50 1vvd n ASP 52 Cb 0.63 -4.61 -0.06 0.00 -0.02 0.00 0.00 41.12 37.06 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 -4.13 4.16 0.93 -0.24 0.04 -1.26 -4.32 135.00 130.17 1vvd s PRO 53 Ca 0.23 0.45 -0.14 0.00 0.04 0.00 0.00 61.00 61.57 1vvd s PRO 53 Cb -0.05 -3.33 0.16 0.00 0.04 0.00 0.00 34.50 31.32 1vvd s PRO 53 CO 0.78 0.42 1.23 -1.25 0.04 0.00 0.00 177.00 178.22 1vvd s PRO 54 N -0.23 0.95 0.03 0.56 0.04 -1.26 -4.79 135.00 130.29 1vvd s PRO 54 Ca 0.25 -0.10 0.05 0.00 0.04 0.00 0.00 61.00 61.24 1vvd s PRO 54 Cb -0.16 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 1vvd s PRO 54 CO 0.12 -2.26 -0.11 0.95 0.04 0.00 0.00 177.00 175.74 1vvd s THR 55 N -3.61 3.28 -0.82 1.26 -4.23 0.67 -4.86 115.64 107.32 1vvd s THR 55 Ca 0.68 -0.97 0.01 0.00 -1.18 0.00 0.00 61.69 60.23 1vvd s THR 55 Cb -0.08 -2.42 0.22 0.00 1.34 0.00 0.00 72.50 71.56 1vvd s THR 55 CO 0.52 0.35 0.78 0.00 -0.54 0.00 0.00 174.62 175.73 1vvd n GLN 57 N 1.83 1.45 -3.81 0.00 1.13 -0.34 -4.53 117.38 113.11 1vvd n GLN 57 Ca 0.23 -0.55 -0.35 0.00 -1.94 0.00 0.00 57.00 54.39 1vvd n GLN 57 Cb 0.37 0.08 -0.09 0.00 0.11 0.00 0.00 30.24 30.70 1vvd n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1vvd s ILE 58 N -0.58 5.13 -0.50 5.09 1.09 -1.26 0.27 121.20 130.44 1vvd s ILE 58 Ca 0.04 0.09 0.05 0.00 -1.10 0.00 0.00 60.65 59.73 1vvd s ILE 58 Cb -0.00 -3.35 0.40 0.00 -1.06 0.00 0.00 42.46 38.45 1vvd s ILE 58 CO 0.03 0.42 1.13 1.33 -0.10 0.00 0.00 174.94 177.75 1vvd n VAL 59 N 3.78 2.65 -2.77 2.92 0.24 -1.26 -4.48 118.33 119.41 1vvd n VAL 59 Ca -0.16 -5.06 -0.43 0.00 -2.04 0.00 0.00 64.34 56.65 1vvd n VAL 59 Cb 0.52 -1.30 -0.04 0.00 -1.47 0.00 0.00 33.84 31.55 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 3.60 0.78 7.34 1.02 -1.26 -3.42 119.74 124.23 1vvd s LYS 60 Ca 0.48 0.28 -0.12 0.00 0.02 0.00 0.00 55.97 56.64 1vvd s LYS 60 Cb 0.37 -3.91 0.06 0.00 -0.52 0.00 0.00 37.83 33.83 1vvd s LYS 60 CO -0.19 -1.23 1.12 0.00 -0.92 0.00 0.00 175.35 174.13 1vvd n PRO 62 N -3.29 0.00 0.00 0.00 -0.04 -1.26 -4.61 135.00 125.81 1vvd n PRO 62 Ca 0.07 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 1vvd n PRO 62 Cb 0.58 -0.90 0.00 0.00 -0.04 0.00 0.00 33.50 33.14 1vvd n PRO 62 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1vvd n HIS 63 N -1.09 0.00 -2.75 0.54 8.25 -1.26 -4.93 115.22 113.97 1vvd n HIS 63 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 1vvd n HIS 63 Cb 0.00 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 1vvd n HIS 63 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1vvd s PRO 64 N -0.63 3.70 -0.10 -0.41 0.04 -1.26 -4.65 135.00 131.68 1vvd s PRO 64 Ca 0.00 -1.65 -0.01 0.00 0.04 0.00 0.00 61.00 59.38 1vvd s PRO 64 Cb 0.00 -5.17 -0.06 0.00 0.04 0.00 0.00 34.50 29.31 1vvd s PRO 64 CO 0.00 -1.99 -0.10 0.25 0.04 0.00 0.00 177.00 175.20 1vvd n THR 65 N 6.01 0.58 -1.09 1.26 -2.24 -1.26 -4.45 114.28 113.10 1vvd n THR 65 Ca 0.32 -0.20 0.11 0.00 -2.27 0.00 0.00 64.05 62.01 1vvd n THR 65 Cb 0.49 -1.11 -0.05 0.00 -2.10 0.00 0.00 70.33 67.56 1vvd n THR 65 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vvd n ILE 66 N -3.02 -0.18 -1.81 2.28 3.06 -1.26 -1.76 119.36 116.66 1vvd n ILE 66 Ca -0.19 0.39 -0.33 0.00 -2.50 0.00 0.00 62.75 60.12 1vvd n ILE 66 Cb 0.68 -0.69 -0.04 0.00 0.54 0.00 0.00 39.64 40.13 1vvd n ILE 66 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 1vvd s SER 67 N -5.83 4.78 -1.29 9.51 0.15 -1.26 -3.80 113.70 115.96 1vvd s SER 67 Ca 0.00 0.43 -0.15 0.00 0.70 0.00 0.00 55.95 56.93 1vvd s SER 67 Cb 0.00 -2.53 0.01 0.00 -1.71 0.00 0.00 66.02 61.79 1vvd s SER 67 CO 0.00 -2.80 0.55 0.59 1.20 0.00 0.00 173.24 172.78 1vvd n ASN 68 N 14.81 -2.71 0.00 5.45 3.02 -1.26 -2.80 115.26 131.77 1vvd n ASN 68 Ca 0.32 -1.11 0.00 0.00 -0.03 0.00 0.00 54.58 53.76 1vvd n ASN 68 Cb 0.51 -2.65 0.00 0.00 -0.61 0.00 0.00 39.78 37.03 1vvd n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vvd n GLY 69 N -1.99 0.00 0.73 7.41 0.00 -1.23 -0.38 105.19 109.74 1vvd n GLY 69 Ca -0.19 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.94 -2.23 -4.31 1.61 0.18 -0.72 -2.02 117.16 107.73 1vvd n TYR 70 Ca 0.00 0.31 -0.22 0.00 1.88 0.00 0.00 57.90 59.87 1vvd n TYR 70 Cb 0.12 -0.58 -0.12 0.00 -0.38 0.00 0.00 39.34 38.39 1vvd n TYR 70 CO 0.00 0.00 0.00 -0.48 -2.08 0.00 0.00 176.86 174.30 1vvd s LEU 71 N 0.00 2.39 0.00 -3.48 -0.00 -1.25 0.25 118.68 116.59 1vvd s LEU 71 Ca 0.00 -0.80 0.10 0.00 -0.00 0.00 0.00 54.13 53.42 1vvd s LEU 71 Cb 0.00 -0.83 0.24 0.00 -0.00 0.00 0.00 46.19 45.59 1vvd s LEU 71 CO 0.00 -0.01 1.14 -1.54 -0.00 0.00 0.00 176.35 175.94 1vvd n SER 72 N 0.55 2.63 0.00 1.48 3.41 -0.50 -4.74 113.62 116.45 1vvd n SER 72 Ca -0.15 -1.88 0.00 0.00 -0.26 0.00 0.00 58.87 56.58 1vvd n SER 72 Cb 0.56 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1vvd n SER 72 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1vvd n SER 73 N 0.45 0.00 -3.15 4.04 7.64 -1.26 -5.00 113.62 116.35 1vvd n SER 73 Ca 0.10 0.42 0.06 0.00 1.01 0.00 0.00 58.87 60.45 1vvd n SER 73 Cb 0.38 -0.47 -0.00 0.00 -1.01 0.00 0.00 64.21 63.11 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 -2.02 -0.91 -0.43 0.23 0.00 -1.26 -5.04 107.32 97.89 1vvd s GLY 74 Ca 0.00 2.18 -0.19 0.00 0.00 0.00 0.00 44.72 46.71 1vvd s GLY 74 CO 0.00 4.14 0.55 -0.12 0.00 0.00 0.00 173.10 177.67 1vvd s PHE 75 N 2.97 3.11 0.35 1.90 5.36 -1.26 -4.89 117.98 125.52 1vvd s PHE 75 Ca 0.29 -0.20 -0.13 0.00 -0.96 0.00 0.00 56.93 55.93 1vvd s PHE 75 Cb -0.01 -3.15 -0.08 0.00 -0.34 0.00 0.00 43.02 39.44 1vvd s PHE 75 CO -0.23 -0.79 0.74 0.15 -1.46 0.00 0.00 175.22 173.63 1vvd s LYS 76 N 2.51 3.90 0.48 10.12 1.02 -1.26 -4.93 119.74 131.59 1vvd s LYS 76 Ca 0.18 0.58 0.28 0.00 0.02 0.00 0.00 55.97 57.03 1vvd s LYS 76 Cb -0.15 -2.42 1.36 0.00 -0.52 0.00 0.00 37.83 36.09 1vvd s LYS 76 CO 0.17 0.08 1.79 0.00 -0.92 0.00 0.00 175.35 176.47 1vvd h ARG 77 N 1.85 0.16 -4.12 1.68 3.08 -2.01 -3.41 114.38 111.60 1vvd h ARG 77 Ca -0.48 -0.01 -0.12 0.00 0.07 0.00 0.00 59.98 59.45 1vvd h ARG 77 Cb 1.18 -0.04 -0.15 0.00 0.08 0.00 0.00 29.97 31.04 1vvd h ARG 77 CO 0.65 0.11 -0.62 -1.54 -1.07 0.00 0.00 179.97 177.50 1vvd s SER 78 N -5.21 0.39 0.05 7.04 1.04 -1.26 -5.04 113.70 110.71 1vvd s SER 78 Ca -0.07 -0.88 0.01 0.00 0.48 0.00 0.00 55.95 55.49 1vvd s SER 78 Cb 0.24 0.22 -0.00 0.00 0.10 0.00 0.00 66.02 66.58 1vvd s SER 78 CO 0.80 -0.60 0.02 -1.22 0.98 0.00 0.00 173.24 173.23 1vvd n TYR 79 N 0.22 -0.00 0.00 5.02 4.02 -1.26 -5.05 117.16 120.10 1vvd n TYR 79 Ca -0.15 -0.35 0.00 0.00 -0.01 0.00 0.00 57.90 57.39 1vvd n TYR 79 Cb 0.61 0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.93 1vvd n TYR 79 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1vvd n SER 80 N -2.13 0.00 -0.71 7.72 3.41 -1.22 -4.07 113.62 116.62 1vvd n SER 80 Ca -0.00 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.67 1vvd n SER 80 Cb 0.08 0.00 0.21 0.00 -0.26 0.00 0.00 64.21 64.24 1vvd n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vvd n TYR 81 N 0.00 0.67 0.00 7.33 4.19 -0.87 -4.18 117.16 124.29 1vvd n TYR 81 Ca 0.00 -1.08 0.00 0.00 3.31 0.00 0.00 57.90 60.13 1vvd n TYR 81 Cb 0.00 -0.30 0.00 0.00 0.49 0.00 0.00 39.34 39.53 1vvd n TYR 81 CO 0.00 0.00 0.00 -1.71 0.91 0.00 0.00 176.86 176.06 1vvd n ASN 82 N -0.91 0.00 -3.31 2.98 5.15 0.71 -3.90 115.26 115.97 1vvd n ASN 82 Ca 0.22 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.92 1vvd n ASN 82 Cb 0.84 0.00 0.03 0.00 -0.53 0.00 0.00 39.78 40.12 1vvd n ASN 82 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1vvd n ASP 83 N 0.00 -6.29 -4.77 1.20 9.92 -1.26 0.27 116.55 115.62 1vvd n ASP 83 Ca 0.00 0.01 -0.39 0.00 -0.53 0.00 0.00 54.79 53.87 1vvd n ASP 83 Cb 0.00 -2.92 -0.03 0.00 -0.64 0.00 0.00 41.12 37.53 1vvd n ASP 83 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1vvd s ASN 84 N -1.97 6.87 -0.14 -2.24 4.22 -1.26 -2.96 114.94 117.47 1vvd s ASN 84 Ca 0.31 2.34 -0.00 0.00 -2.14 0.00 0.00 52.86 53.36 1vvd s ASN 84 Cb -0.05 -2.62 0.03 0.00 1.28 0.00 0.00 41.25 39.90 1vvd s ASN 84 CO 0.84 -0.43 -0.06 0.68 -2.04 0.00 0.00 177.10 176.09 1vvd s VAL 85 N -1.30 1.05 0.00 3.54 -7.23 0.27 -4.74 120.40 111.99 1vvd s VAL 85 Ca 0.51 -0.45 -0.30 0.00 -1.81 0.00 0.00 61.98 59.93 1vvd s VAL 85 Cb -0.32 -1.16 -0.04 0.00 0.56 0.00 0.00 36.38 35.43 1vvd s VAL 85 CO 0.40 0.24 1.12 -0.62 -0.31 0.00 0.00 175.10 175.94 1vvd s ASP 86 N 1.68 7.17 0.14 4.85 -1.08 -1.26 -1.81 116.67 126.36 1vvd s ASP 86 Ca 0.03 1.83 -0.19 0.00 -0.52 0.00 0.00 52.55 53.70 1vvd s ASP 86 Cb -0.14 -2.57 -0.07 0.00 -1.46 0.00 0.00 42.92 38.68 1vvd s ASP 86 CO -0.08 -0.43 0.63 -0.36 0.52 0.00 0.00 175.17 175.44 1vvd s PHE 87 N 1.39 3.72 -0.60 -5.34 0.08 0.74 -1.41 117.98 116.56 1vvd s PHE 87 Ca 0.55 1.28 0.04 0.00 0.12 0.00 0.00 56.93 58.93 1vvd s PHE 87 Cb -0.25 -2.52 0.15 0.00 -0.57 0.00 0.00 43.02 39.83 1vvd s PHE 87 CO 0.26 0.47 0.38 0.21 -0.10 0.00 0.00 175.22 176.44 1vvd s LYS 88 N -1.58 2.14 -0.13 0.44 2.36 0.71 -4.81 119.74 118.86 1vvd s LYS 88 Ca 0.36 -2.93 -0.32 0.00 -2.55 0.00 0.00 55.97 50.53 1vvd s LYS 88 Cb -0.18 -3.24 -0.15 0.00 -1.05 0.00 0.00 37.83 33.21 1vvd s LYS 88 CO 0.20 -1.21 0.96 0.00 1.55 0.00 0.00 175.35 176.85 1vvd n LYS 90 N 1.81 0.00 -3.62 0.00 4.76 0.49 -4.81 118.16 116.80 1vvd n LYS 90 Ca 0.18 0.41 -0.09 0.00 -2.87 0.00 0.00 58.31 55.94 1vvd n LYS 90 Cb 0.02 -0.76 -0.06 0.00 -1.84 0.00 0.00 35.03 32.39 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 -1.30 -0.42 -1.46 2.13 6.14 -1.26 -4.96 117.35 116.22 1vvd s TYR 91 Ca 0.00 0.93 -0.07 0.00 0.64 0.00 0.00 57.07 58.57 1vvd s TYR 91 Cb 0.00 0.40 0.05 0.00 0.42 0.00 0.00 41.96 42.83 1vvd s TYR 91 CO 0.00 -0.26 0.75 0.41 0.64 0.00 0.00 175.55 177.09 1vvd n GLY 92 N 1.67 -0.37 3.21 8.97 0.00 -1.26 -4.96 105.19 112.46 1vvd n GLY 92 Ca -0.12 0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.56 -0.02 -0.14 1.61 2.02 -1.26 -4.74 117.35 111.27 1vvd s TYR 93 Ca 0.33 -0.16 -0.03 0.00 -0.37 0.00 0.00 57.07 56.85 1vvd s TYR 93 Cb -0.17 0.03 -0.03 0.00 -0.40 0.00 0.00 41.96 41.39 1vvd s TYR 93 CO 0.85 -0.46 -0.05 0.15 -1.57 0.00 0.00 175.55 174.46 1vvd s LYS 94 N -2.54 3.53 -0.85 -0.62 1.02 0.53 -4.75 119.74 116.06 1vvd s LYS 94 Ca -0.05 -0.55 -0.25 0.00 0.02 0.00 0.00 55.97 55.14 1vvd s LYS 94 Cb -0.01 -2.84 -0.01 0.00 -0.52 0.00 0.00 37.83 34.45 1vvd s LYS 94 CO -0.04 0.29 1.75 -0.51 -0.92 0.00 0.00 175.35 175.92 1vvd s LEU 95 N 0.22 3.27 -0.71 3.17 1.43 -1.24 0.75 118.68 125.57 1vvd s LEU 95 Ca -0.03 -0.62 -0.26 0.00 -1.03 0.00 0.00 54.13 52.19 1vvd s LEU 95 Cb -0.14 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.52 1vvd s LEU 95 CO 0.03 -2.30 1.62 -0.55 0.23 0.00 0.00 176.35 175.38 1vvd s SER 96 N 6.92 5.68 0.00 2.29 0.15 0.26 -4.24 113.70 124.76 1vvd s SER 96 Ca 0.60 -0.16 0.00 0.00 0.70 0.00 0.00 55.95 57.09 1vvd s SER 96 Cb -0.07 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1vvd s SER 96 CO 0.03 -2.14 0.00 0.61 1.20 0.00 0.00 173.24 172.94 1vvd n GLY 97 N 5.75 0.11 3.19 9.45 0.00 -1.26 -0.82 105.19 121.61 1vvd n GLY 97 Ca 0.16 -0.02 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 1vvd n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vvd s SER 98 N -4.00 -0.37 0.02 1.61 0.01 -1.17 -4.85 113.70 104.96 1vvd s SER 98 Ca 0.00 0.78 -0.20 0.00 1.31 0.00 0.00 55.95 57.84 1vvd s SER 98 Cb 0.00 0.71 -0.17 0.00 0.21 0.00 0.00 66.02 66.77 1vvd s SER 98 CO 0.00 -0.19 1.24 0.77 0.41 0.00 0.00 173.24 175.47 1vvd h SER 99 N 7.31 0.44 -3.70 2.44 4.64 -1.91 -3.12 113.55 119.66 1vvd h SER 99 Ca -0.35 -0.60 -0.67 0.00 -0.47 0.00 0.00 61.79 59.70 1vvd h SER 99 Cb 1.16 -0.13 -0.21 0.00 -0.31 0.00 0.00 62.40 62.92 1vvd h SER 99 CO 0.29 0.97 -0.54 -0.94 -0.87 0.00 0.00 176.83 175.74 1vvd s SER 100 N -6.38 5.70 0.51 4.97 1.04 -1.26 0.26 113.70 118.55 1vvd s SER 100 Ca -0.14 -0.42 0.01 0.00 0.48 0.00 0.00 55.95 55.88 1vvd s SER 100 Cb 0.05 -2.04 -0.01 0.00 0.10 0.00 0.00 66.02 64.11 1vvd s SER 100 CO 0.78 -0.18 0.01 -0.44 0.98 0.00 0.00 173.24 174.39 1vvd s SER 101 N 1.66 4.04 -0.18 7.02 0.01 -0.75 -4.54 113.70 120.96 1vvd s SER 101 Ca 0.05 -1.68 -0.12 0.00 1.31 0.00 0.00 55.95 55.51 1vvd s SER 101 Cb -0.17 0.58 0.05 0.00 0.21 0.00 0.00 66.02 66.70 1vvd s SER 101 CO 0.08 -0.89 0.45 -0.89 0.41 0.00 0.00 173.24 172.40 1vvd s THR 102 N -2.91 -0.01 -0.97 1.44 2.01 0.30 0.93 115.64 116.44 1vvd s THR 102 Ca 0.05 0.05 -0.27 0.00 0.31 0.00 0.00 61.69 61.83 1vvd s THR 102 Cb 0.01 -0.65 -0.23 0.00 0.01 0.00 0.00 72.50 71.65 1vvd s THR 102 CO 0.03 0.02 2.02 0.00 -0.69 0.00 0.00 174.62 176.00 1vvd n SER 104 N 17.40 -3.32 -0.77 0.00 2.88 -0.88 0.26 113.62 129.18 1vvd n SER 104 Ca 0.43 -0.56 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 1vvd n SER 104 Cb 0.46 -0.98 0.00 0.00 -0.75 0.00 0.00 64.21 62.94 1vvd n SER 104 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1vvd n PRO 105 N -4.26 0.95 -0.12 -1.46 -0.04 -1.25 -3.25 135.00 125.58 1vvd n PRO 105 Ca 0.08 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.62 1vvd n PRO 105 Cb 0.53 -1.23 0.11 0.00 -0.04 0.00 0.00 33.50 32.86 1vvd n PRO 105 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vvd n GLY 106 N 0.30 4.02 3.08 0.55 0.00 -1.26 -4.64 105.19 107.24 1vvd n GLY 106 Ca 0.00 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.14 -3.26 -3.08 1.61 3.02 -1.20 -4.93 115.26 106.27 1vvd n ASN 107 Ca 0.12 -0.56 -0.06 0.00 -0.03 0.00 0.00 54.58 54.05 1vvd n ASN 107 Cb 0.61 -4.54 0.02 0.00 -0.61 0.00 0.00 39.78 35.26 1vvd n ASN 107 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1vvd s THR 108 N -3.32 0.00 -0.66 3.41 -4.23 -1.26 -4.07 115.64 105.52 1vvd s THR 108 Ca 0.12 -0.82 -0.05 0.00 -1.18 0.00 0.00 61.69 59.76 1vvd s THR 108 Cb -0.02 -2.93 0.17 0.00 1.34 0.00 0.00 72.50 71.07 1vvd s THR 108 CO 0.64 0.00 0.50 0.26 -0.54 0.00 0.00 174.62 175.47 1vvd s TRP 109 N -2.18 3.48 0.15 3.99 0.52 -1.26 -2.06 118.94 121.57 1vvd s TRP 109 Ca 0.19 -2.56 0.03 0.00 0.02 0.00 0.00 56.10 53.77 1vvd s TRP 109 Cb -0.04 -3.32 -0.04 0.00 -1.15 0.00 0.00 33.47 28.92 1vvd s TRP 109 CO 0.09 -0.87 0.28 0.15 0.02 0.00 0.00 176.95 176.61 1vvd s LYS 110 N 0.02 3.41 1.25 4.98 -0.14 -0.90 -3.54 119.74 124.83 1vvd s LYS 110 Ca 0.17 -0.61 -0.21 0.00 -1.36 0.00 0.00 55.97 53.95 1vvd s LYS 110 Cb -0.19 -2.95 0.31 0.00 -1.68 0.00 0.00 37.83 33.33 1vvd s LYS 110 CO -0.04 0.52 1.10 -0.35 -0.76 0.00 0.00 175.35 175.81 1vvd n PRO 111 N -0.53 -3.23 -1.23 -1.68 -0.04 -1.26 0.11 135.00 127.13 1vvd n PRO 111 Ca -0.07 -1.76 -0.48 0.00 -0.04 0.00 0.00 63.50 61.15 1vvd n PRO 111 Cb 0.54 -1.67 -0.07 0.00 -0.04 0.00 0.00 33.50 32.26 1vvd n PRO 111 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1vvd n GLU 112 N -4.92 0.00 -1.56 0.54 1.02 -1.26 -4.73 120.64 109.74 1vvd n GLU 112 Ca 0.15 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.86 1vvd n GLU 112 Cb 0.60 -1.08 -0.01 0.00 -0.02 0.00 0.00 31.44 30.93 1vvd n GLU 112 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1vvd n LEU 113 N 2.56 1.41 -4.77 -4.62 7.94 -1.23 -3.03 117.00 115.26 1vvd n LEU 113 Ca 0.21 1.10 -0.32 0.00 -1.11 0.00 0.00 56.01 55.89 1vvd n LEU 113 Cb -0.03 -1.25 0.07 0.00 0.53 0.00 0.00 43.42 42.75 1vvd n LEU 113 CO 0.61 -1.79 0.71 -2.16 -1.11 0.00 0.00 177.39 173.65 1vvd s PRO 114 N -1.61 2.48 -0.27 1.96 0.04 -1.18 -4.34 135.00 132.08 1vvd s PRO 114 Ca 0.61 1.21 0.02 0.00 0.04 0.00 0.00 61.00 62.88 1vvd s PRO 114 Cb -0.67 -1.92 0.07 0.00 0.04 0.00 0.00 34.50 32.02 1vvd s PRO 114 CO 0.59 -1.48 -0.03 0.21 0.04 0.00 0.00 177.00 176.33 1vvd s LYS 115 N -4.67 1.63 -0.97 4.56 2.20 0.00 -4.21 119.74 118.28 1vvd s LYS 115 Ca 0.63 -1.23 -0.26 0.00 -0.36 0.00 0.00 55.97 54.74 1vvd s LYS 115 Cb -0.18 -2.71 -0.21 0.00 -1.51 0.00 0.00 37.83 33.22 1vvd s LYS 115 CO 0.51 -0.69 2.00 0.00 -0.36 0.00 0.00 175.35 176.81 1vvd n VAL 117 N 8.38 0.00 -0.41 0.00 0.24 0.23 -4.61 118.33 122.16 1vvd n VAL 117 Ca 0.43 -0.63 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 1vvd n VAL 117 Cb 0.46 -1.16 0.00 0.00 -1.47 0.00 0.00 33.84 31.67 1vvd n VAL 117 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58