#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 1.76 -0.37 5.55 -2.85 -1.25 -4.84 119.74 117.74 1vvd s LYS 2 Ca 0.00 -2.03 0.06 0.00 -1.00 0.00 0.00 55.97 53.00 1vvd s LYS 2 Cb 0.00 0.09 0.19 0.00 -2.06 0.00 0.00 37.83 36.05 1vvd s LYS 2 CO 0.00 -0.59 0.65 0.00 0.10 0.00 0.00 175.35 175.51 1vvd s GLN 4 N 2.17 -0.50 0.33 0.00 -0.21 -1.26 0.28 119.66 120.48 1vvd s GLN 4 Ca 0.15 -0.11 -0.27 0.00 0.02 0.00 0.00 55.36 55.14 1vvd s GLN 4 Cb -0.05 -1.68 -0.13 0.00 1.00 0.00 0.00 33.01 32.14 1vvd s GLN 4 CO -0.13 -3.23 1.07 -1.13 -2.12 0.00 0.00 175.29 169.75 1vvd n SER 5 N -4.41 1.60 -4.78 5.90 3.41 -1.24 -4.46 113.62 109.65 1vvd n SER 5 Ca 0.13 1.15 -0.34 0.00 -0.26 0.00 0.00 58.87 59.55 1vvd n SER 5 Cb 0.59 -1.35 0.02 0.00 -0.26 0.00 0.00 64.21 63.22 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 -1.74 3.12 0.92 4.33 0.04 -1.26 -5.03 135.00 135.38 1vvd s PRO 6 Ca 0.59 1.42 -0.13 0.00 0.04 0.00 0.00 61.00 62.92 1vvd s PRO 6 Cb -0.64 -1.99 0.15 0.00 0.04 0.00 0.00 34.50 32.06 1vvd s PRO 6 CO 0.60 -1.00 1.14 -1.25 0.04 0.00 0.00 177.00 176.53 1vvd s PRO 7 N -3.80 1.03 1.22 0.56 0.04 -1.26 -4.79 135.00 128.00 1vvd s PRO 7 Ca 0.68 0.25 -0.20 0.00 0.04 0.00 0.00 61.00 61.77 1vvd s PRO 7 Cb -0.20 -1.83 0.29 0.00 0.04 0.00 0.00 34.50 32.80 1vvd s PRO 7 CO 0.35 -2.26 1.11 -1.54 0.04 0.00 0.00 177.00 174.69 1vvd s SER 8 N -4.06 0.77 0.01 6.66 1.04 -1.26 -4.65 113.70 112.21 1vvd s SER 8 Ca 0.64 0.61 0.00 0.00 0.48 0.00 0.00 55.95 57.68 1vvd s SER 8 Cb -0.14 -0.83 -0.00 0.00 0.10 0.00 0.00 66.02 65.15 1vvd s SER 8 CO 0.53 -4.21 0.01 2.30 0.98 0.00 0.00 173.24 172.85 1vvd n ILE 9 N -4.82 0.00 -1.37 -1.02 -5.35 0.60 -4.98 119.36 102.43 1vvd n ILE 9 Ca 0.14 -0.04 -0.26 0.00 -0.27 0.00 0.00 62.75 62.31 1vvd n ILE 9 Cb 0.60 0.02 -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 -2.74 -0.77 -2.57 7.28 7.64 -1.26 -0.42 113.62 120.79 1vvd n SER 10 Ca 0.00 -0.26 -0.06 0.00 1.01 0.00 0.00 58.87 59.56 1vvd n SER 10 Cb 0.01 -0.61 -0.00 0.00 -1.01 0.00 0.00 64.21 62.60 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 6.65 -2.01 -4.18 6.43 5.03 -1.26 -3.90 115.26 122.03 1vvd n ASN 11 Ca 0.61 0.33 -0.11 0.00 0.87 0.00 0.00 54.58 56.28 1vvd n ASN 11 Cb 0.09 -1.80 -0.10 0.00 -1.02 0.00 0.00 39.78 36.95 1vvd n ASN 11 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1vvd s GLY 12 N -2.07 0.92 0.16 7.41 0.00 0.44 -3.02 107.32 111.16 1vvd s GLY 12 Ca 0.04 -1.43 0.00 0.00 0.00 0.00 0.00 44.72 43.33 1vvd s GLY 12 CO 0.05 -1.45 0.02 -0.96 0.00 0.00 0.00 173.10 170.76 1vvd n ARG 13 N -0.10 1.56 -4.18 2.90 1.85 0.28 -0.29 116.66 118.68 1vvd n ARG 13 Ca -0.09 -1.14 -0.16 0.00 -1.00 0.00 0.00 57.85 55.45 1vvd n ARG 13 Cb 0.62 0.28 -0.11 0.00 -1.05 0.00 0.00 32.46 32.20 1vvd n ARG 13 CO 0.00 0.00 0.00 -3.38 -0.01 0.00 0.00 177.63 174.24 1vvd s HIS 14 N -1.46 1.14 0.00 2.89 -3.43 -1.26 0.25 115.29 113.41 1vvd s HIS 14 Ca 0.01 -0.58 0.00 0.00 -0.80 0.00 0.00 55.06 53.70 1vvd s HIS 14 Cb -0.00 -0.62 0.00 0.00 -1.43 0.00 0.00 32.58 30.53 1vvd s HIS 14 CO 0.01 0.04 0.00 -1.71 -2.00 0.00 0.00 174.74 171.08 1vvd n ASN 15 N 0.79 0.00 0.00 7.38 5.15 -1.23 -4.83 115.26 122.52 1vvd n ASN 15 Ca -0.18 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.80 1vvd n ASN 15 Cb 0.56 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.81 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 0.00 1.57 3.19 8.20 0.00 -1.26 -3.76 105.19 113.14 1vvd n GLY 16 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 -2.71 -4.08 1.61 4.01 -1.26 -5.03 117.16 109.71 1vvd n TYR 17 Ca 0.00 0.99 -0.08 0.00 -0.16 0.00 0.00 57.90 58.64 1vvd n TYR 17 Cb 0.00 -4.03 -0.03 0.00 -0.31 0.00 0.00 39.34 34.97 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 -2.46 0.20 0.00 -0.72 -0.00 -1.26 -5.08 120.64 111.32 1vvd n GLU 18 Ca -0.04 -1.46 0.00 0.00 -0.00 0.00 0.00 57.16 55.65 1vvd n GLU 18 Cb 0.56 1.23 0.00 0.00 -0.00 0.00 0.00 31.44 33.22 1vvd n GLU 18 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1vvd n ASP 19 N -2.34 0.00 -2.75 -1.84 8.00 -1.26 -5.04 116.55 111.33 1vvd n ASP 19 Ca 0.03 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.45 1vvd n ASP 19 Cb 0.27 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.42 1vvd n ASP 19 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1vvd n PHE 20 N -0.84 -3.27 -0.68 1.24 -1.74 -1.26 -3.70 117.46 107.22 1vvd n PHE 20 Ca 0.00 -1.68 -0.22 0.00 -0.56 0.00 0.00 57.45 54.99 1vvd n PHE 20 Cb 0.00 1.54 0.11 0.00 1.52 0.00 0.00 39.48 42.65 1vvd n PHE 20 CO 0.00 0.00 0.00 0.66 -0.56 0.00 0.00 176.76 176.86 1vvd n TYR 21 N 1.73 -1.79 0.05 2.97 4.01 0.82 -4.50 117.16 120.45 1vvd n TYR 21 Ca 0.09 0.25 0.00 0.00 -0.16 0.00 0.00 57.90 58.09 1vvd n TYR 21 Cb 0.63 -1.42 0.00 0.00 -0.31 0.00 0.00 39.34 38.24 1vvd n TYR 21 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1vvd n THR 22 N -4.03 0.21 -3.61 -0.72 -1.04 -1.25 0.53 114.28 104.37 1vvd n THR 22 Ca 0.02 0.07 -0.08 0.00 -2.04 0.00 0.00 64.05 62.03 1vvd n THR 22 Cb 0.43 -0.88 -0.05 0.00 -1.82 0.00 0.00 70.33 68.00 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 -5.17 -0.27 -0.29 8.00 2.15 -1.25 -3.67 116.67 116.17 1vvd s ASP 23 Ca 0.00 0.35 0.00 0.00 0.43 0.00 0.00 52.55 53.33 1vvd s ASP 23 Cb 0.00 0.29 0.00 0.00 -0.30 0.00 0.00 42.92 42.91 1vvd s ASP 23 CO 0.00 -0.22 0.00 0.61 -0.17 0.00 0.00 175.17 175.39 1vvd n GLY 24 N 0.91 0.40 3.95 2.66 0.00 0.46 -4.90 105.19 108.67 1vvd n GLY 24 Ca -0.08 -0.06 -0.26 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.15 4.19 0.04 1.61 0.01 -0.97 -4.83 113.70 111.60 1vvd s SER 25 Ca 0.00 0.09 -0.16 0.00 1.31 0.00 0.00 55.95 57.20 1vvd s SER 25 Cb 0.00 -0.48 0.03 0.00 0.21 0.00 0.00 66.02 65.77 1vvd s SER 25 CO 0.00 -1.99 0.35 -0.69 0.41 0.00 0.00 173.24 171.32 1vvd s VAL 26 N -3.37 0.07 -0.10 3.43 1.01 -1.25 -0.68 120.40 119.50 1vvd s VAL 26 Ca 0.66 -0.58 -0.02 0.00 0.00 0.00 0.00 61.98 62.04 1vvd s VAL 26 Cb -0.07 -0.94 0.04 0.00 0.00 0.00 0.00 36.38 35.41 1vvd s VAL 26 CO 0.47 -0.32 0.01 -0.69 0.00 0.00 0.00 175.10 174.56 1vvd s VAL 27 N -2.50 0.44 -0.51 2.92 1.01 -0.98 -4.80 120.40 115.98 1vvd s VAL 27 Ca -0.05 -0.07 -0.27 0.00 0.00 0.00 0.00 61.98 61.59 1vvd s VAL 27 Cb -0.01 -0.68 -0.01 0.00 0.00 0.00 0.00 36.38 35.67 1vvd s VAL 27 CO -0.03 0.15 1.76 0.42 0.00 0.00 0.00 175.10 177.40 1vvd s THR 28 N 1.93 3.47 0.19 3.92 -4.23 -1.25 -0.40 115.64 119.28 1vvd s THR 28 Ca 0.04 0.39 -0.30 0.00 -1.18 0.00 0.00 61.69 60.63 1vvd s THR 28 Cb -0.13 -3.92 -0.09 0.00 1.34 0.00 0.00 72.50 69.70 1vvd s THR 28 CO -0.06 -0.77 1.37 -0.31 -0.54 0.00 0.00 174.62 174.31 1vvd s TYR 29 N 7.85 3.19 0.26 3.99 1.51 -1.26 -3.52 117.35 129.37 1vvd s TYR 29 Ca 0.69 1.08 -0.05 0.00 -1.01 0.00 0.00 57.07 57.78 1vvd s TYR 29 Cb -0.15 -3.69 -0.05 0.00 -0.11 0.00 0.00 41.96 37.95 1vvd s TYR 29 CO 0.26 -2.27 0.52 -1.12 -1.11 0.00 0.00 175.55 171.83 1vvd s SER 30 N 0.58 6.47 0.19 2.29 0.01 0.68 -4.88 113.70 119.04 1vvd s SER 30 Ca 0.60 0.70 0.11 0.00 1.31 0.00 0.00 55.95 58.67 1vvd s SER 30 Cb -0.38 -2.14 -0.04 0.00 0.21 0.00 0.00 66.02 63.67 1vvd s SER 30 CO 0.37 -0.14 -0.23 0.00 0.41 0.00 0.00 173.24 173.65 1vvd n ASN 32 N 0.22 0.43 -4.36 0.00 2.85 -1.17 -4.60 115.26 108.62 1vvd n ASN 32 Ca -0.12 1.15 -0.53 0.00 -0.11 0.00 0.00 54.58 54.97 1vvd n ASN 32 Cb 0.56 -1.18 -0.10 0.00 1.24 0.00 0.00 39.78 40.30 1vvd n ASN 32 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1vvd n SER 33 N 1.45 1.33 0.00 1.20 2.88 -1.26 0.31 113.62 119.53 1vvd n SER 33 Ca 0.12 0.48 0.00 0.00 -1.33 0.00 0.00 58.87 58.14 1vvd n SER 33 Cb 0.30 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 1vvd n SER 33 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vvd n GLY 34 N 6.96 1.19 3.68 0.46 0.00 -1.26 -5.10 105.19 111.11 1vvd n GLY 34 Ca 0.50 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.00 3.02 0.03 1.61 1.51 0.15 -4.74 117.35 116.94 1vvd s TYR 35 Ca 0.00 0.03 -0.20 0.00 -1.01 0.00 0.00 57.07 55.89 1vvd s TYR 35 Cb 0.00 -1.61 -0.06 0.00 -0.11 0.00 0.00 41.96 40.18 1vvd s TYR 35 CO 0.00 0.46 0.57 0.45 -1.11 0.00 0.00 175.55 175.92 1vvd s SER 36 N -1.84 7.01 -0.43 2.29 0.15 0.75 -4.78 113.70 116.85 1vvd s SER 36 Ca 0.22 1.20 -0.19 0.00 0.70 0.00 0.00 55.95 57.88 1vvd s SER 36 Cb -0.12 -2.36 0.02 0.00 -1.71 0.00 0.00 66.02 61.86 1vvd s SER 36 CO 0.13 0.20 0.55 -0.22 1.20 0.00 0.00 173.24 175.10 1vvd s LEU 37 N -0.69 4.67 0.04 3.45 2.96 -1.25 -1.04 118.68 126.82 1vvd s LEU 37 Ca 0.29 -0.50 0.03 0.00 -0.22 0.00 0.00 54.13 53.74 1vvd s LEU 37 Cb -0.19 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.90 1vvd s LEU 37 CO 0.18 -0.69 0.02 -0.63 -1.32 0.00 0.00 176.35 173.91 1vvd s ILE 38 N 2.50 4.21 0.00 6.68 -1.09 0.14 -4.83 121.20 128.80 1vvd s ILE 38 Ca 0.18 -0.75 0.00 0.00 -2.23 0.00 0.00 60.65 57.85 1vvd s ILE 38 Cb -0.15 -2.95 0.00 0.00 -1.58 0.00 0.00 42.46 37.78 1vvd s ILE 38 CO 0.16 0.24 0.00 0.61 -1.23 0.00 0.00 174.94 174.73 1vvd n GLY 39 N 0.94 -0.94 3.72 6.18 0.00 -1.26 0.27 105.19 114.10 1vvd n GLY 39 Ca -0.12 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.35 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 6.63 -0.39 1.61 0.01 -1.26 -4.84 114.94 112.70 1vvd s ASN 40 Ca 0.00 2.59 -0.05 0.00 -0.71 0.00 0.00 52.86 54.69 1vvd s ASN 40 Cb 0.00 -2.60 -0.15 0.00 0.41 0.00 0.00 41.25 38.91 1vvd s ASN 40 CO 0.00 -0.78 2.60 -1.54 -1.51 0.00 0.00 177.10 175.87 1vvd n SER 41 N 3.70 4.54 0.00 -1.22 3.41 -1.26 -4.24 113.62 118.55 1vvd n SER 41 Ca 0.12 -2.26 0.00 0.00 -0.26 0.00 0.00 58.87 56.47 1vvd n SER 41 Cb 0.39 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.26 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 3.00 1.78 3.00 5.00 0.00 -1.25 -4.51 105.19 112.21 1vvd n GLY 42 Ca 0.39 0.18 -0.18 0.00 0.00 0.00 0.00 46.02 46.41 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 -3.59 1.61 0.31 0.46 -4.28 118.33 112.84 1vvd n VAL 43 Ca 0.00 -0.05 -0.27 0.00 -0.01 0.00 0.00 64.34 64.01 1vvd n VAL 43 Cb 0.00 -0.40 -0.16 0.00 -0.91 0.00 0.00 33.84 32.36 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 1.56 0.52 -0.53 7.52 2.96 -0.85 -2.32 118.68 127.54 1vvd s LEU 44 Ca 0.33 -0.92 -0.24 0.00 -0.22 0.00 0.00 54.13 53.07 1vvd s LEU 44 Cb -0.05 -0.32 0.04 0.00 0.50 0.00 0.00 46.19 46.36 1vvd s LEU 44 CO 0.34 -0.39 0.94 0.00 -1.32 0.00 0.00 176.35 175.92 1vvd s SER 46 N 2.69 4.30 0.00 0.00 0.01 -1.04 0.17 113.70 119.83 1vvd s SER 46 Ca 0.32 -1.67 0.00 0.00 1.31 0.00 0.00 55.95 55.91 1vvd s SER 46 Cb -0.12 -1.32 0.00 0.00 0.21 0.00 0.00 66.02 64.80 1vvd s SER 46 CO 0.21 -0.33 0.00 0.61 0.41 0.00 0.00 173.24 174.14 1vvd n GLY 47 N 4.53 0.63 4.00 3.44 0.00 -1.26 -3.93 105.19 112.61 1vvd n GLY 47 Ca -0.04 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.15 -0.30 3.06 -0.02 0.00 -1.02 -4.93 105.19 100.83 1vvd n GLY 48 Ca 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 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 -6.63 0.52 0.28 1.61 2.02 -1.25 -5.02 118.70 110.24 1vvd s GLU 49 Ca 0.22 0.31 -0.29 0.00 0.02 0.00 0.00 54.97 55.23 1vvd s GLU 49 Cb -0.12 0.01 -0.10 0.00 0.10 0.00 0.00 34.13 34.03 1vvd s GLU 49 CO 0.89 -1.06 1.30 -1.58 0.02 0.00 0.00 175.26 174.83 1vvd s TRP 50 N 2.63 3.15 0.20 1.61 0.52 -1.26 -2.49 118.94 123.30 1vvd s TRP 50 Ca 0.10 1.35 -0.01 0.00 0.02 0.00 0.00 56.10 57.56 1vvd s TRP 50 Cb -0.11 -3.64 -0.04 0.00 -1.15 0.00 0.00 33.47 28.54 1vvd s TRP 50 CO -0.26 -1.83 0.13 -1.54 0.02 0.00 0.00 176.95 173.48 1vvd s SER 51 N -0.21 0.15 -0.92 2.95 1.04 -0.61 -4.91 113.70 111.19 1vvd s SER 51 Ca 0.52 -1.37 -0.08 0.00 0.48 0.00 0.00 55.95 55.50 1vvd s SER 51 Cb -0.38 0.38 -0.01 0.00 0.10 0.00 0.00 66.02 66.11 1vvd s SER 51 CO 0.47 -0.84 0.73 0.47 0.98 0.00 0.00 173.24 175.04 1vvd n ASP 52 N -0.26 -6.17 -4.72 7.02 9.92 -1.26 -2.01 116.55 119.06 1vvd n ASP 52 Ca 0.02 -0.66 -0.38 0.00 -0.53 0.00 0.00 54.79 53.23 1vvd n ASP 52 Cb 0.66 -3.76 -0.06 0.00 -0.64 0.00 0.00 41.12 37.32 1vvd n ASP 52 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 1vvd s PRO 53 N -4.59 4.35 0.98 -0.24 0.04 -1.26 -4.32 135.00 129.97 1vvd s PRO 53 Ca 0.20 0.55 -0.16 0.00 0.04 0.00 0.00 61.00 61.63 1vvd s PRO 53 Cb -0.06 -3.43 0.20 0.00 0.04 0.00 0.00 34.50 31.24 1vvd s PRO 53 CO 0.82 0.16 1.25 -1.25 0.04 0.00 0.00 177.00 178.02 1vvd s PRO 54 N 0.60 0.50 0.20 0.56 0.04 -1.26 -4.78 135.00 130.86 1vvd s PRO 54 Ca 0.29 -0.23 0.07 0.00 0.04 0.00 0.00 61.00 61.16 1vvd s PRO 54 Cb -0.16 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 1vvd s PRO 54 CO 0.12 -2.53 0.07 0.95 0.04 0.00 0.00 177.00 175.65 1vvd s THR 55 N -3.65 4.00 -0.67 1.26 -4.23 0.77 -4.79 115.64 108.34 1vvd s THR 55 Ca 0.71 -1.41 0.05 0.00 -1.18 0.00 0.00 61.69 59.86 1vvd s THR 55 Cb -0.07 -3.07 0.17 0.00 1.34 0.00 0.00 72.50 70.88 1vvd s THR 55 CO 0.53 -0.19 0.48 0.00 -0.54 0.00 0.00 174.62 174.89 1vvd n GLN 57 N 2.08 3.51 -3.70 0.00 1.13 -0.21 -4.70 117.38 115.49 1vvd n GLN 57 Ca 0.21 0.00 -0.25 0.00 -1.94 0.00 0.00 57.00 55.02 1vvd n GLN 57 Cb 0.37 0.00 -0.17 0.00 0.11 0.00 0.00 30.24 30.55 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 3.49 0.20 -0.77 5.09 1.09 -1.26 0.27 121.20 129.31 1vvd s ILE 58 Ca 0.00 -0.11 0.03 0.00 -1.10 0.00 0.00 60.65 59.47 1vvd s ILE 58 Cb 0.00 -0.62 0.33 0.00 -1.06 0.00 0.00 42.46 41.10 1vvd s ILE 58 CO 0.00 -0.05 1.29 1.33 -0.10 0.00 0.00 174.94 177.41 1vvd n VAL 59 N 5.18 4.28 -1.32 2.92 0.24 -1.26 -4.83 118.33 123.54 1vvd n VAL 59 Ca -0.07 -5.74 -0.31 0.00 -2.04 0.00 0.00 64.34 56.18 1vvd n VAL 59 Cb 0.49 -1.50 0.09 0.00 -1.47 0.00 0.00 33.84 31.44 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 -3.75 2.32 0.39 7.34 1.02 -1.26 -3.63 119.74 122.17 1vvd s LYS 60 Ca 0.44 1.20 0.08 0.00 0.02 0.00 0.00 55.97 57.71 1vvd s LYS 60 Cb 0.23 -1.90 -0.07 0.00 -0.52 0.00 0.00 37.83 35.57 1vvd s LYS 60 CO -0.12 -1.60 0.01 0.00 -0.92 0.00 0.00 175.35 172.72 1vvd n PRO 62 N -0.97 0.00 0.00 0.00 -0.04 -1.26 -4.48 135.00 128.25 1vvd n PRO 62 Ca -0.04 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1vvd n PRO 62 Cb 0.66 -0.21 0.00 0.00 -0.04 0.00 0.00 33.50 33.91 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 -0.82 0.00 -1.36 0.54 8.25 -1.26 -4.85 115.22 115.72 1vvd n HIS 63 Ca 0.00 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.07 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 -0.35 0.64 0.00 0.00 176.34 176.63 1vvd n PRO 64 N 0.00 2.44 -2.02 -0.41 -0.04 -1.26 -4.92 135.00 128.80 1vvd n PRO 64 Ca 0.00 -2.16 -0.29 0.00 -0.04 0.00 0.00 63.50 61.02 1vvd n PRO 64 Cb 0.00 -2.99 0.14 0.00 -0.04 0.00 0.00 33.50 30.61 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 3.66 2.04 -0.07 0.52 -4.23 -1.26 -4.61 115.64 111.69 1vvd s THR 65 Ca 0.53 -0.08 -0.31 0.00 -1.18 0.00 0.00 61.69 60.64 1vvd s THR 65 Cb 0.14 -2.95 0.12 0.00 1.34 0.00 0.00 72.50 71.14 1vvd s THR 65 CO -0.01 0.00 1.12 -0.51 -0.54 0.00 0.00 174.62 174.68 1vvd s ILE 66 N -3.68 0.00 -0.65 2.99 2.07 -1.26 -4.71 121.20 115.96 1vvd s ILE 66 Ca 0.69 -0.13 -0.27 0.00 -1.41 0.00 0.00 60.65 59.53 1vvd s ILE 66 Cb -0.06 -1.35 -0.01 0.00 0.13 0.00 0.00 42.46 41.17 1vvd s ILE 66 CO 0.50 0.00 1.69 -0.94 -1.91 0.00 0.00 174.94 174.28 1vvd s SER 67 N -2.52 5.54 -1.62 4.50 1.04 -1.26 -3.89 113.70 115.50 1vvd s SER 67 Ca 0.10 0.11 -0.10 0.00 0.48 0.00 0.00 55.95 56.54 1vvd s SER 67 Cb 0.00 -2.54 0.09 0.00 0.10 0.00 0.00 66.02 63.68 1vvd s SER 67 CO -0.05 -2.21 0.47 0.59 0.98 0.00 0.00 173.24 173.03 1vvd n ASN 68 N 11.71 -1.24 -1.34 7.02 4.13 -1.26 -2.71 115.26 131.58 1vvd n ASN 68 Ca 0.15 -1.11 -0.03 0.00 1.68 0.00 0.00 54.58 55.27 1vvd n ASN 68 Cb 0.51 -2.38 -0.02 0.00 -1.54 0.00 0.00 39.78 36.35 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 -1.79 0.81 1.74 7.41 0.00 -1.25 0.50 105.19 112.62 1vvd n GLY 69 Ca -0.12 -0.33 -0.04 0.00 0.00 0.00 0.00 46.02 45.53 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 0.04 -1.33 -4.12 1.61 4.11 -1.25 -3.20 117.16 113.02 1vvd n TYR 70 Ca -0.15 0.20 -0.23 0.00 -0.00 0.00 0.00 57.90 57.72 1vvd n TYR 70 Cb 0.86 -0.82 -0.06 0.00 -0.00 0.00 0.00 39.34 39.32 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 3.36 0.00 -3.48 -0.00 -1.26 0.31 118.68 117.61 1vvd s LEU 71 Ca 0.10 -0.63 0.00 0.00 -0.00 0.00 0.00 54.13 53.60 1vvd s LEU 71 Cb -0.02 -1.88 0.00 0.00 -0.00 0.00 0.00 46.19 44.30 1vvd s LEU 71 CO 0.08 -0.19 0.63 -0.24 -0.00 0.00 0.00 176.35 176.64 1vvd n SER 72 N -1.11 0.00 -0.00 1.48 2.88 -1.09 -4.75 113.62 111.03 1vvd n SER 72 Ca -0.04 -1.38 -0.00 0.00 -1.33 0.00 0.00 58.87 56.11 1vvd n SER 72 Cb 0.60 -0.08 -0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1vvd n SER 72 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1vvd n SER 73 N 0.00 0.04 -3.48 -3.46 2.88 -1.26 -4.90 113.62 103.44 1vvd n SER 73 Ca 0.00 0.14 -0.27 0.00 -1.33 0.00 0.00 58.87 57.41 1vvd n SER 73 Cb 0.58 -0.51 -0.11 0.00 -0.75 0.00 0.00 64.21 63.42 1vvd n SER 73 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1vvd s GLY 74 N -2.77 1.42 0.25 0.46 0.00 -1.26 -5.01 107.32 100.41 1vvd s GLY 74 Ca -0.00 -2.59 0.07 0.00 0.00 0.00 0.00 44.72 42.20 1vvd s GLY 74 CO 0.01 1.96 0.19 -0.12 0.00 0.00 0.00 173.10 175.14 1vvd s PHE 75 N -0.03 3.10 -0.08 1.90 2.19 -1.26 -4.53 117.98 119.27 1vvd s PHE 75 Ca 0.30 -0.11 -0.27 0.00 0.33 0.00 0.00 56.93 57.17 1vvd s PHE 75 Cb -0.01 -1.40 0.06 0.00 -1.31 0.00 0.00 43.02 40.36 1vvd s PHE 75 CO -0.17 0.52 0.63 0.21 1.83 0.00 0.00 175.22 178.25 1vvd s LYS 76 N -3.84 0.96 0.45 10.12 2.20 -1.26 -5.01 119.74 123.36 1vvd s LYS 76 Ca 0.33 0.33 0.30 0.00 -0.36 0.00 0.00 55.97 56.56 1vvd s LYS 76 Cb -0.08 0.45 1.39 0.00 -1.51 0.00 0.00 37.83 38.08 1vvd s LYS 76 CO 0.25 -0.27 1.69 0.00 -0.36 0.00 0.00 175.35 176.66 1vvd h ARG 77 N 3.50 0.14 -3.76 4.03 3.08 -2.00 -3.40 114.38 115.97 1vvd h ARG 77 Ca -0.28 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 59.63 1vvd h ARG 77 Cb 1.15 -0.03 -0.18 0.00 0.08 0.00 0.00 29.97 30.98 1vvd h ARG 77 CO 0.33 0.09 -0.53 -1.12 -1.07 0.00 0.00 179.97 177.68 1vvd s SER 78 N -4.74 0.15 0.00 7.04 0.01 -1.26 -4.90 113.70 109.99 1vvd s SER 78 Ca -0.07 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.72 1vvd s SER 78 Cb 0.27 0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.71 1vvd s SER 78 CO 0.82 -0.46 0.00 -1.22 0.41 0.00 0.00 173.24 172.79 1vvd n TYR 79 N 0.97 0.00 0.00 2.43 4.02 -1.26 -4.96 117.16 118.36 1vvd n TYR 79 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.69 1vvd n TYR 79 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.90 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 0.00 0.00 -2.22 7.72 3.41 -1.25 -3.58 113.62 117.70 1vvd n SER 80 Ca 0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.37 1vvd n SER 80 Cb 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.13 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 3.06 0.00 7.33 4.11 -0.92 -4.17 117.16 126.56 1vvd n TYR 81 Ca 0.00 -1.83 0.00 0.00 -0.00 0.00 0.00 57.90 56.07 1vvd n TYR 81 Cb 0.00 -0.94 0.00 0.00 -0.00 0.00 0.00 39.34 38.40 1vvd n TYR 81 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 1vvd n ASN 82 N -1.13 0.00 -3.32 9.48 5.15 0.54 -4.04 115.26 121.94 1vvd n ASN 82 Ca 0.59 0.00 -0.20 0.00 -0.60 0.00 0.00 54.58 54.38 1vvd n ASN 82 Cb 1.67 0.00 0.01 0.00 -0.53 0.00 0.00 39.78 40.94 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 -6.44 -4.69 1.20 9.92 -1.26 0.26 116.55 115.54 1vvd n ASP 83 Ca 0.00 -0.17 -0.42 0.00 -0.53 0.00 0.00 54.79 53.67 1vvd n ASP 83 Cb 0.00 -3.37 -0.03 0.00 -0.64 0.00 0.00 41.12 37.08 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 -2.46 6.79 -0.27 -2.24 2.20 -1.26 -3.68 114.94 114.03 1vvd s ASN 84 Ca 0.17 2.21 -0.07 0.00 -0.94 0.00 0.00 52.86 54.23 1vvd s ASN 84 Cb -0.03 -2.56 -0.01 0.00 -2.00 0.00 0.00 41.25 36.64 1vvd s ASN 84 CO 0.83 -0.75 0.07 0.68 -2.94 0.00 0.00 177.10 174.99 1vvd s VAL 85 N 2.37 4.14 0.19 3.54 -7.23 0.41 -4.47 120.40 119.35 1vvd s VAL 85 Ca 0.66 -0.38 -0.30 0.00 -1.81 0.00 0.00 61.98 60.15 1vvd s VAL 85 Cb -0.34 -3.01 -0.08 0.00 0.56 0.00 0.00 36.38 33.52 1vvd s VAL 85 CO 0.28 0.24 0.99 -0.62 -0.31 0.00 0.00 175.10 175.68 1vvd s ASP 86 N 1.57 7.51 -0.07 4.85 2.15 -1.26 -2.14 116.67 129.28 1vvd s ASP 86 Ca 0.05 1.95 -0.13 0.00 0.43 0.00 0.00 52.55 54.86 1vvd s ASP 86 Cb -0.16 -2.60 -0.05 0.00 -0.30 0.00 0.00 42.92 39.81 1vvd s ASP 86 CO 0.03 0.00 0.32 -0.36 -0.17 0.00 0.00 175.17 174.99 1vvd s PHE 87 N -0.67 3.64 -0.57 -5.34 0.40 0.77 -2.65 117.98 113.56 1vvd s PHE 87 Ca 0.44 0.79 -0.04 0.00 -0.60 0.00 0.00 56.93 57.52 1vvd s PHE 87 Cb -0.26 -2.21 0.15 0.00 0.51 0.00 0.00 43.02 41.20 1vvd s PHE 87 CO 0.33 0.58 0.40 0.21 0.70 0.00 0.00 175.22 177.43 1vvd s LYS 88 N -0.72 2.49 0.08 0.44 2.20 0.91 -4.88 119.74 120.26 1vvd s LYS 88 Ca 0.20 -2.27 -0.36 0.00 -0.36 0.00 0.00 55.97 53.18 1vvd s LYS 88 Cb -0.15 -3.77 -0.18 0.00 -1.51 0.00 0.00 37.83 32.23 1vvd s LYS 88 CO 0.09 -1.16 1.11 0.00 -0.36 0.00 0.00 175.35 175.03 1vvd n LYS 90 N 1.79 0.00 -3.64 0.00 4.76 0.18 -4.82 118.16 116.44 1vvd n LYS 90 Ca 0.18 0.52 -0.10 0.00 -2.87 0.00 0.00 58.31 56.04 1vvd n LYS 90 Cb 0.16 -1.07 -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 -1.30 -0.78 -0.90 2.13 6.14 -1.26 -5.00 117.35 116.38 1vvd s TYR 91 Ca 0.00 1.77 -0.06 0.00 0.64 0.00 0.00 57.07 59.41 1vvd s TYR 91 Cb 0.00 0.38 -0.01 0.00 0.42 0.00 0.00 41.96 42.75 1vvd s TYR 91 CO 0.00 -0.38 0.73 0.41 0.64 0.00 0.00 175.55 176.95 1vvd n GLY 92 N 3.07 -1.18 3.82 8.97 0.00 -1.26 -5.00 105.19 113.62 1vvd n GLY 92 Ca -0.16 0.51 -0.06 0.00 0.00 0.00 0.00 46.02 46.32 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 -3.17 -0.09 -0.23 1.61 2.02 -1.26 -4.73 117.35 111.50 1vvd s TYR 93 Ca 0.19 -0.36 -0.01 0.00 -0.37 0.00 0.00 57.07 56.51 1vvd s TYR 93 Cb -0.05 0.72 0.07 0.00 -0.40 0.00 0.00 41.96 42.29 1vvd s TYR 93 CO 0.81 -1.17 0.02 0.15 -1.57 0.00 0.00 175.55 173.80 1vvd s LYS 94 N -3.29 0.96 -0.84 -0.62 1.02 0.74 -4.80 119.74 112.91 1vvd s LYS 94 Ca 0.13 -0.75 -0.22 0.00 0.02 0.00 0.00 55.97 55.15 1vvd s LYS 94 Cb -0.04 -2.24 -0.21 0.00 -0.52 0.00 0.00 37.83 34.82 1vvd s LYS 94 CO 0.06 -0.71 2.39 1.28 -0.92 0.00 0.00 175.35 177.46 1vvd n LEU 95 N 4.88 0.55 -4.60 3.17 4.77 -1.24 -2.12 117.00 122.42 1vvd n LEU 95 Ca -0.08 -0.67 -0.43 0.00 -0.03 0.00 0.00 56.01 54.80 1vvd n LEU 95 Cb 0.45 -1.14 -0.02 0.00 -2.33 0.00 0.00 43.42 40.38 1vvd n LEU 95 CO 0.14 -1.67 1.15 -0.55 -1.33 0.00 0.00 177.39 175.13 1vvd s SER 96 N 7.32 6.44 0.00 -1.43 0.15 0.42 -4.26 113.70 122.33 1vvd s SER 96 Ca 1.15 0.58 0.00 0.00 0.70 0.00 0.00 55.95 58.38 1vvd s SER 96 Cb -0.60 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.17 1vvd s SER 96 CO 0.35 -1.39 0.00 0.61 1.20 0.00 0.00 173.24 174.01 1vvd n GLY 97 N 5.01 1.44 3.23 9.45 0.00 -1.26 -0.92 105.19 122.14 1vvd n GLY 97 Ca 0.14 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.76 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 -4.00 -1.12 0.00 1.61 0.15 -1.26 -4.93 113.70 104.15 1vvd s SER 98 Ca 0.00 0.96 0.20 0.00 0.70 0.00 0.00 55.95 57.82 1vvd s SER 98 Cb 0.00 2.06 1.22 0.00 -1.71 0.00 0.00 66.02 67.59 1vvd s SER 98 CO 0.00 -0.25 1.61 -0.24 1.20 0.00 0.00 173.24 175.55 1vvd n SER 99 N 5.43 0.00 -3.65 5.45 2.88 -1.26 -3.02 113.62 119.45 1vvd n SER 99 Ca -0.04 -0.63 -0.20 0.00 -1.33 0.00 0.00 58.87 56.68 1vvd n SER 99 Cb 0.50 -0.01 -0.17 0.00 -0.75 0.00 0.00 64.21 63.79 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 -2.01 1.19 0.06 -3.46 1.04 -1.26 0.27 113.70 109.54 1vvd s SER 100 Ca 0.31 0.05 0.03 0.00 0.48 0.00 0.00 55.95 56.82 1vvd s SER 100 Cb 0.14 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 66.26 1vvd s SER 100 CO 0.24 -0.27 -0.10 -0.44 0.98 0.00 0.00 173.24 173.66 1vvd s SER 101 N 2.22 1.15 0.16 7.02 0.01 -0.91 -4.47 113.70 118.88 1vvd s SER 101 Ca 0.04 -0.63 0.11 0.00 1.31 0.00 0.00 55.95 56.78 1vvd s SER 101 Cb -0.13 0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.08 1vvd s SER 101 CO -0.05 -0.20 -0.25 -0.89 0.41 0.00 0.00 173.24 172.25 1vvd s THR 102 N -1.65 2.26 -1.29 1.44 2.01 0.01 0.15 115.64 118.57 1vvd s THR 102 Ca -0.05 -1.87 -0.15 0.00 0.31 0.00 0.00 61.69 59.93 1vvd s THR 102 Cb -0.08 -2.03 0.11 0.00 0.01 0.00 0.00 72.50 70.51 1vvd s THR 102 CO 0.00 -0.02 1.72 0.00 -0.69 0.00 0.00 174.62 175.64 1vvd n SER 104 N 6.88 -2.78 -1.72 0.00 7.64 -1.26 0.20 113.62 122.58 1vvd n SER 104 Ca 0.45 -0.26 -0.03 0.00 1.01 0.00 0.00 58.87 60.04 1vvd n SER 104 Cb 0.43 -0.75 -0.05 0.00 -1.01 0.00 0.00 64.21 62.83 1vvd n SER 104 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1vvd n PRO 105 N -1.04 1.16 -0.10 1.43 -0.04 -1.26 -3.13 135.00 132.02 1vvd n PRO 105 Ca 0.03 -0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.21 1vvd n PRO 105 Cb 0.43 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 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 1.88 -2.16 2.82 0.55 0.00 -1.26 -4.72 105.19 102.30 1vvd n GLY 106 Ca 0.12 -0.01 -0.07 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.02 -6.03 -0.05 1.61 4.13 -1.18 -4.97 115.26 108.75 1vvd n ASN 107 Ca 0.00 -0.37 0.00 0.00 1.68 0.00 0.00 54.58 55.89 1vvd n ASN 107 Cb 0.54 -4.30 0.00 0.00 -1.54 0.00 0.00 39.78 34.48 1vvd n ASN 107 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1vvd n THR 108 N -2.38 0.00 -3.47 3.41 -2.24 -1.26 -4.42 114.28 103.92 1vvd n THR 108 Ca -0.03 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.47 1vvd n THR 108 Cb 0.56 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.68 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 -3.29 1.33 -0.14 4.78 0.52 -1.26 -4.09 118.94 116.79 1vvd s TRP 109 Ca 0.00 -2.33 -0.09 0.00 0.02 0.00 0.00 56.10 53.70 1vvd s TRP 109 Cb 0.00 -1.14 -0.04 0.00 -1.15 0.00 0.00 33.47 31.13 1vvd s TRP 109 CO 0.00 -0.80 0.17 0.15 0.02 0.00 0.00 176.95 176.49 1vvd s LYS 110 N 0.07 3.74 0.90 4.98 -0.14 -0.66 -2.61 119.74 126.02 1vvd s LYS 110 Ca 0.29 -0.10 -0.11 0.00 -1.36 0.00 0.00 55.97 54.68 1vvd s LYS 110 Cb -0.02 -3.27 0.13 0.00 -1.68 0.00 0.00 37.83 32.98 1vvd s LYS 110 CO -0.16 0.60 1.09 -1.25 -0.76 0.00 0.00 175.35 174.88 1vvd s PRO 111 N -0.54 1.25 0.49 -1.68 0.04 -1.26 -0.81 135.00 132.49 1vvd s PRO 111 Ca 0.14 0.84 -0.19 0.00 0.04 0.00 0.00 61.00 61.83 1vvd s PRO 111 Cb -0.12 -1.81 -0.14 0.00 0.04 0.00 0.00 34.50 32.47 1vvd s PRO 111 CO 0.03 -2.25 0.01 0.39 0.04 0.00 0.00 177.00 175.21 1vvd n GLU 112 N -3.89 0.08 -1.69 4.56 1.02 -1.07 -4.75 120.64 114.89 1vvd n GLU 112 Ca 0.07 0.03 -0.39 0.00 -0.02 0.00 0.00 57.16 56.85 1vvd n GLU 112 Cb 0.55 -1.10 0.03 0.00 -0.02 0.00 0.00 31.44 30.91 1vvd n GLU 112 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1vvd n LEU 113 N 2.21 4.41 -4.66 -4.62 7.99 -1.24 -4.19 117.00 116.90 1vvd n LEU 113 Ca 0.09 0.98 -0.29 0.00 -0.01 0.00 0.00 56.01 56.79 1vvd n LEU 113 Cb 0.46 -1.49 0.18 0.00 -0.11 0.00 0.00 43.42 42.46 1vvd n LEU 113 CO 0.54 -0.96 0.63 -2.16 -1.51 0.00 0.00 177.39 173.92 1vvd s PRO 114 N -2.57 0.28 -0.26 3.23 0.04 -1.17 -4.55 135.00 130.00 1vvd s PRO 114 Ca 0.69 0.54 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1vvd s PRO 114 Cb -0.46 -1.72 0.07 0.00 0.04 0.00 0.00 34.50 32.44 1vvd s PRO 114 CO 0.52 -2.84 0.01 0.21 0.04 0.00 0.00 177.00 174.94 1vvd s LYS 115 N -4.92 1.19 -0.91 4.56 2.20 -0.10 -4.24 119.74 117.51 1vvd s LYS 115 Ca 0.66 -1.00 -0.26 0.00 -0.36 0.00 0.00 55.97 55.01 1vvd s LYS 115 Cb -0.19 -2.41 -0.13 0.00 -1.51 0.00 0.00 37.83 33.58 1vvd s LYS 115 CO 0.58 -0.74 2.20 0.00 -0.36 0.00 0.00 175.35 177.03 1vvd s VAL 117 N 13.89 2.08 0.00 0.00 -7.23 -0.90 -4.65 120.40 123.58 1vvd s VAL 117 Ca 0.83 -1.16 0.00 0.00 -1.81 0.00 0.00 61.98 59.83 1vvd s VAL 117 Cb -0.09 -2.24 0.00 0.00 0.56 0.00 0.00 36.38 34.61 1vvd s VAL 117 CO 0.09 0.00 0.27 -2.11 -0.31 0.00 0.00 175.10 173.03