#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 1.09 -0.06 7.34 1.02 -1.26 -4.09 119.74 123.78 1vvd s LYS 2 Ca 0.00 -0.88 0.05 0.00 0.02 0.00 0.00 55.97 55.17 1vvd s LYS 2 Cb 0.00 -2.11 -0.02 0.00 -0.52 0.00 0.00 37.83 35.19 1vvd s LYS 2 CO 0.00 -1.96 -0.21 0.00 -0.92 0.00 0.00 175.35 172.25 1vvd s GLN 4 N -0.29 2.33 0.12 0.00 -2.07 -1.26 0.26 119.66 118.75 1vvd s GLN 4 Ca 0.01 -1.82 -0.35 0.00 -1.82 0.00 0.00 55.36 51.38 1vvd s GLN 4 Cb -0.13 -2.13 -0.17 0.00 -1.09 0.00 0.00 33.01 29.50 1vvd s GLN 4 CO 0.03 -0.31 1.16 0.45 -1.32 0.00 0.00 175.29 175.30 1vvd n SER 5 N -1.50 1.08 -4.71 12.60 2.88 -1.24 -4.62 113.62 118.11 1vvd n SER 5 Ca -0.00 1.14 -0.29 0.00 -1.33 0.00 0.00 58.87 58.38 1vvd n SER 5 Cb 0.64 -1.15 0.15 0.00 -0.75 0.00 0.00 64.21 63.09 1vvd n SER 5 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1vvd s PRO 6 N -0.11 1.08 0.92 -1.46 0.04 -1.26 -4.99 135.00 129.23 1vvd s PRO 6 Ca 0.78 0.75 -0.12 0.00 0.04 0.00 0.00 61.00 62.46 1vvd s PRO 6 Cb -0.95 -1.79 0.15 0.00 0.04 0.00 0.00 34.50 31.95 1vvd s PRO 6 CO 0.52 -2.35 1.09 -1.25 0.04 0.00 0.00 177.00 175.05 1vvd s PRO 7 N -4.94 1.02 0.99 0.56 0.04 -1.26 -4.96 135.00 126.45 1vvd s PRO 7 Ca 0.64 0.71 -0.15 0.00 0.04 0.00 0.00 61.00 62.24 1vvd s PRO 7 Cb -0.18 -1.79 0.19 0.00 0.04 0.00 0.00 34.50 32.76 1vvd s PRO 7 CO 0.57 -2.37 1.22 -1.54 0.04 0.00 0.00 177.00 174.92 1vvd s SER 8 N -3.46 2.88 0.01 6.66 1.04 -1.26 -4.88 113.70 114.69 1vvd s SER 8 Ca 0.64 0.55 0.00 0.00 0.48 0.00 0.00 55.95 57.62 1vvd s SER 8 Cb -0.18 -0.80 -0.00 0.00 0.10 0.00 0.00 66.02 65.14 1vvd s SER 8 CO 0.57 -2.90 0.01 2.30 0.98 0.00 0.00 173.24 174.20 1vvd n ILE 9 N -3.93 0.00 -1.52 -1.02 -5.35 -1.12 -5.01 119.36 101.41 1vvd n ILE 9 Ca 0.12 -0.08 -0.22 0.00 -0.27 0.00 0.00 62.75 62.30 1vvd n ILE 9 Cb 0.60 0.04 -0.17 0.00 -1.74 0.00 0.00 39.64 38.37 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 -2.82 -0.21 -4.21 7.28 7.64 -1.26 -2.32 113.62 117.73 1vvd n SER 10 Ca 0.00 -0.73 -0.31 0.00 1.01 0.00 0.00 58.87 58.84 1vvd n SER 10 Cb 0.02 -0.93 -0.07 0.00 -1.01 0.00 0.00 64.21 62.22 1vvd n SER 10 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1vvd n ASN 11 N 10.17 0.11 -3.74 6.43 4.05 -1.26 -4.39 115.26 126.63 1vvd n ASN 11 Ca 0.61 -1.22 -0.13 0.00 0.45 0.00 0.00 54.58 54.29 1vvd n ASN 11 Cb 0.23 -1.95 -0.08 0.00 1.23 0.00 0.00 39.78 39.21 1vvd n ASN 11 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 1vvd s GLY 12 N -4.29 -0.18 0.51 8.20 0.00 -0.98 -2.22 107.32 108.36 1vvd s GLY 12 Ca 0.05 0.29 0.04 0.00 0.00 0.00 0.00 44.72 45.10 1vvd s GLY 12 CO 0.97 0.06 0.33 -0.96 0.00 0.00 0.00 173.10 173.51 1vvd n ARG 13 N 0.99 0.75 0.00 2.90 1.85 0.20 -2.78 116.66 120.56 1vvd n ARG 13 Ca -0.20 -3.24 0.00 0.00 -1.00 0.00 0.00 57.85 53.41 1vvd n ARG 13 Cb 0.57 0.42 0.00 0.00 -1.05 0.00 0.00 32.46 32.40 1vvd n ARG 13 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1vvd n HIS 14 N -1.63 0.00 0.00 2.89 8.25 -1.26 0.11 115.22 123.58 1vvd n HIS 14 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 1vvd n HIS 14 Cb 0.59 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.70 1vvd n HIS 14 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1vvd n ASN 15 N 0.00 0.00 0.00 0.41 5.15 -0.63 -0.43 115.26 119.76 1vvd n ASN 15 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1vvd n ASN 15 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 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 3.78 -0.19 2.90 8.20 0.00 -1.26 -4.69 105.19 113.92 1vvd n GLY 16 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1vvd n GLY 16 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1vvd s TYR 17 N -0.88 -1.29 -0.11 1.61 5.04 -1.26 -5.04 117.35 115.43 1vvd s TYR 17 Ca 0.00 -0.14 -0.08 0.00 -2.44 0.00 0.00 57.07 54.41 1vvd s TYR 17 Cb 0.00 0.25 -0.05 0.00 0.35 0.00 0.00 41.96 42.51 1vvd s TYR 17 CO 0.00 -0.95 -0.19 0.39 -1.34 0.00 0.00 175.55 173.46 1vvd n GLU 18 N 3.49 0.30 -1.48 4.97 4.71 -1.26 -4.98 120.64 126.39 1vvd n GLU 18 Ca 0.13 0.13 -0.17 0.00 -0.01 0.00 0.00 57.16 57.24 1vvd n GLU 18 Cb 0.59 -1.01 -0.07 0.00 -1.01 0.00 0.00 31.44 29.94 1vvd n GLU 18 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1vvd n ASP 19 N -3.80 -5.34 -3.55 1.62 9.92 -1.26 -4.90 116.55 109.24 1vvd n ASP 19 Ca -0.20 0.41 -0.15 0.00 -0.53 0.00 0.00 54.79 54.32 1vvd n ASP 19 Cb 0.53 -4.46 -0.06 0.00 -0.64 0.00 0.00 41.12 36.50 1vvd n ASP 19 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1vvd s PHE 20 N -2.41 -0.56 0.25 1.24 0.08 -1.26 -3.66 117.98 111.65 1vvd s PHE 20 Ca 0.00 1.00 -0.21 0.00 0.12 0.00 0.00 56.93 57.84 1vvd s PHE 20 Cb 0.00 0.41 0.06 0.00 -0.57 0.00 0.00 43.02 42.92 1vvd s PHE 20 CO 0.00 -0.49 0.89 0.71 -0.10 0.00 0.00 175.22 176.23 1vvd s TYR 21 N -1.03 -0.02 0.00 0.36 2.02 0.74 -4.74 117.35 114.69 1vvd s TYR 21 Ca -0.07 -0.44 0.00 0.00 -0.37 0.00 0.00 57.07 56.19 1vvd s TYR 21 Cb -0.01 0.73 0.00 0.00 -0.40 0.00 0.00 41.96 42.28 1vvd s TYR 21 CO 0.06 -1.14 0.00 0.25 -1.57 0.00 0.00 175.55 173.15 1vvd n THR 22 N -0.55 0.00 -3.58 -0.71 -2.24 -1.25 0.99 114.28 106.95 1vvd n THR 22 Ca -0.05 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.58 1vvd n THR 22 Cb 0.60 -0.21 -0.06 0.00 -2.10 0.00 0.00 70.33 68.56 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 -4.22 -0.65 -0.36 3.42 2.15 -1.26 -3.37 116.67 112.40 1vvd s ASP 23 Ca 0.00 0.98 0.00 0.00 0.43 0.00 0.00 52.55 53.96 1vvd s ASP 23 Cb 0.00 0.90 0.00 0.00 -0.30 0.00 0.00 42.92 43.52 1vvd s ASP 23 CO 0.00 -0.41 0.00 0.61 -0.17 0.00 0.00 175.17 175.20 1vvd n GLY 24 N 1.67 0.47 3.93 2.66 0.00 0.34 -4.92 105.19 109.34 1vvd n GLY 24 Ca -0.16 -0.08 -0.28 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.20 3.97 0.07 1.61 0.01 -0.91 -4.84 113.70 111.43 1vvd s SER 25 Ca 0.00 0.35 -0.18 0.00 1.31 0.00 0.00 55.95 57.44 1vvd s SER 25 Cb 0.00 -0.68 0.04 0.00 0.21 0.00 0.00 66.02 65.59 1vvd s SER 25 CO 0.00 -2.18 0.42 -0.69 0.41 0.00 0.00 173.24 171.20 1vvd s VAL 26 N -3.59 0.06 -0.13 3.43 1.01 -1.25 -1.24 120.40 118.69 1vvd s VAL 26 Ca 0.67 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 62.16 1vvd s VAL 26 Cb -0.07 -1.03 0.05 0.00 0.00 0.00 0.00 36.38 35.32 1vvd s VAL 26 CO 0.49 -0.26 0.05 -0.69 0.00 0.00 0.00 175.10 174.69 1vvd s VAL 27 N -2.96 0.22 -0.55 2.92 1.01 -0.97 -4.73 120.40 115.34 1vvd s VAL 27 Ca -0.02 -0.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.57 1vvd s VAL 27 Cb 0.00 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.73 1vvd s VAL 27 CO -0.06 -0.04 1.78 -0.89 0.00 0.00 0.00 175.10 175.89 1vvd s THR 28 N 2.01 3.45 -0.67 3.92 2.01 -1.26 0.11 115.64 125.21 1vvd s THR 28 Ca 0.02 0.33 -0.26 0.00 0.31 0.00 0.00 61.69 62.09 1vvd s THR 28 Cb -0.15 -3.96 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 1vvd s THR 28 CO -0.07 -0.85 1.97 -0.31 -0.69 0.00 0.00 174.62 174.67 1vvd s TYR 29 N 8.17 1.60 0.30 4.92 2.02 -1.25 -1.61 117.35 131.50 1vvd s TYR 29 Ca 0.67 0.90 -0.29 0.00 -0.37 0.00 0.00 57.07 57.98 1vvd s TYR 29 Cb -0.14 -3.99 -0.10 0.00 -0.40 0.00 0.00 41.96 37.33 1vvd s TYR 29 CO 0.24 -2.19 1.23 -1.12 -1.57 0.00 0.00 175.55 172.14 1vvd s SER 30 N 8.71 6.98 0.14 2.29 0.01 0.31 -4.73 113.70 127.41 1vvd s SER 30 Ca 0.72 2.50 0.06 0.00 1.31 0.00 0.00 55.95 60.54 1vvd s SER 30 Cb -0.12 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 1vvd s SER 30 CO 0.16 -0.38 0.05 0.00 0.41 0.00 0.00 173.24 173.48 1vvd n ASN 32 N 0.04 -0.42 -4.53 0.00 4.13 -0.94 -4.59 115.26 108.94 1vvd n ASN 32 Ca -0.09 1.11 -0.34 0.00 1.68 0.00 0.00 54.58 56.94 1vvd n ASN 32 Cb 0.54 -1.08 -0.09 0.00 -1.54 0.00 0.00 39.78 37.61 1vvd n ASN 32 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1vvd n SER 33 N 1.67 1.36 0.00 6.41 3.41 -1.26 -0.84 113.62 124.37 1vvd n SER 33 Ca 0.14 -0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 1vvd n SER 33 Cb 0.30 -1.32 0.00 0.00 -0.26 0.00 0.00 64.21 62.93 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 6.22 -0.22 3.82 5.00 0.00 -1.26 -5.14 105.19 113.61 1vvd n GLY 34 Ca 0.49 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.30 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 -0.57 3.06 -0.19 1.61 1.51 -0.02 -4.82 117.35 117.92 1vvd s TYR 35 Ca 0.00 -0.15 -0.08 0.00 -1.01 0.00 0.00 57.07 55.83 1vvd s TYR 35 Cb 0.00 -1.47 -0.04 0.00 -0.11 0.00 0.00 41.96 40.33 1vvd s TYR 35 CO 0.00 0.46 0.08 -1.12 -1.11 0.00 0.00 175.55 173.86 1vvd s SER 36 N -3.87 5.81 -0.24 2.29 0.01 0.24 -4.81 113.70 113.13 1vvd s SER 36 Ca 0.34 0.13 -0.21 0.00 1.31 0.00 0.00 55.95 57.52 1vvd s SER 36 Cb -0.07 -2.00 -0.02 0.00 0.21 0.00 0.00 66.02 64.14 1vvd s SER 36 CO 0.25 0.18 0.65 -0.22 0.41 0.00 0.00 173.24 174.51 1vvd s LEU 37 N 0.36 4.08 -0.00 2.44 2.96 -1.26 0.27 118.68 127.53 1vvd s LEU 37 Ca 0.05 0.77 0.07 0.00 -0.22 0.00 0.00 54.13 54.80 1vvd s LEU 37 Cb -0.12 -2.90 -0.02 0.00 0.50 0.00 0.00 46.19 43.65 1vvd s LEU 37 CO -0.01 -0.37 -0.23 -0.63 -1.32 0.00 0.00 176.35 173.80 1vvd s ILE 38 N 2.42 2.36 0.00 6.68 -1.09 -0.97 -4.78 121.20 125.83 1vvd s ILE 38 Ca 0.28 -1.11 0.00 0.00 -2.23 0.00 0.00 60.65 57.58 1vvd s ILE 38 Cb -0.16 -1.89 0.00 0.00 -1.58 0.00 0.00 42.46 38.83 1vvd s ILE 38 CO 0.09 0.50 0.00 0.61 -1.23 0.00 0.00 174.94 174.91 1vvd n GLY 39 N 2.13 0.81 0.58 6.18 0.00 -1.26 0.33 105.19 113.96 1vvd n GLY 39 Ca -0.16 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.93 1vvd n GLY 39 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1vvd n ASN 40 N 0.00 -3.49 -3.34 1.61 5.15 -1.26 -3.36 115.26 110.56 1vvd n ASN 40 Ca 0.00 0.43 -0.33 0.00 -0.60 0.00 0.00 54.58 54.08 1vvd n ASN 40 Cb 0.00 -1.90 -0.03 0.00 -0.53 0.00 0.00 39.78 37.33 1vvd n ASN 40 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1vvd n SER 41 N -3.22 5.35 0.00 1.20 7.64 -1.26 -4.58 113.62 118.74 1vvd n SER 41 Ca -0.02 -3.61 0.00 0.00 1.01 0.00 0.00 58.87 56.25 1vvd n SER 41 Cb 0.27 -0.83 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 1vvd n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vvd n GLY 42 N 0.20 1.82 2.94 0.23 0.00 -1.24 -4.27 105.19 104.88 1vvd n GLY 42 Ca 0.34 0.39 -0.28 0.00 0.00 0.00 0.00 46.02 46.47 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 -3.48 1.61 0.31 0.29 -4.39 118.33 112.67 1vvd n VAL 43 Ca 0.00 -0.04 -0.22 0.00 -0.01 0.00 0.00 64.34 64.07 1vvd n VAL 43 Cb 0.00 -0.93 -0.13 0.00 -0.91 0.00 0.00 33.84 31.87 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 0.10 -0.38 7.52 2.96 -0.86 -2.28 118.68 125.73 1vvd s LEU 44 Ca 0.62 -0.84 -0.25 0.00 -0.22 0.00 0.00 54.13 53.45 1vvd s LEU 44 Cb -0.10 0.13 0.01 0.00 0.50 0.00 0.00 46.19 46.73 1vvd s LEU 44 CO 0.52 -0.39 0.87 0.00 -1.32 0.00 0.00 176.35 176.02 1vvd s SER 46 N 1.91 1.59 0.00 0.00 1.04 0.47 0.13 113.70 118.83 1vvd s SER 46 Ca 0.35 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.53 1vvd s SER 46 Cb -0.12 -0.32 0.00 0.00 0.10 0.00 0.00 66.02 65.68 1vvd s SER 46 CO 0.19 0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.15 1vvd n GLY 47 N 3.02 0.16 0.66 7.32 0.00 -1.26 -1.81 105.19 113.29 1vvd n GLY 47 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.36 1.40 3.07 -0.02 0.00 -1.25 -4.46 105.19 103.56 1vvd n GLY 48 Ca 0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.87 0.22 0.19 1.61 2.02 -0.75 -4.87 118.70 115.25 1vvd s GLU 49 Ca 0.00 0.40 -0.29 0.00 0.02 0.00 0.00 54.97 55.10 1vvd s GLU 49 Cb 0.00 0.00 -0.08 0.00 0.10 0.00 0.00 34.13 34.15 1vvd s GLU 49 CO 0.00 -0.09 0.92 -1.58 0.02 0.00 0.00 175.26 174.52 1vvd s TRP 50 N 0.66 3.92 0.14 1.61 0.52 -1.26 -0.40 118.94 124.13 1vvd s TRP 50 Ca -0.04 1.83 -0.03 0.00 0.02 0.00 0.00 56.10 57.88 1vvd s TRP 50 Cb -0.06 -2.97 -0.03 0.00 -1.15 0.00 0.00 33.47 29.26 1vvd s TRP 50 CO -0.04 0.39 0.11 -1.12 0.02 0.00 0.00 176.95 176.32 1vvd s SER 51 N -0.82 0.24 -1.01 2.95 0.01 -0.33 -4.94 113.70 109.80 1vvd s SER 51 Ca 0.42 -1.13 -0.16 0.00 1.31 0.00 0.00 55.95 56.38 1vvd s SER 51 Cb -0.25 0.33 0.02 0.00 0.21 0.00 0.00 66.02 66.33 1vvd s SER 51 CO 0.30 -0.77 0.67 -0.67 0.41 0.00 0.00 173.24 173.18 1vvd n ASP 52 N -0.13 -4.86 -4.68 2.44 -0.08 -1.26 -2.04 116.55 105.95 1vvd n ASP 52 Ca -0.06 -1.04 -0.39 0.00 -1.51 0.00 0.00 54.79 51.79 1vvd n ASP 52 Cb 0.64 -2.16 -0.07 0.00 2.34 0.00 0.00 41.12 41.87 1vvd n ASP 52 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 1vvd s PRO 53 N -5.89 4.22 1.04 -0.67 0.04 -1.26 -4.32 135.00 128.16 1vvd s PRO 53 Ca 0.25 0.42 -0.17 0.00 0.04 0.00 0.00 61.00 61.53 1vvd s PRO 53 Cb -0.13 -3.53 0.26 0.00 0.04 0.00 0.00 34.50 31.14 1vvd s PRO 53 CO 0.91 -0.07 0.96 -0.35 0.04 0.00 0.00 177.00 178.49 1vvd n PRO 54 N 4.52 -2.68 -1.81 0.56 -0.04 -1.22 -4.88 135.00 129.45 1vvd n PRO 54 Ca -0.05 -1.53 0.00 0.00 -0.04 0.00 0.00 63.50 61.88 1vvd n PRO 54 Cb 0.51 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 1vvd n PRO 54 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1vvd n THR 55 N -4.44 0.00 -3.21 0.52 -2.24 0.99 -4.84 114.28 101.06 1vvd n THR 55 Ca 0.13 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.79 1vvd n THR 55 Cb 0.51 -0.01 -0.05 0.00 -2.10 0.00 0.00 70.33 68.68 1vvd n THR 55 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vvd n GLN 57 N 3.81 2.85 -3.21 0.00 6.02 0.14 -4.65 117.38 122.34 1vvd n GLN 57 Ca 0.15 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.92 1vvd n GLN 57 Cb 0.50 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.69 1vvd n GLN 57 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1vvd n ILE 58 N 0.00 -0.82 -2.13 5.09 -0.00 -1.26 0.83 119.36 121.07 1vvd n ILE 58 Ca 0.00 -3.38 -0.42 0.00 -0.00 0.00 0.00 62.75 58.95 1vvd n ILE 58 Cb 0.00 -1.38 -0.03 0.00 -0.00 0.00 0.00 39.64 38.23 1vvd n ILE 58 CO 0.00 0.00 0.00 0.68 -0.00 0.00 0.00 176.55 177.23 1vvd s VAL 59 N -0.40 3.42 -0.34 1.39 -7.23 -1.25 -4.93 120.40 111.06 1vvd s VAL 59 Ca 0.34 0.89 0.02 0.00 -1.81 0.00 0.00 61.98 61.42 1vvd s VAL 59 Cb 0.11 -3.57 0.15 0.00 0.56 0.00 0.00 36.38 33.62 1vvd s VAL 59 CO -0.15 0.02 0.34 -0.54 -0.31 0.00 0.00 175.10 174.45 1vvd s LYS 60 N 2.09 0.52 0.85 4.82 1.02 -1.26 -4.30 119.74 123.49 1vvd s LYS 60 Ca 0.67 -0.64 -0.11 0.00 0.02 0.00 0.00 55.97 55.90 1vvd s LYS 60 Cb -0.35 -0.74 0.10 0.00 -0.52 0.00 0.00 37.83 36.32 1vvd s LYS 60 CO 0.29 -1.14 1.09 0.00 -0.92 0.00 0.00 175.35 174.67 1vvd n PRO 62 N -3.77 0.00 -3.63 0.00 -0.04 -1.26 -4.35 135.00 121.93 1vvd n PRO 62 Ca 0.08 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.50 1vvd n PRO 62 Cb 0.54 -0.17 -0.07 0.00 -0.04 0.00 0.00 33.50 33.76 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 -0.82 -1.33 0.54 3.76 -1.26 -4.79 115.29 111.39 1vvd s HIS 63 Ca 0.00 1.62 -0.13 0.00 -0.15 0.00 0.00 55.06 56.40 1vvd s HIS 63 Cb 0.00 0.49 -0.04 0.00 1.11 0.00 0.00 32.58 34.14 1vvd s HIS 63 CO 0.00 -0.40 2.39 -0.35 -0.85 0.00 0.00 174.74 175.52 1vvd n PRO 64 N 4.07 2.79 -2.15 8.40 -0.04 -1.26 -4.91 135.00 141.90 1vvd n PRO 64 Ca -0.19 -2.21 -0.28 0.00 -0.04 0.00 0.00 63.50 60.79 1vvd n PRO 64 Cb 0.58 -2.97 0.17 0.00 -0.04 0.00 0.00 33.50 31.23 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 3.21 2.02 -0.19 0.52 -4.23 -1.26 -4.56 115.64 111.14 1vvd s THR 65 Ca 0.55 -0.20 -0.34 0.00 -1.18 0.00 0.00 61.69 60.52 1vvd s THR 65 Cb 0.15 -2.83 0.14 0.00 1.34 0.00 0.00 72.50 71.30 1vvd s THR 65 CO -0.04 0.00 1.20 -0.51 -0.54 0.00 0.00 174.62 174.73 1vvd s ILE 66 N -3.68 0.00 -0.50 2.99 2.07 -1.26 -4.74 121.20 116.08 1vvd s ILE 66 Ca 0.73 0.00 -0.27 0.00 -1.41 0.00 0.00 60.65 59.70 1vvd s ILE 66 Cb -0.04 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.51 1vvd s ILE 66 CO 0.51 0.00 2.14 -0.44 -1.91 0.00 0.00 174.94 175.24 1vvd s SER 67 N -2.00 4.95 -1.50 4.50 0.01 -1.26 -3.57 113.70 114.84 1vvd s SER 67 Ca 0.09 0.90 -0.03 0.00 1.31 0.00 0.00 55.95 58.22 1vvd s SER 67 Cb -0.01 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1vvd s SER 67 CO -0.05 -2.52 0.05 0.59 0.41 0.00 0.00 173.24 171.73 1vvd n ASN 68 N 13.91 0.58 -1.38 2.44 4.13 -1.26 -2.16 115.26 131.51 1vvd n ASN 68 Ca 0.29 -1.26 -0.05 0.00 1.68 0.00 0.00 54.58 55.24 1vvd n ASN 68 Cb 0.52 -1.56 -0.02 0.00 -1.54 0.00 0.00 39.78 37.18 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 -2.53 0.85 0.78 7.41 0.00 -1.23 -1.24 105.19 109.23 1vvd n GLY 69 Ca -0.31 -0.10 -0.02 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.28 -0.90 -3.90 1.61 4.11 -1.26 -3.31 117.16 113.23 1vvd n TYR 70 Ca -0.24 0.08 -0.22 0.00 -0.00 0.00 0.00 57.90 57.52 1vvd n TYR 70 Cb 0.76 -0.37 -0.05 0.00 -0.00 0.00 0.00 39.34 39.68 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 3.31 0.00 -3.48 -0.00 -1.26 0.29 118.68 117.55 1vvd s LEU 71 Ca 0.05 -0.81 0.10 0.00 -0.00 0.00 0.00 54.13 53.47 1vvd s LEU 71 Cb -0.01 -1.82 0.16 0.00 -0.00 0.00 0.00 46.19 44.52 1vvd s LEU 71 CO 0.04 -0.48 1.00 -0.24 -0.00 0.00 0.00 176.35 176.67 1vvd n SER 72 N -1.33 0.25 0.00 1.48 2.88 -0.91 -4.71 113.62 111.28 1vvd n SER 72 Ca -0.00 -1.87 0.00 0.00 -1.33 0.00 0.00 58.87 55.66 1vvd n SER 72 Cb 0.62 -0.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.93 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 0.18 0.00 -3.59 -3.46 2.88 -1.26 -4.93 113.62 103.45 1vvd n SER 73 Ca -0.01 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.25 1vvd n SER 73 Cb 0.84 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.21 1vvd n SER 73 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vvd n GLY 74 N 3.36 4.62 3.98 0.46 0.00 -1.26 -5.01 105.19 111.34 1vvd n GLY 74 Ca 0.00 -2.72 -0.20 0.00 0.00 0.00 0.00 46.02 43.10 1vvd n GLY 74 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1vvd s PHE 75 N -2.21 3.16 -0.06 1.61 2.19 -1.26 -4.66 117.98 116.75 1vvd s PHE 75 Ca 0.35 -0.09 -0.30 0.00 0.33 0.00 0.00 56.93 57.22 1vvd s PHE 75 Cb 0.09 -2.06 0.11 0.00 -1.31 0.00 0.00 43.02 39.85 1vvd s PHE 75 CO -0.05 -0.09 0.96 0.21 1.83 0.00 0.00 175.22 178.09 1vvd s LYS 76 N -4.27 0.70 0.56 10.12 2.20 -1.26 -5.00 119.74 122.80 1vvd s LYS 76 Ca 0.45 -0.22 0.29 0.00 -0.36 0.00 0.00 55.97 56.13 1vvd s LYS 76 Cb -0.10 0.32 1.47 0.00 -1.51 0.00 0.00 37.83 38.01 1vvd s LYS 76 CO 0.33 -0.30 1.92 0.00 -0.36 0.00 0.00 175.35 176.94 1vvd h ARG 77 N 2.05 0.00 -4.61 4.03 3.08 -1.99 -3.43 114.38 113.51 1vvd h ARG 77 Ca -0.19 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.55 1vvd h ARG 77 Cb 1.22 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.13 1vvd h ARG 77 CO 0.29 0.00 -0.51 -1.54 -1.07 0.00 0.00 179.97 177.14 1vvd s SER 78 N -5.54 0.73 0.00 7.04 1.04 -1.26 -4.95 113.70 110.75 1vvd s SER 78 Ca -0.05 -1.50 0.00 0.00 0.48 0.00 0.00 55.95 54.89 1vvd s SER 78 Cb 0.18 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.77 1vvd s SER 78 CO 0.65 -0.97 0.00 -1.22 0.98 0.00 0.00 173.24 172.68 1vvd n TYR 79 N -0.42 -0.36 0.00 5.02 4.01 -1.26 -5.03 117.16 119.12 1vvd n TYR 79 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 1vvd n TYR 79 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.67 1vvd n TYR 79 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1vvd n SER 80 N -1.73 0.00 -0.13 7.72 3.41 -1.26 -3.91 113.62 117.72 1vvd n SER 80 Ca 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.70 1vvd n SER 80 Cb 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.09 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 0.07 0.00 7.33 4.19 -1.16 -3.98 117.16 123.61 1vvd n TYR 81 Ca 0.00 -0.96 0.00 0.00 3.31 0.00 0.00 57.90 60.25 1vvd n TYR 81 Cb 0.00 -0.16 0.00 0.00 0.49 0.00 0.00 39.34 39.67 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 -1.30 0.00 -3.55 2.98 2.85 0.80 -3.94 115.26 113.10 1vvd n ASN 82 Ca 0.15 0.00 -0.23 0.00 -0.11 0.00 0.00 54.58 54.40 1vvd n ASN 82 Cb 0.64 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.66 1vvd n ASN 82 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1vvd n ASP 83 N 0.00 -5.68 -4.62 1.20 9.92 -1.26 0.28 116.55 116.38 1vvd n ASP 83 Ca 0.00 -0.55 -0.43 0.00 -0.53 0.00 0.00 54.79 53.28 1vvd n ASP 83 Cb 0.00 -2.52 -0.03 0.00 -0.64 0.00 0.00 41.12 37.94 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 -2.64 6.26 -0.26 -2.24 2.20 -1.26 -3.04 114.94 113.95 1vvd s ASN 84 Ca 0.10 1.60 -0.11 0.00 -0.94 0.00 0.00 52.86 53.50 1vvd s ASN 84 Cb -0.01 -2.53 -0.05 0.00 -2.00 0.00 0.00 41.25 36.66 1vvd s ASN 84 CO 0.86 -1.36 0.21 0.68 -2.94 0.00 0.00 177.10 174.55 1vvd s VAL 85 N 5.60 5.31 0.07 3.54 -7.23 0.74 -4.31 120.40 124.10 1vvd s VAL 85 Ca 0.75 0.24 -0.27 0.00 -1.81 0.00 0.00 61.98 60.89 1vvd s VAL 85 Cb -0.25 -3.55 -0.06 0.00 0.56 0.00 0.00 36.38 33.09 1vvd s VAL 85 CO 0.31 0.27 0.83 -0.62 -0.31 0.00 0.00 175.10 175.58 1vvd s ASP 86 N 1.48 7.30 -0.07 4.85 2.15 -1.26 -1.21 116.67 129.91 1vvd s ASP 86 Ca 0.09 1.56 -0.18 0.00 0.43 0.00 0.00 52.55 54.44 1vvd s ASP 86 Cb -0.15 -2.51 -0.05 0.00 -0.30 0.00 0.00 42.92 39.92 1vvd s ASP 86 CO 0.09 -0.01 0.49 -0.36 -0.17 0.00 0.00 175.17 175.21 1vvd s PHE 87 N -0.04 3.59 -0.61 -5.34 0.08 0.78 -2.14 117.98 114.29 1vvd s PHE 87 Ca 0.41 0.97 -0.04 0.00 0.12 0.00 0.00 56.93 58.39 1vvd s PHE 87 Cb -0.21 -2.52 0.16 0.00 -0.57 0.00 0.00 43.02 39.88 1vvd s PHE 87 CO 0.25 0.29 0.44 0.21 -0.10 0.00 0.00 175.22 176.31 1vvd s LYS 88 N 0.15 2.59 -0.02 0.44 2.36 0.84 -4.88 119.74 121.21 1vvd s LYS 88 Ca 0.27 -2.41 -0.39 0.00 -2.55 0.00 0.00 55.97 50.89 1vvd s LYS 88 Cb -0.16 -3.78 -0.18 0.00 -1.05 0.00 0.00 37.83 32.65 1vvd s LYS 88 CO 0.12 -1.17 1.29 0.00 1.55 0.00 0.00 175.35 177.14 1vvd n LYS 90 N 2.51 0.00 -3.62 0.00 4.76 -0.37 -4.85 118.16 116.59 1vvd n LYS 90 Ca 0.21 0.21 -0.15 0.00 -2.87 0.00 0.00 58.31 55.71 1vvd n LYS 90 Cb 0.13 -0.72 -0.07 0.00 -1.84 0.00 0.00 35.03 32.52 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 -0.45 -0.72 -1.19 2.13 6.14 -1.26 -4.96 117.35 117.03 1vvd s TYR 91 Ca 0.00 1.67 -0.07 0.00 0.64 0.00 0.00 57.07 59.31 1vvd s TYR 91 Cb 0.00 0.29 -0.02 0.00 0.42 0.00 0.00 41.96 42.65 1vvd s TYR 91 CO 0.00 -0.41 0.80 0.41 0.64 0.00 0.00 175.55 176.98 1vvd n GLY 92 N 2.32 -0.68 3.74 8.97 0.00 -1.26 -4.98 105.19 113.29 1vvd n GLY 92 Ca -0.15 0.32 -0.08 0.00 0.00 0.00 0.00 46.02 46.11 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 -3.53 -0.28 -0.16 1.61 2.02 -1.26 -4.69 117.35 111.07 1vvd s TYR 93 Ca 0.23 -0.11 -0.01 0.00 -0.37 0.00 0.00 57.07 56.81 1vvd s TYR 93 Cb -0.06 0.67 0.05 0.00 -0.40 0.00 0.00 41.96 42.22 1vvd s TYR 93 CO 0.80 -1.12 -0.01 0.21 -1.57 0.00 0.00 175.55 173.86 1vvd s LYS 94 N -3.85 1.00 -0.52 -0.62 2.20 0.66 -4.78 119.74 113.83 1vvd s LYS 94 Ca 0.08 -0.36 -0.37 0.00 -0.36 0.00 0.00 55.97 54.97 1vvd s LYS 94 Cb -0.05 -1.84 -0.15 0.00 -1.51 0.00 0.00 37.83 34.29 1vvd s LYS 94 CO 0.02 -0.48 2.28 1.28 -0.36 0.00 0.00 175.35 178.09 1vvd n LEU 95 N 4.99 1.40 -4.43 5.43 4.77 -1.26 -2.09 117.00 125.81 1vvd n LEU 95 Ca -0.10 0.38 -0.44 0.00 -0.03 0.00 0.00 56.01 55.83 1vvd n LEU 95 Cb 0.48 -1.12 -0.04 0.00 -2.33 0.00 0.00 43.42 40.42 1vvd n LEU 95 CO 0.14 -0.81 0.74 -0.55 -1.33 0.00 0.00 177.39 175.58 1vvd s SER 96 N 7.59 6.31 0.00 -1.43 0.15 0.13 -4.04 113.70 122.40 1vvd s SER 96 Ca 1.16 -1.41 0.00 0.00 0.70 0.00 0.00 55.95 56.41 1vvd s SER 96 Cb -1.07 -2.38 0.00 0.00 -1.71 0.00 0.00 66.02 60.85 1vvd s SER 96 CO 0.52 -1.25 0.00 0.61 1.20 0.00 0.00 173.24 174.32 1vvd n GLY 97 N 5.34 4.70 0.00 9.45 0.00 -1.26 -1.66 105.19 121.76 1vvd n GLY 97 Ca 0.03 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1vvd n GLY 97 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vvd n SER 98 N 0.00 0.00 0.07 1.61 3.41 -1.26 -4.70 113.62 112.75 1vvd n SER 98 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1vvd n SER 98 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1vvd n SER 98 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1vvd n SER 99 N 0.16 -0.74 -4.21 4.04 3.41 -1.26 -4.56 113.62 110.46 1vvd n SER 99 Ca 0.00 0.25 -0.38 0.00 -0.26 0.00 0.00 58.87 58.48 1vvd n SER 99 Cb 0.00 0.88 -0.12 0.00 -0.26 0.00 0.00 64.21 64.72 1vvd n SER 99 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1vvd s SER 100 N -3.62 5.33 0.33 4.04 1.04 -1.26 0.28 113.70 119.84 1vvd s SER 100 Ca 0.00 -1.53 0.09 0.00 0.48 0.00 0.00 55.95 54.99 1vvd s SER 100 Cb 0.00 -1.87 -0.05 0.00 0.10 0.00 0.00 66.02 64.20 1vvd s SER 100 CO 0.00 -0.45 0.07 -0.44 0.98 0.00 0.00 173.24 173.40 1vvd s SER 101 N 1.74 4.44 0.01 7.02 0.01 -0.35 -4.30 113.70 122.28 1vvd s SER 101 Ca 0.02 -0.85 0.03 0.00 1.31 0.00 0.00 55.95 56.46 1vvd s SER 101 Cb -0.22 -0.66 -0.01 0.00 0.21 0.00 0.00 66.02 65.34 1vvd s SER 101 CO -0.00 -0.23 -0.09 -0.89 0.41 0.00 0.00 173.24 172.44 1vvd s THR 102 N -2.45 0.73 -0.70 1.44 2.01 0.49 0.26 115.64 117.42 1vvd s THR 102 Ca 0.36 -0.65 -0.26 0.00 0.31 0.00 0.00 61.69 61.45 1vvd s THR 102 Cb -0.02 -0.66 -0.01 0.00 0.01 0.00 0.00 72.50 71.82 1vvd s THR 102 CO 0.21 0.02 1.70 0.00 -0.69 0.00 0.00 174.62 175.86 1vvd s SER 104 N 6.81 0.84 0.26 0.00 1.04 -1.22 0.28 113.70 121.71 1vvd s SER 104 Ca 0.58 0.79 0.04 0.00 0.48 0.00 0.00 55.95 57.85 1vvd s SER 104 Cb -0.10 -1.15 0.33 0.00 0.10 0.00 0.00 66.02 65.20 1vvd s SER 104 CO 0.15 -4.19 1.63 1.55 0.98 0.00 0.00 173.24 173.36 1vvd h PRO 105 N -2.62 0.32 0.00 4.02 0.13 -1.69 -2.81 132.00 129.34 1vvd h PRO 105 Ca -0.47 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 1vvd h PRO 105 Cb 1.31 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1vvd h PRO 105 CO 0.38 0.72 0.00 0.41 -0.23 0.00 0.00 178.00 179.28 1vvd n GLY 106 N -0.00 -0.77 1.61 1.56 0.00 -1.26 -3.94 105.19 102.39 1vvd n GLY 106 Ca -0.02 -0.08 -0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.77 -2.57 -0.17 1.61 3.02 -1.06 -4.85 115.26 110.47 1vvd n ASN 107 Ca 0.10 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.78 1vvd n ASN 107 Cb 0.05 -1.41 0.00 0.00 -0.61 0.00 0.00 39.78 37.81 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 0.03 0.00 -3.47 3.41 -2.24 -1.26 -4.54 114.28 106.21 1vvd n THR 108 Ca 0.00 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.53 1vvd n THR 108 Cb 0.00 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.11 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 -2.16 0.10 0.01 4.78 0.23 -1.26 -3.44 118.94 117.20 1vvd s TRP 109 Ca 0.00 -0.77 0.01 0.00 -2.03 0.00 0.00 56.10 53.32 1vvd s TRP 109 Cb 0.00 -0.73 -0.04 0.00 0.03 0.00 0.00 33.47 32.73 1vvd s TRP 109 CO 0.00 -0.87 0.03 0.15 0.96 0.00 0.00 176.95 177.22 1vvd s LYS 110 N 1.99 2.85 1.15 4.98 1.02 -1.01 -3.67 119.74 127.05 1vvd s LYS 110 Ca 0.11 -0.60 -0.19 0.00 0.02 0.00 0.00 55.97 55.31 1vvd s LYS 110 Cb -0.16 -2.72 0.27 0.00 -0.52 0.00 0.00 37.83 34.70 1vvd s LYS 110 CO -0.28 0.62 1.18 -1.25 -0.92 0.00 0.00 175.35 174.70 1vvd s PRO 111 N -1.74 -0.80 -0.42 -1.68 0.04 -1.26 0.19 135.00 129.32 1vvd s PRO 111 Ca 0.22 -0.23 -0.46 0.00 0.04 0.00 0.00 61.00 60.58 1vvd s PRO 111 Cb -0.12 -1.66 -0.20 0.00 0.04 0.00 0.00 34.50 32.57 1vvd s PRO 111 CO 0.13 -3.40 1.55 -1.91 0.04 0.00 0.00 177.00 173.41 1vvd n GLU 112 N -4.51 0.11 -1.43 4.56 2.13 -1.25 -4.71 120.64 115.54 1vvd n GLU 112 Ca 0.15 0.04 -0.49 0.00 0.66 0.00 0.00 57.16 57.51 1vvd n GLU 112 Cb 0.60 -1.56 -0.04 0.00 0.27 0.00 0.00 31.44 30.71 1vvd n GLU 112 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1vvd n LEU 113 N 3.84 -0.81 -4.82 4.31 4.32 -1.24 -4.17 117.00 118.43 1vvd n LEU 113 Ca 0.29 1.14 -0.31 0.00 -0.02 0.00 0.00 56.01 57.11 1vvd n LEU 113 Cb -0.03 -0.98 0.06 0.00 -1.62 0.00 0.00 43.42 40.85 1vvd n LEU 113 CO 0.86 -2.70 0.71 -2.16 -1.22 0.00 0.00 177.39 172.88 1vvd s PRO 114 N -0.89 2.82 -0.33 3.23 0.04 -1.26 -4.63 135.00 133.99 1vvd s PRO 114 Ca 0.67 0.91 0.02 0.00 0.04 0.00 0.00 61.00 62.64 1vvd s PRO 114 Cb -0.96 -1.98 0.10 0.00 0.04 0.00 0.00 34.50 31.70 1vvd s PRO 114 CO 0.56 -1.17 0.07 0.21 0.04 0.00 0.00 177.00 176.72 1vvd s LYS 115 N -5.06 1.12 -0.63 4.56 2.20 -0.66 -4.10 119.74 117.16 1vvd s LYS 115 Ca 0.58 -1.51 -0.28 0.00 -0.36 0.00 0.00 55.97 54.41 1vvd s LYS 115 Cb -0.14 -2.63 -0.12 0.00 -1.51 0.00 0.00 37.83 33.43 1vvd s LYS 115 CO 0.55 -0.96 2.49 0.00 -0.36 0.00 0.00 175.35 177.06 1vvd s VAL 117 N 10.88 1.14 0.00 0.00 -7.23 -0.89 -4.72 120.40 119.58 1vvd s VAL 117 Ca 1.10 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1vvd s VAL 117 Cb -0.55 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 34.31 1vvd s VAL 117 CO 0.35 0.00 0.40 -2.11 -0.31 0.00 0.00 175.10 173.43