#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vvd n LYS 2 N 0.00 0.89 -3.56 1.45 2.85 -1.26 -4.94 118.16 113.58 1vvd n LYS 2 Ca 0.00 -1.75 -0.28 0.00 -1.05 0.00 0.00 58.31 55.24 1vvd n LYS 2 Cb 0.00 2.17 -0.11 0.00 -0.65 0.00 0.00 35.03 36.45 1vvd n LYS 2 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1vvd s GLN 4 N -0.32 -2.57 0.37 0.00 -0.21 -1.19 0.13 119.66 115.87 1vvd s GLN 4 Ca 0.29 0.08 -0.24 0.00 0.02 0.00 0.00 55.36 55.51 1vvd s GLN 4 Cb -0.02 -1.42 -0.13 0.00 1.00 0.00 0.00 33.01 32.44 1vvd s GLN 4 CO -0.17 -4.63 0.64 -1.13 -2.12 0.00 0.00 175.29 167.89 1vvd n SER 5 N -5.44 -0.47 -4.80 5.90 3.41 -1.26 -4.39 113.62 106.58 1vvd n SER 5 Ca 0.13 0.99 -0.34 0.00 -0.26 0.00 0.00 58.87 59.39 1vvd n SER 5 Cb 0.60 -1.13 -0.01 0.00 -0.26 0.00 0.00 64.21 63.40 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 -1.51 3.57 0.97 4.33 0.04 -1.26 -5.04 135.00 136.10 1vvd s PRO 6 Ca 0.62 1.34 -0.13 0.00 0.04 0.00 0.00 61.00 62.87 1vvd s PRO 6 Cb -0.66 -2.06 0.17 0.00 0.04 0.00 0.00 34.50 31.99 1vvd s PRO 6 CO 0.58 -0.62 1.14 -1.25 0.04 0.00 0.00 177.00 176.89 1vvd s PRO 7 N -3.53 0.68 1.16 0.56 0.04 -1.26 -4.87 135.00 127.78 1vvd s PRO 7 Ca 0.67 0.25 -0.18 0.00 0.04 0.00 0.00 61.00 61.78 1vvd s PRO 7 Cb -0.17 -1.79 0.27 0.00 0.04 0.00 0.00 34.50 32.84 1vvd s PRO 7 CO 0.27 -2.50 1.10 -1.54 0.04 0.00 0.00 177.00 174.37 1vvd s SER 8 N -3.94 1.28 0.01 6.66 1.04 -1.26 -4.78 113.70 112.70 1vvd s SER 8 Ca 0.66 0.76 0.00 0.00 0.48 0.00 0.00 55.95 57.85 1vvd s SER 8 Cb -0.14 -1.11 -0.00 0.00 0.10 0.00 0.00 66.02 64.86 1vvd s SER 8 CO 0.54 -3.91 0.01 2.30 0.98 0.00 0.00 173.24 173.16 1vvd n ILE 9 N -4.64 0.00 -1.53 -1.02 -5.35 -1.05 -5.03 119.36 100.75 1vvd n ILE 9 Ca 0.11 -0.04 -0.37 0.00 -0.27 0.00 0.00 62.75 62.18 1vvd n ILE 9 Cb 0.59 0.02 -0.08 0.00 -1.74 0.00 0.00 39.64 38.43 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 -2.76 1.40 -4.08 7.28 2.88 -1.26 -2.73 113.62 114.35 1vvd n SER 10 Ca 0.00 -0.27 -0.42 0.00 -1.33 0.00 0.00 58.87 56.86 1vvd n SER 10 Cb 0.01 -1.30 -0.00 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 13.64 -3.09 -3.56 -3.46 4.13 -1.26 -3.98 115.26 117.68 1vvd n ASN 11 Ca 0.50 -1.26 -0.14 0.00 1.68 0.00 0.00 54.58 55.35 1vvd n ASN 11 Cb 0.33 -1.88 -0.06 0.00 -1.54 0.00 0.00 39.78 36.63 1vvd n ASN 11 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1vvd s GLY 12 N -3.73 -0.43 0.44 7.41 0.00 -1.11 -2.94 107.32 106.96 1vvd s GLY 12 Ca 0.38 1.72 0.05 0.00 0.00 0.00 0.00 44.72 46.87 1vvd s GLY 12 CO 0.96 1.09 0.60 0.54 0.00 0.00 0.00 173.10 176.30 1vvd n ARG 13 N 1.04 0.57 -3.81 2.90 1.74 0.24 -2.51 116.66 116.82 1vvd n ARG 13 Ca -0.15 -2.14 -0.13 0.00 -0.77 0.00 0.00 57.85 54.67 1vvd n ARG 13 Cb 0.57 -0.25 -0.13 0.00 -1.02 0.00 0.00 32.46 31.64 1vvd n ARG 13 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1vvd s HIS 14 N -1.69 -0.16 0.00 -1.55 -3.43 -1.26 0.20 115.29 107.40 1vvd s HIS 14 Ca 0.44 0.40 0.00 0.00 -0.80 0.00 0.00 55.06 55.10 1vvd s HIS 14 Cb -0.03 0.04 0.00 0.00 -1.43 0.00 0.00 32.58 31.15 1vvd s HIS 14 CO 0.28 -0.09 0.00 -1.71 -2.00 0.00 0.00 174.74 171.22 1vvd n ASN 15 N 3.17 2.90 0.00 7.38 2.85 -1.26 -4.89 115.26 125.40 1vvd n ASN 15 Ca -0.14 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.33 1vvd n ASN 15 Cb 0.58 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.60 1vvd n ASN 15 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1vvd n GLY 16 N 0.00 1.31 3.78 8.20 0.00 -1.26 -4.26 105.19 112.95 1vvd n GLY 16 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.08 -2.01 -2.50 1.61 4.02 -1.26 -4.98 117.16 111.97 1vvd n TYR 17 Ca 0.00 0.85 0.00 0.00 -0.01 0.00 0.00 57.90 58.74 1vvd n TYR 17 Cb 0.00 -4.24 0.00 0.00 -0.02 0.00 0.00 39.34 35.08 1vvd n TYR 17 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1vvd n GLU 18 N -4.40 3.53 0.00 -0.72 0.28 -1.26 -5.05 120.64 113.03 1vvd n GLU 18 Ca -0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.79 1vvd n GLU 18 Cb 0.64 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.51 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 0.00 0.00 -2.70 -1.84 -0.08 -1.26 -5.02 116.55 105.65 1vvd n ASP 19 Ca 0.00 0.00 -0.07 0.00 -1.51 0.00 0.00 54.79 53.21 1vvd n ASP 19 Cb 0.00 0.00 0.09 0.00 2.34 0.00 0.00 41.12 43.55 1vvd n ASP 19 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 1vvd n PHE 20 N 0.00 -1.95 -0.96 -0.67 -1.74 -1.26 -3.98 117.46 106.90 1vvd n PHE 20 Ca 0.00 -1.61 -0.35 0.00 -0.56 0.00 0.00 57.45 54.93 1vvd n PHE 20 Cb 0.00 1.48 0.06 0.00 1.52 0.00 0.00 39.48 42.54 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 -0.09 -4.10 0.08 2.97 4.01 0.34 -4.46 117.16 115.92 1vvd n TYR 21 Ca -0.04 0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1vvd n TYR 21 Cb 0.75 -1.54 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 -2.76 0.91 -3.63 -0.72 -1.04 -1.25 0.22 114.28 106.00 1vvd n THR 22 Ca 0.01 0.30 -0.10 0.00 -2.04 0.00 0.00 64.05 62.21 1vvd n THR 22 Cb 0.55 -1.30 -0.07 0.00 -1.82 0.00 0.00 70.33 67.69 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 -5.73 -0.51 -0.46 8.00 2.15 -1.26 -3.36 116.67 115.50 1vvd s ASP 23 Ca 0.00 0.96 0.00 0.00 0.43 0.00 0.00 52.55 53.94 1vvd s ASP 23 Cb 0.00 0.96 0.00 0.00 -0.30 0.00 0.00 42.92 43.58 1vvd s ASP 23 CO 0.00 -0.19 0.00 0.61 -0.17 0.00 0.00 175.17 175.42 1vvd n GLY 24 N 2.22 0.71 3.99 2.66 0.00 0.42 -4.91 105.19 110.27 1vvd n GLY 24 Ca -0.13 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.68 5.67 0.07 1.61 0.01 -0.99 -4.90 113.70 112.49 1vvd s SER 25 Ca 0.00 -0.17 0.01 0.00 1.31 0.00 0.00 55.95 57.10 1vvd s SER 25 Cb 0.00 -0.97 -0.04 0.00 0.21 0.00 0.00 66.02 65.22 1vvd s SER 25 CO 0.00 -0.76 -0.05 -0.69 0.41 0.00 0.00 173.24 172.15 1vvd s VAL 26 N -2.43 0.51 -0.22 3.43 1.01 -1.25 -1.11 120.40 120.35 1vvd s VAL 26 Ca 0.52 -1.76 -0.04 0.00 0.00 0.00 0.00 61.98 60.71 1vvd s VAL 26 Cb -0.10 -1.45 0.09 0.00 0.00 0.00 0.00 36.38 34.92 1vvd s VAL 26 CO 0.34 -0.84 0.19 -0.69 0.00 0.00 0.00 175.10 174.11 1vvd s VAL 27 N -3.36 -0.25 -0.45 2.92 1.01 -0.25 -4.76 120.40 115.25 1vvd s VAL 27 Ca 0.07 -0.25 -0.28 0.00 0.00 0.00 0.00 61.98 61.52 1vvd s VAL 27 Cb 0.04 -0.73 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 1vvd s VAL 27 CO -0.06 -0.32 1.82 0.42 0.00 0.00 0.00 175.10 176.97 1vvd s THR 28 N 2.26 3.44 -0.08 3.92 -4.23 -1.26 -0.13 115.64 119.56 1vvd s THR 28 Ca 0.06 0.38 -0.30 0.00 -1.18 0.00 0.00 61.69 60.66 1vvd s THR 28 Cb -0.16 -3.77 -0.05 0.00 1.34 0.00 0.00 72.50 69.87 1vvd s THR 28 CO -0.17 -0.61 1.62 -0.31 -0.54 0.00 0.00 174.62 174.61 1vvd s TYR 29 N 7.86 2.05 0.59 3.99 1.51 -1.26 -4.01 117.35 128.08 1vvd s TYR 29 Ca 0.74 0.29 -0.18 0.00 -1.01 0.00 0.00 57.07 56.92 1vvd s TYR 29 Cb -0.18 -3.89 -0.03 0.00 -0.11 0.00 0.00 41.96 37.75 1vvd s TYR 29 CO 0.28 -3.61 1.12 -1.12 -1.11 0.00 0.00 175.55 171.12 1vvd s SER 30 N 3.34 5.47 0.31 2.29 0.01 0.53 -4.79 113.70 120.85 1vvd s SER 30 Ca 0.72 2.11 0.09 0.00 1.31 0.00 0.00 55.95 60.18 1vvd s SER 30 Cb -0.32 -2.57 -0.06 0.00 0.21 0.00 0.00 66.02 63.28 1vvd s SER 30 CO 0.28 -1.39 -0.10 0.00 0.41 0.00 0.00 173.24 172.44 1vvd n ASN 32 N -0.69 3.57 -4.41 0.00 4.13 -1.15 -4.73 115.26 111.98 1vvd n ASN 32 Ca -0.05 1.21 -0.49 0.00 1.68 0.00 0.00 54.58 56.93 1vvd n ASN 32 Cb 0.63 -1.58 -0.12 0.00 -1.54 0.00 0.00 39.78 37.17 1vvd n ASN 32 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1vvd n SER 33 N 0.86 0.88 0.00 6.41 7.64 -1.26 0.10 113.62 128.25 1vvd n SER 33 Ca 0.03 0.33 0.00 0.00 1.01 0.00 0.00 58.87 60.24 1vvd n SER 33 Cb 0.38 -1.02 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 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 6.81 1.25 3.72 0.23 0.00 -1.26 -5.08 105.19 110.86 1vvd n GLY 34 Ca 0.56 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.87 3.38 0.43 1.61 1.51 0.28 -4.71 117.35 118.99 1vvd s TYR 35 Ca 0.00 1.21 -0.21 0.00 -1.01 0.00 0.00 57.07 57.06 1vvd s TYR 35 Cb 0.00 -3.49 -0.10 0.00 -0.11 0.00 0.00 41.96 38.25 1vvd s TYR 35 CO 0.00 -1.58 0.98 0.45 -1.11 0.00 0.00 175.55 174.28 1vvd s SER 36 N 1.02 6.82 -0.37 2.29 0.15 0.81 -4.59 113.70 119.82 1vvd s SER 36 Ca 0.60 1.78 -0.17 0.00 0.70 0.00 0.00 55.95 58.85 1vvd s SER 36 Cb -0.32 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.45 1vvd s SER 36 CO 0.30 -0.45 0.47 -0.22 1.20 0.00 0.00 173.24 174.54 1vvd s LEU 37 N -3.14 4.50 0.10 3.45 2.96 -1.25 -1.63 118.68 123.66 1vvd s LEU 37 Ca 0.62 -0.26 0.05 0.00 -0.22 0.00 0.00 54.13 54.32 1vvd s LEU 37 Cb -0.12 -2.49 -0.04 0.00 0.50 0.00 0.00 46.19 44.04 1vvd s LEU 37 CO 0.16 -0.49 0.01 -0.63 -1.32 0.00 0.00 176.35 174.07 1vvd s ILE 38 N 2.28 4.03 0.00 6.68 -1.09 0.17 -4.83 121.20 128.44 1vvd s ILE 38 Ca 0.16 -1.02 0.00 0.00 -2.23 0.00 0.00 60.65 57.56 1vvd s ILE 38 Cb -0.16 -2.93 0.00 0.00 -1.58 0.00 0.00 42.46 37.79 1vvd s ILE 38 CO 0.13 0.09 0.00 0.61 -1.23 0.00 0.00 174.94 174.55 1vvd n GLY 39 N 0.48 0.14 2.71 6.18 0.00 -1.26 0.30 105.19 113.74 1vvd n GLY 39 Ca -0.10 -1.67 -0.34 0.00 0.00 0.00 0.00 46.02 43.91 1vvd n GLY 39 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vvd n ASN 40 N 0.00 6.10 -2.81 1.61 3.02 -1.26 -4.93 115.26 116.99 1vvd n ASN 40 Ca 0.00 -3.77 -0.04 0.00 -0.03 0.00 0.00 54.58 50.74 1vvd n ASN 40 Cb 0.00 -0.78 -0.01 0.00 -0.61 0.00 0.00 39.78 38.38 1vvd n ASN 40 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1vvd n SER 41 N -0.46 0.09 0.00 6.41 3.41 -1.26 -4.65 113.62 117.16 1vvd n SER 41 Ca 0.45 -0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 1vvd n SER 41 Cb 0.43 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 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 -1.21 3.75 3.66 5.00 0.00 -1.26 -4.54 105.19 110.59 1vvd n GLY 42 Ca -0.04 -0.28 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 1vvd n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vvd s VAL 43 N -0.16 4.76 -0.53 1.61 1.01 0.81 -4.56 120.40 123.33 1vvd s VAL 43 Ca 0.00 1.88 -0.19 0.00 0.00 0.00 0.00 61.98 63.67 1vvd s VAL 43 Cb 0.00 -4.25 0.08 0.00 0.00 0.00 0.00 36.38 32.21 1vvd s VAL 43 CO 0.00 -0.10 0.63 -0.22 0.00 0.00 0.00 175.10 175.41 1vvd s LEU 44 N 2.79 5.21 -0.20 3.92 2.96 -0.63 -1.10 118.68 131.63 1vvd s LEU 44 Ca 0.42 -1.15 -0.28 0.00 -0.22 0.00 0.00 54.13 52.89 1vvd s LEU 44 Cb -0.16 -2.37 0.00 0.00 0.50 0.00 0.00 46.19 44.17 1vvd s LEU 44 CO 0.09 -0.94 0.99 0.00 -1.32 0.00 0.00 176.35 175.17 1vvd s SER 46 N 1.19 1.30 -0.38 0.00 0.01 -1.10 0.16 113.70 114.88 1vvd s SER 46 Ca 0.43 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.59 1vvd s SER 46 Cb -0.16 -0.44 0.00 0.00 0.21 0.00 0.00 66.02 65.63 1vvd s SER 46 CO 0.09 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.21 1vvd n GLY 47 N 4.70 0.65 1.30 3.44 0.00 -1.26 -2.87 105.19 111.14 1vvd n GLY 47 Ca -0.15 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.12 0.80 2.60 -0.02 0.00 -1.21 -4.83 105.19 100.42 1vvd n GLY 48 Ca -0.04 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.27 0.17 0.30 1.61 2.02 -1.14 -4.87 118.70 114.53 1vvd s GLU 49 Ca 0.00 -0.30 -0.29 0.00 0.02 0.00 0.00 54.97 54.39 1vvd s GLU 49 Cb 0.00 -1.27 -0.12 0.00 0.10 0.00 0.00 34.13 32.83 1vvd s GLU 49 CO 0.00 -0.90 1.39 0.91 0.02 0.00 0.00 175.26 176.68 1vvd n TRP 50 N 5.27 2.38 -4.27 1.61 7.02 -1.26 -2.71 117.44 125.48 1vvd n TRP 50 Ca -0.06 0.45 -0.19 0.00 -1.02 0.00 0.00 57.50 56.69 1vvd n TRP 50 Cb 0.45 -2.47 -0.08 0.00 -2.42 0.00 0.00 31.31 26.79 1vvd n TRP 50 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 1vvd s SER 51 N 0.05 1.65 -0.97 -0.99 0.01 -0.74 -4.92 113.70 107.79 1vvd s SER 51 Ca 0.61 -1.75 -0.16 0.00 1.31 0.00 0.00 55.95 55.96 1vvd s SER 51 Cb -0.58 0.57 0.02 0.00 0.21 0.00 0.00 66.02 66.24 1vvd s SER 51 CO 0.56 -1.09 0.61 0.47 0.41 0.00 0.00 173.24 174.20 1vvd n ASP 52 N -1.57 -4.29 -4.70 2.44 9.92 -1.26 -1.61 116.55 115.48 1vvd n ASP 52 Ca 0.07 -1.10 -0.39 0.00 -0.53 0.00 0.00 54.79 52.84 1vvd n ASP 52 Cb 0.62 -1.53 -0.06 0.00 -0.64 0.00 0.00 41.12 39.52 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 -6.07 4.31 1.02 -0.24 0.04 -1.26 -4.05 135.00 128.75 1vvd s PRO 53 Ca 0.22 0.57 -0.16 0.00 0.04 0.00 0.00 61.00 61.67 1vvd s PRO 53 Cb -0.13 -3.49 0.21 0.00 0.04 0.00 0.00 34.50 31.14 1vvd s PRO 53 CO 0.90 0.00 1.24 -1.25 0.04 0.00 0.00 177.00 177.93 1vvd s PRO 54 N 1.10 0.22 0.18 0.56 0.04 -1.25 -4.80 135.00 131.06 1vvd s PRO 54 Ca 0.29 -0.22 0.11 0.00 0.04 0.00 0.00 61.00 61.22 1vvd s PRO 54 Cb -0.16 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 1vvd s PRO 54 CO 0.12 -2.72 -0.25 0.95 0.04 0.00 0.00 177.00 175.14 1vvd s THR 55 N -3.57 2.34 -0.82 1.26 -4.23 0.86 -4.85 115.64 106.63 1vvd s THR 55 Ca 0.72 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 59.26 1vvd s THR 55 Cb -0.07 -2.10 0.21 0.00 1.34 0.00 0.00 72.50 71.88 1vvd s THR 55 CO 0.54 -0.07 0.72 0.00 -0.54 0.00 0.00 174.62 175.26 1vvd n GLN 57 N 2.02 0.88 -3.51 0.00 10.64 -0.65 -4.74 117.38 122.02 1vvd n GLN 57 Ca 0.22 -3.05 -0.37 0.00 -1.83 0.00 0.00 57.00 51.97 1vvd n GLN 57 Cb 0.36 0.59 -0.07 0.00 -0.86 0.00 0.00 30.24 30.27 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 -2.45 5.29 -0.49 -0.39 1.09 -1.26 0.28 121.20 123.27 1vvd s ILE 58 Ca 0.13 0.60 0.04 0.00 -1.10 0.00 0.00 60.65 60.32 1vvd s ILE 58 Cb -0.01 -3.66 0.41 0.00 -1.06 0.00 0.00 42.46 38.14 1vvd s ILE 58 CO 0.08 0.38 1.24 1.33 -0.10 0.00 0.00 174.94 177.87 1vvd n VAL 59 N 3.59 2.54 -0.08 2.92 0.24 -1.26 -3.75 118.33 122.53 1vvd n VAL 59 Ca -0.11 -4.85 0.00 0.00 -2.04 0.00 0.00 64.34 57.34 1vvd n VAL 59 Cb 0.52 -1.26 0.00 0.00 -1.47 0.00 0.00 33.84 31.62 1vvd n VAL 59 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1vvd n LYS 60 N -0.49 0.18 -3.72 7.34 5.02 -1.26 -2.79 118.16 122.43 1vvd n LYS 60 Ca 0.41 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.58 1vvd n LYS 60 Cb 0.60 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.54 1vvd n LYS 60 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vvd h PRO 62 N 3.18 0.00 0.00 0.00 0.13 -1.83 -3.41 132.00 130.07 1vvd h PRO 62 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1vvd h PRO 62 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1vvd h PRO 62 CO 0.45 0.03 0.00 0.72 -0.23 0.00 0.00 178.00 178.96 1vvd n HIS 63 N -4.76 0.00 -1.60 1.56 8.25 -1.26 -4.94 115.22 112.47 1vvd n HIS 63 Ca -0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.04 1vvd n HIS 63 Cb 0.04 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.14 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 3.08 -2.64 -0.41 -0.04 -1.26 -4.92 135.00 128.80 1vvd n PRO 64 Ca 0.00 -2.48 -0.23 0.00 -0.04 0.00 0.00 63.50 60.75 1vvd n PRO 64 Cb 0.00 -3.15 0.10 0.00 -0.04 0.00 0.00 33.50 30.41 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 2.92 2.19 -0.13 0.52 -4.23 -1.26 -4.57 115.64 111.09 1vvd s THR 65 Ca 0.54 -0.65 -0.33 0.00 -1.18 0.00 0.00 61.69 60.06 1vvd s THR 65 Cb 0.15 -2.54 0.13 0.00 1.34 0.00 0.00 72.50 71.58 1vvd s THR 65 CO -0.08 0.00 1.21 -0.51 -0.54 0.00 0.00 174.62 174.70 1vvd s ILE 66 N -3.05 0.00 -0.37 2.99 2.07 -1.26 -4.81 121.20 116.77 1vvd s ILE 66 Ca 0.65 -0.07 -0.28 0.00 -1.41 0.00 0.00 60.65 59.53 1vvd s ILE 66 Cb -0.06 -1.29 -0.02 0.00 0.13 0.00 0.00 42.46 41.22 1vvd s ILE 66 CO 0.43 0.00 1.86 -0.55 -1.91 0.00 0.00 174.94 174.77 1vvd s SER 67 N -2.42 5.71 -0.87 4.50 0.15 -1.26 -3.57 113.70 115.94 1vvd s SER 67 Ca 0.11 1.21 -0.11 0.00 0.70 0.00 0.00 55.95 57.85 1vvd s SER 67 Cb 0.01 -2.52 0.11 0.00 -1.71 0.00 0.00 66.02 61.90 1vvd s SER 67 CO -0.04 -1.87 0.28 0.59 1.20 0.00 0.00 173.24 173.39 1vvd n ASN 68 N 10.97 -1.32 -2.21 5.45 3.02 -1.26 -3.02 115.26 126.89 1vvd n ASN 68 Ca 0.24 -0.34 -0.00 0.00 -0.03 0.00 0.00 54.58 54.45 1vvd n ASN 68 Cb 0.48 -1.21 0.04 0.00 -0.61 0.00 0.00 39.78 38.48 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 -0.74 1.46 0.00 7.41 0.00 -1.23 0.16 105.19 112.24 1vvd n GLY 69 Ca 0.06 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.39 -0.55 -4.51 1.61 0.18 -1.25 -3.39 117.16 108.86 1vvd n TYR 70 Ca -0.02 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.43 1vvd n TYR 70 Cb 0.90 0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 39.70 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 2.35 0.00 -3.48 0.05 -1.25 0.33 118.68 116.67 1vvd s LEU 71 Ca 0.00 -0.53 0.15 0.00 0.05 0.00 0.00 54.13 53.80 1vvd s LEU 71 Cb 0.00 -1.52 0.42 0.00 -2.05 0.00 0.00 46.19 43.03 1vvd s LEU 71 CO 0.00 0.07 1.35 -1.54 -0.55 0.00 0.00 176.35 175.68 1vvd n SER 72 N 4.14 2.52 0.00 1.48 3.41 -1.08 -4.46 113.62 119.64 1vvd n SER 72 Ca -0.19 -2.00 0.00 0.00 -0.26 0.00 0.00 58.87 56.42 1vvd n SER 72 Cb 0.51 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 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 0.88 0.00 -3.11 4.04 7.64 -1.25 -4.98 113.62 116.84 1vvd n SER 73 Ca 0.16 0.43 0.05 0.00 1.01 0.00 0.00 58.87 60.52 1vvd n SER 73 Cb 0.40 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 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 -1.79 -1.06 0.53 0.23 0.00 -1.26 -5.01 107.32 98.95 1vvd s GLY 74 Ca 0.00 1.81 0.08 0.00 0.00 0.00 0.00 44.72 46.60 1vvd s GLY 74 CO 0.00 4.06 0.73 -0.12 0.00 0.00 0.00 173.10 177.77 1vvd s PHE 75 N 2.79 2.01 0.13 1.90 2.19 -1.26 -4.88 117.98 120.86 1vvd s PHE 75 Ca 0.24 -0.52 -0.25 0.00 0.33 0.00 0.00 56.93 56.72 1vvd s PHE 75 Cb -0.02 -2.38 0.07 0.00 -1.31 0.00 0.00 43.02 39.38 1vvd s PHE 75 CO -0.22 -0.93 0.94 0.21 1.83 0.00 0.00 175.22 177.05 1vvd s LYS 76 N -4.61 1.15 0.50 10.12 2.20 -1.26 -5.01 119.74 122.83 1vvd s LYS 76 Ca 0.60 -0.61 0.21 0.00 -0.36 0.00 0.00 55.97 55.81 1vvd s LYS 76 Cb -0.07 0.41 1.29 0.00 -1.51 0.00 0.00 37.83 37.94 1vvd s LYS 76 CO 0.37 -0.52 2.00 0.00 -0.36 0.00 0.00 175.35 176.84 1vvd h ARG 77 N 2.00 0.11 -3.32 4.03 3.08 -2.00 -3.44 114.38 114.84 1vvd h ARG 77 Ca -0.24 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.78 1vvd h ARG 77 Cb 1.23 -0.02 -0.11 0.00 0.08 0.00 0.00 29.97 31.15 1vvd h ARG 77 CO 0.26 0.07 0.01 -1.12 -1.07 0.00 0.00 179.97 178.12 1vvd s SER 78 N -6.30 -0.27 0.00 7.04 0.01 -1.26 -4.92 113.70 108.01 1vvd s SER 78 Ca -0.06 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.78 1vvd s SER 78 Cb 0.19 0.55 0.00 0.00 0.21 0.00 0.00 66.02 66.98 1vvd s SER 78 CO 0.73 -1.00 0.00 -1.22 0.41 0.00 0.00 173.24 172.16 1vvd n TYR 79 N -0.31 0.00 -1.70 2.43 4.02 -1.26 -4.96 117.16 115.37 1vvd n TYR 79 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.77 1vvd n TYR 79 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.95 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 -1.19 0.06 -4.77 7.72 3.41 -1.24 -3.56 113.62 114.06 1vvd n SER 80 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.23 1vvd n SER 80 Cb 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.93 1vvd n SER 80 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1vvd s TYR 81 N 0.75 3.04 0.00 7.33 5.04 -1.12 -4.32 117.35 128.07 1vvd s TYR 81 Ca 0.00 1.56 0.00 0.00 -2.44 0.00 0.00 57.07 56.19 1vvd s TYR 81 Cb 0.00 -3.37 0.00 0.00 0.35 0.00 0.00 41.96 38.94 1vvd s TYR 81 CO 0.00 -1.31 0.00 -1.71 -1.34 0.00 0.00 175.55 171.19 1vvd n ASN 82 N -0.06 0.00 -3.19 4.32 2.85 0.73 -4.84 115.26 115.06 1vvd n ASN 82 Ca 0.05 0.00 -0.17 0.00 -0.11 0.00 0.00 54.58 54.35 1vvd n ASN 82 Cb 0.47 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.51 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 11.00 -6.61 -4.75 1.20 9.92 -1.26 0.29 116.55 126.34 1vvd n ASP 83 Ca 0.00 0.36 -0.40 0.00 -0.53 0.00 0.00 54.79 54.22 1vvd n ASP 83 Cb 0.00 -2.81 -0.05 0.00 -0.64 0.00 0.00 41.12 37.62 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 -1.55 7.18 -0.19 -2.24 4.22 -1.26 -1.73 114.94 119.37 1vvd s ASN 84 Ca 0.19 1.41 0.01 0.00 -2.14 0.00 0.00 52.86 52.33 1vvd s ASN 84 Cb -0.03 -2.45 0.02 0.00 1.28 0.00 0.00 41.25 40.08 1vvd s ASN 84 CO 0.58 0.05 -0.19 0.68 -2.04 0.00 0.00 177.10 176.18 1vvd s VAL 85 N -0.16 2.08 0.17 3.54 -7.23 -0.47 -4.83 120.40 113.50 1vvd s VAL 85 Ca 0.37 -1.01 -0.30 0.00 -1.81 0.00 0.00 61.98 59.23 1vvd s VAL 85 Cb -0.20 -1.91 -0.08 0.00 0.56 0.00 0.00 36.38 34.75 1vvd s VAL 85 CO 0.22 0.48 1.17 -0.62 -0.31 0.00 0.00 175.10 176.04 1vvd s ASP 86 N 1.27 7.13 -0.15 4.85 2.15 -1.26 -2.22 116.67 128.43 1vvd s ASP 86 Ca 0.04 2.17 -0.16 0.00 0.43 0.00 0.00 52.55 55.03 1vvd s ASP 86 Cb -0.14 -2.60 -0.04 0.00 -0.30 0.00 0.00 42.92 39.84 1vvd s ASP 86 CO -0.12 -0.35 0.38 -0.36 -0.17 0.00 0.00 175.17 174.55 1vvd s PHE 87 N 0.05 3.47 -0.57 -5.34 0.08 0.62 -2.62 117.98 113.67 1vvd s PHE 87 Ca 0.53 0.71 -0.09 0.00 0.12 0.00 0.00 56.93 58.20 1vvd s PHE 87 Cb -0.31 -2.45 0.15 0.00 -0.57 0.00 0.00 43.02 39.83 1vvd s PHE 87 CO 0.35 0.17 0.45 0.21 -0.10 0.00 0.00 175.22 176.30 1vvd s LYS 88 N 0.65 2.71 0.15 0.44 2.36 0.98 -4.82 119.74 122.22 1vvd s LYS 88 Ca 0.20 -2.06 -0.34 0.00 -2.55 0.00 0.00 55.97 51.23 1vvd s LYS 88 Cb -0.14 -3.98 -0.16 0.00 -1.05 0.00 0.00 37.83 32.49 1vvd s LYS 88 CO 0.07 -1.21 1.16 0.00 1.55 0.00 0.00 175.35 176.92 1vvd n LYS 90 N 1.84 0.00 -3.64 0.00 4.76 0.43 -4.84 118.16 116.71 1vvd n LYS 90 Ca 0.16 0.24 -0.08 0.00 -2.87 0.00 0.00 58.31 55.75 1vvd n LYS 90 Cb 0.23 -0.74 -0.07 0.00 -1.84 0.00 0.00 35.03 32.61 1vvd n LYS 90 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1vvd s TYR 91 N -0.48 -0.76 -0.87 2.13 2.02 -1.26 -4.96 117.35 113.17 1vvd s TYR 91 Ca 0.00 1.66 -0.01 0.00 -0.37 0.00 0.00 57.07 58.36 1vvd s TYR 91 Cb 0.00 0.42 0.00 0.00 -0.40 0.00 0.00 41.96 41.98 1vvd s TYR 91 CO 0.00 -0.37 0.73 0.41 -1.57 0.00 0.00 175.55 174.75 1vvd n GLY 92 N 3.27 -0.13 3.63 0.71 0.00 -1.26 -5.02 105.19 106.39 1vvd n GLY 92 Ca -0.16 -0.06 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.25 0.28 -0.24 1.61 2.02 -1.26 -4.73 117.35 111.78 1vvd s TYR 93 Ca 0.04 -0.66 -0.01 0.00 -0.37 0.00 0.00 57.07 56.08 1vvd s TYR 93 Cb -0.02 0.27 0.07 0.00 -0.40 0.00 0.00 41.96 41.88 1vvd s TYR 93 CO 0.52 -1.03 0.03 0.15 -1.57 0.00 0.00 175.55 173.65 1vvd s LYS 94 N -4.00 0.96 -0.71 -0.62 3.01 0.67 -4.79 119.74 114.25 1vvd s LYS 94 Ca 0.21 -0.76 -0.32 0.00 -1.01 0.00 0.00 55.97 54.09 1vvd s LYS 94 Cb -0.01 -2.24 -0.16 0.00 -1.01 0.00 0.00 37.83 34.41 1vvd s LYS 94 CO 0.09 -0.72 2.48 1.28 0.51 0.00 0.00 175.35 178.99 1vvd n LEU 95 N 4.88 1.16 -4.54 3.17 4.77 -1.24 -2.34 117.00 122.86 1vvd n LEU 95 Ca -0.08 0.10 -0.41 0.00 -0.03 0.00 0.00 56.01 55.59 1vvd n LEU 95 Cb 0.45 -1.14 -0.03 0.00 -2.33 0.00 0.00 43.42 40.36 1vvd n LEU 95 CO 0.14 -0.94 1.17 -0.55 -1.33 0.00 0.00 177.39 175.88 1vvd s SER 96 N 9.22 6.23 0.00 -1.43 0.15 0.76 -4.34 113.70 124.28 1vvd s SER 96 Ca 1.20 -0.71 0.00 0.00 0.70 0.00 0.00 55.95 57.14 1vvd s SER 96 Cb -0.94 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 60.82 1vvd s SER 96 CO 0.45 -1.72 0.00 0.61 1.20 0.00 0.00 173.24 173.78 1vvd n GLY 97 N 5.62 0.43 3.64 9.45 0.00 -1.26 -1.37 105.19 121.70 1vvd n GLY 97 Ca 0.08 -0.08 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.04 -0.02 1.61 0.01 -1.25 -4.89 113.70 104.12 1vvd s SER 98 Ca 0.00 1.52 -0.22 0.00 1.31 0.00 0.00 55.95 58.56 1vvd s SER 98 Cb 0.00 1.88 -0.14 0.00 0.21 0.00 0.00 66.02 67.96 1vvd s SER 98 CO 0.00 -0.22 0.97 0.77 0.41 0.00 0.00 173.24 175.17 1vvd h SER 99 N 7.52 -0.35 -3.63 2.44 4.64 -1.88 -3.16 113.55 119.13 1vvd h SER 99 Ca -0.23 -0.19 -0.62 0.00 -0.47 0.00 0.00 61.79 60.28 1vvd h SER 99 Cb 1.16 0.09 -0.13 0.00 -0.31 0.00 0.00 62.40 63.20 1vvd h SER 99 CO 0.13 0.10 -0.19 -0.94 -0.87 0.00 0.00 176.83 175.06 1vvd s SER 100 N -5.15 6.34 0.24 4.97 1.04 -1.26 0.23 113.70 120.10 1vvd s SER 100 Ca -0.12 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.70 1vvd s SER 100 Cb 0.01 -2.23 -0.00 0.00 0.10 0.00 0.00 66.02 63.90 1vvd s SER 100 CO 0.45 -0.17 0.01 -1.20 0.98 0.00 0.00 173.24 173.31 1vvd n SER 101 N 5.12 2.47 -3.66 7.02 7.64 -0.94 -4.65 113.62 126.62 1vvd n SER 101 Ca -0.08 -2.07 -0.07 0.00 1.01 0.00 0.00 58.87 57.66 1vvd n SER 101 Cb 0.51 0.22 -0.08 0.00 -1.01 0.00 0.00 64.21 63.84 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 -1.94 -0.14 -0.80 0.44 2.01 0.95 -1.36 115.64 114.80 1vvd s THR 102 Ca 0.01 0.03 -0.25 0.00 0.31 0.00 0.00 61.69 61.79 1vvd s THR 102 Cb 0.00 -0.88 -0.08 0.00 0.01 0.00 0.00 72.50 71.56 1vvd s THR 102 CO 0.01 0.01 2.14 0.00 -0.69 0.00 0.00 174.62 176.10 1vvd n SER 104 N 15.71 -1.72 -4.67 0.00 2.88 -1.25 0.26 113.62 124.84 1vvd n SER 104 Ca 0.40 -1.23 -0.43 0.00 -1.33 0.00 0.00 58.87 56.28 1vvd n SER 104 Cb 0.47 -1.02 -0.02 0.00 -0.75 0.00 0.00 64.21 62.89 1vvd n SER 104 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1vvd s PRO 105 N -5.58 4.30 0.00 -1.46 0.04 -1.26 -3.67 135.00 127.36 1vvd s PRO 105 Ca 0.72 1.32 0.00 0.00 0.04 0.00 0.00 61.00 63.09 1vvd s PRO 105 Cb -0.06 -3.61 0.00 0.00 0.04 0.00 0.00 34.50 30.87 1vvd s PRO 105 CO 0.55 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 177.47 1vvd n GLY 106 N 3.30 0.18 1.45 0.56 0.00 -1.25 -4.95 105.19 104.47 1vvd n GLY 106 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1vvd n GLY 106 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1vvd n ASN 107 N 0.00 -1.93 0.00 1.61 2.85 -1.20 -4.91 115.26 111.68 1vvd n ASN 107 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1vvd n ASN 107 Cb 0.00 -0.96 0.00 0.00 1.24 0.00 0.00 39.78 40.06 1vvd n ASN 107 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1vvd n THR 108 N -0.09 0.00 -3.47 -0.44 -2.24 -1.25 -4.67 114.28 102.12 1vvd n THR 108 Ca 0.00 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.49 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 -3.00 0.74 -0.08 4.78 0.52 -1.26 -3.85 118.94 116.78 1vvd s TRP 109 Ca 0.00 -1.63 -0.07 0.00 0.02 0.00 0.00 56.10 54.42 1vvd s TRP 109 Cb 0.00 -0.93 -0.04 0.00 -1.15 0.00 0.00 33.47 31.35 1vvd s TRP 109 CO 0.00 -0.83 0.18 0.15 0.02 0.00 0.00 176.95 176.47 1vvd s LYS 110 N 1.06 3.49 1.05 4.98 -0.14 -0.87 -3.36 119.74 125.94 1vvd s LYS 110 Ca 0.18 -0.11 -0.15 0.00 -1.36 0.00 0.00 55.97 54.53 1vvd s LYS 110 Cb -0.23 -3.17 0.21 0.00 -1.68 0.00 0.00 37.83 32.96 1vvd s LYS 110 CO 0.01 0.75 1.13 -1.25 -0.76 0.00 0.00 175.35 175.23 1vvd s PRO 111 N -1.22 0.03 0.16 -1.68 0.04 -1.26 -0.03 135.00 131.04 1vvd s PRO 111 Ca 0.18 0.17 -0.31 0.00 0.04 0.00 0.00 61.00 61.09 1vvd s PRO 111 Cb -0.13 -1.72 -0.17 0.00 0.04 0.00 0.00 34.50 32.52 1vvd s PRO 111 CO 0.08 -2.92 0.68 -0.85 0.04 0.00 0.00 177.00 174.02 1vvd n GLU 112 N -4.25 0.11 -1.61 4.56 0.28 -1.21 -4.78 120.64 113.73 1vvd n GLU 112 Ca 0.09 0.04 -0.41 0.00 -0.16 0.00 0.00 57.16 56.72 1vvd n GLU 112 Cb 0.59 -1.17 0.02 0.00 1.43 0.00 0.00 31.44 32.30 1vvd n GLU 112 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1vvd n LEU 113 N 1.86 2.74 -4.77 -1.84 4.32 -1.24 -3.95 117.00 114.13 1vvd n LEU 113 Ca 0.18 1.00 -0.30 0.00 -0.02 0.00 0.00 56.01 56.87 1vvd n LEU 113 Cb 0.22 -1.36 0.10 0.00 -1.62 0.00 0.00 43.42 40.77 1vvd n LEU 113 CO 0.57 -1.53 0.69 -2.16 -1.22 0.00 0.00 177.39 173.74 1vvd s PRO 114 N -2.11 1.89 -0.17 3.23 0.04 -1.20 -4.50 135.00 132.18 1vvd s PRO 114 Ca 0.65 0.82 -0.00 0.00 0.04 0.00 0.00 61.00 62.51 1vvd s PRO 114 Cb -0.53 -1.88 0.04 0.00 0.04 0.00 0.00 34.50 32.16 1vvd s PRO 114 CO 0.56 -1.80 -0.07 0.21 0.04 0.00 0.00 177.00 175.94 1vvd s LYS 115 N -5.02 1.60 -0.54 4.56 2.20 -0.47 -4.43 119.74 117.63 1vvd s LYS 115 Ca 0.61 -0.58 -0.27 0.00 -0.36 0.00 0.00 55.97 55.38 1vvd s LYS 115 Cb -0.16 -2.09 -0.04 0.00 -1.51 0.00 0.00 37.83 34.03 1vvd s LYS 115 CO 0.56 -0.42 2.05 0.00 -0.36 0.00 0.00 175.35 177.17 1vvd n VAL 117 N 7.50 0.00 0.98 0.00 0.24 -0.99 -4.74 118.33 121.31 1vvd n VAL 117 Ca 0.26 -1.76 0.12 0.00 -2.04 0.00 0.00 64.34 60.91 1vvd n VAL 117 Cb 0.52 0.27 0.10 0.00 -1.47 0.00 0.00 33.84 33.26 1vvd n VAL 117 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23