#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vhz n LEU 1 N 0.00 3.80 -4.72 1.04 4.77 -1.26 -4.94 117.00 115.69 1vhz n LEU 1 Ca 0.00 1.04 -0.42 0.00 -0.03 0.00 0.00 56.01 56.59 1vhz n LEU 1 Cb 0.00 -1.53 -0.01 0.00 -2.33 0.00 0.00 43.42 39.55 1vhz n LEU 1 CO 0.00 0.07 1.08 -0.24 -1.33 0.00 0.00 177.39 176.98 1vhz n SER 2 N 4.53 3.32 -4.36 -1.43 2.88 -1.26 -4.99 113.62 112.32 1vhz n SER 2 Ca 0.17 1.18 -0.19 0.00 -1.33 0.00 0.00 58.87 58.70 1vhz n SER 2 Cb 0.34 -1.53 -0.10 0.00 -0.75 0.00 0.00 64.21 62.17 1vhz n SER 2 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1vhz s LYS 3 N -1.15 1.36 0.91 -1.46 0.00 -1.26 -5.15 119.74 113.00 1vhz s LYS 3 Ca 0.61 -1.64 -0.12 0.00 0.00 0.00 0.00 55.97 54.82 1vhz s LYS 3 Cb -0.54 -1.00 0.13 0.00 0.00 0.00 0.00 37.83 36.42 1vhz s LYS 3 CO 0.55 0.09 1.09 -1.12 0.00 0.00 0.00 175.35 175.96 1vhz s SER 4 N -3.33 3.39 0.36 0.03 0.01 -1.26 -5.00 113.70 107.91 1vhz s SER 4 Ca 0.25 1.43 -0.26 0.00 1.31 0.00 0.00 55.95 58.67 1vhz s SER 4 Cb 0.02 -2.11 -0.09 0.00 0.21 0.00 0.00 66.02 64.05 1vhz s SER 4 CO 0.08 -2.68 1.14 -0.76 0.41 0.00 0.00 173.24 171.43 1vhz s LEU 5 N -6.23 4.30 -0.13 2.44 1.43 -1.26 -5.03 118.68 114.20 1vhz s LEU 5 Ca 0.64 2.29 -0.01 0.00 -1.03 0.00 0.00 54.13 56.02 1vhz s LEU 5 Cb -0.18 -3.92 0.03 0.00 0.03 0.00 0.00 46.19 42.16 1vhz s LEU 5 CO 0.57 -0.48 -0.05 -1.58 0.23 0.00 0.00 176.35 175.03 1vhz s GLN 6 N -2.06 1.34 0.53 1.70 0.74 -1.26 -5.13 119.66 115.52 1vhz s GLN 6 Ca 0.53 -0.29 -0.21 0.00 0.05 0.00 0.00 55.36 55.44 1vhz s GLN 6 Cb -0.30 -1.64 -0.05 0.00 1.10 0.00 0.00 33.01 32.11 1vhz s GLN 6 CO 0.38 -0.33 1.24 0.15 -0.55 0.00 0.00 175.29 176.18 1vhz s LYS 7 N 1.73 3.31 0.80 1.67 1.02 -1.26 -4.48 119.74 122.53 1vhz s LYS 7 Ca 0.04 1.93 -0.12 0.00 0.02 0.00 0.00 55.97 57.84 1vhz s LYS 7 Cb -0.13 -2.20 0.08 0.00 -0.52 0.00 0.00 37.83 35.05 1vhz s LYS 7 CO -0.08 -0.97 1.13 -1.25 -0.92 0.00 0.00 175.35 173.27 1vhz s PRO 8 N -2.98 1.90 -0.10 -1.68 0.04 -1.26 -4.71 135.00 126.21 1vhz s PRO 8 Ca 0.71 1.41 -0.10 0.00 0.04 0.00 0.00 61.00 63.06 1vhz s PRO 8 Cb -0.33 -1.84 -0.05 0.00 0.04 0.00 0.00 34.50 32.33 1vhz s PRO 8 CO 0.38 -1.95 0.22 -0.08 0.04 0.00 0.00 177.00 175.61 1vhz s THR 9 N -2.61 5.36 -0.39 1.26 -1.32 0.41 -4.88 115.64 113.47 1vhz s THR 9 Ca 0.66 0.40 -0.27 0.00 -1.21 0.00 0.00 61.69 61.27 1vhz s THR 9 Cb -0.21 -3.51 0.02 0.00 -1.51 0.00 0.00 72.50 67.29 1vhz s THR 9 CO 0.53 0.57 1.02 -0.63 -2.21 0.00 0.00 174.62 173.91 1vhz s ILE 10 N -0.79 4.46 0.01 5.08 1.01 -1.26 -1.37 121.20 128.33 1vhz s ILE 10 Ca 0.17 1.33 -0.09 0.00 0.00 0.00 0.00 60.65 62.06 1vhz s ILE 10 Cb -0.13 -4.43 -0.31 0.00 0.01 0.00 0.00 42.46 37.60 1vhz s ILE 10 CO 0.06 -0.65 0.88 -0.07 0.00 0.00 0.00 174.94 175.16 1vhz h LEU 11 N 10.39 0.59 -7.00 2.97 3.38 -0.63 -3.48 115.31 121.53 1vhz h LEU 11 Ca -0.22 -0.74 -0.05 0.00 0.09 0.00 0.00 57.88 56.96 1vhz h LEU 11 Cb 1.07 -0.19 -0.20 0.00 0.09 0.00 0.00 40.66 41.43 1vhz h LEU 11 CO 1.04 1.61 0.19 0.21 0.09 0.00 0.00 178.44 181.57 1vhz s ASN 12 N -7.26 -0.67 -0.08 -0.43 2.47 -1.20 -4.97 114.94 102.79 1vhz s ASN 12 Ca -0.10 0.94 0.01 0.00 0.42 0.00 0.00 52.86 54.13 1vhz s ASN 12 Cb 0.06 0.83 0.02 0.00 -1.45 0.00 0.00 41.25 40.70 1vhz s ASN 12 CO 0.88 -0.48 -0.10 -0.69 -3.72 0.00 0.00 177.10 173.00 1vhz s VAL 13 N -0.66 1.05 -0.01 -5.21 1.01 -1.26 -0.01 120.40 115.30 1vhz s VAL 13 Ca -0.07 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.53 1vhz s VAL 13 Cb -0.02 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.37 1vhz s VAL 13 CO 0.06 0.35 -0.00 -0.70 0.00 0.00 0.00 175.10 174.81 1vhz s GLU 14 N 1.06 0.13 -0.04 2.72 2.56 -0.44 -4.98 118.70 119.72 1vhz s GLU 14 Ca -0.07 0.04 -0.30 0.00 0.00 0.00 0.00 54.97 54.63 1vhz s GLU 14 Cb -0.14 -0.24 -0.04 0.00 2.00 0.00 0.00 34.13 35.70 1vhz s GLU 14 CO -0.01 -0.06 1.27 0.99 -0.56 0.00 0.00 175.26 176.89 1vhz s THR 15 N 0.49 4.08 -0.10 -1.70 2.01 -1.26 0.20 115.64 119.36 1vhz s THR 15 Ca -0.04 1.42 0.01 0.00 0.31 0.00 0.00 61.69 63.38 1vhz s THR 15 Cb -0.07 -3.91 0.01 0.00 0.01 0.00 0.00 72.50 68.53 1vhz s THR 15 CO -0.01 -0.01 0.48 0.55 -0.69 0.00 0.00 174.62 174.94 1vhz n VAL 16 N 4.67 0.00 -3.64 3.82 3.14 0.79 -4.90 118.33 122.20 1vhz n VAL 16 Ca 0.12 -0.50 -0.03 0.00 -2.96 0.00 0.00 64.34 60.97 1vhz n VAL 16 Cb 0.45 1.02 -0.07 0.00 -1.06 0.00 0.00 33.84 34.18 1vhz n VAL 16 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1vhz s ALA 17 N -0.16 -2.28 -0.07 1.55 0.00 -1.12 -5.01 121.76 114.67 1vhz s ALA 17 Ca 0.01 1.97 -0.03 0.00 0.00 0.00 0.00 51.96 53.91 1vhz s ALA 17 Cb 0.01 -1.72 0.04 0.00 0.00 0.00 0.00 23.12 21.45 1vhz s ALA 17 CO 0.01 -0.26 0.15 -0.98 0.00 0.00 0.00 175.76 174.69 1vhz s ARG 18 N 0.74 0.07 0.00 0.00 1.70 -1.26 -0.36 118.95 119.84 1vhz s ARG 18 Ca -0.02 0.45 0.00 0.00 -0.47 0.00 0.00 55.73 55.68 1vhz s ARG 18 Cb -0.04 -0.21 0.00 0.00 -0.57 0.00 0.00 34.95 34.13 1vhz s ARG 18 CO -0.12 -0.22 0.00 -1.13 -1.08 0.00 0.00 175.30 172.75 1vhz n SER 19 N 4.62 0.96 0.13 -2.89 3.41 0.13 -4.99 113.62 114.99 1vhz n SER 19 Ca -0.19 -0.96 -0.01 0.00 -0.26 0.00 0.00 58.87 57.46 1vhz n SER 19 Cb 0.51 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.70 1vhz n SER 19 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1vhz h ARG 20 N 0.00 0.10 0.00 4.33 2.43 -2.06 -3.29 114.38 115.89 1vhz h ARG 20 Ca 0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1vhz h ARG 20 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1vhz h ARG 20 CO 0.00 0.56 -0.33 -0.11 -1.51 0.00 0.00 179.97 178.58 1vhz n LEU 21 N -3.97 0.19 -4.23 3.80 7.94 -1.26 -5.03 117.00 114.43 1vhz n LEU 21 Ca -0.02 -0.44 -0.27 0.00 -1.11 0.00 0.00 56.01 54.17 1vhz n LEU 21 Cb 0.51 0.00 -0.15 0.00 0.53 0.00 0.00 43.42 44.31 1vhz n LEU 21 CO 0.41 0.05 -0.53 -0.36 -1.11 0.00 0.00 177.39 175.85 1vhz s PHE 22 N -1.53 1.86 -0.25 1.96 0.08 -1.24 -5.10 117.98 113.76 1vhz s PHE 22 Ca 0.01 -0.36 -0.02 0.00 0.12 0.00 0.00 56.93 56.68 1vhz s PHE 22 Cb 0.03 -1.16 0.08 0.00 -0.57 0.00 0.00 43.02 41.40 1vhz s PHE 22 CO 0.19 0.01 0.06 -0.08 -0.10 0.00 0.00 175.22 175.30 1vhz s THR 23 N -0.60 0.67 -0.13 0.64 -1.32 -1.26 0.19 115.64 113.82 1vhz s THR 23 Ca 0.08 -0.94 -0.16 0.00 -1.21 0.00 0.00 61.69 59.46 1vhz s THR 23 Cb -0.08 -1.32 -0.04 0.00 -1.51 0.00 0.00 72.50 69.54 1vhz s THR 23 CO 0.00 -0.43 0.38 0.54 -2.21 0.00 0.00 174.62 172.90 1vhz s VAL 24 N 1.76 5.24 0.04 5.08 0.11 0.51 -0.00 120.40 133.14 1vhz s VAL 24 Ca 0.04 0.74 0.04 0.00 -2.93 0.00 0.00 61.98 59.87 1vhz s VAL 24 Cb -0.17 -3.72 -0.04 0.00 -1.53 0.00 0.00 36.38 30.93 1vhz s VAL 24 CO -0.17 0.37 -0.05 -1.61 -3.33 0.00 0.00 175.10 170.31 1vhz s GLU 25 N 0.44 2.51 -0.20 1.54 2.02 0.77 -0.15 118.70 125.63 1vhz s GLU 25 Ca 0.21 -0.78 -0.08 0.00 0.02 0.00 0.00 54.97 54.34 1vhz s GLU 25 Cb -0.14 -2.50 -0.04 0.00 0.10 0.00 0.00 34.13 31.55 1vhz s GLU 25 CO 0.07 0.58 0.07 0.45 0.02 0.00 0.00 175.26 176.45 1vhz s SER 26 N -1.74 5.56 -0.20 -0.19 0.15 0.13 -1.33 113.70 116.08 1vhz s SER 26 Ca 0.20 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.87 1vhz s SER 26 Cb -0.11 -1.97 0.02 0.00 -1.71 0.00 0.00 66.02 62.25 1vhz s SER 26 CO 0.11 0.12 -0.16 -0.69 1.20 0.00 0.00 173.24 173.82 1vhz s VAL 27 N 0.69 2.31 -0.11 4.45 1.01 0.20 -1.32 120.40 127.62 1vhz s VAL 27 Ca 0.04 -0.93 -0.24 0.00 0.00 0.00 0.00 61.98 60.84 1vhz s VAL 27 Cb -0.13 -2.03 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 1vhz s VAL 27 CO 0.02 0.46 0.75 -1.81 0.00 0.00 0.00 175.10 174.52 1vhz s ASP 28 N 1.31 6.97 0.12 3.32 1.01 0.99 -0.70 116.67 129.68 1vhz s ASP 28 Ca 0.04 1.17 0.08 0.00 0.71 0.00 0.00 52.55 54.55 1vhz s ASP 28 Cb -0.14 -2.43 -0.04 0.00 1.01 0.00 0.00 42.92 41.33 1vhz s ASP 28 CO -0.10 -0.24 -0.20 -0.76 0.21 0.00 0.00 175.17 174.08 1vhz s LEU 29 N 1.39 2.34 -0.23 1.23 1.43 0.14 0.17 118.68 125.14 1vhz s LEU 29 Ca 0.38 -0.73 -0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1vhz s LEU 29 Cb -0.17 -0.87 0.07 0.00 0.03 0.00 0.00 46.19 45.24 1vhz s LEU 29 CO 0.16 0.03 -0.01 -0.70 0.23 0.00 0.00 176.35 176.06 1vhz s GLU 30 N -2.14 1.26 0.89 1.70 2.12 -0.47 -1.92 118.70 120.14 1vhz s GLU 30 Ca 0.09 -0.87 -0.12 0.00 0.36 0.00 0.00 54.97 54.43 1vhz s GLU 30 Cb -0.09 -2.43 0.13 0.00 0.26 0.00 0.00 34.13 32.00 1vhz s GLU 30 CO 0.05 -0.66 1.10 -0.06 -0.54 0.00 0.00 175.26 175.15 1vhz s PHE 31 N 1.53 2.45 0.50 5.30 0.40 0.38 -0.44 117.98 128.09 1vhz s PHE 31 Ca -0.02 1.09 0.23 0.00 -0.60 0.00 0.00 56.93 57.62 1vhz s PHE 31 Cb -0.18 -3.22 1.31 0.00 0.51 0.00 0.00 43.02 41.44 1vhz s PHE 31 CO -0.08 -2.33 1.97 0.77 0.70 0.00 0.00 175.22 176.25 1vhz h SER 32 N -1.49 0.10 -0.28 1.36 0.02 -1.84 -1.01 113.55 110.41 1vhz h SER 32 Ca -0.50 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1vhz h SER 32 Cb 1.30 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1vhz h SER 32 CO 0.58 0.05 0.00 -0.46 -1.14 0.00 0.00 176.83 175.86 1vhz n ASN 33 N -4.40 1.57 0.00 3.07 0.23 -1.26 -4.92 115.26 109.55 1vhz n ASN 33 Ca 0.11 -1.95 0.00 0.00 -0.53 0.00 0.00 54.58 52.22 1vhz n ASN 33 Cb 0.60 -0.18 0.00 0.00 -2.08 0.00 0.00 39.78 38.12 1vhz n ASN 33 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1vhz n GLY 34 N 0.99 1.02 3.72 4.83 0.00 -0.38 -5.02 105.19 110.35 1vhz n GLY 34 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1vhz n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vhz s VAL 35 N -3.71 3.57 -0.06 1.61 1.01 -1.26 -4.76 120.40 116.80 1vhz s VAL 35 Ca 0.00 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.16 1vhz s VAL 35 Cb 0.00 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1vhz s VAL 35 CO 0.00 0.12 -0.04 -0.13 0.00 0.00 0.00 175.10 175.05 1vhz s ARG 36 N 0.70 2.80 0.02 2.72 0.52 -1.26 -0.47 118.95 123.98 1vhz s ARG 36 Ca 0.60 -0.53 -0.17 0.00 -0.52 0.00 0.00 55.73 55.10 1vhz s ARG 36 Cb -0.34 -2.64 0.03 0.00 0.52 0.00 0.00 34.95 32.52 1vhz s ARG 36 CO 0.32 0.67 0.38 1.03 0.02 0.00 0.00 175.30 177.72 1vhz s ARG 37 N -0.94 0.85 -0.27 3.54 3.00 -0.81 -5.02 118.95 119.30 1vhz s ARG 37 Ca 0.14 -0.31 -0.04 0.00 0.00 0.00 0.00 55.73 55.52 1vhz s ARG 37 Cb -0.11 0.38 0.02 0.00 0.00 0.00 0.00 34.95 35.24 1vhz s ARG 37 CO 0.03 -0.28 -0.01 0.08 0.00 0.00 0.00 175.30 175.13 1vhz s VAL 38 N -2.15 3.28 0.29 3.52 1.01 -1.26 -0.69 120.40 124.40 1vhz s VAL 38 Ca -0.07 -0.91 0.07 0.00 0.00 0.00 0.00 61.98 61.07 1vhz s VAL 38 Cb -0.02 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.64 1vhz s VAL 38 CO -0.00 0.14 0.22 -0.31 0.00 0.00 0.00 175.10 175.15 1vhz s TYR 39 N 1.39 3.00 0.05 5.22 4.12 0.12 -4.90 117.35 126.34 1vhz s TYR 39 Ca 0.01 -0.20 0.08 0.00 0.02 0.00 0.00 57.07 56.99 1vhz s TYR 39 Cb -0.17 -1.55 -0.03 0.00 -1.52 0.00 0.00 41.96 38.69 1vhz s TYR 39 CO -0.02 0.39 -0.24 -1.21 0.02 0.00 0.00 175.55 174.50 1vhz s GLU 40 N -3.89 1.59 0.25 -0.62 2.02 -1.26 0.60 118.70 117.39 1vhz s GLU 40 Ca 0.36 -1.05 -0.17 0.00 0.02 0.00 0.00 54.97 54.13 1vhz s GLU 40 Cb -0.07 -1.75 0.01 0.00 0.10 0.00 0.00 34.13 32.42 1vhz s GLU 40 CO 0.25 0.45 0.59 -0.98 0.02 0.00 0.00 175.26 175.59 1vhz s ARG 41 N -1.26 1.62 0.14 1.61 1.70 -0.44 -4.78 118.95 117.54 1vhz s ARG 41 Ca 0.10 -1.07 -0.25 0.00 -0.47 0.00 0.00 55.73 54.03 1vhz s ARG 41 Cb -0.09 0.54 -0.07 0.00 -0.57 0.00 0.00 34.95 34.75 1vhz s ARG 41 CO 0.02 -0.71 0.77 1.41 -1.08 0.00 0.00 175.30 175.72 1vhz s MET 42 N -3.95 4.55 0.01 3.89 1.75 -0.01 -0.17 119.30 125.38 1vhz s MET 42 Ca 0.15 1.14 -0.37 0.00 -1.25 0.00 0.00 55.69 55.36 1vhz s MET 42 Cb -0.03 -3.28 -0.16 0.00 2.84 0.00 0.00 34.83 34.20 1vhz s MET 42 CO 0.06 0.52 1.43 -2.13 -0.65 0.00 0.00 175.02 174.25 1vhz n ARG 43 N 1.81 1.17 -1.83 4.11 0.63 1.00 -4.76 116.66 118.79 1vhz n ARG 43 Ca -0.05 0.42 -0.41 0.00 -0.92 0.00 0.00 57.85 56.89 1vhz n ARG 43 Cb 0.49 -2.08 -0.02 0.00 0.45 0.00 0.00 32.46 31.31 1vhz n ARG 43 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 1vhz s PRO 44 N 1.13 4.15 0.09 -0.14 0.02 -1.26 -4.88 135.00 134.11 1vhz s PRO 44 Ca 0.87 2.52 0.02 0.00 0.02 0.00 0.00 61.00 64.42 1vhz s PRO 44 Cb -0.97 -3.03 -0.04 0.00 0.02 0.00 0.00 34.50 30.48 1vhz s PRO 44 CO 0.50 -0.57 -0.07 -0.08 -0.33 0.00 0.00 177.00 176.46 1vhz s THR 45 N -0.19 0.66 -1.57 0.99 -1.32 -1.26 -5.03 115.64 107.91 1vhz s THR 45 Ca 0.61 -1.83 0.15 0.00 -1.21 0.00 0.00 61.69 59.40 1vhz s THR 45 Cb -0.46 -1.55 0.27 0.00 -1.51 0.00 0.00 72.50 69.25 1vhz s THR 45 CO 0.49 -0.82 1.17 0.59 -2.21 0.00 0.00 174.62 173.84 1vhz n ASN 46 N 0.14 2.77 -4.65 8.08 3.02 -1.26 -4.74 115.26 118.61 1vhz n ASN 46 Ca -0.13 -1.82 -0.43 0.00 -0.03 0.00 0.00 54.58 52.17 1vhz n ASN 46 Cb 0.60 -0.16 -0.02 0.00 -0.61 0.00 0.00 39.78 39.59 1vhz n ASN 46 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1vhz s ARG 47 N -1.13 4.14 0.30 3.52 6.06 -1.26 -5.00 118.95 125.58 1vhz s ARG 47 Ca 0.25 1.78 0.07 0.00 -2.50 0.00 0.00 55.73 55.32 1vhz s ARG 47 Cb 0.15 -3.87 -0.03 0.00 0.06 0.00 0.00 34.95 31.26 1vhz s ARG 47 CO 0.20 -0.85 0.32 -1.21 -2.50 0.00 0.00 175.30 171.26 1vhz s GLU 48 N 3.84 2.97 0.31 5.12 2.02 -1.26 -4.61 118.70 127.09 1vhz s GLU 48 Ca 0.62 -1.09 0.08 0.00 0.02 0.00 0.00 54.97 54.60 1vhz s GLU 48 Cb -0.25 -2.64 -0.04 0.00 0.10 0.00 0.00 34.13 31.31 1vhz s GLU 48 CO 0.21 0.21 0.19 0.00 0.02 0.00 0.00 175.26 175.89 1vhz s ALA 49 N -2.18 3.59 -0.01 5.21 0.00 -0.26 -0.18 121.76 127.92 1vhz s ALA 49 Ca 0.39 -1.65 0.02 0.00 0.00 0.00 0.00 51.96 50.71 1vhz s ALA 49 Cb -0.08 -1.02 -0.00 0.00 0.00 0.00 0.00 23.12 22.03 1vhz s ALA 49 CO 0.28 0.11 -0.05 0.54 0.00 0.00 0.00 175.76 176.63 1vhz s VAL 50 N -2.31 0.41 -0.07 0.00 0.11 0.64 -0.75 120.40 118.44 1vhz s VAL 50 Ca 0.37 -0.22 0.03 0.00 -2.93 0.00 0.00 61.98 59.23 1vhz s VAL 50 Cb -0.05 -0.36 0.01 0.00 -1.53 0.00 0.00 36.38 34.45 1vhz s VAL 50 CO 0.24 0.12 -0.17 -0.32 -3.33 0.00 0.00 175.10 171.64 1vhz s MET 51 N -0.07 2.20 -0.11 1.54 -2.45 0.78 -1.13 119.30 120.07 1vhz s MET 51 Ca 0.01 -0.61 0.01 0.00 -1.25 0.00 0.00 55.69 53.85 1vhz s MET 51 Cb -0.03 -1.75 -0.02 0.00 1.25 0.00 0.00 34.83 34.28 1vhz s MET 51 CO -0.00 0.11 -0.13 0.42 1.05 0.00 0.00 175.02 176.47 1vhz s ILE 52 N 0.46 3.07 -0.52 10.11 1.09 0.03 -0.71 121.20 134.74 1vhz s ILE 52 Ca -0.15 -0.67 -0.00 0.00 -1.10 0.00 0.00 60.65 58.72 1vhz s ILE 52 Cb -0.16 -2.26 0.14 0.00 -1.06 0.00 0.00 42.46 39.11 1vhz s ILE 52 CO 0.05 0.55 0.30 -0.69 -0.10 0.00 0.00 174.94 175.05 1vhz s VAL 53 N 0.01 3.19 0.07 2.92 1.01 0.01 -3.47 120.40 124.14 1vhz s VAL 53 Ca -0.04 -2.76 -0.28 0.00 0.00 0.00 0.00 61.98 58.89 1vhz s VAL 53 Cb -0.14 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 1vhz s VAL 53 CO 0.04 -0.78 0.90 -2.16 0.00 0.00 0.00 175.10 173.10 1vhz s PRO 54 N 0.28 4.61 -0.14 2.72 0.05 -1.26 -1.41 135.00 139.85 1vhz s PRO 54 Ca 0.14 1.32 0.02 0.00 0.05 0.00 0.00 61.00 62.53 1vhz s PRO 54 Cb -0.22 -3.39 0.02 0.00 0.05 0.00 0.00 34.50 30.96 1vhz s PRO 54 CO -0.03 0.19 -0.18 0.42 0.05 0.00 0.00 177.00 177.44 1vhz s ILE 55 N 0.16 1.83 -0.03 0.56 1.01 0.04 -1.39 121.20 123.37 1vhz s ILE 55 Ca 0.45 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 60.27 1vhz s ILE 55 Cb -0.22 -1.65 0.03 0.00 0.01 0.00 0.00 42.46 40.62 1vhz s ILE 55 CO 0.27 0.50 0.05 0.54 0.00 0.00 0.00 174.94 176.30 1vhz s VAL 56 N 1.09 -0.05 -1.32 2.92 0.11 -0.38 -4.42 120.40 118.35 1vhz s VAL 56 Ca -0.02 0.17 -0.13 0.00 -2.93 0.00 0.00 61.98 59.07 1vhz s VAL 56 Cb -0.14 -0.10 0.01 0.00 -1.53 0.00 0.00 36.38 34.62 1vhz s VAL 56 CO -0.06 0.07 0.51 0.47 -3.33 0.00 0.00 175.10 172.76 1vhz n ASP 57 N 3.97 -2.22 -2.04 3.54 8.00 -1.26 -0.81 116.55 125.73 1vhz n ASP 57 Ca -0.25 -1.11 -0.17 0.00 0.71 0.00 0.00 54.79 53.97 1vhz n ASP 57 Cb 0.52 -2.62 -0.04 0.00 -0.02 0.00 0.00 41.12 38.96 1vhz n ASP 57 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1vhz n ASP 58 N -2.72 -4.81 -4.17 -2.24 9.92 -1.26 -4.97 116.55 106.31 1vhz n ASP 58 Ca -0.22 0.22 -0.19 0.00 -0.53 0.00 0.00 54.79 54.08 1vhz n ASP 58 Cb 0.64 -4.15 -0.12 0.00 -0.64 0.00 0.00 41.12 36.84 1vhz n ASP 58 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1vhz s HIS 59 N -2.68 1.22 0.36 1.24 3.76 0.01 -1.64 115.29 117.55 1vhz s HIS 59 Ca 0.00 -0.45 -0.15 0.00 -0.15 0.00 0.00 55.06 54.31 1vhz s HIS 59 Cb 0.00 -0.69 -0.09 0.00 1.11 0.00 0.00 32.58 32.91 1vhz s HIS 59 CO 0.00 0.06 0.77 -0.51 -0.85 0.00 0.00 174.74 174.21 1vhz s LEU 60 N -1.69 3.99 -0.32 0.89 1.02 0.35 -1.25 118.68 121.66 1vhz s LEU 60 Ca -0.02 1.29 -0.05 0.00 0.02 0.00 0.00 54.13 55.37 1vhz s LEU 60 Cb -0.10 -4.12 0.04 0.00 0.02 0.00 0.00 46.19 42.03 1vhz s LEU 60 CO 0.02 -0.27 0.08 -0.63 0.02 0.00 0.00 176.35 175.56 1vhz s ILE 61 N -2.11 3.62 0.34 -0.59 -1.09 -0.49 -1.16 121.20 119.73 1vhz s ILE 61 Ca 0.54 -1.13 0.07 0.00 -2.23 0.00 0.00 60.65 57.91 1vhz s ILE 61 Cb -0.10 -3.03 -0.03 0.00 -1.58 0.00 0.00 42.46 37.72 1vhz s ILE 61 CO 0.20 -0.12 0.29 -0.76 -1.23 0.00 0.00 174.94 173.32 1vhz s LEU 62 N 1.38 3.57 0.12 2.97 2.01 0.89 -4.49 118.68 125.13 1vhz s LEU 62 Ca -0.02 -0.52 0.05 0.00 0.01 0.00 0.00 54.13 53.65 1vhz s LEU 62 Cb -0.19 -2.19 -0.04 0.00 0.01 0.00 0.00 46.19 43.78 1vhz s LEU 62 CO 0.02 -0.37 -0.11 0.27 1.01 0.00 0.00 176.35 177.16 1vhz s ILE 63 N -2.32 1.16 -0.18 -0.59 -4.36 0.64 -0.13 121.20 115.42 1vhz s ILE 63 Ca 0.41 -1.81 -0.06 0.00 -0.26 0.00 0.00 60.65 58.94 1vhz s ILE 63 Cb -0.05 -1.58 -0.03 0.00 1.25 0.00 0.00 42.46 42.04 1vhz s ILE 63 CO 0.26 -0.57 0.02 -0.13 0.24 0.00 0.00 174.94 174.76 1vhz s ARG 64 N -3.07 3.80 -0.08 0.37 0.52 -0.27 -1.33 118.95 118.90 1vhz s ARG 64 Ca 0.10 -0.44 -0.05 0.00 -0.52 0.00 0.00 55.73 54.82 1vhz s ARG 64 Cb -0.02 -3.09 0.03 0.00 0.52 0.00 0.00 34.95 32.40 1vhz s ARG 64 CO 0.01 0.21 0.20 -2.00 0.02 0.00 0.00 175.30 173.74 1vhz s GLU 65 N 0.49 0.19 0.36 3.54 2.12 -0.77 -3.92 118.70 120.71 1vhz s GLU 65 Ca 0.00 0.37 -0.27 0.00 0.36 0.00 0.00 54.97 55.42 1vhz s GLU 65 Cb -0.13 -0.02 -0.09 0.00 0.26 0.00 0.00 34.13 34.14 1vhz s GLU 65 CO 0.02 -0.10 1.26 -0.47 -0.54 0.00 0.00 175.26 175.43 1vhz s TYR 66 N 0.68 3.05 -0.21 5.30 6.14 -1.26 -0.35 117.35 130.70 1vhz s TYR 66 Ca -0.05 1.47 -0.00 0.00 0.64 0.00 0.00 57.07 59.13 1vhz s TYR 66 Cb -0.06 -3.59 0.06 0.00 0.42 0.00 0.00 41.96 38.79 1vhz s TYR 66 CO -0.04 -1.68 -0.03 0.00 0.64 0.00 0.00 175.55 174.44 1vhz s ALA 67 N -1.22 1.65 0.27 3.97 0.00 -0.07 -4.88 121.76 121.49 1vhz s ALA 67 Ca 0.52 -1.10 0.26 0.00 0.00 0.00 0.00 51.96 51.63 1vhz s ALA 67 Cb -0.37 -1.32 1.17 0.00 0.00 0.00 0.00 23.12 22.61 1vhz s ALA 67 CO 0.48 -1.11 1.94 -0.24 0.00 0.00 0.00 175.76 176.83 1vhz h VAL 68 N 6.58 0.56 -0.84 0.00 3.04 -1.95 0.19 116.25 123.82 1vhz h VAL 68 Ca -0.19 -0.85 -0.02 0.00 -1.01 0.00 0.00 66.70 64.63 1vhz h VAL 68 Cb 1.09 1.57 -0.04 0.00 -2.01 0.00 0.00 31.29 31.90 1vhz h VAL 68 CO 0.39 0.18 0.45 1.23 -1.01 0.00 0.00 177.57 178.81 1vhz h GLY 69 N 1.49 1.27 -0.54 3.17 0.00 -1.95 -3.10 103.07 103.41 1vhz h GLY 69 Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 47.33 46.74 1vhz h GLY 69 CO 0.02 0.56 -0.34 -1.30 0.00 0.00 0.00 176.54 175.48 1vhz n THR 70 N -4.37 0.00 -3.56 4.70 -2.24 -1.17 -5.01 114.28 102.63 1vhz n THR 70 Ca 0.08 -0.33 -0.24 0.00 -2.27 0.00 0.00 64.05 61.30 1vhz n THR 70 Cb 0.10 1.14 0.05 0.00 -2.10 0.00 0.00 70.33 69.52 1vhz n THR 70 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vhz n GLU 71 N -0.34 -2.59 -3.87 -0.78 1.02 0.63 -4.98 120.64 109.73 1vhz n GLU 71 Ca 0.05 0.63 -0.08 0.00 -0.02 0.00 0.00 57.16 57.74 1vhz n GLU 71 Cb 0.28 -4.94 -0.01 0.00 -0.02 0.00 0.00 31.44 26.76 1vhz n GLU 71 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1vhz s SER 72 N -3.70 -0.05 -0.21 1.62 1.04 -1.03 -5.00 113.70 106.37 1vhz s SER 72 Ca 0.34 -0.92 -0.13 0.00 0.48 0.00 0.00 55.95 55.72 1vhz s SER 72 Cb -0.09 0.76 -0.05 0.00 0.10 0.00 0.00 66.02 66.74 1vhz s SER 72 CO 0.81 -1.46 0.25 -0.31 0.98 0.00 0.00 173.24 173.51 1vhz s TYR 73 N -3.23 3.38 0.31 5.02 1.51 -1.26 -0.89 117.35 122.18 1vhz s TYR 73 Ca 0.15 0.43 -0.01 0.00 -1.01 0.00 0.00 57.07 56.63 1vhz s TYR 73 Cb -0.05 -2.34 -0.04 0.00 -0.11 0.00 0.00 41.96 39.42 1vhz s TYR 73 CO 0.10 0.11 0.53 -1.83 -1.11 0.00 0.00 175.55 173.35 1vhz s GLU 74 N 0.91 3.52 -0.19 -0.62 -1.05 0.53 -4.85 118.70 116.96 1vhz s GLU 74 Ca 0.13 -0.26 -0.02 0.00 -0.15 0.00 0.00 54.97 54.66 1vhz s GLU 74 Cb -0.13 -2.69 -0.00 0.00 -0.44 0.00 0.00 34.13 30.87 1vhz s GLU 74 CO 0.04 0.20 -0.10 -1.17 0.95 0.00 0.00 175.26 175.19 1vhz s LEU 75 N -4.00 2.69 0.00 1.83 2.96 -0.20 -1.84 118.68 120.12 1vhz s LEU 75 Ca 0.41 -0.42 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 1vhz s LEU 75 Cb -0.10 -1.65 0.00 0.00 0.50 0.00 0.00 46.19 44.94 1vhz s LEU 75 CO 0.34 0.04 0.00 0.61 -1.32 0.00 0.00 176.35 176.01 1vhz n GLY 76 N 4.41 -0.66 3.84 7.98 0.00 -0.44 -3.66 105.19 116.65 1vhz n GLY 76 Ca -0.19 -0.65 -0.35 0.00 0.00 0.00 0.00 46.02 44.83 1vhz n GLY 76 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vhz s PHE 77 N -3.00 3.59 0.29 1.61 0.40 -1.26 -0.26 117.98 119.35 1vhz s PHE 77 Ca 0.00 1.16 -0.30 0.00 -0.60 0.00 0.00 56.93 57.19 1vhz s PHE 77 Cb 0.00 -2.45 -0.11 0.00 0.51 0.00 0.00 43.02 40.97 1vhz s PHE 77 CO 0.00 0.37 1.57 0.45 0.70 0.00 0.00 175.22 178.31 1vhz s SER 78 N -1.77 6.42 0.04 1.36 0.15 -1.23 -4.84 113.70 113.83 1vhz s SER 78 Ca 0.41 2.90 0.01 0.00 0.70 0.00 0.00 55.95 59.97 1vhz s SER 78 Cb -0.15 -2.63 -0.03 0.00 -1.71 0.00 0.00 66.02 61.50 1vhz s SER 78 CO 0.20 -0.88 -0.06 -0.54 1.20 0.00 0.00 173.24 173.16 1vhz s LYS 79 N -0.51 0.48 0.13 5.44 1.02 -1.26 -0.79 119.74 124.25 1vhz s LYS 79 Ca 0.62 -0.78 -0.12 0.00 0.02 0.00 0.00 55.97 55.71 1vhz s LYS 79 Cb -0.47 -0.11 0.04 0.00 -0.52 0.00 0.00 37.83 36.78 1vhz s LYS 79 CO 0.47 -0.00 0.60 0.41 -0.92 0.00 0.00 175.35 175.91 1vhz n GLY 80 N 1.30 0.95 3.91 -3.33 0.00 -0.28 -5.01 105.19 102.73 1vhz n GLY 80 Ca -0.22 -1.07 -0.32 0.00 0.00 0.00 0.00 46.02 44.41 1vhz n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vhz s LEU 81 N 0.00 4.35 -0.22 0.99 1.43 -1.26 -0.26 118.68 123.71 1vhz s LEU 81 Ca 0.13 0.28 -0.24 0.00 -1.03 0.00 0.00 54.13 53.27 1vhz s LEU 81 Cb -0.02 -2.87 -0.01 0.00 0.03 0.00 0.00 46.19 43.32 1vhz s LEU 81 CO 0.04 0.19 0.81 -0.63 0.23 0.00 0.00 176.35 176.99 1vhz s ILE 82 N -1.46 4.87 0.40 -0.59 1.01 0.74 -4.81 121.20 121.35 1vhz s ILE 82 Ca 0.33 1.55 -0.24 0.00 0.00 0.00 0.00 60.65 62.29 1vhz s ILE 82 Cb -0.13 -4.10 -0.09 0.00 0.01 0.00 0.00 42.46 38.15 1vhz s ILE 82 CO 0.26 -0.03 1.04 -1.81 0.00 0.00 0.00 174.94 174.40 1vhz s ASP 83 N 1.28 6.79 0.13 3.58 1.01 -1.26 -4.53 116.67 123.67 1vhz s ASP 83 Ca 0.35 2.01 -0.35 0.00 0.71 0.00 0.00 52.55 55.27 1vhz s ASP 83 Cb -0.16 -2.58 -0.16 0.00 1.01 0.00 0.00 42.92 41.03 1vhz s ASP 83 CO 0.09 -0.47 1.37 -2.65 0.21 0.00 0.00 175.17 173.72 1vhz n PRO 84 N -0.07 1.42 0.00 8.23 -0.02 -1.26 -1.24 135.00 142.07 1vhz n PRO 84 Ca 0.05 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1vhz n PRO 84 Cb 0.50 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1vhz n PRO 84 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vhz n GLY 85 N 2.61 3.01 3.82 -1.23 0.00 -1.26 -5.05 105.19 107.09 1vhz n GLY 85 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1vhz n GLY 85 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vhz s GLU 86 N -0.84 4.17 0.80 1.61 2.02 -0.37 -5.09 118.70 120.99 1vhz s GLU 86 Ca 0.00 0.72 -0.09 0.00 0.02 0.00 0.00 54.97 55.62 1vhz s GLU 86 Cb 0.00 -3.05 0.12 0.00 0.10 0.00 0.00 34.13 31.30 1vhz s GLU 86 CO 0.00 0.52 1.13 -1.54 0.02 0.00 0.00 175.26 175.39 1vhz s SER 87 N -1.45 4.17 0.31 -0.19 1.04 -1.26 -4.83 113.70 111.50 1vhz s SER 87 Ca 0.36 0.31 0.02 0.00 0.48 0.00 0.00 55.95 57.12 1vhz s SER 87 Cb -0.18 -0.71 0.50 0.00 0.10 0.00 0.00 66.02 65.73 1vhz s SER 87 CO 0.20 -2.03 1.83 -0.37 0.98 0.00 0.00 173.24 173.84 1vhz h VAL 88 N -0.98 1.22 -0.51 5.02 -1.51 -1.99 -1.63 116.25 115.87 1vhz h VAL 88 Ca -0.43 -0.87 -0.06 0.00 -1.23 0.00 0.00 66.70 64.10 1vhz h VAL 88 Cb 1.29 0.92 -0.02 0.00 -2.13 0.00 0.00 31.29 31.35 1vhz h VAL 88 CO 0.51 0.30 0.07 1.88 -1.23 0.00 0.00 177.57 179.10 1vhz h TYR 89 N 0.59 0.90 -0.27 5.19 0.05 -1.97 -1.14 116.97 120.33 1vhz h TYR 89 Ca 0.12 -0.13 -0.04 0.00 0.05 0.00 0.00 58.73 58.74 1vhz h TYR 89 Cb 0.38 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 1vhz h TYR 89 CO 0.02 0.82 0.02 0.93 -1.05 0.00 0.00 178.16 178.90 1vhz h GLU 90 N 0.72 0.46 -0.61 4.88 5.08 -1.87 0.01 114.58 123.26 1vhz h GLU 90 Ca 0.15 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1vhz h GLU 90 Cb 0.42 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1vhz h GLU 90 CO 0.01 0.60 0.18 0.00 -1.00 0.00 0.00 179.01 178.80 1vhz h ALA 91 N 0.84 0.79 -0.07 3.43 0.00 -1.28 -1.52 119.26 121.46 1vhz h ALA 91 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1vhz h ALA 91 Cb 0.38 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1vhz h ALA 91 CO 0.01 0.48 0.04 0.00 0.00 0.00 0.00 179.25 179.78 1vhz h ALA 92 N 1.05 0.09 -0.38 0.00 0.00 -0.83 0.90 119.26 120.09 1vhz h ALA 92 Ca 0.19 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1vhz h ALA 92 Cb 0.31 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1vhz h ALA 92 CO -0.00 -0.41 0.22 -0.97 0.00 0.00 0.00 179.25 178.09 1vhz h ASN 93 N 0.08 0.35 -0.17 0.00 -1.24 -0.87 -0.46 115.58 113.27 1vhz h ASN 93 Ca 0.03 0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.04 1vhz h ASN 93 Cb 0.01 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 38.99 1vhz h ASN 93 CO -0.01 0.25 0.09 -0.09 -1.29 0.00 0.00 177.43 176.38 1vhz h ARG 94 N 0.44 0.24 -0.75 6.67 2.43 -1.06 -2.16 114.38 120.19 1vhz h ARG 94 Ca 0.15 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 1vhz h ARG 94 Cb 0.02 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.49 1vhz h ARG 94 CO -0.08 0.26 0.41 0.93 -1.51 0.00 0.00 179.97 179.99 1vhz h GLU 95 N 0.16 1.05 -0.10 0.20 4.39 -0.58 -1.05 114.58 118.65 1vhz h GLU 95 Ca 0.06 -0.12 0.01 0.00 0.34 0.00 0.00 59.36 59.65 1vhz h GLU 95 Cb 0.10 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 1vhz h GLU 95 CO -0.01 0.78 0.01 -0.07 -1.16 0.00 0.00 179.01 178.56 1vhz h LEU 96 N 1.04 -0.02 -0.54 1.33 3.38 -0.88 0.47 115.31 120.09 1vhz h LEU 96 Ca 0.27 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.31 1vhz h LEU 96 Cb 0.03 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1vhz h LEU 96 CO -0.04 0.00 0.25 0.11 0.09 0.00 0.00 178.44 178.85 1vhz h LYS 97 N 0.04 0.47 -0.46 1.13 1.57 -0.58 0.31 116.57 119.06 1vhz h LYS 97 Ca 0.04 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 1vhz h LYS 97 Cb 0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1vhz h LYS 97 CO -0.07 0.31 -0.18 0.93 -0.57 0.00 0.00 179.45 179.86 1vhz h GLU 98 N 0.48 0.90 0.01 3.15 5.08 -0.98 -2.48 114.58 120.74 1vhz h GLU 98 Ca 0.25 -0.36 -0.33 0.00 -1.00 0.00 0.00 59.36 57.92 1vhz h GLU 98 Cb 0.21 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.36 1vhz h GLU 98 CO -0.20 1.01 -2.02 0.39 -1.00 0.00 0.00 179.01 177.18 1vhz n GLU 99 N -4.12 0.66 0.00 2.33 1.02 0.14 -4.39 120.64 116.27 1vhz n GLU 99 Ca 0.01 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1vhz n GLU 99 Cb 0.43 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1vhz n GLU 99 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1vhz n VAL 100 N -2.98 0.00 -1.20 2.62 0.31 0.11 -4.72 118.33 112.47 1vhz n VAL 100 Ca -0.26 -0.39 -0.05 0.00 -0.01 0.00 0.00 64.34 63.64 1vhz n VAL 100 Cb 1.09 1.21 -0.02 0.00 -0.91 0.00 0.00 33.84 35.21 1vhz n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1vhz n GLY 101 N 0.04 0.70 3.12 2.92 0.00 -0.95 -4.98 105.19 106.04 1vhz n GLY 101 Ca 0.00 -0.84 -0.13 0.00 0.00 0.00 0.00 46.02 45.05 1vhz n GLY 101 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vhz s PHE 102 N -2.18 0.84 0.46 1.61 0.08 -1.11 -1.14 117.98 116.53 1vhz s PHE 102 Ca 0.00 -0.65 0.06 0.00 0.12 0.00 0.00 56.93 56.46 1vhz s PHE 102 Cb 0.00 -0.48 -0.01 0.00 -0.57 0.00 0.00 43.02 41.95 1vhz s PHE 102 CO 0.00 -0.08 0.29 0.20 -0.10 0.00 0.00 175.22 175.53 1vhz s GLY 103 N -2.20 2.34 -0.01 4.36 0.00 0.45 -1.43 107.32 110.83 1vhz s GLY 103 Ca -0.00 -1.70 0.02 0.00 0.00 0.00 0.00 44.72 43.04 1vhz s GLY 103 CO -0.01 -1.89 -0.06 0.00 0.00 0.00 0.00 173.10 171.14 1vhz s ALA 104 N -2.64 0.55 -0.72 3.20 0.00 -1.26 -1.92 121.76 118.97 1vhz s ALA 104 Ca 0.39 -0.20 0.25 0.00 0.00 0.00 0.00 51.96 52.39 1vhz s ALA 104 Cb 0.00 -0.20 0.54 0.00 0.00 0.00 0.00 23.12 23.46 1vhz s ALA 104 CO 0.22 0.09 1.49 0.09 0.00 0.00 0.00 175.76 177.65 1vhz n ASN 105 N 3.21 0.67 -3.80 0.00 3.02 0.63 -4.66 115.26 114.33 1vhz n ASN 105 Ca -0.16 0.23 -0.30 0.00 -0.03 0.00 0.00 54.58 54.31 1vhz n ASN 105 Cb 0.56 -0.12 -0.15 0.00 -0.61 0.00 0.00 39.78 39.46 1vhz n ASN 105 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1vhz s ASP 106 N -4.11 4.19 -0.16 6.41 3.68 -0.40 -5.02 116.67 121.26 1vhz s ASP 106 Ca 0.08 -1.75 -0.02 0.00 2.13 0.00 0.00 52.55 53.00 1vhz s ASP 106 Cb 0.14 -1.04 -0.02 0.00 -1.45 0.00 0.00 42.92 40.55 1vhz s ASP 106 CO 0.67 -0.40 -0.09 -0.76 0.13 0.00 0.00 175.17 174.72 1vhz s LEU 107 N 1.45 2.89 -0.10 -1.34 1.43 -1.26 -0.91 118.68 120.84 1vhz s LEU 107 Ca 0.10 -0.30 0.02 0.00 -1.03 0.00 0.00 54.13 52.92 1vhz s LEU 107 Cb -0.18 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.37 1vhz s LEU 107 CO -0.21 0.12 -0.15 0.28 0.23 0.00 0.00 176.35 176.61 1vhz s THR 108 N 0.66 1.49 -0.42 5.49 -1.32 0.33 -4.94 115.64 116.92 1vhz s THR 108 Ca -0.05 -0.64 -0.25 0.00 -1.21 0.00 0.00 61.69 59.54 1vhz s THR 108 Cb -0.15 -1.35 0.02 0.00 -1.51 0.00 0.00 72.50 69.51 1vhz s THR 108 CO 0.02 0.44 0.88 0.12 -2.21 0.00 0.00 174.62 173.87 1vhz s PHE 109 N 0.93 3.00 -0.19 9.09 5.99 -1.26 -0.16 117.98 135.38 1vhz s PHE 109 Ca -0.08 0.47 0.05 0.00 0.00 0.00 0.00 56.93 57.37 1vhz s PHE 109 Cb -0.15 -3.75 -0.21 0.00 0.00 0.00 0.00 43.02 38.90 1vhz s PHE 109 CO -0.01 -0.96 0.05 -0.11 -0.00 0.00 0.00 175.22 174.20 1vhz n LEU 110 N 6.88 2.02 -3.54 6.12 7.94 -0.38 -5.02 117.00 131.03 1vhz n LEU 110 Ca 0.05 0.02 -0.10 0.00 -1.11 0.00 0.00 56.01 54.87 1vhz n LEU 110 Cb 0.48 -0.52 -0.04 0.00 0.53 0.00 0.00 43.42 43.87 1vhz n LEU 110 CO 0.60 0.77 0.71 -0.75 -1.11 0.00 0.00 177.39 177.61 1vhz s LYS 111 N -2.53 0.73 -0.11 1.96 2.47 -1.22 -5.01 119.74 116.04 1vhz s LYS 111 Ca -0.24 -0.06 0.04 0.00 -1.56 0.00 0.00 55.97 54.15 1vhz s LYS 111 Cb 0.08 0.34 0.00 0.00 -1.46 0.00 0.00 37.83 36.79 1vhz s LYS 111 CO 0.71 -0.28 -0.23 0.21 0.16 0.00 0.00 175.35 175.92 1vhz s LYS 112 N -2.10 3.03 0.07 4.03 2.20 -1.26 -0.25 119.74 125.46 1vhz s LYS 112 Ca 0.01 -0.87 0.06 0.00 -0.36 0.00 0.00 55.97 54.81 1vhz s LYS 112 Cb -0.01 -2.32 -0.03 0.00 -1.51 0.00 0.00 37.83 33.96 1vhz s LYS 112 CO -0.03 0.14 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.42 1vhz s LEU 113 N 0.44 2.25 0.37 5.43 1.02 0.11 -4.92 118.68 123.38 1vhz s LEU 113 Ca -0.16 -0.59 0.03 0.00 0.02 0.00 0.00 54.13 53.42 1vhz s LEU 113 Cb -0.17 -0.72 -0.01 0.00 0.02 0.00 0.00 46.19 45.30 1vhz s LEU 113 CO 0.07 0.02 0.55 -0.94 0.02 0.00 0.00 176.35 176.07 1vhz s SER 114 N -1.59 6.03 -0.13 2.29 1.04 -1.26 0.85 113.70 120.93 1vhz s SER 114 Ca 0.03 0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.59 1vhz s SER 114 Cb -0.09 -1.60 0.05 0.00 0.10 0.00 0.00 66.02 64.47 1vhz s SER 114 CO 0.03 -0.46 0.04 -0.32 0.98 0.00 0.00 173.24 173.51 1vhz s MET 115 N -4.33 0.42 -0.94 4.02 1.75 -1.22 -4.90 119.30 114.11 1vhz s MET 115 Ca 0.44 -0.09 -0.10 0.00 -1.25 0.00 0.00 55.69 54.68 1vhz s MET 115 Cb -0.10 -1.52 0.01 0.00 2.84 0.00 0.00 34.83 36.06 1vhz s MET 115 CO 0.34 -0.51 0.67 0.00 -0.65 0.00 0.00 175.02 174.87 1vhz n ALA 116 N 5.16 -2.68 0.28 4.11 0.00 -1.26 -4.55 120.51 121.56 1vhz n ALA 116 Ca -0.07 -0.29 0.03 0.00 0.00 0.00 0.00 53.44 53.12 1vhz n ALA 116 Cb 0.49 -1.78 0.16 0.00 0.00 0.00 0.00 19.45 18.32 1vhz n ALA 116 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1vhz n PRO 117 N -3.22 0.04 0.09 0.00 -0.04 -1.23 -1.43 135.00 129.20 1vhz n PRO 117 Ca -0.19 0.32 -0.02 0.00 -0.04 0.00 0.00 63.50 63.56 1vhz n PRO 117 Cb 0.62 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.81 1vhz n PRO 117 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1vhz h SER 118 N 0.00 0.28 0.00 3.54 0.02 -2.00 -3.36 113.55 112.03 1vhz h SER 118 Ca 0.00 -0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 60.81 1vhz h SER 118 Cb 0.10 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1vhz h SER 118 CO 0.00 0.64 -1.20 -1.22 -1.14 0.00 0.00 176.83 173.91 1vhz n TYR 119 N -4.05 0.00 -4.22 3.45 4.01 -1.03 -4.85 117.16 110.47 1vhz n TYR 119 Ca -0.01 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.53 1vhz n TYR 119 Cb 0.46 -0.12 -0.12 0.00 -0.31 0.00 0.00 39.34 39.25 1vhz n TYR 119 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1vhz s PHE 120 N -2.16 1.41 -0.88 -0.72 0.40 -0.51 -0.83 117.98 114.69 1vhz s PHE 120 Ca -0.01 -0.49 0.10 0.00 -0.60 0.00 0.00 56.93 55.93 1vhz s PHE 120 Cb 0.02 -0.77 0.27 0.00 0.51 0.00 0.00 43.02 43.05 1vhz s PHE 120 CO 0.14 0.13 1.21 -1.13 0.70 0.00 0.00 175.22 176.27 1vhz n SER 121 N 0.93 2.80 -4.77 1.36 3.41 -1.26 -3.56 113.62 112.53 1vhz n SER 121 Ca -0.18 -1.97 -0.38 0.00 -0.26 0.00 0.00 58.87 56.08 1vhz n SER 121 Cb 0.55 -0.20 -0.01 0.00 -0.26 0.00 0.00 64.21 64.29 1vhz n SER 121 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1vhz s SER 122 N -0.99 6.24 0.10 4.04 0.15 -1.26 -4.87 113.70 117.10 1vhz s SER 122 Ca 0.21 2.42 0.08 0.00 0.70 0.00 0.00 55.95 59.36 1vhz s SER 122 Cb 0.11 -2.62 -0.04 0.00 -1.71 0.00 0.00 66.02 61.77 1vhz s SER 122 CO 0.14 -0.88 -0.17 -0.54 1.20 0.00 0.00 173.24 172.99 1vhz s LYS 123 N -2.50 1.87 -0.14 5.44 -0.14 -1.26 -3.42 119.74 119.60 1vhz s LYS 123 Ca 0.61 -1.12 0.02 0.00 -1.36 0.00 0.00 55.97 54.11 1vhz s LYS 123 Cb -0.32 -2.15 0.02 0.00 -1.68 0.00 0.00 37.83 33.70 1vhz s LYS 123 CO 0.40 0.49 -0.18 1.41 -0.76 0.00 0.00 175.35 176.71 1vhz s MET 124 N -2.01 2.59 -0.25 1.68 -2.45 0.25 -1.11 119.30 118.01 1vhz s MET 124 Ca 0.18 -0.69 -0.11 0.00 -1.25 0.00 0.00 55.69 53.82 1vhz s MET 124 Cb -0.11 -2.20 -0.05 0.00 1.25 0.00 0.00 34.83 33.72 1vhz s MET 124 CO 0.09 -0.11 0.18 -0.80 1.05 0.00 0.00 175.02 175.44 1vhz s ASN 125 N 1.09 6.10 -0.25 1.11 0.01 0.07 0.04 114.94 123.12 1vhz s ASN 125 Ca -0.02 0.09 -0.16 0.00 -0.71 0.00 0.00 52.86 52.06 1vhz s ASN 125 Cb -0.14 -2.12 -0.03 0.00 0.41 0.00 0.00 41.25 39.37 1vhz s ASN 125 CO -0.05 0.02 0.43 -0.63 -1.51 0.00 0.00 177.10 175.36 1vhz s ILE 126 N 1.27 5.14 -0.02 0.60 1.01 0.65 -0.16 121.20 129.70 1vhz s ILE 126 Ca 0.08 0.72 0.07 0.00 0.00 0.00 0.00 60.65 61.52 1vhz s ILE 126 Cb -0.14 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.56 1vhz s ILE 126 CO 0.06 0.15 -0.23 -0.69 0.00 0.00 0.00 174.94 174.23 1vhz s VAL 127 N 2.03 1.82 -0.18 2.92 1.01 0.12 -1.25 120.40 126.87 1vhz s VAL 127 Ca 0.18 -0.98 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 1vhz s VAL 127 Cb -0.16 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1vhz s VAL 127 CO 0.09 0.51 0.09 -0.69 0.00 0.00 0.00 175.10 175.11 1vhz s VAL 128 N -0.50 5.08 -0.19 2.92 1.01 0.78 -0.81 120.40 128.68 1vhz s VAL 128 Ca 0.08 0.07 -0.03 0.00 0.00 0.00 0.00 61.98 62.10 1vhz s VAL 128 Cb -0.09 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 32.99 1vhz s VAL 128 CO -0.01 0.48 -0.07 0.00 0.00 0.00 0.00 175.10 175.50 1vhz s ALA 129 N 0.17 2.77 0.26 5.51 0.00 -0.50 -0.51 121.76 129.46 1vhz s ALA 129 Ca 0.07 -1.08 0.02 0.00 0.00 0.00 0.00 51.96 50.96 1vhz s ALA 129 Cb -0.12 -1.57 -0.05 0.00 0.00 0.00 0.00 23.12 21.38 1vhz s ALA 129 CO -0.00 -0.23 0.07 -0.65 0.00 0.00 0.00 175.76 174.95 1vhz s GLN 130 N 1.14 1.41 -0.97 0.00 -0.21 -0.09 -0.78 119.66 120.16 1vhz s GLN 130 Ca 0.01 -1.76 -0.08 0.00 0.02 0.00 0.00 55.36 53.56 1vhz s GLN 130 Cb -0.14 -0.38 -0.03 0.00 1.00 0.00 0.00 33.01 33.45 1vhz s GLN 130 CO -0.01 -0.25 0.81 -3.47 -2.12 0.00 0.00 175.29 170.25 1vhz n ASP 131 N -0.47 -6.55 -4.86 5.90 2.03 -1.26 -1.27 116.55 110.06 1vhz n ASP 131 Ca -0.01 -0.62 -0.31 0.00 0.52 0.00 0.00 54.79 54.36 1vhz n ASP 131 Cb 0.66 -4.57 -0.02 0.00 -0.72 0.00 0.00 41.12 36.46 1vhz n ASP 131 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1vhz s LEU 132 N -5.24 3.61 -0.04 -2.67 1.43 -1.26 -0.27 118.68 114.25 1vhz s LEU 132 Ca 0.31 1.36 -0.08 0.00 -1.03 0.00 0.00 54.13 54.69 1vhz s LEU 132 Cb -0.07 -4.30 0.01 0.00 0.03 0.00 0.00 46.19 41.86 1vhz s LEU 132 CO 0.78 -0.58 0.19 -0.72 0.23 0.00 0.00 176.35 176.25 1vhz s TYR 133 N -2.66 -0.10 0.17 0.29 -0.85 -0.81 -4.94 117.35 108.45 1vhz s TYR 133 Ca 0.55 0.22 -0.32 0.00 -0.52 0.00 0.00 57.07 57.00 1vhz s TYR 133 Cb -0.10 0.02 -0.10 0.00 0.38 0.00 0.00 41.96 42.16 1vhz s TYR 133 CO 0.37 -0.21 1.60 -2.14 -1.52 0.00 0.00 175.55 173.64 1vhz s PRO 134 N -0.69 4.20 -0.30 -3.49 0.02 -1.26 -0.41 135.00 133.07 1vhz s PRO 134 Ca -0.08 2.40 -0.18 0.00 0.02 0.00 0.00 61.00 63.17 1vhz s PRO 134 Cb -0.04 -3.14 0.19 0.00 0.02 0.00 0.00 34.50 31.52 1vhz s PRO 134 CO 0.01 -0.63 1.19 -2.00 -0.33 0.00 0.00 177.00 175.24 1vhz s GLU 135 N 1.15 0.13 0.04 5.54 2.12 -0.29 -4.80 118.70 122.58 1vhz s GLU 135 Ca 0.71 0.29 0.05 0.00 0.36 0.00 0.00 54.97 56.38 1vhz s GLU 135 Cb -0.45 0.15 -0.03 0.00 0.26 0.00 0.00 34.13 34.06 1vhz s GLU 135 CO 0.31 -0.04 -0.11 0.45 -0.54 0.00 0.00 175.26 175.34 1vhz s SER 136 N 1.97 4.32 0.06 -1.70 0.15 -1.26 -2.77 113.70 114.48 1vhz s SER 136 Ca -0.02 -0.28 0.03 0.00 0.70 0.00 0.00 55.95 56.37 1vhz s SER 136 Cb -0.03 -0.88 -0.03 0.00 -1.71 0.00 0.00 66.02 63.37 1vhz s SER 136 CO -0.16 0.25 -0.09 -0.76 1.20 0.00 0.00 173.24 173.69 1vhz s LEU 137 N -1.61 2.32 -0.26 3.45 1.02 -1.13 -4.94 118.68 117.53 1vhz s LEU 137 Ca 0.17 -0.67 -0.29 0.00 0.02 0.00 0.00 54.13 53.36 1vhz s LEU 137 Cb -0.11 -0.22 0.01 0.00 0.02 0.00 0.00 46.19 45.89 1vhz s LEU 137 CO 0.08 -0.24 1.11 -1.61 0.02 0.00 0.00 176.35 175.72 1vhz s GLU 138 N -2.15 4.14 0.06 1.70 0.41 -1.26 -4.03 118.70 117.56 1vhz s GLU 138 Ca -0.03 1.27 0.01 0.00 -0.41 0.00 0.00 54.97 55.81 1vhz s GLU 138 Cb -0.06 -3.72 0.01 0.00 -1.78 0.00 0.00 34.13 28.57 1vhz s GLU 138 CO -0.00 -0.80 0.07 0.41 -0.49 0.00 0.00 175.26 174.45 1vhz n GLY 139 N 3.68 2.09 0.86 -1.39 0.00 -1.26 -4.96 105.19 104.21 1vhz n GLY 139 Ca 0.13 -2.15 0.08 0.00 0.00 0.00 0.00 46.02 44.08 1vhz n GLY 139 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vhz n ASP 140 N -2.80 3.18 -4.77 1.61 8.00 -1.26 -5.01 116.55 115.51 1vhz n ASP 140 Ca 0.01 -1.96 -0.41 0.00 0.71 0.00 0.00 54.79 53.14 1vhz n ASP 140 Cb 0.06 -0.29 -0.01 0.00 -0.02 0.00 0.00 41.12 40.86 1vhz n ASP 140 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1vhz s GLU 141 N -1.03 4.25 0.39 -1.24 1.03 -1.26 -4.92 118.70 115.92 1vhz s GLU 141 Ca 0.31 2.36 0.21 0.00 0.03 0.00 0.00 54.97 57.88 1vhz s GLU 141 Cb 0.16 -3.04 0.58 0.00 -0.80 0.00 0.00 34.13 31.03 1vhz s GLU 141 CO 0.22 -0.35 1.68 -1.00 -1.33 0.00 0.00 175.26 174.47 1vhz h PRO 142 N 3.56 0.00 -3.82 -4.83 0.13 -2.04 -3.45 132.00 121.54 1vhz h PRO 142 Ca -0.49 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.52 1vhz h PRO 142 Cb 1.23 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.19 1vhz h PRO 142 CO 0.67 0.29 -0.50 -1.83 -0.23 0.00 0.00 178.00 176.40 1vhz s GLU 143 N -3.37 0.64 0.61 0.86 -1.05 -1.26 -5.14 118.70 109.98 1vhz s GLU 143 Ca 0.02 -0.82 -0.19 0.00 -0.15 0.00 0.00 54.97 53.83 1vhz s GLU 143 Cb 0.09 0.25 -0.03 0.00 -0.44 0.00 0.00 34.13 34.00 1vhz s GLU 143 CO 0.67 -0.17 1.19 -2.30 0.95 0.00 0.00 175.26 175.61 1vhz n PRO 144 N 0.56 1.16 -3.44 -4.83 -0.02 -1.26 -4.98 135.00 122.18 1vhz n PRO 144 Ca -0.18 0.44 -0.43 0.00 -2.02 0.00 0.00 63.50 61.31 1vhz n PRO 144 Cb 0.59 -2.41 -0.08 0.00 -0.02 0.00 0.00 33.50 31.59 1vhz n PRO 144 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1vhz s LEU 145 N -3.30 5.62 0.31 2.45 1.43 -1.26 -5.01 118.68 118.92 1vhz s LEU 145 Ca 0.78 -1.51 -0.30 0.00 -1.03 0.00 0.00 54.13 52.08 1vhz s LEU 145 Cb -0.40 -2.12 -0.12 0.00 0.03 0.00 0.00 46.19 43.58 1vhz s LEU 145 CO 0.45 -0.66 1.56 -2.65 0.23 0.00 0.00 176.35 175.27 1vhz n PRO 146 N 5.12 2.66 -3.64 1.29 -0.02 -1.25 -4.74 135.00 134.41 1vhz n PRO 146 Ca -0.12 0.94 -0.35 0.00 -2.02 0.00 0.00 63.50 61.96 1vhz n PRO 146 Cb 0.43 -2.70 -0.05 0.00 -0.02 0.00 0.00 33.50 31.15 1vhz n PRO 146 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1vhz s GLN 147 N -0.87 3.70 -0.12 -0.52 -0.21 -1.26 -1.11 119.66 119.27 1vhz s GLN 147 Ca 0.62 0.09 -0.00 0.00 0.02 0.00 0.00 55.36 56.09 1vhz s GLN 147 Cb -0.50 -3.05 0.03 0.00 1.00 0.00 0.00 33.01 30.49 1vhz s GLN 147 CO 0.52 0.61 -0.07 0.08 -2.12 0.00 0.00 175.29 174.31 1vhz s VAL 148 N -1.33 1.01 -0.17 1.09 1.01 0.81 -4.96 120.40 117.85 1vhz s VAL 148 Ca 0.30 -0.31 -0.23 0.00 0.00 0.00 0.00 61.98 61.74 1vhz s VAL 148 Cb -0.14 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 1vhz s VAL 148 CO 0.17 0.34 0.73 -0.13 0.00 0.00 0.00 175.10 176.21 1vhz s ARG 149 N 1.71 4.27 -0.13 2.72 0.52 -1.26 -0.08 118.95 126.70 1vhz s ARG 149 Ca 0.05 0.83 0.00 0.00 -0.52 0.00 0.00 55.73 56.09 1vhz s ARG 149 Cb -0.13 -3.57 0.02 0.00 0.52 0.00 0.00 34.95 31.80 1vhz s ARG 149 CO -0.08 -0.26 -0.12 -0.46 0.02 0.00 0.00 175.30 174.40 1vhz s TRP 150 N 1.94 1.87 0.28 -0.53 -0.11 -0.31 -4.93 118.94 117.16 1vhz s TRP 150 Ca 0.34 -0.99 -0.30 0.00 1.22 0.00 0.00 56.10 56.37 1vhz s TRP 150 Cb -0.16 -1.43 -0.11 0.00 -1.50 0.00 0.00 33.47 30.27 1vhz s TRP 150 CO 0.12 -0.58 1.54 -1.25 -4.62 0.00 0.00 176.95 172.16 1vhz s PRO 151 N 1.50 4.17 0.25 5.86 0.04 -1.26 0.13 135.00 145.69 1vhz s PRO 151 Ca 0.03 2.49 -0.05 0.00 0.04 0.00 0.00 61.00 63.51 1vhz s PRO 151 Cb -0.13 -3.05 0.28 0.00 0.04 0.00 0.00 34.50 31.64 1vhz s PRO 151 CO -0.09 -0.56 1.92 -0.07 0.04 0.00 0.00 177.00 178.25 1vhz h LEU 152 N 4.86 1.14 -2.62 -3.56 3.38 -1.65 -1.41 115.31 115.45 1vhz h LEU 152 Ca -0.47 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.49 1vhz h LEU 152 Cb 1.22 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1vhz h LEU 152 CO 0.78 0.81 0.09 0.00 0.09 0.00 0.00 178.44 180.21 1vhz h ALA 153 N 1.38 1.26 0.00 1.53 0.00 -1.91 -1.65 119.26 119.88 1vhz h ALA 153 Ca 0.38 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 1vhz h ALA 153 Cb -0.10 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1vhz h ALA 153 CO -0.10 -0.11 -0.39 0.72 0.00 0.00 0.00 179.25 179.37 1vhz n HIS 154 N -3.27 0.00 -0.21 0.00 8.25 -0.60 -4.86 115.22 114.54 1vhz n HIS 154 Ca -0.02 -1.03 -0.00 0.00 -0.26 0.00 0.00 57.72 56.40 1vhz n HIS 154 Cb 0.17 -0.18 0.07 0.00 1.12 0.00 0.00 29.99 31.17 1vhz n HIS 154 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1vhz h MET 155 N 0.54 0.02 0.00 -0.41 2.86 -0.59 0.24 114.93 117.59 1vhz h MET 155 Ca -0.03 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1vhz h MET 155 Cb 1.16 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.81 1vhz h MET 155 CO 0.01 0.01 0.00 0.52 1.06 0.00 0.00 176.91 178.52 1vhz h MET 156 N 0.02 0.00 0.00 1.72 2.86 -1.89 -2.56 114.93 115.08 1vhz h MET 156 Ca 0.30 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.94 1vhz h MET 156 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1vhz h MET 156 CO -0.61 0.00 0.00 -0.44 1.06 0.00 0.00 176.91 176.92 1vhz h ASP 157 N 0.00 0.00 -0.07 1.22 3.32 -1.34 -2.57 116.42 116.99 1vhz h ASP 157 Ca 0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 1vhz h ASP 157 Cb 0.01 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1vhz h ASP 157 CO 0.00 0.00 0.10 -0.07 -1.72 0.00 0.00 179.24 177.55 1vhz h LEU 158 N 0.00 0.00 0.00 1.55 3.38 -1.63 -0.95 115.31 117.66 1vhz h LEU 158 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1vhz h LEU 158 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1vhz h LEU 158 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 1vhz n LEU 159 N -3.60 0.00 -0.62 1.67 4.32 -0.97 -1.65 117.00 116.15 1vhz n LEU 159 Ca -0.01 0.38 0.12 0.00 -0.02 0.00 0.00 56.01 56.48 1vhz n LEU 159 Cb 0.19 -0.38 0.20 0.00 -1.62 0.00 0.00 43.42 41.80 1vhz n LEU 159 CO 0.25 -0.20 0.59 -0.62 -1.22 0.00 0.00 177.39 176.18 1vhz n GLU 160 N -1.38 1.64 -3.62 3.23 -0.58 -0.36 -4.82 120.64 114.76 1vhz n GLU 160 Ca 0.05 -1.25 -0.40 0.00 -0.42 0.00 0.00 57.16 55.14 1vhz n GLU 160 Cb 0.14 -1.47 -0.11 0.00 -0.57 0.00 0.00 31.44 29.42 1vhz n GLU 160 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1vhz s ASP 161 N -2.22 5.67 0.55 1.62 3.68 -0.66 -4.97 116.67 120.35 1vhz s ASP 161 Ca 0.27 -1.00 0.26 0.00 2.13 0.00 0.00 52.55 54.21 1vhz s ASP 161 Cb 0.20 -2.00 1.47 0.00 -1.45 0.00 0.00 42.92 41.14 1vhz s ASP 161 CO 0.42 -0.37 2.02 -0.65 0.13 0.00 0.00 175.17 176.72 1vhz h PRO 162 N 8.40 0.00 0.00 4.34 0.11 -1.87 -0.76 132.00 142.22 1vhz h PRO 162 Ca -0.25 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 1vhz h PRO 162 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1vhz h PRO 162 CO 0.66 0.00 -0.06 -0.44 -0.21 0.00 0.00 178.00 177.95 1vhz h ASP 163 N 0.00 0.00 0.23 -2.05 3.45 -1.91 -2.96 116.42 113.18 1vhz h ASP 163 Ca 0.18 0.00 -0.30 0.00 0.43 0.00 0.00 57.03 57.34 1vhz h ASP 163 Cb 0.81 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 39.53 1vhz h ASP 163 CO -0.00 0.06 -2.05 0.33 -1.57 0.00 0.00 179.24 176.01 1vhz n PHE 164 N -3.23 0.41 -1.18 4.55 -0.00 -0.32 -1.04 117.46 116.65 1vhz n PHE 164 Ca -0.00 0.14 -0.40 0.00 -0.00 0.00 0.00 57.45 57.19 1vhz n PHE 164 Cb 0.27 -1.03 -0.07 0.00 -0.00 0.00 0.00 39.48 38.65 1vhz n PHE 164 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 1vhz n ASN 165 N -2.82 2.21 -4.27 -2.13 3.02 -1.01 -4.57 115.26 105.70 1vhz n ASN 165 Ca -0.23 -2.63 -0.30 0.00 -0.03 0.00 0.00 54.58 51.38 1vhz n ASN 165 Cb 1.05 -1.11 -0.16 0.00 -0.61 0.00 0.00 39.78 38.94 1vhz n ASN 165 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1vhz s GLU 166 N 5.87 2.19 0.31 3.52 -6.30 -1.26 -5.01 118.70 118.00 1vhz s GLU 166 Ca 0.63 -0.87 0.07 0.00 -2.50 0.00 0.00 54.97 52.29 1vhz s GLU 166 Cb 0.11 -1.99 0.80 0.00 0.00 0.00 0.00 34.13 33.05 1vhz s GLU 166 CO 0.18 0.46 1.72 0.00 0.02 0.00 0.00 175.26 177.64 1vhz h ALA 167 N 5.76 1.64 -0.19 6.30 0.00 -1.99 0.35 119.26 131.12 1vhz h ALA 167 Ca -0.38 0.13 -0.20 0.00 0.00 0.00 0.00 54.91 54.46 1vhz h ALA 167 Cb 1.15 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1vhz h ALA 167 CO 0.47 -0.27 -0.69 0.00 0.00 0.00 0.00 179.25 178.77 1vhz h ARG 168 N 0.54 0.76 -0.20 0.00 3.08 -1.97 -1.61 114.38 114.99 1vhz h ARG 168 Ca 0.60 -0.57 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1vhz h ARG 168 Cb 1.12 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 1vhz h ARG 168 CO -0.48 1.19 0.07 -0.91 -1.07 0.00 0.00 179.97 178.77 1vhz h ASN 169 N 0.55 0.29 -0.40 7.04 2.35 -1.51 -1.20 115.58 122.69 1vhz h ASN 169 Ca -0.03 -0.19 -0.04 0.00 -0.55 0.00 0.00 56.30 55.50 1vhz h ASN 169 Cb 1.30 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 39.58 1vhz h ASN 169 CO 0.14 0.40 0.11 0.58 -1.65 0.00 0.00 177.43 177.01 1vhz h VAL 170 N 0.16 1.22 -0.33 2.81 2.07 -1.02 0.00 116.25 121.17 1vhz h VAL 170 Ca 0.07 -0.76 0.04 0.00 0.82 0.00 0.00 66.70 66.87 1vhz h VAL 170 Cb 0.21 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 1vhz h VAL 170 CO -0.00 0.27 0.09 0.28 0.02 0.00 0.00 177.57 178.23 1vhz h SER 171 N 0.51 0.08 -0.29 0.57 0.02 -1.24 -2.24 113.55 110.95 1vhz h SER 171 Ca 0.13 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.13 1vhz h SER 171 Cb 0.29 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 1vhz h SER 171 CO -0.00 0.08 0.17 0.00 -1.14 0.00 0.00 176.83 175.93 1vhz h ALA 172 N 1.23 0.36 -0.20 3.77 0.00 -0.94 -1.02 119.26 122.46 1vhz h ALA 172 Ca 0.15 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.11 1vhz h ALA 172 Cb 0.15 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 1vhz h ALA 172 CO -0.18 -0.21 -0.16 1.25 0.00 0.00 0.00 179.25 179.95 1vhz h LEU 173 N 0.34 -0.52 -0.85 0.00 5.85 -0.65 -0.33 115.31 119.14 1vhz h LEU 173 Ca 0.11 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.84 1vhz h LEU 173 Cb -0.00 0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 1vhz h LEU 173 CO -0.05 -0.21 -0.19 -0.26 -0.34 0.00 0.00 178.44 177.40 1vhz h PHE 174 N -0.17 0.72 -0.42 1.25 -1.00 -1.29 -2.07 116.94 113.95 1vhz h PHE 174 Ca 0.12 -0.14 -0.14 0.00 2.81 0.00 0.00 57.97 60.62 1vhz h PHE 174 Cb 0.35 -0.18 -0.01 0.00 3.61 0.00 0.00 35.95 39.72 1vhz h PHE 174 CO -0.31 0.79 -0.27 -0.07 -1.61 0.00 0.00 178.31 176.84 1vhz h LEU 175 N 0.58 0.94 -0.45 1.54 3.38 -0.74 -1.85 115.31 118.71 1vhz h LEU 175 Ca 0.09 -0.37 -0.12 0.00 0.09 0.00 0.00 57.88 57.57 1vhz h LEU 175 Cb 0.64 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1vhz h LEU 175 CO 0.05 1.14 -0.19 0.58 0.09 0.00 0.00 178.44 180.10 1vhz h VAL 176 N 0.77 1.27 -0.75 1.22 2.07 -0.97 -1.46 116.25 118.41 1vhz h VAL 176 Ca 0.09 -1.34 -0.01 0.00 0.82 0.00 0.00 66.70 66.25 1vhz h VAL 176 Cb 0.83 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.76 1vhz h VAL 176 CO 0.07 0.46 0.42 -0.09 0.02 0.00 0.00 177.57 178.45 1vhz h ARG 177 N 0.76 1.04 -0.26 1.57 2.43 -1.31 0.29 114.38 118.89 1vhz h ARG 177 Ca 0.10 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1vhz h ARG 177 Cb 0.76 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1vhz h ARG 177 CO 0.06 0.76 0.15 0.93 -1.51 0.00 0.00 179.97 180.37 1vhz h GLU 178 N 1.03 0.36 -0.75 0.20 4.39 -1.13 -1.87 114.58 116.82 1vhz h GLU 178 Ca 0.26 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.93 1vhz h GLU 178 Cb 0.02 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.56 1vhz h GLU 178 CO -0.04 0.30 0.49 2.35 -1.16 0.00 0.00 179.01 180.95 1vhz h TRP 179 N 0.32 0.96 -0.55 4.33 7.01 -0.76 -2.06 115.95 125.20 1vhz h TRP 179 Ca 0.09 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.11 1vhz h TRP 179 Cb 0.04 -0.32 -0.03 0.00 -2.10 0.00 0.00 29.16 26.75 1vhz h TRP 179 CO -0.04 0.61 0.36 -0.07 -2.79 0.00 0.00 178.44 176.52 1vhz h LEU 180 N 1.02 0.64 -0.58 0.65 4.07 -0.17 -2.26 115.31 118.68 1vhz h LEU 180 Ca 0.27 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 58.20 1vhz h LEU 180 Cb -0.10 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 41.45 1vhz h LEU 180 CO -0.06 0.47 0.30 0.11 -1.08 0.00 0.00 178.44 178.18 1vhz h LYS 181 N 0.75 0.82 -0.73 1.13 1.57 -0.64 -0.19 116.57 119.27 1vhz h LYS 181 Ca 0.20 -0.11 0.12 0.00 -1.87 0.00 0.00 60.65 59.00 1vhz h LYS 181 Cb -0.08 -0.15 -0.13 0.00 0.08 0.00 0.00 32.23 31.95 1vhz h LYS 181 CO -0.04 0.64 -0.36 0.78 -0.57 0.00 0.00 179.45 179.90 1vhz h GLY 182 N 0.78 -0.06 -0.55 3.86 0.00 -1.03 0.46 103.07 106.53 1vhz h GLY 182 Ca 0.20 0.47 0.00 0.00 0.00 0.00 0.00 47.33 48.00 1vhz h GLY 182 CO -0.03 -0.20 0.00 0.61 0.00 0.00 0.00 176.54 176.92 1vhz n GLN 183 N -5.45 1.67 -3.60 4.80 10.64 -1.16 -4.96 117.38 119.33 1vhz n GLN 183 Ca 0.06 -0.99 -0.23 0.00 -1.83 0.00 0.00 57.00 54.01 1vhz n GLN 183 Cb 0.37 -1.45 0.08 0.00 -0.86 0.00 0.00 30.24 28.37 1vhz n GLN 183 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1vhz n GLY 184 N 1.16 -0.50 0.00 2.61 0.00 0.16 -5.11 105.19 103.51 1vhz n GLY 184 Ca 0.18 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1vhz n GLY 184 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36