#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w94 h SER 2 N 0.00 0.00 -0.40 7.83 4.64 -2.08 -1.17 113.55 122.38 2w94 h SER 2 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2w94 h SER 2 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 2w94 h SER 2 CO 0.00 0.00 0.03 0.35 -0.87 0.00 0.00 176.83 176.34 2w94 n THR 3 N -3.87 2.51 -1.64 2.95 -2.24 -1.26 -5.01 114.28 105.72 2w94 n THR 3 Ca -0.01 -1.81 -0.44 0.00 -2.27 0.00 0.00 64.05 59.52 2w94 n THR 3 Cb 0.17 -0.28 -0.02 0.00 -2.10 0.00 0.00 70.33 68.10 2w94 n THR 3 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w94 n GLN 4 N -0.25 1.75 -0.64 -0.78 10.64 -0.44 -1.98 117.38 125.68 2w94 n GLN 4 Ca 0.26 0.62 0.00 0.00 -1.83 0.00 0.00 57.00 56.05 2w94 n GLN 4 Cb 1.04 -2.15 0.00 0.00 -0.86 0.00 0.00 30.24 28.27 2w94 n GLN 4 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2w94 n GLY 5 N 1.45 1.29 3.91 2.61 0.00 -1.26 -5.02 105.19 108.16 2w94 n GLY 5 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 2w94 n GLY 5 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w94 s LEU 6 N 0.00 4.04 -0.11 0.99 1.43 -0.84 -4.49 118.68 119.70 2w94 s LEU 6 Ca 0.00 0.68 -0.25 0.00 -1.03 0.00 0.00 54.13 53.53 2w94 s LEU 6 Cb 0.00 -3.51 -0.03 0.00 0.03 0.00 0.00 46.19 42.68 2w94 s LEU 6 CO 0.00 -0.22 0.78 -0.69 0.23 0.00 0.00 176.35 176.45 2w94 s VAL 7 N -2.14 4.95 -0.63 -1.59 1.01 0.39 -4.85 120.40 117.55 2w94 s VAL 7 Ca 0.43 1.58 -0.26 0.00 0.00 0.00 0.00 61.98 63.74 2w94 s VAL 7 Cb -0.11 -4.11 0.04 0.00 0.00 0.00 0.00 36.38 32.21 2w94 s VAL 7 CO 0.31 0.14 1.10 -1.10 0.00 0.00 0.00 175.10 175.55 2w94 s GLN 8 N 1.47 3.30 0.04 2.72 -0.21 -1.26 -1.24 119.66 124.48 2w94 s GLN 8 Ca 0.39 -0.22 -0.24 0.00 0.02 0.00 0.00 55.36 55.31 2w94 s GLN 8 Cb -0.17 -4.11 -0.16 0.00 1.00 0.00 0.00 33.01 29.57 2w94 s GLN 8 CO 0.16 -1.77 1.48 1.25 -2.12 0.00 0.00 175.29 174.30 2w94 h LEU 9 N 11.84 0.07 -0.43 2.90 5.85 -1.67 -1.36 115.31 132.51 2w94 h LEU 9 Ca -0.27 -0.28 -0.15 0.00 0.84 0.00 0.00 57.88 58.03 2w94 h LEU 9 Cb 1.06 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 2w94 h LEU 9 CO 1.18 0.33 -0.30 -0.07 -0.34 0.00 0.00 178.44 179.24 2w94 h LEU 10 N -0.19 1.02 -1.23 2.25 4.07 -1.92 -0.76 115.31 118.55 2w94 h LEU 10 Ca 0.01 -0.43 -0.06 0.00 0.08 0.00 0.00 57.88 57.48 2w94 h LEU 10 Cb 0.29 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 2w94 h LEU 10 CO 0.00 1.23 -0.15 0.00 -1.08 0.00 0.00 178.44 178.44 2w94 h ALA 11 N 0.82 1.36 -0.10 1.53 0.00 -1.91 -1.77 119.26 119.18 2w94 h ALA 11 Ca 0.09 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2w94 h ALA 11 Cb 0.89 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2w94 h ALA 11 CO 0.08 0.43 0.00 0.09 0.00 0.00 0.00 179.25 179.86 2w94 n ASN 12 N -4.22 1.35 -3.77 0.00 3.02 -0.52 -4.93 115.26 106.20 2w94 n ASN 12 Ca -0.00 -1.59 -0.27 0.00 -0.03 0.00 0.00 54.58 52.69 2w94 n ASN 12 Cb 0.31 -0.06 0.05 0.00 -0.61 0.00 0.00 39.78 39.47 2w94 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w94 n ALA 13 N 0.09 -1.37 1.23 5.41 0.00 -0.67 -4.89 120.51 120.31 2w94 n ALA 13 Ca 0.17 0.24 0.13 0.00 0.00 0.00 0.00 53.44 53.98 2w94 n ALA 13 Cb 0.29 -4.65 0.31 0.00 0.00 0.00 0.00 19.45 15.40 2w94 n ALA 13 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2w94 n GLN 14 N -4.77 1.21 -4.15 0.00 1.13 -0.32 -4.91 117.38 105.57 2w94 n GLN 14 Ca -0.00 -0.82 -0.13 0.00 -1.94 0.00 0.00 57.00 54.11 2w94 n GLN 14 Cb 0.55 -1.48 -0.11 0.00 0.11 0.00 0.00 30.24 29.31 2w94 n GLN 14 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2w94 s HIS 16 N -2.74 3.56 -0.13 0.00 2.46 -0.05 -4.84 115.29 113.54 2w94 s HIS 16 Ca 0.05 0.97 0.03 0.00 0.47 0.00 0.00 55.06 56.57 2w94 s HIS 16 Cb -0.01 -2.30 0.01 0.00 -0.13 0.00 0.00 32.58 30.15 2w94 s HIS 16 CO -0.02 0.41 -0.21 -0.51 -2.47 0.00 0.00 174.74 171.93 2w94 s LEU 17 N -2.16 2.07 -0.03 8.88 1.43 -1.26 -0.50 118.68 127.11 2w94 s LEU 17 Ca 0.39 -0.59 0.07 0.00 -1.03 0.00 0.00 54.13 52.97 2w94 s LEU 17 Cb -0.14 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.66 2w94 s LEU 17 CO 0.19 0.08 -0.24 -0.60 0.23 0.00 0.00 176.35 176.01 2w94 s ARG 18 N 0.80 2.14 0.25 1.70 3.52 -0.62 -4.98 118.95 121.77 2w94 s ARG 18 Ca -0.08 -0.86 0.10 0.00 -0.13 0.00 0.00 55.73 54.76 2w94 s ARG 18 Cb -0.16 -1.96 -0.05 0.00 -1.56 0.00 0.00 34.95 31.23 2w94 s ARG 18 CO -0.01 0.46 -0.10 0.95 -0.81 0.00 0.00 175.30 175.79 2w94 s THR 19 N -0.40 3.04 0.05 4.11 -4.23 -1.26 -0.20 115.64 116.74 2w94 s THR 19 Ca 0.04 -2.03 -0.23 0.00 -1.18 0.00 0.00 61.69 58.29 2w94 s THR 19 Cb -0.11 -2.59 -0.15 0.00 1.34 0.00 0.00 72.50 71.00 2w94 s THR 19 CO 0.01 -0.32 1.50 0.77 -0.54 0.00 0.00 174.62 176.04 2w94 h SER 20 N 2.26 0.13 -5.05 3.99 4.64 -1.66 -3.47 113.55 114.39 2w94 h SER 20 Ca -0.43 -0.27 -0.06 0.00 -0.47 0.00 0.00 61.79 60.56 2w94 h SER 20 Cb 1.24 -0.03 -0.14 0.00 -0.31 0.00 0.00 62.40 63.16 2w94 h SER 20 CO 0.58 0.36 -0.03 0.42 -0.87 0.00 0.00 176.83 177.30 2w94 s THR 21 N -5.13 0.05 -0.07 2.95 -4.23 -1.26 -5.03 115.64 102.91 2w94 s THR 21 Ca -0.14 -0.42 0.03 0.00 -1.18 0.00 0.00 61.69 59.98 2w94 s THR 21 Cb 0.05 -1.06 0.01 0.00 1.34 0.00 0.00 72.50 72.83 2w94 s THR 21 CO 0.69 -0.23 -0.15 0.20 -0.54 0.00 0.00 174.62 174.59 2w94 s ASN 22 N -2.46 2.10 0.20 3.99 0.01 -1.26 -4.03 114.94 113.49 2w94 s ASN 22 Ca -0.01 -0.36 -0.11 0.00 -0.71 0.00 0.00 52.86 51.67 2w94 s ASN 22 Cb 0.00 -0.94 0.26 0.00 0.41 0.00 0.00 41.25 40.99 2w94 s ASN 22 CO -0.08 0.07 1.70 0.22 -1.51 0.00 0.00 177.10 177.50 2w94 h TYR 23 N 6.84 0.11 -1.49 2.20 3.20 -1.08 -3.37 116.97 123.38 2w94 h TYR 23 Ca -0.28 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.62 2w94 h TYR 23 Cb 1.20 0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.51 2w94 h TYR 23 CO 0.48 -0.07 0.00 0.27 -1.64 0.00 0.00 178.16 177.20 2w94 n ASN 24 N -5.17 0.00 0.00 -2.11 0.23 -1.26 -4.81 115.26 102.14 2w94 n ASN 24 Ca 0.08 -0.49 0.09 0.00 -0.53 0.00 0.00 54.58 53.72 2w94 n ASN 24 Cb 0.31 0.00 0.41 0.00 -2.08 0.00 0.00 39.78 38.42 2w94 n ASN 24 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2w94 n GLY 25 N 0.00 -1.01 0.32 4.83 0.00 -1.26 -1.99 105.19 106.08 2w94 n GLY 25 Ca 0.00 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.03 2w94 n GLY 25 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2w94 n VAL 26 N -1.40 1.89 -1.49 1.61 0.24 -1.26 -4.49 118.33 113.43 2w94 n VAL 26 Ca 0.06 -2.00 0.07 0.00 -2.04 0.00 0.00 64.34 60.43 2w94 n VAL 26 Cb 0.18 -0.15 0.16 0.00 -1.47 0.00 0.00 33.84 32.55 2w94 n VAL 26 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2w94 n HIS 27 N -1.02 0.00 -2.52 6.34 8.25 -0.84 -2.37 115.22 123.06 2w94 n HIS 27 Ca 0.16 -1.14 -0.23 0.00 -0.26 0.00 0.00 57.72 56.25 2w94 n HIS 27 Cb 0.67 -0.19 0.13 0.00 1.12 0.00 0.00 29.99 31.71 2w94 n HIS 27 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2w94 n THR 28 N -1.05 0.00 0.16 1.59 -2.24 -1.25 -1.36 114.28 110.13 2w94 n THR 28 Ca 0.16 -1.46 0.10 0.00 -2.27 0.00 0.00 64.05 60.58 2w94 n THR 28 Cb 0.71 -0.98 0.53 0.00 -2.10 0.00 0.00 70.33 68.49 2w94 n THR 28 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2w94 n GLN 29 N -2.90 0.13 0.30 -0.78 0.00 -1.26 -1.37 117.38 111.50 2w94 n GLN 29 Ca 0.16 0.62 0.17 0.00 0.00 0.00 0.00 57.00 57.95 2w94 n GLN 29 Cb 0.57 -2.00 0.97 0.00 0.00 0.00 0.00 30.24 29.79 2w94 n GLN 29 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.06 177.80 2w94 h PHE 30 N 0.00 0.00 -0.43 2.61 0.04 -1.95 -2.62 116.94 114.58 2w94 h PHE 30 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2w94 h PHE 30 Cb 0.16 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.31 2w94 h PHE 30 CO 0.00 0.00 0.00 0.09 -0.60 0.00 0.00 178.31 177.80 2w94 n ASN 31 N -3.66 4.62 0.15 2.17 3.02 -0.47 -4.71 115.26 116.38 2w94 n ASN 31 Ca -0.02 -2.84 0.12 0.00 -0.03 0.00 0.00 54.58 51.80 2w94 n ASN 31 Cb 0.12 -0.58 0.08 0.00 -0.61 0.00 0.00 39.78 38.79 2w94 n ASN 31 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2w94 h SER 32 N 2.93 0.00 -3.65 6.41 4.64 -1.60 -2.87 113.55 119.41 2w94 h SER 32 Ca 0.00 -0.01 -0.54 0.00 -0.47 0.00 0.00 61.79 60.77 2w94 h SER 32 Cb 1.59 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 63.79 2w94 h SER 32 CO 0.31 0.01 0.77 0.00 -0.87 0.00 0.00 176.83 177.05 2w94 n ALA 33 N -2.13 2.29 -1.55 5.18 0.00 -1.26 -0.92 120.51 122.12 2w94 n ALA 33 Ca 0.02 0.35 -0.49 0.00 0.00 0.00 0.00 53.44 53.32 2w94 n ALA 33 Cb 0.53 -2.41 -0.04 0.00 0.00 0.00 0.00 19.45 17.54 2w94 n ALA 33 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2w94 n LEU 34 N 1.00 1.09 -0.27 0.00 7.94 -0.67 -1.01 117.00 125.08 2w94 n LEU 34 Ca 0.04 1.15 -0.04 0.00 -1.11 0.00 0.00 56.01 56.05 2w94 n LEU 34 Cb 0.38 -1.17 -0.02 0.00 0.53 0.00 0.00 43.42 43.14 2w94 n LEU 34 CO 0.64 -1.58 -0.03 0.59 -1.11 0.00 0.00 177.39 175.89 2w94 n ASN 35 N 1.84 -5.25 -4.67 1.96 3.02 -1.26 -4.96 115.26 105.93 2w94 n ASN 35 Ca 0.15 0.09 -0.46 0.00 -0.03 0.00 0.00 54.58 54.33 2w94 n ASN 35 Cb 0.25 -3.06 -0.04 0.00 -0.61 0.00 0.00 39.78 36.31 2w94 n ASN 35 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w94 n TYR 36 N -2.29 2.27 -4.09 3.10 4.19 -0.18 -5.00 117.16 115.16 2w94 n TYR 36 Ca -0.04 0.29 -0.14 0.00 3.31 0.00 0.00 57.90 61.33 2w94 n TYR 36 Cb 0.42 -2.53 -0.12 0.00 0.49 0.00 0.00 39.34 37.60 2w94 n TYR 36 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 2w94 s LYS 37 N 0.70 0.49 0.00 2.98 1.02 -1.26 -4.81 119.74 118.86 2w94 s LYS 37 Ca 0.77 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 56.18 2w94 s LYS 37 Cb -0.67 -0.32 0.00 0.00 -0.52 0.00 0.00 37.83 36.31 2w94 s LYS 37 CO 0.40 0.07 0.00 0.27 -0.92 0.00 0.00 175.35 175.16 2w94 n ASN 38 N 1.93 1.46 -4.58 2.83 0.23 -1.26 -5.07 115.26 110.79 2w94 n ASN 38 Ca -0.20 -0.36 -0.42 0.00 -0.53 0.00 0.00 54.58 53.07 2w94 n ASN 38 Cb 0.56 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.23 2w94 n ASN 38 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 2w94 s ASN 39 N 0.28 6.39 0.15 0.53 3.84 -1.26 -4.88 114.94 119.99 2w94 s ASN 39 Ca 0.00 0.17 0.24 0.00 0.21 0.00 0.00 52.86 53.48 2w94 s ASN 39 Cb 0.00 -2.55 0.91 0.00 -0.55 0.00 0.00 41.25 39.06 2w94 s ASN 39 CO 0.00 -1.52 1.72 0.61 -2.79 0.00 0.00 177.10 175.12 2w94 n GLY 40 N 5.10 -1.39 0.21 1.21 0.00 -1.26 -2.95 105.19 106.10 2w94 n GLY 40 Ca 0.10 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.24 2w94 n GLY 40 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2w94 n THR 41 N -1.97 0.00 -4.32 2.61 -2.24 -1.26 -4.85 114.28 102.24 2w94 n THR 41 Ca 0.04 -0.11 -0.23 0.00 -2.27 0.00 0.00 64.05 61.48 2w94 n THR 41 Cb 0.30 0.34 -0.17 0.00 -2.10 0.00 0.00 70.33 68.70 2w94 n THR 41 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2w94 s ASN 42 N -2.56 1.58 0.27 3.42 3.04 -1.15 -5.04 114.94 114.50 2w94 s ASN 42 Ca 0.23 -0.24 0.25 0.00 0.04 0.00 0.00 52.86 53.14 2w94 s ASN 42 Cb 0.19 -0.70 0.53 0.00 -1.54 0.00 0.00 41.25 39.73 2w94 s ASN 42 CO 0.54 -0.03 1.60 0.71 -3.04 0.00 0.00 177.10 176.88 2w94 h THR 43 N 6.07 0.00 0.00 -5.21 1.35 -1.89 -3.39 112.91 109.84 2w94 h THR 43 Ca -0.32 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 2w94 h THR 43 Cb 1.17 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 2w94 h THR 43 CO 0.45 0.00 0.00 0.16 -0.25 0.00 0.00 175.52 175.88 2w94 h ILE 44 N 0.00 0.00 -0.20 6.82 3.07 -1.96 -2.56 117.51 122.68 2w94 h ILE 44 Ca 0.00 -0.44 0.00 0.00 1.55 0.00 0.00 64.86 65.97 2w94 h ILE 44 Cb 0.85 1.33 0.00 0.00 -0.27 0.00 0.00 36.82 38.73 2w94 h ILE 44 CO 0.00 0.00 0.00 -0.90 -1.05 0.00 0.00 178.15 176.20 2w94 n ASP 45 N -2.55 2.14 0.00 2.16 5.75 -1.26 -4.91 116.55 117.88 2w94 n ASP 45 Ca 0.03 -1.78 0.00 0.00 -0.01 0.00 0.00 54.79 53.03 2w94 n ASP 45 Cb 0.33 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2w94 n ASP 45 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w94 n GLY 46 N 1.23 -0.61 3.85 6.12 0.00 -0.97 -4.87 105.19 109.94 2w94 n GLY 46 Ca 0.17 -1.14 -0.34 0.00 0.00 0.00 0.00 46.02 44.71 2w94 n GLY 46 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w94 s SER 47 N -4.00 6.80 -1.35 1.61 1.04 -1.00 -4.99 113.70 111.82 2w94 s SER 47 Ca 0.00 1.17 -0.09 0.00 0.48 0.00 0.00 55.95 57.51 2w94 s SER 47 Cb 0.00 -2.32 0.12 0.00 0.10 0.00 0.00 66.02 63.91 2w94 s SER 47 CO 0.00 -0.06 2.13 -0.62 0.98 0.00 0.00 173.24 175.67 2w94 n GLU 48 N 0.16 3.71 0.00 4.02 1.02 -1.26 -4.81 120.64 123.48 2w94 n GLU 48 Ca -0.00 -3.26 0.00 0.00 -0.02 0.00 0.00 57.16 53.88 2w94 n GLU 48 Cb 0.52 -2.91 0.00 0.00 -0.02 0.00 0.00 31.44 29.03 2w94 n GLU 48 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2w94 n ALA 49 N 3.75 0.00 -2.34 0.62 0.00 -1.08 -1.73 120.51 119.74 2w94 n ALA 49 Ca 0.49 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.52 2w94 n ALA 49 Cb 0.33 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.74 2w94 n ALA 49 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2w94 s TRP 50 N -2.00 3.74 -0.04 0.00 -0.00 -0.20 -4.52 118.94 115.93 2w94 s TRP 50 Ca 0.00 1.74 0.02 0.00 -0.00 0.00 0.00 56.10 57.85 2w94 s TRP 50 Cb 0.00 -3.11 0.01 0.00 -0.00 0.00 0.00 33.47 30.37 2w94 s TRP 50 CO 0.00 0.01 -0.07 0.00 -0.00 0.00 0.00 176.95 176.89 2w94 s SER 52 N 0.54 5.26 -0.06 0.00 1.04 -0.97 -0.85 113.70 118.64 2w94 s SER 52 Ca -0.08 1.72 -0.08 0.00 0.48 0.00 0.00 55.95 57.99 2w94 s SER 52 Cb -0.12 -2.51 -0.29 0.00 0.10 0.00 0.00 66.02 63.20 2w94 s SER 52 CO 0.01 -1.53 0.60 -1.28 0.98 0.00 0.00 173.24 172.02 2w94 h SER 53 N -0.54 0.52 -2.93 7.02 0.87 -1.73 -3.31 113.55 113.45 2w94 h SER 53 Ca -0.44 -0.88 -0.65 0.00 -1.23 0.00 0.00 61.79 58.58 2w94 h SER 53 Cb 1.22 -0.17 -0.10 0.00 -0.44 0.00 0.00 62.40 62.91 2w94 h SER 53 CO 0.56 1.76 -0.51 -0.63 -0.53 0.00 0.00 176.83 177.48 2w94 s ILE 54 N -2.58 5.26 -0.47 2.23 1.01 -1.26 -4.94 121.20 120.45 2w94 s ILE 54 Ca -0.17 0.12 -0.06 0.00 0.00 0.00 0.00 60.65 60.54 2w94 s ILE 54 Cb 0.06 -3.31 0.12 0.00 0.01 0.00 0.00 42.46 39.34 2w94 s ILE 54 CO 0.83 0.56 0.30 -0.69 0.00 0.00 0.00 174.94 175.94 2w94 s VAL 55 N -0.56 3.77 0.27 2.92 1.01 -1.26 -4.90 120.40 121.66 2w94 s VAL 55 Ca 0.12 -2.04 -0.11 0.00 0.00 0.00 0.00 61.98 59.95 2w94 s VAL 55 Cb -0.12 -3.52 0.04 0.00 0.00 0.00 0.00 36.38 32.79 2w94 s VAL 55 CO 0.02 -0.75 0.59 -0.90 0.00 0.00 0.00 175.10 174.06 2w94 n ASP 56 N 4.61 -1.64 -1.12 3.32 5.68 -1.26 -5.04 116.55 121.10 2w94 n ASP 56 Ca -0.03 -2.12 0.04 0.00 -0.50 0.00 0.00 54.79 52.18 2w94 n ASP 56 Cb 0.41 2.73 0.20 0.00 -1.14 0.00 0.00 41.12 43.32 2w94 n ASP 56 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2w94 n THR 57 N -0.40 1.24 -0.38 2.12 -2.24 -1.26 -4.00 114.28 109.36 2w94 n THR 57 Ca -0.06 -0.67 0.07 0.00 -2.27 0.00 0.00 64.05 61.11 2w94 n THR 57 Cb 0.43 -0.27 0.20 0.00 -2.10 0.00 0.00 70.33 68.58 2w94 n THR 57 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2w94 n ASN 58 N 0.37 3.28 -4.93 3.42 3.02 -1.26 -4.91 115.26 114.25 2w94 n ASN 58 Ca 0.14 -2.23 -0.25 0.00 -0.03 0.00 0.00 54.58 52.20 2w94 n ASN 58 Cb 0.66 -0.33 0.01 0.00 -0.61 0.00 0.00 39.78 39.51 2w94 n ASN 58 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2w94 s GLN 59 N -1.42 3.24 -0.03 3.52 -1.52 -1.26 -4.99 119.66 117.21 2w94 s GLN 59 Ca 0.30 -0.14 -0.29 0.00 -1.95 0.00 0.00 55.36 53.28 2w94 s GLN 59 Cb 0.18 -2.45 0.11 0.00 -0.22 0.00 0.00 33.01 30.63 2w94 s GLN 59 CO 0.16 -0.28 0.90 1.52 -0.25 0.00 0.00 175.29 177.33 2w94 s TYR 60 N -2.68 -0.37 -0.10 0.91 -0.85 -1.26 -3.84 117.35 109.17 2w94 s TYR 60 Ca 0.48 0.32 0.04 0.00 -0.52 0.00 0.00 57.07 57.39 2w94 s TYR 60 Cb -0.10 0.52 0.00 0.00 0.38 0.00 0.00 41.96 42.76 2w94 s TYR 60 CO 0.41 -0.51 -0.23 -1.50 -1.52 0.00 0.00 175.55 172.20 2w94 s ILE 61 N -2.69 1.97 -0.10 -3.49 2.07 -0.78 -1.52 121.20 116.66 2w94 s ILE 61 Ca 0.03 -0.96 -0.01 0.00 -1.41 0.00 0.00 60.65 58.30 2w94 s ILE 61 Cb -0.01 -1.72 -0.03 0.00 0.13 0.00 0.00 42.46 40.83 2w94 s ILE 61 CO -0.06 0.54 -0.05 -0.69 -1.91 0.00 0.00 174.94 172.77 2w94 s VAL 62 N 0.45 3.84 -0.13 4.00 1.01 0.72 -1.34 120.40 128.95 2w94 s VAL 62 Ca -0.17 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 2w94 s VAL 62 Cb -0.17 -2.62 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 2w94 s VAL 62 CO 0.07 0.56 -0.09 0.00 0.00 0.00 0.00 175.10 175.64 2w94 s ALA 63 N -0.41 2.77 -0.08 5.51 0.00 0.22 -1.59 121.76 128.19 2w94 s ALA 63 Ca 0.06 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.19 2w94 s ALA 63 Cb -0.12 -1.33 0.00 0.00 0.00 0.00 0.00 23.12 21.67 2w94 s ALA 63 CO 0.02 0.26 -0.19 0.20 0.00 0.00 0.00 175.76 176.05 2w94 s GLY 64 N 0.28 1.07 -0.08 0.00 0.00 0.35 -1.32 107.32 107.62 2w94 s GLY 64 Ca -0.07 -0.72 0.03 0.00 0.00 0.00 0.00 44.72 43.96 2w94 s GLY 64 CO 0.04 -0.17 -0.18 0.00 0.00 0.00 0.00 173.10 172.80 2w94 h GLU 66 N 6.88 0.00 -5.19 0.00 5.08 -1.89 -3.41 114.58 116.05 2w94 h GLU 66 Ca -0.25 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.49 2w94 h GLU 66 Cb 1.21 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.32 2w94 h GLU 66 CO 0.47 0.34 -0.31 0.08 -1.00 0.00 0.00 179.01 178.59 2w94 s VAL 67 N -3.76 5.24 0.40 3.13 1.01 -1.26 -5.04 120.40 120.11 2w94 s VAL 67 Ca -0.01 0.49 -0.26 0.00 0.00 0.00 0.00 61.98 62.20 2w94 s VAL 67 Cb 0.12 -3.65 -0.10 0.00 0.00 0.00 0.00 36.38 32.75 2w94 s VAL 67 CO 0.68 0.24 1.30 -2.65 0.00 0.00 0.00 175.10 174.66 2w94 n PRO 68 N 4.82 2.04 -4.34 2.72 -0.02 -1.26 -4.84 135.00 134.12 2w94 n PRO 68 Ca -0.10 0.72 -0.18 0.00 -2.02 0.00 0.00 63.50 61.92 2w94 n PRO 68 Cb 0.51 -2.40 -0.10 0.00 -0.02 0.00 0.00 33.50 31.50 2w94 n PRO 68 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2w94 s ARG 69 N -2.13 1.31 -0.45 -0.52 1.81 -0.16 -4.97 118.95 113.85 2w94 s ARG 69 Ca 0.59 -1.58 -0.15 0.00 -1.72 0.00 0.00 55.73 52.86 2w94 s ARG 69 Cb -0.52 -1.09 0.05 0.00 -0.45 0.00 0.00 34.95 32.94 2w94 s ARG 69 CO 0.59 0.18 0.36 0.99 -0.68 0.00 0.00 175.30 176.75 2w94 s THR 70 N -2.99 5.23 -0.31 0.02 2.01 -1.26 -1.89 115.64 116.45 2w94 s THR 70 Ca 0.22 -0.86 -0.26 0.00 0.31 0.00 0.00 61.69 61.11 2w94 s THR 70 Cb -0.01 -4.05 0.01 0.00 0.01 0.00 0.00 72.50 68.47 2w94 s THR 70 CO 0.06 -0.47 0.90 -0.36 -0.69 0.00 0.00 174.62 174.07 2w94 s PHE 71 N 1.70 3.19 -0.11 4.92 0.40 0.91 -1.83 117.98 127.15 2w94 s PHE 71 Ca 0.05 0.98 -0.09 0.00 -0.60 0.00 0.00 56.93 57.27 2w94 s PHE 71 Cb -0.22 -3.38 -0.27 0.00 0.51 0.00 0.00 43.02 39.66 2w94 s PHE 71 CO 0.08 -0.63 0.42 0.52 0.70 0.00 0.00 175.22 176.31 2w94 h MET 72 N 8.07 0.28 -2.90 0.44 2.86 -1.32 -1.16 114.93 121.20 2w94 h MET 72 Ca -0.23 -0.47 -0.13 0.00 -2.06 0.00 0.00 59.70 56.81 2w94 h MET 72 Cb 1.08 0.18 -0.23 0.00 0.06 0.00 0.00 31.60 32.69 2w94 h MET 72 CO 0.94 1.23 -0.28 0.00 1.06 0.00 0.00 176.91 179.86 2w94 s VAL 74 N -0.32 2.53 -0.14 0.00 0.11 -0.35 -0.96 120.40 121.27 2w94 s VAL 74 Ca -0.05 -0.85 -0.05 0.00 -2.93 0.00 0.00 61.98 58.10 2w94 s VAL 74 Cb -0.03 -2.02 -0.04 0.00 -1.53 0.00 0.00 36.38 32.76 2w94 s VAL 74 CO 0.02 0.54 0.05 0.00 -3.33 0.00 0.00 175.10 172.38 2w94 s ALA 75 N 0.34 3.41 0.11 1.54 0.00 -0.01 -0.65 121.76 126.50 2w94 s ALA 75 Ca -0.15 -0.75 0.07 0.00 0.00 0.00 0.00 51.96 51.12 2w94 s ALA 75 Cb -0.17 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 21.17 2w94 s ALA 75 CO 0.07 0.40 -0.07 -1.17 0.00 0.00 0.00 175.76 174.99 2w94 s LEU 76 N -0.31 3.14 -0.03 0.00 2.96 -0.93 -1.76 118.68 121.75 2w94 s LEU 76 Ca 0.08 -0.35 -0.14 0.00 -0.22 0.00 0.00 54.13 53.50 2w94 s LEU 76 Cb -0.12 -1.91 0.02 0.00 0.50 0.00 0.00 46.19 44.68 2w94 s LEU 76 CO 0.02 0.17 0.31 -1.58 -1.32 0.00 0.00 176.35 173.95 2w94 s GLN 77 N -2.30 0.62 0.97 1.98 0.74 -0.61 -1.20 119.66 119.85 2w94 s GLN 77 Ca 0.23 -0.08 -0.16 0.00 0.05 0.00 0.00 55.36 55.40 2w94 s GLN 77 Cb -0.11 0.28 0.24 0.00 1.10 0.00 0.00 33.01 34.51 2w94 s GLN 77 CO 0.15 -0.16 0.96 0.41 -0.55 0.00 0.00 175.29 176.11 2w94 n GLY 78 N 1.57 -2.37 3.72 2.59 0.00 -0.85 -1.40 105.19 108.44 2w94 n GLY 78 Ca -0.20 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 43.86 2w94 n GLY 78 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2w94 s ARG 79 N -5.16 4.44 0.33 1.61 3.52 -0.22 -4.06 118.95 119.41 2w94 s ARG 79 Ca 0.60 1.83 0.16 0.00 -0.13 0.00 0.00 55.73 58.19 2w94 s ARG 79 Cb -0.05 -3.31 0.54 0.00 -1.56 0.00 0.00 34.95 30.58 2w94 s ARG 79 CO 0.45 -0.23 1.68 0.78 -0.81 0.00 0.00 175.30 177.17 2w94 h GLY 80 N 6.38 0.00 -0.61 8.12 0.00 -1.54 -3.34 103.07 112.08 2w94 h GLY 80 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2w94 h GLY 80 CO 0.80 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.43 2w94 n ASP 81 N -3.62 1.67 -3.74 0.19 5.75 -1.26 -4.98 116.55 110.55 2w94 n ASP 81 Ca -0.01 -1.34 -0.10 0.00 -0.01 0.00 0.00 54.79 53.33 2w94 n ASP 81 Cb 0.55 -0.01 -0.04 0.00 -1.03 0.00 0.00 41.12 40.59 2w94 n ASP 81 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2w94 s ALA 82 N -0.64 -0.82 -1.36 2.12 0.00 -1.25 -5.05 121.76 114.76 2w94 s ALA 82 Ca 0.09 -0.26 -0.10 0.00 0.00 0.00 0.00 51.96 51.68 2w94 s ALA 82 Cb 0.06 0.82 0.11 0.00 0.00 0.00 0.00 23.12 24.11 2w94 s ALA 82 CO 0.09 -0.75 2.11 -0.25 0.00 0.00 0.00 175.76 176.96 2w94 n ASP 83 N -0.30 5.26 -3.98 0.00 8.00 -1.26 -4.51 116.55 119.77 2w94 n ASP 83 Ca -0.11 -3.00 -0.20 0.00 0.71 0.00 0.00 54.79 52.19 2w94 n ASP 83 Cb 0.63 -1.52 -0.15 0.00 -0.02 0.00 0.00 41.12 40.05 2w94 n ASP 83 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2w94 s GLN 84 N 1.17 0.88 0.09 -1.24 -0.21 -1.26 -4.40 119.66 114.69 2w94 s GLN 84 Ca 0.45 -0.25 -0.26 0.00 0.02 0.00 0.00 55.36 55.31 2w94 s GLN 84 Cb 0.12 -0.83 0.08 0.00 1.00 0.00 0.00 33.01 33.38 2w94 s GLN 84 CO -0.04 0.08 0.89 1.67 -2.12 0.00 0.00 175.29 175.77 2w94 s TRP 85 N 0.29 -0.26 -0.26 0.91 -2.14 -0.72 -1.05 118.94 115.72 2w94 s TRP 85 Ca -0.04 0.03 -0.10 0.00 2.66 0.00 0.00 56.10 58.65 2w94 s TRP 85 Cb -0.09 0.59 -0.04 0.00 -3.10 0.00 0.00 33.47 30.83 2w94 s TRP 85 CO 0.00 -0.72 0.14 0.08 -2.66 0.00 0.00 176.95 173.80 2w94 s VAL 86 N -3.28 5.04 -0.16 -0.66 1.01 -1.24 -0.28 120.40 120.83 2w94 s VAL 86 Ca 0.08 0.07 0.20 0.00 0.00 0.00 0.00 61.98 62.33 2w94 s VAL 86 Cb -0.01 -3.37 -0.10 0.00 0.00 0.00 0.00 36.38 32.90 2w94 s VAL 86 CO -0.04 0.31 0.86 0.35 0.00 0.00 0.00 175.10 176.58 2w94 n THR 87 N 4.72 0.87 -3.54 3.92 -2.24 -0.11 -1.13 114.28 116.76 2w94 n THR 87 Ca -0.15 -0.62 -0.12 0.00 -2.27 0.00 0.00 64.05 60.89 2w94 n THR 87 Cb 0.52 -0.51 -0.04 0.00 -2.10 0.00 0.00 70.33 68.20 2w94 n THR 87 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2w94 s SER 88 N -5.50 -0.41 0.13 3.42 1.04 -1.13 -0.63 113.70 110.62 2w94 s SER 88 Ca -0.03 -0.05 -0.19 0.00 0.48 0.00 0.00 55.95 56.16 2w94 s SER 88 Cb 0.09 0.52 0.05 0.00 0.10 0.00 0.00 66.02 66.78 2w94 s SER 88 CO 0.81 -0.85 0.48 -0.72 0.98 0.00 0.00 173.24 173.94 2w94 s TYR 89 N -3.34 -0.34 0.19 5.02 1.13 -0.78 -0.92 117.35 118.31 2w94 s TYR 89 Ca -0.00 0.09 0.07 0.00 -1.41 0.00 0.00 57.07 55.81 2w94 s TYR 89 Cb 0.00 0.37 -0.04 0.00 -1.10 0.00 0.00 41.96 41.19 2w94 s TYR 89 CO -0.09 -0.75 0.07 -1.59 -2.51 0.00 0.00 175.55 170.68 2w94 s LYS 90 N -3.68 2.62 -0.14 -3.49 -2.85 -0.36 0.35 119.74 112.19 2w94 s LYS 90 Ca 0.02 -1.06 0.01 0.00 -1.00 0.00 0.00 55.97 53.93 2w94 s LYS 90 Cb 0.01 -2.46 -0.01 0.00 -2.06 0.00 0.00 37.83 33.31 2w94 s LYS 90 CO -0.12 0.45 -0.15 0.42 0.10 0.00 0.00 175.35 176.05 2w94 s ILE 91 N -1.86 2.76 0.19 3.79 -1.09 -1.26 -0.97 121.20 122.77 2w94 s ILE 91 Ca 0.30 -0.75 0.11 0.00 -2.23 0.00 0.00 60.65 58.08 2w94 s ILE 91 Cb -0.09 -2.15 -0.04 0.00 -1.58 0.00 0.00 42.46 38.60 2w94 s ILE 91 CO 0.21 0.52 -0.24 -0.13 -1.23 0.00 0.00 174.94 174.08 2w94 s ARG 92 N 0.54 1.53 0.14 2.79 0.52 -0.82 -0.83 118.95 122.81 2w94 s ARG 92 Ca -0.10 -1.52 -0.15 0.00 -0.52 0.00 0.00 55.73 53.44 2w94 s ARG 92 Cb -0.16 -1.85 0.03 0.00 0.52 0.00 0.00 34.95 33.48 2w94 s ARG 92 CO 0.04 0.40 0.39 1.52 0.02 0.00 0.00 175.30 177.67 2w94 s TYR 93 N -1.66 -0.10 -0.05 -0.53 -0.85 0.10 -0.30 117.35 113.97 2w94 s TYR 93 Ca 0.21 -0.24 -0.04 0.00 -0.52 0.00 0.00 57.07 56.48 2w94 s TYR 93 Cb -0.08 0.22 0.02 0.00 0.38 0.00 0.00 41.96 42.50 2w94 s TYR 93 CO 0.10 -0.72 0.12 0.45 -1.52 0.00 0.00 175.55 173.97 2w94 s SER 94 N -2.84 -0.12 -0.19 -0.18 0.15 -0.01 -0.84 113.70 109.68 2w94 s SER 94 Ca 0.05 0.24 -0.21 0.00 0.70 0.00 0.00 55.95 56.73 2w94 s SER 94 Cb 0.02 0.22 -0.21 0.00 -1.71 0.00 0.00 66.02 64.34 2w94 s SER 94 CO -0.09 -0.06 0.30 0.25 1.20 0.00 0.00 173.24 174.84 2w94 h LEU 95 N 6.22 0.04 -0.08 3.45 5.85 -1.77 0.15 115.31 129.17 2w94 h LEU 95 Ca -0.29 -0.61 0.00 0.00 0.84 0.00 0.00 57.88 57.83 2w94 h LEU 95 Cb 1.19 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2w94 h LEU 95 CO 0.43 1.47 -0.43 -0.90 -0.34 0.00 0.00 178.44 178.67 2w94 n ASP 96 N -4.37 0.56 -1.28 1.25 5.75 -1.26 -3.98 116.55 113.22 2w94 n ASP 96 Ca -0.29 -0.33 -0.16 0.00 -0.01 0.00 0.00 54.79 54.01 2w94 n ASP 96 Cb 0.69 0.19 -0.06 0.00 -1.03 0.00 0.00 41.12 40.91 2w94 n ASP 96 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2w94 n ASN 97 N -1.35 -4.84 0.00 -1.12 5.03 -1.26 -4.80 115.26 106.92 2w94 n ASN 97 Ca 0.07 0.33 -0.03 0.00 0.87 0.00 0.00 54.58 55.81 2w94 n ASN 97 Cb 0.34 -3.75 -0.01 0.00 -1.02 0.00 0.00 39.78 35.34 2w94 n ASN 97 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 2w94 n VAL 98 N -2.77 0.89 -3.88 2.41 0.31 -1.26 -5.04 118.33 109.00 2w94 n VAL 98 Ca -0.16 0.19 -0.36 0.00 -0.01 0.00 0.00 64.34 64.00 2w94 n VAL 98 Cb 0.53 -1.67 -0.08 0.00 -0.91 0.00 0.00 33.84 31.71 2w94 n VAL 98 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2w94 s SER 99 N -5.78 6.10 0.09 4.52 0.01 -1.26 -5.10 113.70 112.28 2w94 s SER 99 Ca -0.06 0.28 0.04 0.00 1.31 0.00 0.00 55.95 57.51 2w94 s SER 99 Cb 0.02 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 2w94 s SER 99 CO 0.09 0.27 0.07 0.26 0.41 0.00 0.00 173.24 174.34 2w94 s TRP 100 N -0.20 3.14 0.20 2.43 0.52 -1.26 -4.43 118.94 119.33 2w94 s TRP 100 Ca 0.10 0.04 0.05 0.00 0.02 0.00 0.00 56.10 56.32 2w94 s TRP 100 Cb -0.12 -1.59 -0.05 0.00 -1.15 0.00 0.00 33.47 30.57 2w94 s TRP 100 CO 0.01 0.51 -0.09 -0.06 0.02 0.00 0.00 176.95 177.34 2w94 s PHE 101 N -1.41 1.54 -0.10 -1.98 0.40 -0.02 -4.98 117.98 111.43 2w94 s PHE 101 Ca 0.29 -0.74 0.04 0.00 -0.60 0.00 0.00 56.93 55.92 2w94 s PHE 101 Cb -0.12 -0.80 -0.01 0.00 0.51 0.00 0.00 43.02 42.60 2w94 s PHE 101 CO 0.21 0.16 -0.22 -1.21 0.70 0.00 0.00 175.22 174.86 2w94 s GLU 102 N -3.74 2.99 0.28 0.44 2.02 -1.26 -0.72 118.70 118.72 2w94 s GLU 102 Ca 0.23 -0.85 -0.30 0.00 0.02 0.00 0.00 54.97 54.07 2w94 s GLU 102 Cb 0.03 -2.33 -0.11 0.00 0.10 0.00 0.00 34.13 31.81 2w94 s GLU 102 CO 0.06 0.24 1.56 -0.47 0.02 0.00 0.00 175.26 176.66 2w94 s TYR 103 N 0.21 2.81 -1.36 1.61 6.14 -0.01 -2.66 117.35 124.09 2w94 s TYR 103 Ca -0.14 0.84 -0.08 0.00 0.64 0.00 0.00 57.07 58.34 2w94 s TYR 103 Cb -0.17 -4.01 0.05 0.00 0.42 0.00 0.00 41.96 38.25 2w94 s TYR 103 CO 0.07 -3.38 0.52 0.54 0.64 0.00 0.00 175.55 173.94 2w94 n ARG 104 N 2.18 -3.86 -2.26 4.97 1.74 -1.26 -0.16 116.66 118.01 2w94 n ARG 104 Ca 0.08 0.61 -0.12 0.00 -0.77 0.00 0.00 57.85 57.65 2w94 n ARG 104 Cb 0.38 -5.37 -0.01 0.00 -1.02 0.00 0.00 32.46 26.44 2w94 n ARG 104 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2w94 n ASN 105 N -2.35 -3.66 0.00 0.55 5.15 -1.09 -1.54 115.26 112.32 2w94 n ASN 105 Ca -0.05 0.22 0.00 0.00 -0.60 0.00 0.00 54.58 54.15 2w94 n ASN 105 Cb 0.57 -3.17 0.00 0.00 -0.53 0.00 0.00 39.78 36.65 2w94 n ASN 105 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2w94 n GLY 106 N -0.70 0.57 3.75 8.20 0.00 0.77 -5.00 105.19 112.79 2w94 n GLY 106 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 2w94 n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w94 s ALA 107 N -2.16 2.24 0.37 4.61 0.00 -0.59 -4.79 121.76 121.45 2w94 s ALA 107 Ca 0.00 0.46 -0.26 0.00 0.00 0.00 0.00 51.96 52.17 2w94 s ALA 107 Cb 0.00 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.70 2w94 s ALA 107 CO 0.00 -1.70 1.10 0.00 0.00 0.00 0.00 175.76 175.15 2w94 s ALA 108 N -2.58 3.17 0.00 0.00 0.00 -1.26 -4.63 121.76 116.47 2w94 s ALA 108 Ca 0.65 0.82 0.01 0.00 0.00 0.00 0.00 51.96 53.45 2w94 s ALA 108 Cb -0.20 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 2w94 s ALA 108 CO 0.50 -0.30 0.02 0.08 0.00 0.00 0.00 175.76 176.06 2w94 s VAL 109 N -1.47 4.31 0.02 0.00 1.01 0.16 -4.94 120.40 119.49 2w94 s VAL 109 Ca 0.55 -0.57 -0.30 0.00 0.00 0.00 0.00 61.98 61.66 2w94 s VAL 109 Cb -0.27 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.12 2w94 s VAL 109 CO 0.34 0.36 1.24 -0.89 0.00 0.00 0.00 175.10 176.14 2w94 s THR 110 N -1.13 4.01 0.00 3.92 2.01 -1.26 -1.87 115.64 121.31 2w94 s THR 110 Ca 0.21 1.41 0.00 0.00 0.31 0.00 0.00 61.69 63.62 2w94 s THR 110 Cb -0.12 -3.90 0.00 0.00 0.01 0.00 0.00 72.50 68.49 2w94 s THR 110 CO 0.12 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.72 2w94 n GLY 111 N 3.34 1.63 3.84 4.40 0.00 0.19 -4.90 105.19 113.69 2w94 n GLY 111 Ca 0.10 -1.50 -0.26 0.00 0.00 0.00 0.00 46.02 44.36 2w94 n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2w94 s VAL 112 N 4.15 1.94 0.00 1.61 -7.23 -0.28 -4.85 120.40 115.73 2w94 s VAL 112 Ca 0.00 -1.58 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 2w94 s VAL 112 Cb 0.00 -2.52 0.00 0.00 0.56 0.00 0.00 36.38 34.42 2w94 s VAL 112 CO 0.00 0.00 0.39 0.35 -0.31 0.00 0.00 175.10 175.53 2w94 n THR 113 N -1.53 0.13 -3.43 5.32 -2.24 -1.26 -4.16 114.28 107.10 2w94 n THR 113 Ca -0.02 -0.17 -0.03 0.00 -2.27 0.00 0.00 64.05 61.55 2w94 n THR 113 Cb 0.64 1.28 0.00 0.00 -2.10 0.00 0.00 70.33 70.15 2w94 n THR 113 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2w94 n ASP 114 N -0.06 -0.59 -0.03 3.42 5.68 -1.26 -5.08 116.55 118.63 2w94 n ASP 114 Ca 0.00 -1.53 -0.16 0.00 -0.50 0.00 0.00 54.79 52.60 2w94 n ASP 114 Cb 0.33 1.02 -0.09 0.00 -1.14 0.00 0.00 41.12 41.25 2w94 n ASP 114 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 2w94 h ARG 115 N 0.00 0.47 0.00 0.11 3.08 -1.88 -3.31 114.38 112.86 2w94 h ARG 115 Ca -0.10 -0.39 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2w94 h ARG 115 Cb 0.38 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.51 2w94 h ARG 115 CO 0.12 1.03 -1.10 0.09 -1.07 0.00 0.00 179.97 179.05 2w94 n ASN 116 N -4.27 4.38 -4.63 7.04 3.02 -1.26 -2.02 115.26 117.52 2w94 n ASN 116 Ca -0.08 -0.01 -0.43 0.00 -0.03 0.00 0.00 54.58 54.03 2w94 n ASN 116 Cb 0.59 1.11 -0.02 0.00 -0.61 0.00 0.00 39.78 40.84 2w94 n ASN 116 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2w94 s THR 117 N -2.16 4.12 0.26 3.41 2.01 -1.26 -4.87 115.64 117.15 2w94 s THR 117 Ca -0.01 1.26 -0.30 0.00 0.31 0.00 0.00 61.69 62.95 2w94 s THR 117 Cb 0.02 -4.14 -0.09 0.00 0.01 0.00 0.00 72.50 68.29 2w94 s THR 117 CO 0.10 -0.48 1.24 -0.69 -0.69 0.00 0.00 174.62 174.10 2w94 s VAL 118 N 4.44 3.19 -0.27 3.82 1.01 -1.26 -4.71 120.40 126.63 2w94 s VAL 118 Ca 0.57 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.65 2w94 s VAL 118 Cb -0.17 -3.70 0.05 0.00 0.00 0.00 0.00 36.38 32.56 2w94 s VAL 118 CO 0.24 0.22 -0.07 -0.69 0.00 0.00 0.00 175.10 174.79 2w94 s VAL 119 N -0.61 2.55 0.11 2.92 1.01 -0.34 -4.99 120.40 121.06 2w94 s VAL 119 Ca 0.51 -1.40 -0.28 0.00 0.00 0.00 0.00 61.98 60.81 2w94 s VAL 119 Cb -0.36 -2.43 -0.06 0.00 0.00 0.00 0.00 36.38 33.53 2w94 s VAL 119 CO 0.43 0.02 0.87 0.20 0.00 0.00 0.00 175.10 176.62 2w94 s ASN 120 N 1.20 7.40 -0.28 3.32 0.01 -1.26 -2.19 114.94 123.14 2w94 s ASN 120 Ca -0.05 1.67 0.02 0.00 -0.71 0.00 0.00 52.86 53.79 2w94 s ASN 120 Cb -0.19 -2.54 0.08 0.00 0.41 0.00 0.00 41.25 39.01 2w94 s ASN 120 CO -0.04 0.02 -0.03 -2.28 -1.51 0.00 0.00 177.10 173.27 2w94 s HIS 121 N -0.30 3.09 -0.23 2.20 5.65 0.18 -4.99 115.29 120.89 2w94 s HIS 121 Ca 0.42 -2.36 -0.28 0.00 0.25 0.00 0.00 55.06 53.09 2w94 s HIS 121 Cb -0.23 -2.15 0.00 0.00 -1.18 0.00 0.00 32.58 29.03 2w94 s HIS 121 CO 0.27 -0.88 0.97 -0.06 -0.65 0.00 0.00 174.74 174.39 2w94 s PHE 122 N 1.15 3.34 0.32 3.88 0.40 -1.26 -1.22 117.98 124.60 2w94 s PHE 122 Ca -0.00 1.37 -0.29 0.00 -0.60 0.00 0.00 56.93 57.40 2w94 s PHE 122 Cb -0.19 -3.19 -0.12 0.00 0.51 0.00 0.00 43.02 40.03 2w94 s PHE 122 CO -0.08 -0.44 1.47 1.19 0.70 0.00 0.00 175.22 178.07 2w94 n PHE 123 N 6.12 2.69 -0.24 0.36 3.01 -0.62 -4.87 117.46 123.90 2w94 n PHE 123 Ca 0.10 0.40 0.03 0.00 1.01 0.00 0.00 57.45 58.99 2w94 n PHE 123 Cb 0.47 -2.52 0.13 0.00 -0.01 0.00 0.00 39.48 37.54 2w94 n PHE 123 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 2w94 h ASP 124 N 3.63 -0.43 -4.20 4.37 3.32 -1.95 -3.35 116.42 117.82 2w94 h ASP 124 Ca -0.48 0.19 -0.55 0.00 0.02 0.00 0.00 57.03 56.21 2w94 h ASP 124 Cb 1.25 0.36 -0.30 0.00 0.22 0.00 0.00 39.33 40.86 2w94 h ASP 124 CO 0.70 -0.19 -0.84 -0.89 -1.72 0.00 0.00 179.24 176.31 2w94 s THR 125 N -6.16 1.41 0.50 0.35 2.01 -1.26 -5.13 115.64 107.36 2w94 s THR 125 Ca -0.14 -0.74 -0.22 0.00 0.31 0.00 0.00 61.69 60.90 2w94 s THR 125 Cb 0.21 -1.18 -0.08 0.00 0.01 0.00 0.00 72.50 71.46 2w94 s THR 125 CO 0.75 0.40 1.00 -2.65 -0.69 0.00 0.00 174.62 173.42 2w94 n PRO 126 N 2.80 1.19 -4.31 4.92 -0.02 -1.26 -4.95 135.00 133.38 2w94 n PRO 126 Ca -0.16 0.44 -0.34 0.00 -2.02 0.00 0.00 63.50 61.42 2w94 n PRO 126 Cb 0.54 -2.12 -0.14 0.00 -0.02 0.00 0.00 33.50 31.76 2w94 n PRO 126 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2w94 s ILE 127 N -1.39 3.37 -0.31 4.25 1.01 -0.44 -4.90 121.20 122.79 2w94 s ILE 127 Ca 0.68 -0.52 -0.17 0.00 0.00 0.00 0.00 60.65 60.64 2w94 s ILE 127 Cb -0.48 -2.48 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 2w94 s ILE 127 CO 0.53 0.47 0.45 -0.60 0.00 0.00 0.00 174.94 175.79 2w94 s ARG 128 N 0.86 3.78 0.08 2.79 6.06 -1.26 -0.06 118.95 131.18 2w94 s ARG 128 Ca -0.02 -0.08 -0.23 0.00 -2.50 0.00 0.00 55.73 52.90 2w94 s ARG 128 Cb -0.15 -3.75 0.06 0.00 0.06 0.00 0.00 34.95 31.17 2w94 s ARG 128 CO 0.01 -0.49 0.55 0.00 -2.50 0.00 0.00 175.30 172.87 2w94 s ALA 129 N 2.24 -1.41 -0.23 6.12 0.00 -0.79 -4.42 121.76 123.26 2w94 s ALA 129 Ca 0.17 0.58 -0.16 0.00 0.00 0.00 0.00 51.96 52.55 2w94 s ALA 129 Cb -0.16 0.51 -0.17 0.00 0.00 0.00 0.00 23.12 23.30 2w94 s ALA 129 CO 0.12 -0.58 0.01 0.54 0.00 0.00 0.00 175.76 175.85 2w94 n ARG 130 N 0.18 0.60 -4.60 0.00 1.74 0.43 -0.99 116.66 114.01 2w94 n ARG 130 Ca -0.18 0.42 -0.29 0.00 -0.77 0.00 0.00 57.85 57.03 2w94 n ARG 130 Cb 0.62 -1.65 -0.14 0.00 -1.02 0.00 0.00 32.46 30.27 2w94 n ARG 130 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2w94 s SER 131 N -7.08 3.23 -0.05 0.55 0.01 -0.67 -0.78 113.70 108.91 2w94 s SER 131 Ca -0.32 -0.68 -0.10 0.00 1.31 0.00 0.00 55.95 56.16 2w94 s SER 131 Cb 0.09 -0.25 0.02 0.00 0.21 0.00 0.00 66.02 66.10 2w94 s SER 131 CO 0.57 0.21 0.25 -0.51 0.41 0.00 0.00 173.24 174.17 2w94 s ILE 132 N -0.96 0.03 -0.01 1.44 2.07 -0.43 -0.83 121.20 122.52 2w94 s ILE 132 Ca 0.13 -0.27 0.01 0.00 -1.41 0.00 0.00 60.65 59.11 2w94 s ILE 132 Cb -0.10 -0.44 -0.00 0.00 0.13 0.00 0.00 42.46 42.05 2w94 s ILE 132 CO 0.04 -0.15 -0.05 0.00 -1.91 0.00 0.00 174.94 172.88 2w94 s ALA 133 N -0.56 0.43 -0.27 1.50 0.00 0.59 -0.61 121.76 122.84 2w94 s ALA 133 Ca -0.07 -0.18 -0.14 0.00 0.00 0.00 0.00 51.96 51.58 2w94 s ALA 133 Cb -0.04 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 2w94 s ALA 133 CO 0.02 0.08 0.31 0.42 0.00 0.00 0.00 175.76 176.59 2w94 s ILE 134 N 0.02 5.23 -0.45 0.00 1.01 -0.45 -1.94 121.20 124.62 2w94 s ILE 134 Ca 0.00 0.44 -0.01 0.00 0.00 0.00 0.00 60.65 61.09 2w94 s ILE 134 Cb -0.04 -3.64 0.12 0.00 0.01 0.00 0.00 42.46 38.92 2w94 s ILE 134 CO -0.00 0.20 0.23 -1.00 0.00 0.00 0.00 174.94 174.37 2w94 s HIS 135 N 1.87 3.54 0.19 3.97 3.76 -0.14 -1.86 115.29 126.63 2w94 s HIS 135 Ca 0.12 -2.70 -0.33 0.00 -0.15 0.00 0.00 55.06 52.00 2w94 s HIS 135 Cb -0.16 -3.11 -0.14 0.00 1.11 0.00 0.00 32.58 30.29 2w94 s HIS 135 CO 0.10 -0.91 1.47 -2.30 -0.85 0.00 0.00 174.74 172.25 2w94 n PRO 136 N 4.10 2.01 -0.07 8.40 -0.02 -1.25 -1.22 135.00 146.94 2w94 n PRO 136 Ca 0.02 0.72 -0.09 0.00 -2.02 0.00 0.00 63.50 62.13 2w94 n PRO 136 Cb 0.40 -2.42 -0.07 0.00 -0.02 0.00 0.00 33.50 31.38 2w94 n PRO 136 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2w94 n LEU 137 N 2.73 2.30 -4.02 2.45 4.77 -0.10 -4.71 117.00 120.41 2w94 n LEU 137 Ca 0.14 -0.06 -0.09 0.00 -0.03 0.00 0.00 56.01 55.98 2w94 n LEU 137 Cb 0.29 -0.32 -0.11 0.00 -2.33 0.00 0.00 43.42 40.96 2w94 n LEU 137 CO 0.63 0.63 -0.36 0.42 -1.33 0.00 0.00 177.39 177.38 2w94 s THR 138 N -2.28 0.17 0.13 -5.08 -4.23 -1.10 -4.90 115.64 98.34 2w94 s THR 138 Ca -0.16 -1.21 -0.15 0.00 -1.18 0.00 0.00 61.69 58.99 2w94 s THR 138 Cb 0.05 -0.69 0.03 0.00 1.34 0.00 0.00 72.50 73.23 2w94 s THR 138 CO 0.36 -0.66 0.39 -1.66 -0.54 0.00 0.00 174.62 172.51 2w94 s TRP 139 N -2.26 -0.14 -0.27 3.99 -2.14 -1.26 -0.94 118.94 115.93 2w94 s TRP 139 Ca -0.08 -0.20 -0.06 0.00 2.66 0.00 0.00 56.10 58.42 2w94 s TRP 139 Cb -0.04 0.23 -0.00 0.00 -3.10 0.00 0.00 33.47 30.55 2w94 s TRP 139 CO -0.04 -0.71 0.04 1.21 -2.66 0.00 0.00 176.95 174.80 2w94 s ASN 140 N -2.82 4.90 0.00 -2.66 2.47 0.62 -4.82 114.94 112.63 2w94 s ASN 140 Ca 0.04 -0.53 0.00 0.00 0.42 0.00 0.00 52.86 52.80 2w94 s ASN 140 Cb 0.02 -1.85 0.00 0.00 -1.45 0.00 0.00 41.25 37.97 2w94 s ASN 140 CO -0.11 -0.11 0.00 0.61 -3.72 0.00 0.00 177.10 173.77 2w94 n GLY 141 N 4.85 1.89 3.47 1.21 0.00 -1.26 -1.75 105.19 113.59 2w94 n GLY 141 Ca -0.16 -0.21 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 2w94 n GLY 141 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2w94 s HIS 142 N 0.00 -0.47 -0.86 1.61 2.46 -1.26 -5.04 115.29 111.73 2w94 s HIS 142 Ca 0.00 0.26 -0.25 0.00 0.47 0.00 0.00 55.06 55.55 2w94 s HIS 142 Cb 0.00 0.56 0.00 0.00 -0.13 0.00 0.00 32.58 33.02 2w94 s HIS 142 CO 0.00 -0.79 1.64 0.42 -2.47 0.00 0.00 174.74 173.54 2w94 s ILE 143 N -3.59 3.64 -0.02 0.89 1.01 -1.26 -3.87 121.20 117.99 2w94 s ILE 143 Ca 0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 60.65 60.42 2w94 s ILE 143 Cb -0.01 -4.52 0.02 0.00 0.01 0.00 0.00 42.46 37.96 2w94 s ILE 143 CO -0.11 -1.44 0.03 -0.44 0.00 0.00 0.00 174.94 172.98 2w94 s SER 144 N 6.23 0.02 0.15 3.58 0.01 -1.26 -2.29 113.70 120.15 2w94 s SER 144 Ca 0.55 0.05 -0.20 0.00 1.31 0.00 0.00 55.95 57.66 2w94 s SER 144 Cb -0.06 -0.01 0.05 0.00 0.21 0.00 0.00 66.02 66.21 2w94 s SER 144 CO 0.03 -0.08 0.52 -1.48 0.41 0.00 0.00 173.24 172.64 2w94 s LEU 145 N 0.65 -0.15 0.18 2.44 0.05 -0.13 -3.73 118.68 118.00 2w94 s LEU 145 Ca -0.05 -0.18 0.11 0.00 0.05 0.00 0.00 54.13 54.05 2w94 s LEU 145 Cb -0.08 2.28 -0.04 0.00 -2.05 0.00 0.00 46.19 46.30 2w94 s LEU 145 CO -0.02 -0.94 -0.22 -0.13 -0.55 0.00 0.00 176.35 174.48 2w94 s ARG 146 N -3.79 1.44 0.28 1.48 0.52 -0.50 -1.03 118.95 117.35 2w94 s ARG 146 Ca 0.03 -1.48 -0.12 0.00 -0.52 0.00 0.00 55.73 53.64 2w94 s ARG 146 Cb -0.00 -1.70 0.00 0.00 0.52 0.00 0.00 34.95 33.78 2w94 s ARG 146 CO -0.11 0.36 0.53 0.00 0.02 0.00 0.00 175.30 176.10 2w94 s GLU 148 N -3.70 0.76 -0.05 0.00 2.56 -0.72 -1.67 118.70 115.88 2w94 s GLU 148 Ca 0.22 -0.17 0.06 0.00 0.00 0.00 0.00 54.97 55.09 2w94 s GLU 148 Cb -0.01 0.34 -0.01 0.00 2.00 0.00 0.00 34.13 36.44 2w94 s GLU 148 CO 0.11 -0.22 -0.24 -0.06 -0.56 0.00 0.00 175.26 174.28 2w94 s PHE 149 N -1.51 2.43 -0.18 5.30 0.40 -1.26 -0.83 117.98 122.33 2w94 s PHE 149 Ca -0.12 -0.60 -0.02 0.00 -0.60 0.00 0.00 56.93 55.60 2w94 s PHE 149 Cb -0.04 -1.58 -0.00 0.00 0.51 0.00 0.00 43.02 41.91 2w94 s PHE 149 CO 0.04 -0.14 -0.11 0.71 0.70 0.00 0.00 175.22 176.43 2w94 s TYR 150 N -0.32 2.87 0.21 0.36 1.51 -0.13 -1.53 117.35 120.32 2w94 s TYR 150 Ca 0.01 -1.01 0.11 0.00 -1.01 0.00 0.00 57.07 55.18 2w94 s TYR 150 Cb -0.12 -1.98 -0.05 0.00 -0.11 0.00 0.00 41.96 39.70 2w94 s TYR 150 CO 0.02 -0.51 -0.23 0.95 -1.11 0.00 0.00 175.55 174.68 2w94 s THR 151 N 1.09 2.35 0.59 -0.71 -4.23 -0.37 -0.89 115.64 113.47 2w94 s THR 151 Ca 0.00 -2.13 -0.20 0.00 -1.18 0.00 0.00 61.69 58.19 2w94 s THR 151 Cb -0.15 -2.16 -0.03 0.00 1.34 0.00 0.00 72.50 71.51 2w94 s THR 151 CO -0.03 -0.21 1.31 -1.10 -0.54 0.00 0.00 174.62 174.06 2w94 s GLN 152 N -2.91 2.91 0.42 3.99 -1.52 -0.76 -0.46 119.66 121.32 2w94 s GLN 152 Ca 0.23 2.11 -0.24 0.00 -1.95 0.00 0.00 55.36 55.51 2w94 s GLN 152 Cb -0.07 -2.06 -0.11 0.00 -0.22 0.00 0.00 33.01 30.55 2w94 s GLN 152 CO 0.11 -1.34 0.90 -2.30 -0.25 0.00 0.00 175.29 172.41 2w94 n PRO 153 N -1.42 1.13 -3.97 2.91 -0.02 -1.26 -4.72 135.00 127.65 2w94 n PRO 153 Ca 0.13 0.41 -0.25 0.00 -2.02 0.00 0.00 63.50 61.77 2w94 n PRO 153 Cb 0.47 -1.89 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 2w94 n PRO 153 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2w94 s VAL 154 N -1.31 5.19 0.06 -1.45 -7.23 -1.26 -5.00 120.40 109.39 2w94 s VAL 154 Ca 0.63 -0.82 0.08 0.00 -1.81 0.00 0.00 61.98 60.07 2w94 s VAL 154 Cb -0.58 -3.71 -0.03 0.00 0.56 0.00 0.00 36.38 32.63 2w94 s VAL 154 CO 0.57 -0.15 -0.22 -1.10 -0.31 0.00 0.00 175.10 173.89 2w94 s GLN 155 N -3.39 1.39 -0.09 4.82 1.11 -1.26 -5.10 119.66 117.14 2w94 s GLN 155 Ca 0.34 -1.01 0.02 0.00 0.01 0.00 0.00 55.36 54.72 2w94 s GLN 155 Cb -0.10 -1.55 0.01 0.00 -1.01 0.00 0.00 33.01 30.36 2w94 s GLN 155 CO 0.28 0.39 -0.14 0.45 0.01 0.00 0.00 175.29 176.28 2w94 s SER 156 N -1.33 2.19 0.11 5.90 0.15 -1.26 -5.02 113.70 114.45 2w94 s SER 156 Ca 0.08 -0.37 0.10 0.00 0.70 0.00 0.00 55.95 56.46 2w94 s SER 156 Cb -0.09 -0.98 -0.04 0.00 -1.71 0.00 0.00 66.02 63.20 2w94 s SER 156 CO 0.02 0.01 -0.25 -0.94 1.20 0.00 0.00 173.24 173.29 2w94 s SER 157 N 0.92 3.42 -0.12 5.45 1.04 -1.26 -0.16 113.70 122.99 2w94 s SER 157 Ca -0.09 -0.68 0.02 0.00 0.48 0.00 0.00 55.95 55.67 2w94 s SER 157 Cb -0.15 -0.30 0.01 0.00 0.10 0.00 0.00 66.02 65.68 2w94 s SER 157 CO 0.00 0.19 -0.16 -0.69 0.98 0.00 0.00 173.24 173.57 2w94 s VAL 158 N -1.04 1.56 -0.03 5.02 1.01 -0.35 -4.99 120.40 121.59 2w94 s VAL 158 Ca 0.14 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.52 2w94 s VAL 158 Cb -0.10 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 2w94 s VAL 158 CO 0.06 0.45 -0.24 -0.89 0.00 0.00 0.00 175.10 174.49 2w94 s THR 159 N 1.01 2.22 -0.10 3.92 2.01 -1.26 -1.41 115.64 122.03 2w94 s THR 159 Ca -0.06 -1.04 0.03 0.00 0.31 0.00 0.00 61.69 60.93 2w94 s THR 159 Cb -0.15 -1.79 0.01 0.00 0.01 0.00 0.00 72.50 70.58 2w94 s THR 159 CO -0.02 0.58 -0.18 -1.10 -0.69 0.00 0.00 174.62 173.21 2w94 s GLN 160 N -0.54 2.43 -0.15 4.92 -0.21 0.45 -5.00 119.66 121.56 2w94 s GLN 160 Ca 0.08 -0.65 -0.12 0.00 0.02 0.00 0.00 55.36 54.68 2w94 s GLN 160 Cb -0.11 -1.95 -0.05 0.00 1.00 0.00 0.00 33.01 31.90 2w94 s GLN 160 CO 0.00 0.04 0.24 0.08 -2.12 0.00 0.00 175.29 173.53 2w94 s VAL 161 N 0.68 5.34 -0.06 1.09 1.01 -1.26 -1.42 120.40 125.77 2w94 s VAL 161 Ca -0.13 0.44 0.05 0.00 0.00 0.00 0.00 61.98 62.35 2w94 s VAL 161 Cb -0.16 -3.56 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 2w94 s VAL 161 CO 0.03 0.46 -0.23 -0.83 0.00 0.00 0.00 175.10 174.53 2w94 s GLY 162 N 0.05 1.20 -0.04 4.51 0.00 -0.61 -5.01 107.32 107.42 2w94 s GLY 162 Ca 0.15 -0.94 -0.01 0.00 0.00 0.00 0.00 44.72 43.93 2w94 s GLY 162 CO 0.03 -0.53 0.02 0.00 0.00 0.00 0.00 173.10 172.63 2w94 s ALA 163 N -0.04 3.37 -0.74 3.20 0.00 -1.26 -0.65 121.76 125.63 2w94 s ALA 163 Ca -0.05 -0.87 -0.03 0.00 0.00 0.00 0.00 51.96 51.01 2w94 s ALA 163 Cb -0.14 -1.47 0.00 0.00 0.00 0.00 0.00 23.12 21.52 2w94 s ALA 163 CO 0.04 0.63 0.64 -0.25 0.00 0.00 0.00 175.76 176.82 2w94 n ASP 164 N 1.67 -3.48 -4.70 0.00 8.00 -1.05 -4.97 116.55 112.02 2w94 n ASP 164 Ca -0.16 -0.33 -0.42 0.00 0.71 0.00 0.00 54.79 54.59 2w94 n ASP 164 Cb 0.53 -3.13 -0.03 0.00 -0.02 0.00 0.00 41.12 38.47 2w94 n ASP 164 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2w94 s ILE 165 N -3.19 3.50 0.01 0.53 -1.09 0.23 -4.86 121.20 116.32 2w94 s ILE 165 Ca 0.20 1.01 0.04 0.00 -2.23 0.00 0.00 60.65 59.67 2w94 s ILE 165 Cb -0.09 -3.65 -0.01 0.00 -1.58 0.00 0.00 42.46 37.13 2w94 s ILE 165 CO 0.42 0.05 -0.12 -0.47 -1.23 0.00 0.00 174.94 173.59 2w94 s TYR 166 N 1.65 1.06 0.41 3.97 5.04 -1.26 -1.27 117.35 126.95 2w94 s TYR 166 Ca 0.64 -0.25 0.11 0.00 -2.44 0.00 0.00 57.07 55.13 2w94 s TYR 166 Cb -0.34 -0.67 0.87 0.00 0.35 0.00 0.00 41.96 42.17 2w94 s TYR 166 CO 0.29 -0.01 1.96 1.79 -1.34 0.00 0.00 175.55 178.25 2w94 h THR 167 N 4.75 1.14 0.00 4.34 1.35 -1.62 -3.49 112.91 119.40 2w94 h THR 167 Ca -0.34 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.91 2w94 h THR 167 Cb 1.17 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 2w94 h THR 167 CO 0.48 0.19 0.00 0.61 -0.25 0.00 0.00 175.52 176.55 2w94 n GLY 168 N -1.03 2.49 3.62 5.82 0.00 -1.26 -4.83 105.19 110.00 2w94 n GLY 168 Ca -0.01 -1.59 -0.43 0.00 0.00 0.00 0.00 46.02 43.99 2w94 n GLY 168 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2w94 n ASP 169 N 0.00 1.69 -4.06 1.61 8.00 -1.26 -3.72 116.55 118.81 2w94 n ASP 169 Ca 0.00 1.15 -0.35 0.00 0.71 0.00 0.00 54.79 56.30 2w94 n ASP 169 Cb 0.00 -1.36 -0.02 0.00 -0.02 0.00 0.00 41.12 39.72 2w94 n ASP 169 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2w94 n ASN 170 N 0.93 -2.02 -4.08 -2.24 5.15 -1.01 -4.92 115.26 107.06 2w94 n ASN 170 Ca 0.08 -1.18 -0.30 0.00 -0.60 0.00 0.00 54.58 52.58 2w94 n ASN 170 Cb 0.35 -2.23 0.21 0.00 -0.53 0.00 0.00 39.78 37.57 2w94 n ASN 170 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2w94 n ALA 172 N -4.28 1.89 0.42 0.00 0.00 -1.26 -0.68 120.51 116.60 2w94 n ALA 172 Ca 0.13 -0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.59 2w94 n ALA 172 Cb 0.59 -1.30 0.42 0.00 0.00 0.00 0.00 19.45 19.17 2w94 n ALA 172 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2w94 n LEU 173 N -1.42 0.41 -0.73 0.00 4.77 -1.26 -3.63 117.00 115.14 2w94 n LEU 173 Ca 0.06 0.60 0.08 0.00 -0.03 0.00 0.00 56.01 56.73 2w94 n LEU 173 Cb 0.19 -0.55 0.25 0.00 -2.33 0.00 0.00 43.42 40.97 2w94 n LEU 173 CO 0.16 -0.46 0.70 -3.20 -1.33 0.00 0.00 177.39 173.26 2w94 n ASN 174 N -1.96 2.14 -4.09 -1.43 5.15 0.14 -1.12 115.26 114.09 2w94 n ASN 174 Ca 0.02 -1.91 -0.10 0.00 -0.60 0.00 0.00 54.58 52.00 2w94 n ASN 174 Cb 0.20 -0.22 -0.09 0.00 -0.53 0.00 0.00 39.78 39.14 2w94 n ASN 174 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2w94 s THR 175 N -1.56 0.05 0.00 -0.44 -1.32 -1.24 -4.74 115.64 106.40 2w94 s THR 175 Ca 0.30 -1.71 0.00 0.00 -1.21 0.00 0.00 61.69 59.07 2w94 s THR 175 Cb 0.16 -2.11 0.00 0.00 -1.51 0.00 0.00 72.50 69.04 2w94 s THR 175 CO 0.22 -0.25 0.00 0.61 -2.21 0.00 0.00 174.62 172.99 2w94 n GLY 176 N -0.21 -1.71 3.57 6.08 0.00 -1.26 -5.00 105.19 106.67 2w94 n GLY 176 Ca -0.04 -1.33 -0.09 0.00 0.00 0.00 0.00 46.02 44.56 2w94 n GLY 176 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w94 s SER 177 N -4.00 -0.24 0.00 1.61 1.04 -1.26 -4.83 113.70 106.01 2w94 s SER 177 Ca 0.00 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 55.88 2w94 s SER 177 Cb 0.00 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.72 2w94 s SER 177 CO 0.00 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.73 2w94 n GLY 178 N -0.36 -2.15 3.68 7.32 0.00 0.39 -4.83 105.19 109.25 2w94 n GLY 178 Ca -0.08 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 2w94 n GLY 178 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2w94 s LYS 179 N -0.21 4.15 0.01 1.61 1.02 -1.26 -4.01 119.74 121.05 2w94 s LYS 179 Ca 0.00 2.55 0.01 0.00 0.02 0.00 0.00 55.97 58.54 2w94 s LYS 179 Cb 0.00 -3.72 -0.01 0.00 -0.52 0.00 0.00 37.83 33.58 2w94 s LYS 179 CO 0.00 -0.85 -0.04 1.03 -0.92 0.00 0.00 175.35 174.57 2w94 s ARG 180 N 3.10 0.30 0.08 1.68 0.52 -0.88 -5.01 118.95 118.75 2w94 s ARG 180 Ca 0.81 -0.39 0.01 0.00 -0.52 0.00 0.00 55.73 55.64 2w94 s ARG 180 Cb -0.44 -0.11 -0.04 0.00 0.52 0.00 0.00 34.95 34.88 2w94 s ARG 180 CO 0.37 0.02 -0.06 -1.83 0.02 0.00 0.00 175.30 173.81 2w94 s GLU 181 N -0.83 0.76 -0.11 3.54 -1.05 -1.26 -2.01 118.70 117.74 2w94 s GLU 181 Ca -0.07 -1.25 -0.00 0.00 -0.15 0.00 0.00 54.97 53.50 2w94 s GLU 181 Cb -0.06 -0.14 0.02 0.00 -0.44 0.00 0.00 34.13 33.52 2w94 s GLU 181 CO -0.00 -0.03 -0.08 0.08 0.95 0.00 0.00 175.26 176.18 2w94 s VAL 182 N -3.44 1.02 -0.21 1.83 1.01 -0.05 -4.80 120.40 115.77 2w94 s VAL 182 Ca 0.09 -0.29 -0.07 0.00 0.00 0.00 0.00 61.98 61.71 2w94 s VAL 182 Cb 0.04 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 2w94 s VAL 182 CO -0.05 0.37 0.05 -0.69 0.00 0.00 0.00 175.10 174.78 2w94 s VAL 183 N 1.66 4.45 -0.23 2.92 1.01 -1.26 -1.35 120.40 127.59 2w94 s VAL 183 Ca 0.04 -0.14 0.02 0.00 0.00 0.00 0.00 61.98 61.90 2w94 s VAL 183 Cb -0.13 -3.03 0.05 0.00 0.00 0.00 0.00 36.38 33.27 2w94 s VAL 183 CO -0.08 0.41 -0.12 -0.69 0.00 0.00 0.00 175.10 174.62 2w94 s VAL 184 N 0.96 2.00 0.26 2.92 1.01 0.15 -4.95 120.40 122.75 2w94 s VAL 184 Ca 0.03 -1.37 -0.30 0.00 0.00 0.00 0.00 61.98 60.35 2w94 s VAL 184 Cb -0.14 -2.07 -0.10 0.00 0.00 0.00 0.00 36.38 34.08 2w94 s VAL 184 CO 0.03 0.10 1.37 -2.84 0.00 0.00 0.00 175.10 173.75 2w94 s PRO 185 N 1.21 4.33 -0.08 2.72 0.02 -1.26 -0.77 135.00 141.17 2w94 s PRO 185 Ca -0.05 2.21 0.03 0.00 0.02 0.00 0.00 61.00 63.22 2w94 s PRO 185 Cb -0.18 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.22 2w94 s PRO 185 CO -0.07 -0.31 -0.19 0.08 -0.33 0.00 0.00 177.00 176.19 2w94 s VAL 186 N -0.30 1.62 -0.15 3.83 1.01 0.18 -4.88 120.40 121.70 2w94 s VAL 186 Ca 0.56 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 2w94 s VAL 186 Cb -0.40 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.55 2w94 s VAL 186 CO 0.45 0.46 -0.10 -0.75 0.00 0.00 0.00 175.10 175.15 2w94 s LYS 187 N 0.40 3.40 0.54 2.72 2.20 -1.26 -1.12 119.74 126.63 2w94 s LYS 187 Ca -0.15 -0.66 -0.21 0.00 -0.36 0.00 0.00 55.97 54.59 2w94 s LYS 187 Cb -0.16 -2.75 -0.05 0.00 -1.51 0.00 0.00 37.83 33.36 2w94 s LYS 187 CO 0.06 0.11 1.28 -0.06 -0.36 0.00 0.00 175.35 176.38 2w94 s PHE 188 N 0.64 2.43 0.31 4.03 0.08 0.64 -4.91 117.98 121.20 2w94 s PHE 188 Ca -0.06 1.45 0.04 0.00 0.12 0.00 0.00 56.93 58.48 2w94 s PHE 188 Cb -0.15 -3.63 0.65 0.00 -0.57 0.00 0.00 43.02 39.31 2w94 s PHE 188 CO 0.03 -2.44 1.86 0.37 -0.10 0.00 0.00 175.22 174.93 2w94 h GLN 189 N 1.43 0.86 -4.13 0.44 4.15 -1.97 -3.43 115.11 112.46 2w94 h GLN 189 Ca -0.50 -0.05 -0.16 0.00 0.77 0.00 0.00 58.65 58.71 2w94 h GLN 189 Cb 1.29 -0.19 -0.18 0.00 0.21 0.00 0.00 27.48 28.60 2w94 h GLN 189 CO 0.57 0.57 -0.69 -0.59 -1.93 0.00 0.00 178.83 176.76 2w94 s PHE 190 N -5.85 0.40 0.12 3.99 -0.12 -1.26 -5.14 117.98 110.12 2w94 s PHE 190 Ca -0.11 -0.76 -0.30 0.00 -0.05 0.00 0.00 56.93 55.71 2w94 s PHE 190 Cb 0.22 -0.29 -0.06 0.00 -0.63 0.00 0.00 43.02 42.25 2w94 s PHE 190 CO 0.80 -0.26 1.14 -2.00 -0.05 0.00 0.00 175.22 174.85 2w94 s GLU 191 N -2.52 4.52 0.52 1.99 2.12 -1.26 -4.89 118.70 119.18 2w94 s GLU 191 Ca -0.06 1.72 -0.19 0.00 0.36 0.00 0.00 54.97 56.80 2w94 s GLU 191 Cb -0.02 -3.32 -0.07 0.00 0.26 0.00 0.00 34.13 30.98 2w94 s GLU 191 CO -0.05 -0.08 1.06 -0.06 -0.54 0.00 0.00 175.26 175.59 2w94 s PHE 192 N 0.40 2.94 0.24 5.30 0.08 -0.57 -4.99 117.98 121.38 2w94 s PHE 192 Ca 0.54 1.56 0.01 0.00 0.12 0.00 0.00 56.93 59.16 2w94 s PHE 192 Cb -0.29 -3.09 0.28 0.00 -0.57 0.00 0.00 43.02 39.35 2w94 s PHE 192 CO 0.32 -1.00 1.61 0.00 -0.10 0.00 0.00 175.22 176.05 2w94 h ALA 193 N 1.28 0.90 -2.24 5.36 0.00 -1.95 -3.46 119.26 119.14 2w94 h ALA 193 Ca -0.49 -0.46 -0.39 0.00 0.00 0.00 0.00 54.91 53.57 2w94 h ALA 193 Cb 1.23 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.78 2w94 h ALA 193 CO 0.58 0.65 -0.60 0.95 0.00 0.00 0.00 179.25 180.83 2w94 s THR 194 N -4.12 0.65 0.05 0.00 -4.23 -1.26 -5.12 115.64 101.61 2w94 s THR 194 Ca -0.06 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.14 2w94 s THR 194 Cb 0.12 -2.64 -0.07 0.00 1.34 0.00 0.00 72.50 71.26 2w94 s THR 194 CO 0.81 0.00 1.49 -0.22 -0.54 0.00 0.00 174.62 176.16 2w94 s LEU 195 N -3.37 4.34 0.52 4.79 2.96 -1.26 -4.81 118.68 121.86 2w94 s LEU 195 Ca 0.37 2.29 -0.07 0.00 -0.22 0.00 0.00 54.13 56.50 2w94 s LEU 195 Cb 0.07 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.16 2w94 s LEU 195 CO 0.15 -0.77 0.86 -2.16 -1.32 0.00 0.00 176.35 173.10 2w94 s PRO 196 N 2.22 3.52 -0.08 0.98 0.04 -1.26 -4.60 135.00 135.82 2w94 s PRO 196 Ca 0.68 0.33 -0.05 0.00 0.04 0.00 0.00 61.00 61.99 2w94 s PRO 196 Cb -0.36 -2.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.85 2w94 s PRO 196 CO 0.29 -0.33 0.15 0.15 0.04 0.00 0.00 177.00 177.30 2w94 s LYS 197 N -4.87 3.42 -0.16 4.56 1.02 -0.14 -4.90 119.74 118.67 2w94 s LYS 197 Ca 0.50 -0.21 0.02 0.00 0.02 0.00 0.00 55.97 56.30 2w94 s LYS 197 Cb -0.10 -3.14 0.02 0.00 -0.52 0.00 0.00 37.83 34.08 2w94 s LYS 197 CO 0.47 0.74 -0.20 0.08 -0.92 0.00 0.00 175.35 175.52 2w94 s VAL 198 N -1.12 2.01 -0.04 3.17 1.01 -1.26 -1.46 120.40 122.71 2w94 s VAL 198 Ca 0.19 -0.93 -0.16 0.00 0.00 0.00 0.00 61.98 61.07 2w94 s VAL 198 Cb -0.12 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 2w94 s VAL 198 CO 0.09 0.54 0.45 0.00 0.00 0.00 0.00 175.10 176.17 2w94 s ALA 199 N 1.06 3.60 -0.19 5.51 0.00 0.38 -4.92 121.76 127.21 2w94 s ALA 199 Ca -0.01 -0.19 -0.04 0.00 0.00 0.00 0.00 51.96 51.72 2w94 s ALA 199 Cb -0.14 -2.51 0.08 0.00 0.00 0.00 0.00 23.12 20.55 2w94 s ALA 199 CO -0.07 0.28 0.18 -1.17 0.00 0.00 0.00 175.76 174.97 2w94 s LEU 200 N -0.40 0.05 0.09 0.00 2.96 -1.26 -1.31 118.68 118.81 2w94 s LEU 200 Ca 0.25 -0.36 0.03 0.00 -0.22 0.00 0.00 54.13 53.82 2w94 s LEU 200 Cb -0.16 0.17 -0.04 0.00 0.50 0.00 0.00 46.19 46.66 2w94 s LEU 200 CO 0.12 -0.34 -0.08 0.20 -1.32 0.00 0.00 176.35 174.94 2w94 s ASN 201 N 2.26 1.22 0.27 3.68 0.01 -0.74 -4.81 114.94 116.83 2w94 s ASN 201 Ca 0.05 -0.87 -0.29 0.00 -0.71 0.00 0.00 52.86 51.03 2w94 s ASN 201 Cb -0.16 0.05 -0.10 0.00 0.41 0.00 0.00 41.25 41.46 2w94 s ASN 201 CO -0.11 -0.36 1.23 -0.36 -1.51 0.00 0.00 177.10 175.99 2w94 s PHE 202 N -2.89 3.30 0.00 2.20 0.40 -1.26 -1.41 117.98 118.32 2w94 s PHE 202 Ca 0.07 1.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.87 2w94 s PHE 202 Cb 0.00 -3.51 0.00 0.00 0.51 0.00 0.00 43.02 40.02 2w94 s PHE 202 CO -0.02 -1.36 0.01 -0.40 0.70 0.00 0.00 175.22 174.15 2w94 n ASP 203 N 1.46 0.03 -3.68 1.36 5.75 -0.47 -4.85 116.55 116.15 2w94 n ASP 203 Ca 0.01 -0.43 -0.09 0.00 -0.01 0.00 0.00 54.79 54.27 2w94 n ASP 203 Cb 0.43 0.80 -0.10 0.00 -1.03 0.00 0.00 41.12 41.23 2w94 n ASP 203 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 2w94 s GLN 204 N -0.80 0.45 -0.06 0.11 0.74 -1.14 -4.98 119.66 113.98 2w94 s GLN 204 Ca 0.00 0.92 0.01 0.00 0.05 0.00 0.00 55.36 56.35 2w94 s GLN 204 Cb 0.00 0.08 0.02 0.00 1.10 0.00 0.00 33.01 34.21 2w94 s GLN 204 CO 0.00 -0.17 -0.07 0.42 -0.55 0.00 0.00 175.29 174.92 2w94 s ILE 205 N 1.65 0.82 -0.32 -2.34 1.01 -1.26 -1.29 121.20 119.46 2w94 s ILE 205 Ca -0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 60.65 60.29 2w94 s ILE 205 Cb -0.08 -0.81 0.11 0.00 0.01 0.00 0.00 42.46 41.69 2w94 s ILE 205 CO -0.14 0.30 0.15 -0.62 0.00 0.00 0.00 174.94 174.62 2w94 s ASP 206 N 1.02 3.56 0.09 3.58 -1.08 -0.89 -5.04 116.67 117.91 2w94 s ASP 206 Ca -0.09 -1.72 -0.15 0.00 -0.52 0.00 0.00 52.55 50.08 2w94 s ASP 206 Cb -0.14 -0.57 0.03 0.00 -1.46 0.00 0.00 42.92 40.77 2w94 s ASP 206 CO -0.00 -0.39 0.35 0.00 0.52 0.00 0.00 175.17 175.65 2w94 s THR 208 N -3.28 4.25 0.73 0.00 2.01 -0.14 -4.97 115.64 114.24 2w94 s THR 208 Ca -0.00 -0.25 -0.11 0.00 0.31 0.00 0.00 61.69 61.63 2w94 s THR 208 Cb 0.01 -2.83 0.03 0.00 0.01 0.00 0.00 72.50 69.73 2w94 s THR 208 CO -0.08 0.55 1.08 1.51 -0.69 0.00 0.00 174.62 176.99 2w94 s ASP 209 N -0.30 4.85 -0.17 3.53 1.47 -1.26 -3.93 116.67 120.87 2w94 s ASP 209 Ca 0.06 1.79 -0.00 0.00 1.18 0.00 0.00 52.55 55.58 2w94 s ASP 209 Cb -0.12 -2.52 0.04 0.00 -0.34 0.00 0.00 42.92 39.98 2w94 s ASP 209 CO 0.02 -1.80 -0.06 0.00 0.68 0.00 0.00 175.17 174.01 2w94 s ALA 210 N -2.85 1.57 -1.40 2.11 0.00 -0.34 -4.73 121.76 116.11 2w94 s ALA 210 Ca 0.61 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 51.58 2w94 s ALA 210 Cb -0.17 -1.14 0.01 0.00 0.00 0.00 0.00 23.12 21.82 2w94 s ALA 210 CO 0.53 -0.78 0.32 2.41 0.00 0.00 0.00 175.76 178.25 2w94 n THR 211 N 4.84 -2.24 -0.83 0.00 -1.04 -1.26 -1.36 114.28 112.40 2w94 n THR 211 Ca -0.12 -0.56 0.00 0.00 -2.04 0.00 0.00 64.05 61.32 2w94 n THR 211 Cb 0.48 -1.92 0.00 0.00 -1.82 0.00 0.00 70.33 67.06 2w94 n THR 211 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2w94 n ASN 212 N -2.69 -0.47 -4.74 8.00 3.02 -1.26 -4.98 115.26 112.12 2w94 n ASN 212 Ca -0.25 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 53.94 2w94 n ASN 212 Cb 0.65 -1.03 -0.07 0.00 -0.61 0.00 0.00 39.78 38.72 2w94 n ASN 212 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2w94 s GLN 213 N -0.42 4.16 -0.10 3.52 2.00 -0.46 -5.01 119.66 123.34 2w94 s GLN 213 Ca 0.00 -0.08 -0.13 0.00 -2.00 0.00 0.00 55.36 53.14 2w94 s GLN 213 Cb 0.00 -3.40 -0.05 0.00 0.80 0.00 0.00 33.01 30.36 2w94 s GLN 213 CO 0.00 0.32 0.32 0.99 -0.50 0.00 0.00 175.29 176.41 2w94 s THR 214 N 0.28 5.24 -0.28 -0.34 2.01 -1.26 -1.19 115.64 120.09 2w94 s THR 214 Ca 0.12 0.61 -0.03 0.00 0.31 0.00 0.00 61.69 62.70 2w94 s THR 214 Cb -0.12 -3.63 0.10 0.00 0.01 0.00 0.00 72.50 68.86 2w94 s THR 214 CO 0.01 0.48 0.16 -0.13 -0.69 0.00 0.00 174.62 174.45 2w94 s ARG 215 N -0.25 0.21 -0.02 4.92 0.52 -1.26 -5.07 118.95 118.00 2w94 s ARG 215 Ca 0.19 -0.43 -0.04 0.00 -0.52 0.00 0.00 55.73 54.93 2w94 s ARG 215 Cb -0.14 -1.10 0.01 0.00 0.52 0.00 0.00 34.95 34.24 2w94 s ARG 215 CO 0.07 -1.00 0.10 0.96 0.02 0.00 0.00 175.30 175.45 2w94 s ILE 216 N 2.15 0.03 0.05 1.52 -4.36 -1.26 -4.47 121.20 114.85 2w94 s ILE 216 Ca 0.09 -0.23 -0.08 0.00 -0.26 0.00 0.00 60.65 60.17 2w94 s ILE 216 Cb -0.16 -0.22 -0.00 0.00 1.25 0.00 0.00 42.46 43.33 2w94 s ILE 216 CO -0.35 -0.13 0.15 -0.83 0.24 0.00 0.00 174.94 174.02 2w94 s GLY 217 N -0.39 0.11 -0.10 6.27 0.00 -0.35 -5.01 107.32 107.86 2w94 s GLY 217 Ca -0.05 -0.49 -0.06 0.00 0.00 0.00 0.00 44.72 44.13 2w94 s GLY 217 CO 0.00 -0.65 0.24 0.54 0.00 0.00 0.00 173.10 173.23 2w94 s VAL 218 N -2.92 -0.03 -0.16 1.40 0.11 -1.26 -0.29 120.40 117.26 2w94 s VAL 218 Ca -0.02 0.10 -0.14 0.00 -2.93 0.00 0.00 61.98 58.98 2w94 s VAL 218 Cb 0.01 -0.36 0.04 0.00 -1.53 0.00 0.00 36.38 34.54 2w94 s VAL 218 CO -0.06 0.04 0.41 -1.58 -3.33 0.00 0.00 175.10 170.58 2w94 s GLN 219 N 0.87 0.48 0.53 1.54 2.00 0.17 -4.93 119.66 120.32 2w94 s GLN 219 Ca -0.06 0.58 -0.19 0.00 -2.00 0.00 0.00 55.36 53.68 2w94 s GLN 219 Cb -0.07 0.23 -0.07 0.00 0.80 0.00 0.00 33.01 33.90 2w94 s GLN 219 CO -0.05 -0.06 1.09 -2.14 -0.50 0.00 0.00 175.29 173.63 2w94 s PRO 220 N 0.24 3.49 0.04 1.67 0.02 -1.26 -0.80 135.00 138.40 2w94 s PRO 220 Ca -0.00 1.50 0.01 0.00 0.02 0.00 0.00 61.00 62.52 2w94 s PRO 220 Cb -0.03 -2.04 -0.03 0.00 0.02 0.00 0.00 34.50 32.43 2w94 s PRO 220 CO 0.00 -0.71 -0.05 0.50 -0.33 0.00 0.00 177.00 176.42 2w94 s ARG 221 N -3.32 0.45 -1.35 5.54 3.52 -0.13 -4.90 118.95 118.76 2w94 s ARG 221 Ca 0.70 -0.79 -0.03 0.00 -0.13 0.00 0.00 55.73 55.47 2w94 s ARG 221 Cb -0.21 -0.00 0.02 0.00 -1.56 0.00 0.00 34.95 33.20 2w94 s ARG 221 CO 0.25 -0.03 0.81 0.09 -0.81 0.00 0.00 175.30 175.61 2w94 n ASN 222 N 1.22 -2.24 -4.70 -2.12 3.02 -1.26 -0.27 115.26 108.90 2w94 n ASN 222 Ca -0.21 -0.78 -0.42 0.00 -0.03 0.00 0.00 54.58 53.14 2w94 n ASN 222 Cb 0.56 -4.16 -0.03 0.00 -0.61 0.00 0.00 39.78 35.54 2w94 n ASN 222 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2w94 s ILE 223 N -3.55 2.78 0.43 2.41 1.01 -1.26 -4.34 121.20 118.68 2w94 s ILE 223 Ca 0.17 0.41 0.03 0.00 0.00 0.00 0.00 60.65 61.26 2w94 s ILE 223 Cb -0.08 -3.26 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 2w94 s ILE 223 CO 0.80 0.01 0.08 0.42 0.00 0.00 0.00 174.94 176.26 2w94 s THR 224 N 1.95 0.88 0.48 2.92 -4.23 0.11 -5.01 115.64 112.73 2w94 s THR 224 Ca 0.73 -2.00 0.39 0.00 -1.18 0.00 0.00 61.69 59.63 2w94 s THR 224 Cb -0.42 -2.35 0.41 0.00 1.34 0.00 0.00 72.50 71.48 2w94 s THR 224 CO 0.32 0.00 2.23 0.71 -0.54 0.00 0.00 174.62 177.34 2w94 h THR 225 N 1.67 0.08 0.00 3.99 1.35 -1.88 -3.26 112.91 114.87 2w94 h THR 225 Ca -0.39 -0.20 -0.21 0.00 -0.55 0.00 0.00 66.41 65.07 2w94 h THR 225 Cb 1.28 1.18 -0.04 0.00 -1.73 0.00 0.00 68.15 68.84 2w94 h THR 225 CO 0.64 0.01 -1.86 0.29 -0.25 0.00 0.00 175.52 174.35 2w94 n LYS 226 N -3.17 0.65 -3.33 4.72 5.02 -1.26 -1.51 118.16 119.28 2w94 n LYS 226 Ca -0.02 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 2w94 n LYS 226 Cb 0.15 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 2w94 n LYS 226 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2w94 n GLY 227 N 1.49 -0.78 3.83 0.72 0.00 -1.23 -0.26 105.19 108.96 2w94 n GLY 227 Ca -0.16 -0.82 -0.06 0.00 0.00 0.00 0.00 46.02 44.98 2w94 n GLY 227 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2w94 s PHE 228 N -3.00 -0.17 -0.27 1.61 -0.71 -0.28 -0.71 117.98 114.45 2w94 s PHE 228 Ca 0.00 -0.24 -0.11 0.00 -1.04 0.00 0.00 56.93 55.54 2w94 s PHE 228 Cb 0.00 0.69 -0.05 0.00 -1.21 0.00 0.00 43.02 42.45 2w94 s PHE 228 CO 0.00 -1.11 0.18 -0.51 -1.34 0.00 0.00 175.22 172.44 2w94 s ASP 229 N -2.93 6.02 -0.46 1.98 1.01 0.63 -0.65 116.67 122.28 2w94 s ASP 229 Ca 0.11 0.01 -0.25 0.00 0.71 0.00 0.00 52.55 53.14 2w94 s ASP 229 Cb -0.05 -2.11 0.03 0.00 1.01 0.00 0.00 42.92 41.80 2w94 s ASP 229 CO 0.06 -0.03 0.89 0.00 0.21 0.00 0.00 175.17 176.30 2w94 s VAL 231 N 3.64 4.73 0.13 0.00 1.01 0.02 -0.67 120.40 129.26 2w94 s VAL 231 Ca 0.35 -1.23 -0.23 0.00 0.00 0.00 0.00 61.98 60.87 2w94 s VAL 231 Cb -0.11 -3.85 -0.07 0.00 0.00 0.00 0.00 36.38 32.34 2w94 s VAL 231 CO 0.25 -0.54 0.70 -0.36 0.00 0.00 0.00 175.10 175.15 2w94 s PHE 232 N 1.53 3.87 0.07 5.22 0.08 -0.46 -0.66 117.98 127.64 2w94 s PHE 232 Ca 0.03 1.50 -0.14 0.00 0.12 0.00 0.00 56.93 58.44 2w94 s PHE 232 Cb -0.24 -2.66 0.02 0.00 -0.57 0.00 0.00 43.02 39.57 2w94 s PHE 232 CO 0.04 0.54 0.33 1.52 -0.10 0.00 0.00 175.22 177.56 2w94 s TYR 233 N -1.14 -0.12 0.32 0.36 -0.85 0.61 -0.87 117.35 115.66 2w94 s TYR 233 Ca 0.33 -0.08 0.06 0.00 -0.52 0.00 0.00 57.07 56.86 2w94 s TYR 233 Cb -0.22 0.14 -0.03 0.00 0.38 0.00 0.00 41.96 42.23 2w94 s TYR 233 CO 0.23 -0.57 0.28 -0.08 -1.52 0.00 0.00 175.55 173.90 2w94 s THR 234 N -3.02 0.00 0.30 -3.49 -1.32 -0.85 -1.22 115.64 106.05 2w94 s THR 234 Ca -0.02 -1.97 -0.06 0.00 -1.21 0.00 0.00 61.69 58.43 2w94 s THR 234 Cb 0.01 -2.51 0.03 0.00 -1.51 0.00 0.00 72.50 68.51 2w94 s THR 234 CO -0.06 0.00 0.51 -2.67 -2.21 0.00 0.00 174.62 170.19 2w94 n TRP 235 N -0.59 -1.66 -3.78 9.09 2.14 -1.26 -2.07 117.44 119.31 2w94 n TRP 235 Ca 0.07 -1.75 0.00 0.00 2.07 0.00 0.00 57.50 57.89 2w94 n TRP 235 Cb 0.62 0.59 0.00 0.00 -0.81 0.00 0.00 31.31 31.72 2w94 n TRP 235 CO 0.00 0.00 0.00 -1.71 2.07 0.00 0.00 177.69 178.05 2w94 n ASN 236 N -1.58 0.00 -0.86 -0.67 2.85 -1.26 -2.96 115.26 110.78 2w94 n ASN 236 Ca -0.03 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.56 2w94 n ASN 236 Cb 0.48 0.00 0.28 0.00 1.24 0.00 0.00 39.78 41.78 2w94 n ASN 236 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2w94 n GLU 237 N 10.18 2.14 -1.77 1.20 -0.58 -1.26 -0.46 120.64 130.09 2w94 n GLU 237 Ca 0.00 -1.70 -0.40 0.00 -0.42 0.00 0.00 57.16 54.64 2w94 n GLU 237 Cb 0.00 -1.46 0.01 0.00 -0.57 0.00 0.00 31.44 29.42 2w94 n GLU 237 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 2w94 s ASN 238 N -1.65 5.95 -0.21 1.62 -0.87 -1.16 -4.93 114.94 113.69 2w94 s ASN 238 Ca 0.35 2.99 -0.04 0.00 -1.57 0.00 0.00 52.86 54.59 2w94 s ASN 238 Cb 0.20 -2.66 -0.01 0.00 -0.02 0.00 0.00 41.25 38.76 2w94 s ASN 238 CO 0.30 -1.13 -0.04 -0.54 -2.57 0.00 0.00 177.10 173.12 2w94 s LYS 239 N -2.38 3.42 -0.18 -0.60 -0.14 -1.25 -4.80 119.74 113.80 2w94 s LYS 239 Ca 0.59 -0.61 -0.00 0.00 -1.36 0.00 0.00 55.97 54.59 2w94 s LYS 239 Cb -0.45 -3.01 0.01 0.00 -1.68 0.00 0.00 37.83 32.70 2w94 s LYS 239 CO 0.59 -0.15 -0.16 0.08 -0.76 0.00 0.00 175.35 174.95 2w94 s VAL 240 N 1.37 2.42 -0.06 3.17 1.01 -0.28 -0.96 120.40 127.07 2w94 s VAL 240 Ca 0.04 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 60.97 2w94 s VAL 240 Cb -0.14 -2.04 -0.18 0.00 0.00 0.00 0.00 36.38 34.01 2w94 s VAL 240 CO -0.02 0.51 0.95 0.22 0.00 0.00 0.00 175.10 176.76 2w94 h TYR 241 N 7.89 -0.11 -3.32 5.22 3.20 -1.40 -1.32 116.97 127.13 2w94 h TYR 241 Ca -0.43 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.38 2w94 h TYR 241 Cb 1.15 0.04 -0.14 0.00 1.54 0.00 0.00 36.73 39.32 2w94 h TYR 241 CO 0.50 0.42 -0.09 -1.54 -1.64 0.00 0.00 178.16 175.81 2w94 s SER 242 N -5.65 -0.24 -0.07 -2.11 1.04 -0.89 -1.33 113.70 104.46 2w94 s SER 242 Ca -0.14 -0.25 -0.07 0.00 0.48 0.00 0.00 55.95 55.97 2w94 s SER 242 Cb 0.00 0.46 0.02 0.00 0.10 0.00 0.00 66.02 66.60 2w94 s SER 242 CO 0.56 -0.80 0.19 -0.76 0.98 0.00 0.00 173.24 173.40 2w94 s LEU 243 N -2.61 1.28 -0.01 2.42 1.43 -1.26 -2.10 118.68 117.82 2w94 s LEU 243 Ca 0.01 0.34 0.05 0.00 -1.03 0.00 0.00 54.13 53.50 2w94 s LEU 243 Cb 0.01 0.67 -0.01 0.00 0.03 0.00 0.00 46.19 46.89 2w94 s LEU 243 CO -0.10 -0.10 -0.15 -0.60 0.23 0.00 0.00 176.35 175.63 2w94 s ARG 244 N -0.03 1.25 0.10 1.70 3.52 -0.41 -1.38 118.95 123.69 2w94 s ARG 244 Ca -0.01 -0.55 0.04 0.00 -0.13 0.00 0.00 55.73 55.08 2w94 s ARG 244 Cb -0.02 -1.21 -0.03 0.00 -1.56 0.00 0.00 34.95 32.13 2w94 s ARG 244 CO 0.00 0.33 -0.12 0.00 -0.81 0.00 0.00 175.30 174.71 2w94 s ALA 245 N -0.36 1.20 0.09 6.12 0.00 -0.40 -1.37 121.76 127.04 2w94 s ALA 245 Ca 0.06 -1.16 0.06 0.00 0.00 0.00 0.00 51.96 50.92 2w94 s ALA 245 Cb -0.06 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 2w94 s ALA 245 CO -0.01 0.04 -0.07 -0.51 0.00 0.00 0.00 175.76 175.21 2w94 s ASP 246 N -2.26 4.55 0.14 0.00 1.01 -0.50 -0.60 116.67 119.01 2w94 s ASP 246 Ca 0.04 -0.31 0.09 0.00 0.71 0.00 0.00 52.55 53.08 2w94 s ASP 246 Cb -0.05 -0.95 -0.04 0.00 1.01 0.00 0.00 42.92 42.89 2w94 s ASP 246 CO 0.01 0.19 -0.21 -0.72 0.21 0.00 0.00 175.17 174.65 2w94 s TYR 247 N -1.20 1.94 -0.16 4.23 1.13 0.18 -1.80 117.35 121.67 2w94 s TYR 247 Ca 0.22 -0.42 -0.01 0.00 -1.41 0.00 0.00 57.07 55.45 2w94 s TYR 247 Cb -0.11 -1.02 0.04 0.00 -1.10 0.00 0.00 41.96 39.77 2w94 s TYR 247 CO 0.14 0.30 -0.03 0.42 -2.51 0.00 0.00 175.55 173.87 2w94 s ILE 248 N -1.49 0.90 -0.14 -3.49 1.09 -0.43 -1.57 121.20 116.07 2w94 s ILE 248 Ca 0.12 -0.51 -0.01 0.00 -1.10 0.00 0.00 60.65 59.15 2w94 s ILE 248 Cb -0.08 -1.13 -0.02 0.00 -1.06 0.00 0.00 42.46 40.17 2w94 s ILE 248 CO 0.06 0.08 -0.11 0.00 -0.10 0.00 0.00 174.94 174.87 2w94 s ALA 249 N 1.72 2.71 -0.04 9.38 0.00 -0.51 -0.47 121.76 134.55 2w94 s ALA 249 Ca 0.01 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.11 2w94 s ALA 249 Cb -0.15 -1.30 0.01 0.00 0.00 0.00 0.00 23.12 21.68 2w94 s ALA 249 CO -0.07 0.23 -0.09 0.99 0.00 0.00 0.00 175.76 176.82 2w94 s THR 250 N 0.38 0.81 0.04 0.00 2.01 -0.54 -0.42 115.64 117.93 2w94 s THR 250 Ca -0.09 -0.33 0.06 0.00 0.31 0.00 0.00 61.69 61.65 2w94 s THR 250 Cb -0.15 -0.76 -0.03 0.00 0.01 0.00 0.00 72.50 71.56 2w94 s THR 250 CO 0.05 0.27 -0.15 0.00 -0.69 0.00 0.00 174.62 174.10 2w94 s ALA 251 N 0.54 2.70 -0.03 7.40 0.00 -0.50 -0.97 121.76 130.90 2w94 s ALA 251 Ca -0.09 -1.16 0.03 0.00 0.00 0.00 0.00 51.96 50.74 2w94 s ALA 251 Cb -0.13 -0.83 -0.03 0.00 0.00 0.00 0.00 23.12 22.14 2w94 s ALA 251 CO 0.01 0.58 -0.09 -0.51 0.00 0.00 0.00 175.76 175.76 2w94 s LEU 252 N -1.47 3.06 0.00 0.00 1.43 -1.26 -1.21 118.68 119.23 2w94 s LEU 252 Ca 0.15 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.13 2w94 s LEU 252 Cb -0.11 -1.71 0.00 0.00 0.03 0.00 0.00 46.19 44.40 2w94 s LEU 252 CO 0.06 0.32 0.00 -0.62 0.23 0.00 0.00 176.35 176.34