#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wvv n ALA 33 N 0.00 -2.23 -1.67 0.00 0.00 -1.26 -4.94 120.51 110.40 1wvv n ALA 33 Ca 0.00 -1.70 -0.44 0.00 0.00 0.00 0.00 53.44 51.30 1wvv n ALA 33 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 19.45 19.33 1wvv n ALA 33 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1wvv n THR 34 N -4.22 1.30 -1.66 0.00 -1.04 -1.26 -3.57 114.28 103.83 1wvv n THR 34 Ca 0.16 -0.33 -0.44 0.00 -2.04 0.00 0.00 64.05 61.40 1wvv n THR 34 Cb 0.58 -1.48 -0.02 0.00 -1.82 0.00 0.00 70.33 67.60 1wvv n THR 34 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wvv n ALA 35 N 1.37 0.82 -1.76 2.41 0.00 -1.26 -1.28 120.51 120.81 1wvv n ALA 35 Ca 0.09 0.40 -0.41 0.00 0.00 0.00 0.00 53.44 53.52 1wvv n ALA 35 Cb 0.33 -2.21 -0.00 0.00 0.00 0.00 0.00 19.45 17.56 1wvv n ALA 35 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1wvv n TRP 36 N 1.16 2.86 -5.15 0.00 -0.00 -0.24 -4.77 117.44 111.30 1wvv n TRP 36 Ca 0.10 0.44 -0.31 0.00 -0.00 0.00 0.00 57.50 57.72 1wvv n TRP 36 Cb 0.32 -2.52 -0.17 0.00 -0.00 0.00 0.00 31.31 28.94 1wvv n TRP 36 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1wvv s SER 37 N -0.07 2.93 0.57 5.87 0.15 -1.26 -5.02 113.70 116.87 1wvv s SER 37 Ca 0.55 -0.52 0.28 0.00 0.70 0.00 0.00 55.95 56.96 1wvv s SER 37 Cb -0.50 -1.28 1.68 0.00 -1.71 0.00 0.00 66.02 64.22 1wvv s SER 37 CO 0.61 0.15 2.20 0.77 1.20 0.00 0.00 173.24 178.18 1wvv h SER 38 N 6.67 0.00 0.62 5.45 4.64 -1.97 -3.04 113.55 125.92 1wvv h SER 38 Ca -0.22 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.83 1wvv h SER 38 Cb 1.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 1wvv h SER 38 CO 0.47 0.03 -1.34 -1.28 -0.87 0.00 0.00 176.83 173.84 1wvv h SER 39 N 0.00 0.29 -3.92 4.97 0.87 -1.97 -2.19 113.55 111.60 1wvv h SER 39 Ca -0.00 -0.36 -0.53 0.00 -1.23 0.00 0.00 61.79 59.67 1wvv h SER 39 Cb 0.08 -0.10 0.08 0.00 -0.44 0.00 0.00 62.40 62.03 1wvv h SER 39 CO 0.00 1.29 0.63 -0.44 -0.53 0.00 0.00 176.83 177.79 1wvv s SER 40 N -6.91 6.51 -0.10 6.23 0.01 -1.15 -4.82 113.70 113.46 1wvv s SER 40 Ca -0.05 2.69 -0.25 0.00 1.31 0.00 0.00 55.95 59.65 1wvv s SER 40 Cb 0.08 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 1wvv s SER 40 CO 0.85 -0.72 0.80 -0.69 0.41 0.00 0.00 173.24 173.90 1wvv s VAL 41 N -1.20 4.95 0.17 3.43 1.01 -1.26 -4.24 120.40 123.25 1wvv s VAL 41 Ca 0.53 1.62 0.09 0.00 0.00 0.00 0.00 61.98 64.22 1wvv s VAL 41 Cb -0.39 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 1wvv s VAL 41 CO 0.51 0.14 -0.10 -0.31 0.00 0.00 0.00 175.10 175.34 1wvv s TYR 42 N 1.42 2.64 0.21 5.22 2.02 0.27 -5.00 117.35 124.14 1wvv s TYR 42 Ca 0.40 -0.22 0.07 0.00 -0.37 0.00 0.00 57.07 56.96 1wvv s TYR 42 Cb -0.18 -1.31 -0.05 0.00 -0.40 0.00 0.00 41.96 40.03 1wvv s TYR 42 CO 0.17 0.49 -0.13 0.99 -1.57 0.00 0.00 175.55 175.51 1wvv s THR 43 N -1.61 1.66 -0.25 -0.71 2.01 -1.26 -1.08 115.64 114.39 1wvv s THR 43 Ca 0.24 -2.19 -0.43 0.00 0.31 0.00 0.00 61.69 59.63 1wvv s THR 43 Cb -0.09 -2.08 -0.19 0.00 0.01 0.00 0.00 72.50 70.15 1wvv s THR 43 CO 0.15 -0.57 1.44 -3.20 -0.69 0.00 0.00 174.62 171.75 1wvv n ASN 44 N -0.39 1.11 0.00 3.53 4.05 -1.26 -0.43 115.26 121.87 1wvv n ASN 44 Ca -0.08 1.15 0.00 0.00 0.45 0.00 0.00 54.58 56.11 1wvv n ASN 44 Cb 0.61 -0.97 0.00 0.00 1.23 0.00 0.00 39.78 40.65 1wvv n ASN 44 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1wvv n GLY 45 N 3.15 1.87 3.74 8.20 0.00 0.40 -4.97 105.19 117.58 1wvv n GLY 45 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 1wvv n GLY 45 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wvv s GLY 46 N -2.21 2.38 -0.09 -0.02 0.00 0.43 -4.73 107.32 103.08 1wvv s GLY 46 Ca 0.00 1.25 0.04 0.00 0.00 0.00 0.00 44.72 46.01 1wvv s GLY 46 CO 0.00 2.20 -0.22 -0.51 0.00 0.00 0.00 173.10 174.57 1wvv s THR 47 N 0.00 1.90 0.29 0.90 -4.23 -1.26 -0.14 115.64 113.10 1wvv s THR 47 Ca 0.58 -0.94 0.02 0.00 -1.18 0.00 0.00 61.69 60.18 1wvv s THR 47 Cb -0.40 -1.65 -0.06 0.00 1.34 0.00 0.00 72.50 71.74 1wvv s THR 47 CO 0.42 0.53 0.08 0.68 -0.54 0.00 0.00 174.62 175.79 1wvv s VAL 48 N 0.29 0.81 0.17 2.29 -7.23 -0.29 -4.46 120.40 111.99 1wvv s VAL 48 Ca -0.15 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.11 1wvv s VAL 48 Cb -0.17 -2.70 -0.04 0.00 0.56 0.00 0.00 36.38 34.03 1wvv s VAL 48 CO 0.07 0.00 -0.11 -0.94 -0.31 0.00 0.00 175.10 173.81 1wvv s SER 49 N -3.39 4.19 -0.30 4.85 1.04 -0.40 -0.93 113.70 118.76 1wvv s SER 49 Ca 0.37 -0.58 -0.14 0.00 0.48 0.00 0.00 55.95 56.08 1wvv s SER 49 Cb 0.08 -0.69 0.16 0.00 0.10 0.00 0.00 66.02 65.68 1wvv s SER 49 CO 0.14 0.11 0.94 -0.47 0.98 0.00 0.00 173.24 174.94 1wvv s TYR 50 N -1.64 -0.79 -1.32 5.02 6.14 -0.13 -1.07 117.35 123.55 1wvv s TYR 50 Ca 0.24 1.30 -0.01 0.00 0.64 0.00 0.00 57.07 59.24 1wvv s TYR 50 Cb -0.09 0.45 -0.00 0.00 0.42 0.00 0.00 41.96 42.74 1wvv s TYR 50 CO 0.14 -0.39 0.62 0.09 0.64 0.00 0.00 175.55 176.65 1wvv n ASN 51 N 5.08 -1.14 0.00 4.32 5.03 -1.26 -3.12 115.26 124.17 1wvv n ASN 51 Ca -0.09 -0.88 0.00 0.00 0.87 0.00 0.00 54.58 54.48 1wvv n ASN 51 Cb 0.52 -3.76 0.00 0.00 -1.02 0.00 0.00 39.78 35.52 1wvv n ASN 51 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1wvv n GLY 52 N -1.69 0.74 3.17 7.41 0.00 -1.26 -5.01 105.19 108.55 1wvv n GLY 52 Ca -0.29 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.53 1wvv n GLY 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wvv s ARG 53 N -0.02 0.92 0.36 1.61 0.52 -1.18 0.50 118.95 121.64 1wvv s ARG 53 Ca 0.00 -0.87 -0.10 0.00 -0.52 0.00 0.00 55.73 54.23 1wvv s ARG 53 Cb 0.00 -0.95 -0.07 0.00 0.52 0.00 0.00 34.95 34.46 1wvv s ARG 53 CO 0.00 0.22 0.71 -0.80 0.02 0.00 0.00 175.30 175.46 1wvv s ASN 54 N -1.44 6.56 -0.01 0.23 0.01 -0.05 -0.96 114.94 119.28 1wvv s ASN 54 Ca 0.01 1.07 -0.03 0.00 -0.71 0.00 0.00 52.86 53.20 1wvv s ASN 54 Cb -0.09 -2.29 -0.00 0.00 0.41 0.00 0.00 41.25 39.28 1wvv s ASN 54 CO 0.02 -0.31 0.06 -0.31 -1.51 0.00 0.00 177.10 175.05 1wvv s TYR 55 N -2.22 0.03 -0.12 2.20 1.51 -0.11 -0.59 117.35 118.06 1wvv s TYR 55 Ca 0.50 -0.05 0.03 0.00 -1.01 0.00 0.00 57.07 56.54 1wvv s TYR 55 Cb -0.10 -0.04 0.01 0.00 -0.11 0.00 0.00 41.96 41.71 1wvv s TYR 55 CO 0.28 -0.13 -0.23 0.99 -1.11 0.00 0.00 175.55 175.36 1wvv s THR 56 N -0.62 2.02 0.27 -0.71 2.01 -0.26 -1.14 115.64 117.20 1wvv s THR 56 Ca -0.07 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 60.66 1wvv s THR 56 Cb -0.04 -1.77 -0.09 0.00 0.01 0.00 0.00 72.50 70.60 1wvv s THR 56 CO 0.00 0.55 1.25 0.00 -0.69 0.00 0.00 174.62 175.72 1wvv s ALA 57 N 0.60 3.48 -0.15 7.40 0.00 0.80 -1.23 121.76 132.65 1wvv s ALA 57 Ca -0.13 1.10 0.22 0.00 0.00 0.00 0.00 51.96 53.15 1wvv s ALA 57 Cb -0.17 -3.44 -0.15 0.00 0.00 0.00 0.00 23.12 19.37 1wvv s ALA 57 CO 0.03 -0.47 0.80 1.63 0.00 0.00 0.00 175.76 177.76 1wvv n LYS 58 N 1.58 0.62 -3.11 0.00 5.02 0.27 -0.45 118.16 122.09 1wvv n LYS 58 Ca 0.02 -0.02 -0.06 0.00 -2.02 0.00 0.00 58.31 56.23 1wvv n LYS 58 Cb 0.43 -1.69 0.02 0.00 -0.02 0.00 0.00 35.03 33.77 1wvv n LYS 58 CO 0.00 0.00 0.00 -2.67 -0.52 0.00 0.00 177.40 174.21 1wvv n TRP 59 N -2.48 -1.83 -1.67 2.13 2.14 -1.26 -4.51 117.44 109.95 1wvv n TRP 59 Ca -0.02 -1.29 -0.46 0.00 2.07 0.00 0.00 57.50 57.81 1wvv n TRP 59 Cb 0.56 0.64 -0.04 0.00 -0.81 0.00 0.00 31.31 31.66 1wvv n TRP 59 CO 0.00 0.00 0.00 1.87 2.07 0.00 0.00 177.69 181.63 1wvv n TRP 60 N -0.43 2.29 -3.72 -2.67 -0.00 -1.26 -4.07 117.44 107.57 1wvv n TRP 60 Ca -0.05 0.29 -0.12 0.00 -0.00 0.00 0.00 57.50 57.61 1wvv n TRP 60 Cb 0.44 -2.53 -0.10 0.00 -0.00 0.00 0.00 31.31 29.11 1wvv n TRP 60 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 177.69 177.61 1wvv s THR 61 N 0.73 -0.01 -0.01 5.87 -1.32 -0.24 -5.00 115.64 115.66 1wvv s THR 61 Ca 0.77 0.04 0.02 0.00 -1.21 0.00 0.00 61.69 61.30 1wvv s THR 61 Cb -0.66 -0.58 -0.00 0.00 -1.51 0.00 0.00 72.50 69.75 1wvv s THR 61 CO 0.40 0.01 -0.07 -1.58 -2.21 0.00 0.00 174.62 171.18 1wvv s GLN 62 N 0.65 0.60 -1.38 7.08 0.74 -1.26 -0.56 119.66 125.53 1wvv s GLN 62 Ca -0.04 -0.24 -0.02 0.00 0.05 0.00 0.00 55.36 55.11 1wvv s GLN 62 Cb -0.05 -0.58 0.02 0.00 1.10 0.00 0.00 33.01 33.49 1wvv s GLN 62 CO -0.04 0.13 0.66 -1.71 -0.55 0.00 0.00 175.29 173.78 1wvv n ASN 63 N 3.03 -1.48 -3.84 6.67 4.05 -0.82 -4.99 115.26 117.88 1wvv n ASN 63 Ca -0.15 -0.87 -0.30 0.00 0.45 0.00 0.00 54.58 53.72 1wvv n ASN 63 Cb 0.57 -3.72 -0.16 0.00 1.23 0.00 0.00 39.78 37.70 1wvv n ASN 63 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1wvv s GLU 64 N -6.25 1.10 0.21 1.20 2.02 -1.26 -5.07 118.70 110.66 1wvv s GLU 64 Ca 0.11 -0.96 -0.31 0.00 0.02 0.00 0.00 54.97 53.83 1wvv s GLU 64 Cb -0.06 -2.35 -0.10 0.00 0.10 0.00 0.00 34.13 31.72 1wvv s GLU 64 CO 0.84 -0.76 1.46 1.03 0.02 0.00 0.00 175.26 177.85 1wvv s ARG 65 N 1.52 4.26 0.39 1.61 0.52 -1.26 -4.93 118.95 121.07 1wvv s ARG 65 Ca 0.02 2.28 -0.25 0.00 -0.52 0.00 0.00 55.73 57.26 1wvv s ARG 65 Cb -0.18 -3.14 -0.11 0.00 0.52 0.00 0.00 34.95 32.04 1wvv s ARG 65 CO -0.13 -0.46 1.01 -2.30 0.02 0.00 0.00 175.30 173.44 1wvv n PRO 66 N 2.94 1.37 0.00 3.54 -0.02 -1.26 -1.88 135.00 139.68 1wvv n PRO 66 Ca 0.09 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1wvv n PRO 66 Cb 0.40 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1wvv n PRO 66 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wvv n GLY 67 N 1.19 2.97 0.93 -1.23 0.00 -1.26 -4.80 105.19 103.00 1wvv n GLY 67 Ca 0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.23 1wvv n GLY 67 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wvv n THR 68 N -0.90 0.16 -3.74 2.61 -2.24 -0.79 -4.96 114.28 104.41 1wvv n THR 68 Ca 0.00 -0.53 -0.12 0.00 -2.27 0.00 0.00 64.05 61.12 1wvv n THR 68 Cb 0.00 1.15 -0.11 0.00 -2.10 0.00 0.00 70.33 69.27 1wvv n THR 68 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1wvv s SER 69 N -1.82 -0.37 0.47 3.42 0.15 -1.25 -4.95 113.70 109.35 1wvv s SER 69 Ca 0.33 0.69 0.33 0.00 0.70 0.00 0.00 55.95 58.00 1wvv s SER 69 Cb 0.21 0.66 1.45 0.00 -1.71 0.00 0.00 66.02 66.63 1wvv s SER 69 CO 0.31 -0.14 1.67 -0.78 1.20 0.00 0.00 173.24 175.50 1wvv h ASP 70 N 6.13 0.19 -0.02 5.45 1.82 -1.96 -2.60 116.42 125.43 1wvv h ASP 70 Ca -0.30 0.08 -0.07 0.00 -0.39 0.00 0.00 57.03 56.35 1wvv h ASP 70 Cb 1.18 0.06 -0.01 0.00 0.68 0.00 0.00 39.33 41.24 1wvv h ASP 70 CO 0.31 -0.07 -0.16 0.58 -1.61 0.00 0.00 179.24 178.29 1wvv h VAL 71 N 0.11 1.22 -3.59 2.25 2.07 -1.96 -3.40 116.25 112.94 1wvv h VAL 71 Ca 0.76 -0.99 -0.64 0.00 0.82 0.00 0.00 66.70 66.65 1wvv h VAL 71 Cb 2.56 1.24 -0.14 0.00 -1.52 0.00 0.00 31.29 33.43 1wvv h VAL 71 CO -0.25 0.31 0.17 0.26 0.02 0.00 0.00 177.57 178.09 1wvv s TRP 72 N -4.65 3.08 -0.19 1.57 0.52 -0.98 -0.56 118.94 117.72 1wvv s TRP 72 Ca -0.06 0.10 -0.27 0.00 0.02 0.00 0.00 56.10 55.89 1wvv s TRP 72 Cb 0.15 -3.34 -0.01 0.00 -1.15 0.00 0.00 33.47 29.12 1wvv s TRP 72 CO 0.76 -0.82 0.92 0.00 0.02 0.00 0.00 176.95 177.82 1wvv s ALA 73 N 2.87 3.56 0.11 0.98 0.00 -0.36 -4.72 121.76 124.21 1wvv s ALA 73 Ca 0.24 0.11 -0.31 0.00 0.00 0.00 0.00 51.96 52.00 1wvv s ALA 73 Cb -0.14 -3.36 -0.09 0.00 0.00 0.00 0.00 23.12 19.53 1wvv s ALA 73 CO 0.18 -0.79 1.61 0.34 0.00 0.00 0.00 175.76 177.10 1wvv s ASP 74 N 1.19 6.60 -0.09 0.00 -1.08 -1.26 -1.11 116.67 120.91 1wvv s ASP 74 Ca 0.41 2.55 0.14 0.00 -0.52 0.00 0.00 52.55 55.12 1wvv s ASP 74 Cb -0.16 -2.58 0.21 0.00 -1.46 0.00 0.00 42.92 38.93 1wvv s ASP 74 CO 0.11 -0.86 1.10 0.29 0.52 0.00 0.00 175.17 176.34 1wvv n LYS 75 N 4.82 1.70 0.00 4.34 4.76 0.25 -4.91 118.16 129.12 1wvv n LYS 75 Ca 0.15 -2.26 0.00 0.00 -2.87 0.00 0.00 58.31 53.33 1wvv n LYS 75 Cb 0.40 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 32.24 1wvv n LYS 75 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1wvv n GLY 76 N -1.16 2.02 3.73 0.72 0.00 -1.24 -4.72 105.19 104.54 1wvv n GLY 76 Ca 0.11 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 1wvv n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wvv n ALA 77 N 1.24 1.64 -2.77 4.61 0.00 -1.26 -0.87 120.51 123.10 1wvv n ALA 77 Ca 0.00 0.31 -0.16 0.00 0.00 0.00 0.00 53.44 53.59 1wvv n ALA 77 Cb 0.00 -2.31 -0.12 0.00 0.00 0.00 0.00 19.45 17.01 1wvv n ALA 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wvv n GLY 79 N 1.62 0.00 0.00 0.00 0.00 -1.26 -4.66 105.19 100.89 1wvv n GLY 79 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1wvv n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wvv n GLY 90 N 0.00 -0.79 3.71 -0.02 0.00 -1.26 -5.10 105.19 101.73 1wvv n GLY 90 Ca 0.00 -1.36 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 1wvv n GLY 90 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1wvv n PHE 91 N 0.24 2.64 0.37 1.61 7.35 -1.26 -4.91 117.46 123.50 1wvv n PHE 91 Ca 0.00 0.13 0.05 0.00 -0.76 0.00 0.00 57.45 56.87 1wvv n PHE 91 Cb 0.00 -2.63 0.23 0.00 0.35 0.00 0.00 39.48 37.43 1wvv n PHE 91 CO 0.00 0.00 0.00 1.33 -0.76 0.00 0.00 176.76 177.33 1wvv n VAL 92 N 3.53 1.26 -3.69 -2.13 0.24 -1.26 -4.31 118.33 111.98 1wvv n VAL 92 Ca 0.15 0.32 -0.38 0.00 -2.04 0.00 0.00 64.34 62.39 1wvv n VAL 92 Cb 0.34 -1.13 -0.12 0.00 -1.47 0.00 0.00 33.84 31.45 1wvv n VAL 92 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1wvv s VAL 93 N -2.99 4.51 0.66 3.34 1.01 -1.26 -4.98 120.40 120.69 1wvv s VAL 93 Ca 0.05 -0.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.62 1wvv s VAL 93 Cb 0.07 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 1wvv s VAL 93 CO 0.19 0.18 1.06 -0.94 0.00 0.00 0.00 175.10 175.59 1wvv s SER 94 N 1.62 5.86 0.29 3.32 1.04 -1.26 -4.85 113.70 119.73 1wvv s SER 94 Ca 0.05 1.33 0.01 0.00 0.48 0.00 0.00 55.95 57.82 1wvv s SER 94 Cb -0.16 -2.27 0.54 0.00 0.10 0.00 0.00 66.02 64.23 1wvv s SER 94 CO 0.05 -1.09 1.87 -0.08 0.98 0.00 0.00 173.24 174.97 1wvv h GLU 95 N -0.48 0.99 -0.50 4.02 4.81 -1.98 -0.70 114.58 120.74 1wvv h GLU 95 Ca -0.44 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 58.62 1wvv h GLU 95 Cb 1.22 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 1wvv h GLU 95 CO 0.62 0.65 -0.11 0.00 -0.73 0.00 0.00 179.01 179.45 1wvv h ALA 96 N 1.52 0.69 -0.50 2.92 0.00 -1.99 -1.84 119.26 120.06 1wvv h ALA 96 Ca 0.45 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1wvv h ALA 96 Cb 0.37 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1wvv h ALA 96 CO -0.21 0.59 0.26 1.96 0.00 0.00 0.00 179.25 181.86 1wvv h GLN 97 N 0.82 0.70 -0.54 0.00 4.20 -1.78 -1.06 115.11 117.45 1wvv h GLN 97 Ca 0.13 -0.09 0.08 0.00 0.06 0.00 0.00 58.65 58.83 1wvv h GLN 97 Cb 0.67 -0.13 -0.06 0.00 0.30 0.00 0.00 27.48 28.25 1wvv h GLN 97 CO 0.05 0.56 0.18 0.35 -0.67 0.00 0.00 178.83 179.30 1wvv h PHE 98 N 0.66 0.31 -0.27 2.96 3.57 -1.00 0.54 116.94 123.71 1wvv h PHE 98 Ca 0.17 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.62 1wvv h PHE 98 Cb 0.07 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1wvv h PHE 98 CO -0.01 0.08 -0.20 -0.91 -2.23 0.00 0.00 178.31 175.04 1wvv h ASN 99 N 0.35 0.49 -0.57 0.41 2.35 -1.03 -0.94 115.58 116.64 1wvv h ASN 99 Ca 0.27 -0.15 -0.06 0.00 -0.55 0.00 0.00 56.30 55.81 1wvv h ASN 99 Cb 0.31 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.52 1wvv h ASN 99 CO -0.28 0.70 0.15 1.56 -1.65 0.00 0.00 177.43 177.91 1wvv h GLN 100 N 0.45 0.95 -0.16 0.81 4.20 -0.26 -2.85 115.11 118.25 1wvv h GLN 100 Ca 0.07 -0.20 -0.17 0.00 0.06 0.00 0.00 58.65 58.41 1wvv h GLN 100 Cb 0.60 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1wvv h GLN 100 CO 0.04 0.84 -0.60 0.52 -0.67 0.00 0.00 178.83 178.97 1wvv h MET 101 N 0.91 0.53 -2.15 1.46 2.86 -0.44 -3.39 114.93 114.71 1wvv h MET 101 Ca 0.20 -0.36 -0.56 0.00 -2.06 0.00 0.00 59.70 56.92 1wvv h MET 101 Cb 0.32 0.05 -0.41 0.00 0.06 0.00 0.00 31.60 31.62 1wvv h MET 101 CO -0.00 0.97 -0.85 1.19 1.06 0.00 0.00 176.91 179.28 1wvv n PHE 102 N -3.93 2.29 0.24 -0.22 3.72 -0.40 -4.92 117.46 114.25 1wvv n PHE 102 Ca -0.04 -3.92 0.12 0.00 -0.05 0.00 0.00 57.45 53.56 1wvv n PHE 102 Cb 0.63 -0.46 0.58 0.00 -0.94 0.00 0.00 39.48 39.29 1wvv n PHE 102 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1wvv h PRO 103 N 3.36 0.00 -0.25 -1.08 0.13 -1.71 -3.12 132.00 129.34 1wvv h PRO 103 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1wvv h PRO 103 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1wvv h PRO 103 CO 0.68 0.16 0.00 0.09 -0.23 0.00 0.00 178.00 178.71 1wvv n ASN 104 N -3.41 3.81 -4.76 1.44 3.02 -1.26 -5.04 115.26 109.06 1wvv n ASN 104 Ca -0.00 -3.01 -0.36 0.00 -0.03 0.00 0.00 54.58 51.17 1wvv n ASN 104 Cb 0.35 -0.54 0.02 0.00 -0.61 0.00 0.00 39.78 39.00 1wvv n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wvv s ARG 105 N -2.81 3.23 0.26 3.52 1.70 -1.18 -4.36 118.95 119.32 1wvv s ARG 105 Ca 0.42 1.77 -0.30 0.00 -0.47 0.00 0.00 55.73 57.14 1wvv s ARG 105 Cb 0.34 -2.04 -0.11 0.00 -0.57 0.00 0.00 34.95 32.56 1wvv s ARG 105 CO 0.09 -0.98 1.61 1.21 -1.08 0.00 0.00 175.30 176.14 1wvv s ASN 106 N -1.59 6.41 0.63 -2.89 3.84 0.27 -4.87 114.94 116.74 1wvv s ASN 106 Ca 0.73 2.89 0.32 0.00 0.21 0.00 0.00 52.86 57.02 1wvv s ASN 106 Cb -0.28 -2.62 1.78 0.00 -0.55 0.00 0.00 41.25 39.57 1wvv s ASN 106 CO 0.32 -0.91 2.06 0.00 -2.79 0.00 0.00 177.10 175.79 1wvv h ALA 107 N 5.37 1.51 -0.90 1.71 0.00 -1.93 -2.20 119.26 122.81 1wvv h ALA 107 Ca -0.46 -0.00 0.23 0.00 0.00 0.00 0.00 54.91 54.67 1wvv h ALA 107 Cb 1.22 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.89 1wvv h ALA 107 CO 0.83 -0.30 0.38 0.35 0.00 0.00 0.00 179.25 180.51 1wvv h PHE 108 N 0.00 0.62 -1.60 0.00 3.57 -1.94 -3.35 116.94 114.24 1wvv h PHE 108 Ca 0.05 0.04 -0.62 0.00 3.53 0.00 0.00 57.97 60.97 1wvv h PHE 108 Cb 0.54 -0.13 -0.12 0.00 2.79 0.00 0.00 35.95 39.02 1wvv h PHE 108 CO 0.00 -0.08 1.26 0.71 -2.23 0.00 0.00 178.31 177.97 1wvv s TYR 109 N -5.88 2.66 0.30 0.41 2.02 -0.83 -4.66 117.35 111.37 1wvv s TYR 109 Ca -0.12 -0.90 -0.03 0.00 -0.37 0.00 0.00 57.07 55.65 1wvv s TYR 109 Cb 0.26 -4.57 -0.05 0.00 -0.40 0.00 0.00 41.96 37.20 1wvv s TYR 109 CO 0.78 -1.83 0.55 0.95 -1.57 0.00 0.00 175.55 174.42 1wvv s THR 110 N 4.44 5.05 0.20 -0.71 -4.23 -1.26 -4.97 115.64 114.16 1wvv s THR 110 Ca 0.41 -0.08 -0.09 0.00 -1.18 0.00 0.00 61.69 60.74 1wvv s THR 110 Cb -0.03 -3.76 0.13 0.00 1.34 0.00 0.00 72.50 70.18 1wvv s THR 110 CO -0.07 -0.38 1.78 0.22 -0.54 0.00 0.00 174.62 175.64 1wvv h TYR 111 N 1.47 1.08 -0.44 3.99 3.20 -1.94 -2.82 116.97 121.51 1wvv h TYR 111 Ca -0.48 -0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.29 1wvv h TYR 111 Cb 1.20 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 39.11 1wvv h TYR 111 CO 0.56 0.80 0.10 -0.22 -1.64 0.00 0.00 178.16 177.76 1wvv h LYS 112 N 1.04 0.65 -0.73 1.82 3.64 -1.99 -0.63 116.57 120.37 1wvv h LYS 112 Ca 0.25 -0.12 0.05 0.00 -1.27 0.00 0.00 60.65 59.56 1wvv h LYS 112 Cb 0.15 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.81 1wvv h LYS 112 CO -0.03 0.60 0.43 0.78 -2.27 0.00 0.00 179.45 178.97 1wvv h GLY 113 N 0.86 1.07 0.71 5.01 0.00 -1.83 0.19 103.07 109.09 1wvv h GLY 113 Ca 0.14 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 1wvv h GLY 113 CO -0.00 0.22 0.00 -2.00 0.00 0.00 0.00 176.54 174.76 1wvv h LEU 114 N 0.81 0.01 -1.09 3.11 5.85 -1.12 -2.13 115.31 120.75 1wvv h LEU 114 Ca 0.31 -0.30 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 1wvv h LEU 114 Cb 0.14 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1wvv h LEU 114 CO -0.16 0.30 0.02 0.71 -0.34 0.00 0.00 178.44 178.97 1wvv h THR 115 N -0.28 1.22 -0.59 1.05 1.35 -0.96 -1.30 112.91 113.39 1wvv h THR 115 Ca 0.00 -0.86 -0.01 0.00 -0.55 0.00 0.00 66.41 64.99 1wvv h THR 115 Cb 0.30 0.88 -0.03 0.00 -1.73 0.00 0.00 68.15 67.57 1wvv h THR 115 CO 0.00 0.30 0.35 0.44 -0.25 0.00 0.00 175.52 176.36 1wvv h ASP 116 N 0.63 0.71 0.83 5.36 3.32 -0.59 -2.81 116.42 123.87 1wvv h ASP 116 Ca 0.13 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 1wvv h ASP 116 Cb 0.36 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1wvv h ASP 116 CO 0.01 0.56 -0.24 0.00 -1.72 0.00 0.00 179.24 177.85 1wvv h ALA 117 N 1.56 1.05 -0.71 3.45 0.00 -0.54 -3.30 119.26 120.77 1wvv h ALA 117 Ca 0.21 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 55.00 1wvv h ALA 117 Cb -0.01 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1wvv h ALA 117 CO -0.04 0.30 0.47 -0.07 0.00 0.00 0.00 179.25 179.91 1wvv h LEU 118 N 0.00 0.54 -1.80 0.00 3.38 -1.18 -1.90 115.31 114.34 1wvv h LEU 118 Ca -0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1wvv h LEU 118 Cb 0.72 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1wvv h LEU 118 CO 0.03 0.32 0.00 0.77 0.09 0.00 0.00 178.44 179.65 1wvv h SER 119 N 0.60 0.00 0.52 -0.43 4.64 -1.76 -0.71 113.55 116.41 1wvv h SER 119 Ca 0.33 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.60 1wvv h SER 119 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 1wvv h SER 119 CO -0.11 0.00 -0.21 0.00 -0.87 0.00 0.00 176.83 175.64 1wvv h ALA 120 N 2.05 1.23 -2.28 5.18 0.00 -1.60 -3.36 119.26 120.47 1wvv h ALA 120 Ca 0.00 -0.19 -0.58 0.00 0.00 0.00 0.00 54.91 54.14 1wvv h ALA 120 Cb 0.26 -0.03 -0.39 0.00 0.00 0.00 0.00 17.79 17.63 1wvv h ALA 120 CO 0.00 0.26 -0.98 0.66 0.00 0.00 0.00 179.25 179.19 1wvv n TYR 121 N -3.67 -0.38 0.31 0.00 4.01 -0.27 -5.01 117.16 112.14 1wvv n TYR 121 Ca -0.01 -3.47 0.17 0.00 -0.16 0.00 0.00 57.90 54.43 1wvv n TYR 121 Cb 0.33 -0.00 1.00 0.00 -0.31 0.00 0.00 39.34 40.36 1wvv n TYR 121 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1wvv h PRO 122 N 5.06 0.00 0.00 -0.72 0.11 -1.71 -0.85 132.00 133.89 1wvv h PRO 122 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1wvv h PRO 122 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1wvv h PRO 122 CO 0.43 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.22 1wvv h ALA 123 N 2.00 1.00 -2.39 -0.75 0.00 -1.93 -3.42 119.26 113.77 1wvv h ALA 123 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 1wvv h ALA 123 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1wvv h ALA 123 CO 0.00 0.00 0.98 0.12 0.00 0.00 0.00 179.25 180.35 1wvv s PHE 124 N -3.22 2.44 -2.06 0.00 5.36 -0.33 -2.22 117.98 117.95 1wvv s PHE 124 Ca 0.08 0.42 0.00 0.00 -0.96 0.00 0.00 56.93 56.46 1wvv s PHE 124 Cb 0.08 -3.88 0.00 0.00 -0.34 0.00 0.00 43.02 38.88 1wvv s PHE 124 CO 0.62 -3.51 0.00 0.00 -1.46 0.00 0.00 175.22 170.87 1wvv n ALA 125 N 5.86 -0.37 -0.77 11.12 0.00 -1.26 -4.78 120.51 130.31 1wvv n ALA 125 Ca 0.15 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1wvv n ALA 125 Cb 0.42 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.85 1wvv n ALA 125 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1wvv n LYS 126 N -2.46 0.95 -4.97 0.00 4.76 -0.94 -4.73 118.16 110.78 1wvv n LYS 126 Ca -0.21 -0.91 -0.32 0.00 -2.87 0.00 0.00 58.31 54.00 1wvv n LYS 126 Cb 0.66 -0.69 -0.15 0.00 -1.84 0.00 0.00 35.03 33.02 1wvv n LYS 126 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1wvv s THR 127 N -0.40 2.67 0.00 -0.18 2.01 -1.13 -4.96 115.64 113.65 1wvv s THR 127 Ca 0.01 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.20 1wvv s THR 127 Cb 0.01 -2.07 0.00 0.00 0.01 0.00 0.00 72.50 70.45 1wvv s THR 127 CO 0.00 0.55 0.00 0.61 -0.69 0.00 0.00 174.62 175.09 1wvv n GLY 128 N 3.32 -1.78 3.74 4.40 0.00 -1.26 -4.05 105.19 109.56 1wvv n GLY 128 Ca -0.18 -1.71 -0.30 0.00 0.00 0.00 0.00 46.02 43.82 1wvv n GLY 128 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wvv s SER 129 N -4.00 3.86 0.35 1.61 1.04 -1.26 -4.72 113.70 110.58 1wvv s SER 129 Ca 0.00 1.56 0.06 0.00 0.48 0.00 0.00 55.95 58.06 1wvv s SER 129 Cb 0.00 -2.26 0.74 0.00 0.10 0.00 0.00 66.02 64.60 1wvv s SER 129 CO 0.00 -2.40 1.93 0.44 0.98 0.00 0.00 173.24 174.19 1wvv h ASP 130 N -1.39 0.68 -0.56 7.02 3.32 -1.99 0.84 116.42 124.35 1wvv h ASP 130 Ca -0.48 0.01 0.03 0.00 0.02 0.00 0.00 57.03 56.62 1wvv h ASP 130 Cb 1.27 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.65 1wvv h ASP 130 CO 0.54 0.42 0.33 -0.08 -1.72 0.00 0.00 179.24 178.73 1wvv h GLU 131 N 0.76 0.62 -0.32 3.56 4.81 -1.97 -1.33 114.58 120.73 1wvv h GLU 131 Ca 0.36 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.41 1wvv h GLU 131 Cb 0.38 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 1wvv h GLU 131 CO -0.13 0.41 -0.35 0.28 -0.73 0.00 0.00 179.01 178.48 1wvv h VAL 132 N 0.64 1.29 -0.46 0.32 2.07 -1.60 -1.39 116.25 117.12 1wvv h VAL 132 Ca 0.23 -1.53 0.05 0.00 0.82 0.00 0.00 66.70 66.27 1wvv h VAL 132 Cb 0.06 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.32 1wvv h VAL 132 CO -0.12 0.50 0.21 0.11 0.02 0.00 0.00 177.57 178.29 1wvv h LYS 133 N 0.57 0.40 -0.39 1.57 1.57 -0.68 0.77 116.57 120.38 1wvv h LYS 133 Ca 0.05 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 1wvv h LYS 133 Cb 0.94 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 1wvv h LYS 133 CO 0.09 0.27 -0.22 0.87 -0.57 0.00 0.00 179.45 179.88 1wvv h LYS 134 N 0.42 0.76 -0.57 3.15 1.57 -1.22 -1.96 116.57 118.72 1wvv h LYS 134 Ca 0.21 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.61 1wvv h LYS 134 Cb 0.14 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1wvv h LYS 134 CO -0.17 0.92 0.07 -0.09 -0.57 0.00 0.00 179.45 179.61 1wvv h ARG 135 N 0.67 0.96 -0.21 3.15 2.43 -0.72 -1.01 114.38 119.64 1wvv h ARG 135 Ca 0.09 -0.27 -0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1wvv h ARG 135 Cb 0.73 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 1wvv h ARG 135 CO 0.06 0.93 0.13 1.49 -1.51 0.00 0.00 179.97 181.06 1wvv h GLU 136 N 0.85 0.29 -0.36 0.20 4.81 -0.68 -0.81 114.58 118.88 1wvv h GLU 136 Ca 0.17 -0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.42 1wvv h GLU 136 Cb 0.45 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 1wvv h GLU 136 CO 0.02 0.24 0.11 0.00 -0.73 0.00 0.00 179.01 178.65 1wvv h ALA 137 N 1.03 0.41 -0.77 2.92 0.00 -1.27 0.37 119.26 121.94 1wvv h ALA 137 Ca 0.08 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1wvv h ALA 137 Cb 0.03 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1wvv h ALA 137 CO -0.01 -0.29 0.50 0.00 0.00 0.00 0.00 179.25 179.44 1wvv h ALA 138 N 1.25 1.01 -0.33 0.00 0.00 -1.08 -0.77 119.26 119.33 1wvv h ALA 138 Ca 0.17 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1wvv h ALA 138 Cb 0.16 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1wvv h ALA 138 CO -0.19 0.31 -0.05 0.00 0.00 0.00 0.00 179.25 179.33 1wvv h ALA 139 N 1.32 0.46 0.37 0.00 0.00 -0.32 -0.21 119.26 120.87 1wvv h ALA 139 Ca 0.31 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1wvv h ALA 139 Cb -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1wvv h ALA 139 CO -0.10 0.26 -0.18 0.35 0.00 0.00 0.00 179.25 179.58 1wvv h PHE 140 N 0.41 -0.46 -0.32 0.00 3.57 -0.82 -2.39 116.94 116.94 1wvv h PHE 140 Ca 0.09 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1wvv h PHE 140 Cb 0.53 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.40 1wvv h PHE 140 CO 0.05 -0.25 -0.04 -0.07 -2.23 0.00 0.00 178.31 175.76 1wvv h LEU 141 N -0.55 0.48 -0.48 0.59 3.38 -1.09 -1.23 115.31 116.42 1wvv h LEU 141 Ca -0.05 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.70 1wvv h LEU 141 Cb 0.41 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1wvv h LEU 141 CO 0.08 0.58 -0.16 0.00 0.09 0.00 0.00 178.44 179.03 1wvv h ALA 142 N 1.48 0.66 -0.35 1.53 0.00 -1.01 0.31 119.26 121.89 1wvv h ALA 142 Ca 0.10 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.50 1wvv h ALA 142 Cb 0.38 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1wvv h ALA 142 CO 0.02 0.61 -0.36 -0.91 0.00 0.00 0.00 179.25 178.60 1wvv h ASN 143 N 0.80 0.84 -0.32 0.00 2.35 -1.19 -0.61 115.58 117.46 1wvv h ASN 143 Ca 0.11 -0.37 0.03 0.00 -0.55 0.00 0.00 56.30 55.52 1wvv h ASN 143 Cb 0.73 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.84 1wvv h ASN 143 CO 0.06 1.11 0.14 0.58 -1.65 0.00 0.00 177.43 177.67 1wvv h VAL 144 N 0.66 0.96 -0.64 2.81 2.07 -1.04 -1.35 116.25 119.72 1wvv h VAL 144 Ca 0.06 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.55 1wvv h VAL 144 Cb 0.91 0.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.26 1wvv h VAL 144 CO 0.08 0.06 0.33 -1.28 0.02 0.00 0.00 177.57 176.78 1wvv h SER 145 N 0.30 0.47 -0.90 0.57 0.87 -0.15 -2.01 113.55 112.70 1wvv h SER 145 Ca 0.14 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 1wvv h SER 145 Cb 0.07 -0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 61.94 1wvv h SER 145 CO -0.11 0.30 0.51 -0.74 -0.53 0.00 0.00 176.83 176.25 1wvv h HIS 146 N 0.61 1.22 0.00 2.24 6.17 -0.66 -0.68 115.15 124.05 1wvv h HIS 146 Ca 0.30 -0.02 -0.12 0.00 0.71 0.00 0.00 60.37 61.24 1wvv h HIS 146 Cb 0.23 -0.39 -0.02 0.00 2.52 0.00 0.00 27.41 29.75 1wvv h HIS 146 CO -0.10 0.83 -0.56 0.37 0.71 0.00 0.00 177.93 179.18 1wvv h GLN 147 N 1.25 0.00 -0.02 5.26 5.75 -0.68 -3.35 115.11 123.32 1wvv h GLN 147 Ca 0.32 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.82 1wvv h GLN 147 Cb 0.00 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1wvv h GLN 147 CO -0.05 0.56 0.00 0.25 -2.65 0.00 0.00 178.83 176.94 1wvv n THR 148 N -3.70 0.53 -2.82 2.39 -2.24 -0.81 -4.93 114.28 102.70 1wvv n THR 148 Ca -0.01 -0.77 -0.10 0.00 -2.27 0.00 0.00 64.05 60.91 1wvv n THR 148 Cb 0.60 0.74 0.04 0.00 -2.10 0.00 0.00 70.33 69.62 1wvv n THR 148 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wvv n GLY 149 N -0.18 0.09 3.28 3.38 0.00 -0.45 -1.52 105.19 109.79 1wvv n GLY 149 Ca 0.01 -0.19 -0.20 0.00 0.00 0.00 0.00 46.02 45.63 1wvv n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wvv n GLY 150 N -1.13 -0.32 2.43 -0.02 0.00 -0.39 -2.76 105.19 103.00 1wvv n GLY 150 Ca -0.10 0.12 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 1wvv n GLY 150 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wvv n LEU 151 N -4.32 -1.28 -0.00 0.99 4.77 -1.21 -3.49 117.00 112.45 1wvv n LEU 151 Ca -0.00 0.31 -0.12 0.00 -0.03 0.00 0.00 56.01 56.17 1wvv n LEU 151 Cb 0.56 -2.32 0.01 0.00 -2.33 0.00 0.00 43.42 39.34 1wvv n LEU 151 CO 0.55 -0.69 0.41 0.15 -1.33 0.00 0.00 177.39 176.48 1wvv h PHE 152 N 0.00 0.78 -3.00 -1.77 3.04 -1.21 0.79 116.94 115.58 1wvv h PHE 152 Ca -0.34 -0.30 -0.63 0.00 3.98 0.00 0.00 57.97 60.68 1wvv h PHE 152 Cb 1.09 -0.14 -0.10 0.00 2.56 0.00 0.00 35.95 39.37 1wvv h PHE 152 CO 0.44 1.07 -0.48 0.71 -2.02 0.00 0.00 178.31 178.04 1wvv s TYR 153 N -3.88 3.50 -0.17 0.41 2.02 -0.58 -4.17 117.35 114.48 1wvv s TYR 153 Ca -0.08 0.43 -0.03 0.00 -0.37 0.00 0.00 57.07 57.02 1wvv s TYR 153 Cb 0.10 -2.07 -0.23 0.00 -0.40 0.00 0.00 41.96 39.36 1wvv s TYR 153 CO 0.86 0.48 0.15 -0.89 -1.57 0.00 0.00 175.55 174.58 1wvv n ILE 154 N 2.85 1.68 -4.33 2.71 5.41 -1.26 -4.77 119.36 121.64 1wvv n ILE 154 Ca -0.18 -0.63 -0.17 0.00 1.00 0.00 0.00 62.75 62.77 1wvv n ILE 154 Cb 0.53 -1.61 -0.10 0.00 -0.71 0.00 0.00 39.64 37.75 1wvv n ILE 154 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 1wvv s LYS 155 N -2.54 1.33 0.28 0.38 -2.85 -1.26 -0.40 119.74 114.68 1wvv s LYS 155 Ca -0.27 -1.65 -0.30 0.00 -1.00 0.00 0.00 55.97 52.75 1wvv s LYS 155 Cb 0.07 -0.74 -0.12 0.00 -2.06 0.00 0.00 37.83 34.98 1wvv s LYS 155 CO 0.71 -0.03 1.47 -1.91 0.10 0.00 0.00 175.35 175.69 1wvv n GLU 156 N -0.41 2.34 0.00 1.78 2.13 -0.08 -4.91 120.64 121.50 1wvv n GLU 156 Ca -0.06 0.83 -0.13 0.00 0.66 0.00 0.00 57.16 58.46 1wvv n GLU 156 Cb 0.63 -2.53 -0.10 0.00 0.27 0.00 0.00 31.44 29.72 1wvv n GLU 156 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1wvv h VAL 157 N 3.08 1.29 -2.52 6.31 2.07 -1.99 -3.40 116.25 121.09 1wvv h VAL 157 Ca -0.46 -1.07 -0.60 0.00 0.82 0.00 0.00 66.70 65.38 1wvv h VAL 157 Cb 1.26 2.00 -0.13 0.00 -1.52 0.00 0.00 31.29 32.90 1wvv h VAL 157 CO 0.74 0.27 0.73 0.21 0.02 0.00 0.00 177.57 179.55 1wvv s ASN 158 N -5.62 6.19 0.66 0.57 3.84 -1.26 -4.87 114.94 114.46 1wvv s ASN 158 Ca -0.16 -0.88 0.43 0.00 0.21 0.00 0.00 52.86 52.47 1wvv s ASN 158 Cb 0.02 -2.46 2.37 0.00 -0.55 0.00 0.00 41.25 40.62 1wvv s ASN 158 CO 0.65 -1.55 2.36 -0.33 -2.79 0.00 0.00 177.10 175.44 1wvv h GLU 159 N 9.69 0.00 0.00 0.43 4.39 -2.01 -1.71 114.58 125.37 1wvv h GLU 159 Ca -0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1wvv h GLU 159 Cb 1.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1wvv h GLU 159 CO 1.22 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 179.07 1wvv h ALA 160 N 2.00 1.00 -0.01 3.43 0.00 -1.97 -2.33 119.26 121.38 1wvv h ALA 160 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wvv h ALA 160 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1wvv h ALA 160 CO 0.00 0.00 -0.03 0.09 0.00 0.00 0.00 179.25 179.31 1wvv n ASN 161 N -2.71 1.23 -0.36 0.00 3.02 -0.64 -4.49 115.26 111.31 1wvv n ASN 161 Ca 0.02 -1.35 0.02 0.00 -0.03 0.00 0.00 54.58 53.24 1wvv n ASN 161 Cb 0.34 0.01 0.17 0.00 -0.61 0.00 0.00 39.78 39.69 1wvv n ASN 161 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 1wvv h TYR 162 N 1.89 1.20 0.00 3.10 -1.99 -1.55 -1.95 116.97 117.67 1wvv h TYR 162 Ca 0.00 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.76 1wvv h TYR 162 Cb 0.43 -0.40 0.00 0.00 2.00 0.00 0.00 36.73 38.77 1wvv h TYR 162 CO 0.00 0.65 0.00 -2.30 -0.00 0.00 0.00 178.16 176.51 1wvv n PRO 163 N -4.48 0.08 0.06 4.88 -0.02 -1.26 -3.64 135.00 130.62 1wvv n PRO 163 Ca 0.15 0.26 0.13 0.00 -2.02 0.00 0.00 63.50 62.02 1wvv n PRO 163 Cb 0.15 -1.50 0.50 0.00 -0.02 0.00 0.00 33.50 32.63 1wvv n PRO 163 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1wvv n HIS 164 N -1.36 0.50 -1.04 6.00 -0.00 -0.73 -4.16 115.22 114.43 1wvv n HIS 164 Ca 0.03 0.15 0.01 0.00 0.46 0.00 0.00 57.72 58.37 1wvv n HIS 164 Cb 0.08 -0.75 0.31 0.00 -0.12 0.00 0.00 29.99 29.51 1wvv n HIS 164 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1wvv n TYR 165 N -1.92 1.85 -3.59 1.57 4.01 -1.24 -4.82 117.16 113.02 1wvv n TYR 165 Ca 0.06 -1.05 -0.41 0.00 -0.16 0.00 0.00 57.90 56.34 1wvv n TYR 165 Cb 0.37 -0.53 -0.11 0.00 -0.31 0.00 0.00 39.34 38.76 1wvv n TYR 165 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1wvv s ASP 167 N 1.76 6.36 0.00 0.00 2.15 -1.26 -4.92 116.67 120.77 1wvv s ASP 167 Ca 0.02 -1.36 0.12 0.00 0.43 0.00 0.00 52.55 51.76 1wvv s ASP 167 Cb -0.21 -2.44 0.54 0.00 -0.30 0.00 0.00 42.92 40.51 1wvv s ASP 167 CO 0.05 -1.36 1.36 0.35 -0.17 0.00 0.00 175.17 175.41 1wvv n THR 168 N 5.94 1.05 0.29 1.71 -2.24 -1.26 -2.66 114.28 117.11 1wvv n THR 168 Ca 0.11 0.26 0.14 0.00 -2.27 0.00 0.00 64.05 62.29 1wvv n THR 168 Cb 0.48 -1.06 0.43 0.00 -2.10 0.00 0.00 70.33 68.08 1wvv n THR 168 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1wvv h THR 169 N 0.00 0.00 -3.86 4.28 1.35 -1.98 -3.43 112.91 109.27 1wvv h THR 169 Ca 0.00 -0.70 -0.52 0.00 -0.55 0.00 0.00 66.41 64.64 1wvv h THR 169 Cb 0.18 1.68 0.05 0.00 -1.73 0.00 0.00 68.15 68.33 1wvv h THR 169 CO 0.00 0.00 0.59 -1.10 -0.25 0.00 0.00 175.52 174.76 1wvv s GLN 170 N -3.40 4.43 0.51 4.72 -1.52 -1.09 -4.89 119.66 118.43 1wvv s GLN 170 Ca 0.05 2.10 0.30 0.00 -1.95 0.00 0.00 55.36 55.85 1wvv s GLN 170 Cb 0.08 -3.10 1.22 0.00 -0.22 0.00 0.00 33.01 30.99 1wvv s GLN 170 CO 0.59 -0.08 1.94 0.66 -0.25 0.00 0.00 175.29 178.15 1wvv h SER 171 N 3.49 0.00 0.55 5.90 4.64 -1.91 -2.24 113.55 123.97 1wvv h SER 171 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1wvv h SER 171 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1wvv h SER 171 CO 0.66 0.09 -0.21 0.00 -0.87 0.00 0.00 176.83 176.50 1wvv n TYR 172 N -3.24 0.00 -3.48 4.77 0.18 -1.26 -5.03 117.16 109.10 1wvv n TYR 172 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1wvv n TYR 172 Cb 0.34 -0.28 0.00 0.00 -0.38 0.00 0.00 39.34 39.03 1wvv n TYR 172 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1wvv n GLY 173 N 1.40 2.36 2.25 -7.48 0.00 -0.85 -4.30 105.19 98.57 1wvv n GLY 173 Ca 0.10 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.54 1wvv n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wvv h PRO 175 N 3.55 0.00 0.00 0.00 0.13 -1.80 -1.17 132.00 132.70 1wvv h PRO 175 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1wvv h PRO 175 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1wvv h PRO 175 CO 0.52 0.05 -0.14 0.00 -0.23 0.00 0.00 178.00 178.21 1wvv n ALA 176 N -2.27 2.47 0.00 -0.56 0.00 -1.25 -4.98 120.51 113.91 1wvv n ALA 176 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1wvv n ALA 176 Cb 0.15 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1wvv n ALA 176 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wvv n GLY 177 N 1.36 4.24 0.30 0.00 0.00 -0.44 -4.72 105.19 105.93 1wvv n GLY 177 Ca 0.05 -1.38 0.12 0.00 0.00 0.00 0.00 46.02 44.82 1wvv n GLY 177 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1wvv h GLN 178 N 0.00 0.00 -0.59 1.61 4.20 -1.94 -2.39 115.11 116.00 1wvv h GLN 178 Ca 0.00 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 1wvv h GLN 178 Cb 0.00 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.72 1wvv h GLN 178 CO 0.00 0.00 0.11 0.00 -0.67 0.00 0.00 178.83 178.27 1wvv n ALA 179 N -2.58 4.07 1.00 3.87 0.00 -1.26 -4.04 120.51 121.58 1wvv n ALA 179 Ca 0.02 -2.22 0.12 0.00 0.00 0.00 0.00 53.44 51.35 1wvv n ALA 179 Cb 0.28 -1.10 0.08 0.00 0.00 0.00 0.00 19.45 18.71 1wvv n ALA 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wvv n ALA 180 N 0.04 2.67 -1.52 0.00 0.00 -0.90 -4.51 120.51 116.28 1wvv n ALA 180 Ca 0.33 -0.68 -0.04 0.00 0.00 0.00 0.00 53.44 53.05 1wvv n ALA 180 Cb 1.23 -0.80 0.19 0.00 0.00 0.00 0.00 19.45 20.07 1wvv n ALA 180 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1wvv n TYR 181 N 1.09 0.98 -1.24 0.00 4.01 -1.26 -4.78 117.16 115.97 1wvv n TYR 181 Ca 0.13 -1.65 -0.29 0.00 -0.16 0.00 0.00 57.90 55.93 1wvv n TYR 181 Cb 0.57 -0.46 0.19 0.00 -0.31 0.00 0.00 39.34 39.33 1wvv n TYR 181 CO 0.00 0.00 0.00 1.52 -0.46 0.00 0.00 176.86 177.92 1wvv s TYR 182 N -3.28 1.78 0.14 -0.72 -0.85 -1.26 -0.96 117.35 112.20 1wvv s TYR 182 Ca 0.44 0.82 -0.31 0.00 -0.52 0.00 0.00 57.07 57.49 1wvv s TYR 182 Cb 0.40 -3.36 -0.09 0.00 0.38 0.00 0.00 41.96 39.29 1wvv s TYR 182 CO -0.02 -3.05 1.55 0.20 -1.52 0.00 0.00 175.55 172.71 1wvv s GLY 183 N -3.70 1.63 0.00 5.49 0.00 -1.24 -4.52 107.32 104.97 1wvv s GLY 183 Ca 0.67 1.30 -0.02 0.00 0.00 0.00 0.00 44.72 46.67 1wvv s GLY 183 CO 0.56 2.62 0.03 0.50 0.00 0.00 0.00 173.10 176.81 1wvv s ARG 184 N 1.35 0.26 0.98 2.90 0.52 -0.93 -0.90 118.95 123.13 1wvv s ARG 184 Ca 0.70 -0.34 0.00 0.00 -0.52 0.00 0.00 55.73 55.56 1wvv s ARG 184 Cb -0.42 0.10 0.00 0.00 0.52 0.00 0.00 34.95 35.15 1wvv s ARG 184 CO 0.31 -0.05 0.00 0.41 0.02 0.00 0.00 175.30 175.99 1wvv n GLY 185 N 2.05 -2.03 0.28 -3.53 0.00 0.47 -1.16 105.19 101.27 1wvv n GLY 185 Ca -0.20 -1.40 0.15 0.00 0.00 0.00 0.00 46.02 44.57 1wvv n GLY 185 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wvv h PRO 186 N 0.00 0.00 -0.21 1.61 0.13 -1.89 -1.67 132.00 129.98 1wvv h PRO 186 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1wvv h PRO 186 Cb 0.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1wvv h PRO 186 CO 0.00 0.09 0.00 0.44 -0.23 0.00 0.00 178.00 178.30 1wvv n ILE 187 N -3.44 1.41 -3.66 -3.56 -5.35 -1.26 -4.55 119.36 98.95 1wvv n ILE 187 Ca -0.01 -1.36 -0.25 0.00 -0.27 0.00 0.00 62.75 60.86 1wvv n ILE 187 Cb 0.23 0.23 0.04 0.00 -1.74 0.00 0.00 39.64 38.40 1wvv n ILE 187 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wvv n GLN 188 N -0.18 -3.08 -1.76 6.28 1.13 -0.63 -4.85 117.38 114.29 1wvv n GLN 188 Ca 0.12 0.57 -0.42 0.00 -1.94 0.00 0.00 57.00 55.33 1wvv n GLN 188 Cb 0.52 -4.82 -0.03 0.00 0.11 0.00 0.00 30.24 26.03 1wvv n GLN 188 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1wvv s LEU 189 N -6.47 4.36 0.00 1.08 2.96 -0.31 -4.33 118.68 115.98 1wvv s LEU 189 Ca 0.23 2.86 -0.05 0.00 -0.22 0.00 0.00 54.13 56.95 1wvv s LEU 189 Cb -0.07 -3.61 -0.00 0.00 0.50 0.00 0.00 46.19 43.01 1wvv s LEU 189 CO 0.83 -0.94 0.09 -0.44 -1.32 0.00 0.00 176.35 174.57 1wvv s SER 190 N 1.01 0.07 0.00 3.68 0.01 -1.26 -2.18 113.70 115.03 1wvv s SER 190 Ca 0.71 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.73 1wvv s SER 190 Cb -0.49 0.18 0.00 0.00 0.21 0.00 0.00 66.02 65.92 1wvv s SER 190 CO 0.36 -0.32 0.00 0.79 0.41 0.00 0.00 173.24 174.48 1wvv n TRP 191 N 1.64 0.00 -0.34 2.43 7.02 -0.13 -4.22 117.44 123.84 1wvv n TRP 191 Ca -0.22 0.00 0.18 0.00 -1.02 0.00 0.00 57.50 56.44 1wvv n TRP 191 Cb 0.56 -0.80 0.40 0.00 -2.42 0.00 0.00 31.31 29.04 1wvv n TRP 191 CO 0.00 0.00 0.00 -2.95 -2.02 0.00 0.00 177.69 172.72 1wvv h ASN 192 N 0.00 0.61 0.68 -0.99 -1.07 -1.65 -1.02 115.58 112.14 1wvv h ASN 192 Ca 0.00 0.15 -0.14 0.00 0.07 0.00 0.00 56.30 56.38 1wvv h ASN 192 Cb 0.00 0.06 -0.02 0.00 -2.07 0.00 0.00 38.32 36.29 1wvv h ASN 192 CO 0.00 0.05 -0.69 2.19 0.07 0.00 0.00 177.43 179.05 1wvv h PHE 193 N 0.51 0.01 -0.15 4.14 -5.15 -1.87 -0.14 116.94 114.30 1wvv h PHE 193 Ca 0.66 -0.00 -0.21 0.00 -0.20 0.00 0.00 57.97 58.21 1wvv h PHE 193 Cb 1.30 -0.00 0.01 0.00 0.22 0.00 0.00 35.95 37.48 1wvv h PHE 193 CO -0.02 0.69 -0.76 -0.91 -2.00 0.00 0.00 178.31 175.31 1wvv h ASN 194 N 0.00 0.86 -0.88 -0.68 -0.26 -1.39 -1.67 115.58 111.56 1wvv h ASN 194 Ca -0.01 -0.56 -0.01 0.00 -0.56 0.00 0.00 56.30 55.17 1wvv h ASN 194 Cb 1.21 -0.25 -0.04 0.00 -1.06 0.00 0.00 38.32 38.18 1wvv h ASN 194 CO 0.09 1.34 0.51 1.88 -1.06 0.00 0.00 177.43 180.19 1wvv h TYR 195 N 0.50 1.19 0.21 1.19 -1.99 -1.27 -0.17 116.97 116.63 1wvv h TYR 195 Ca -0.05 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 1wvv h TYR 195 Cb 1.38 -0.38 0.00 0.00 2.00 0.00 0.00 36.73 39.72 1wvv h TYR 195 CO 0.08 0.81 -0.10 -0.22 -0.00 0.00 0.00 178.16 178.72 1wvv h LYS 196 N 1.22 -0.27 -0.19 4.88 1.63 -0.99 -1.38 116.57 121.48 1wvv h LYS 196 Ca 0.31 0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 60.10 1wvv h LYS 196 Cb -0.01 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.67 1wvv h LYS 196 CO -0.05 -0.16 -0.01 0.00 -3.45 0.00 0.00 179.45 175.77 1wvv h ALA 197 N 0.48 0.25 -0.44 5.00 0.00 -1.20 -0.73 119.26 122.62 1wvv h ALA 197 Ca -0.03 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.71 1wvv h ALA 197 Cb 0.24 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1wvv h ALA 197 CO 0.05 -0.01 0.19 0.00 0.00 0.00 0.00 179.25 179.47 1wvv h ALA 198 N 0.76 0.54 -0.49 0.00 0.00 -1.07 -1.81 119.26 117.19 1wvv h ALA 198 Ca 0.05 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1wvv h ALA 198 Cb 0.42 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1wvv h ALA 198 CO 0.01 -0.18 0.15 0.78 0.00 0.00 0.00 179.25 180.01 1wvv h GLY 199 N 0.39 0.83 0.69 0.00 0.00 -1.11 -0.37 103.07 103.49 1wvv h GLY 199 Ca 0.20 -0.50 0.06 0.00 0.00 0.00 0.00 47.33 47.09 1wvv h GLY 199 CO -0.17 0.47 0.44 -0.55 0.00 0.00 0.00 176.54 176.73 1wvv h ASP 200 N 0.67 0.67 -0.16 0.19 3.32 -0.96 0.14 116.42 120.29 1wvv h ASP 200 Ca 0.16 0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.12 1wvv h ASP 200 Cb 0.29 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1wvv h ASP 200 CO -0.00 0.43 -0.26 0.00 -1.72 0.00 0.00 179.24 177.69 1wvv h ALA 201 N 1.38 0.97 -0.00 3.45 0.00 -0.84 -3.04 119.26 121.17 1wvv h ALA 201 Ca 0.34 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1wvv h ALA 201 Cb 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1wvv h ALA 201 CO -0.18 0.60 -0.34 1.28 0.00 0.00 0.00 179.25 180.61 1wvv n LEU 202 N -4.10 0.66 -1.02 0.00 4.77 -0.19 -4.94 117.00 112.17 1wvv n LEU 202 Ca -0.00 -0.06 -0.10 0.00 -0.03 0.00 0.00 56.01 55.82 1wvv n LEU 202 Cb 0.43 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 1wvv n LEU 202 CO 0.43 0.14 -0.12 0.61 -1.33 0.00 0.00 177.39 177.13 1wvv n GLY 203 N 1.42 0.24 2.98 -0.72 0.00 0.38 -5.03 105.19 104.47 1wvv n GLY 203 Ca 0.09 -0.51 -0.24 0.00 0.00 0.00 0.00 46.02 45.36 1wvv n GLY 203 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wvv s ILE 204 N -2.45 1.01 -1.19 -0.61 1.01 -0.58 -5.04 121.20 113.36 1wvv s ILE 204 Ca 0.00 -0.39 -0.20 0.00 0.00 0.00 0.00 60.65 60.06 1wvv s ILE 204 Cb 0.00 -0.95 0.04 0.00 0.01 0.00 0.00 42.46 41.55 1wvv s ILE 204 CO 0.00 0.33 1.70 0.21 0.00 0.00 0.00 174.94 177.18 1wvv s ASN 205 N 0.84 6.42 0.41 3.58 3.84 -1.26 -4.18 114.94 124.59 1wvv s ASN 205 Ca -0.11 -1.98 0.23 0.00 0.21 0.00 0.00 52.86 51.21 1wvv s ASN 205 Cb -0.15 -2.58 0.32 0.00 -0.55 0.00 0.00 41.25 38.29 1wvv s ASN 205 CO 0.02 -1.60 1.56 -0.07 -2.79 0.00 0.00 177.10 174.22 1wvv h LEU 206 N 13.60 0.00 -0.31 3.21 3.38 -1.80 -1.45 115.31 131.94 1wvv h LEU 206 Ca 0.33 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 1wvv h LEU 206 Cb 0.92 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 1wvv h LEU 206 CO 1.41 0.00 0.13 0.25 0.09 0.00 0.00 178.44 180.32 1wvv h LEU 207 N 0.00 0.43 -0.11 1.67 5.85 -1.84 -1.54 115.31 119.76 1wvv h LEU 207 Ca 0.00 -0.16 -0.24 0.00 0.84 0.00 0.00 57.88 58.32 1wvv h LEU 207 Cb 1.00 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 41.93 1wvv h LEU 207 CO 0.00 0.47 -0.92 0.00 -0.34 0.00 0.00 178.44 177.65 1wvv h ALA 208 N 0.98 0.26 -2.17 1.25 0.00 -1.94 -3.34 119.26 114.29 1wvv h ALA 208 Ca 0.10 -0.66 -0.59 0.00 0.00 0.00 0.00 54.91 53.77 1wvv h ALA 208 Cb 0.17 0.01 -0.41 0.00 0.00 0.00 0.00 17.79 17.56 1wvv h ALA 208 CO -0.01 0.71 -0.71 -1.71 0.00 0.00 0.00 179.25 177.53 1wvv n ASN 209 N -3.87 3.19 0.26 0.00 2.85 -0.55 -4.48 115.26 112.66 1wvv n ASN 209 Ca -0.09 -3.35 0.14 0.00 -0.11 0.00 0.00 54.58 51.17 1wvv n ASN 209 Cb 0.82 -0.65 0.68 0.00 1.24 0.00 0.00 39.78 41.87 1wvv n ASN 209 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1wvv h PRO 210 N 3.90 0.00 0.00 1.20 0.13 -1.48 -2.73 132.00 133.02 1wvv h PRO 210 Ca 0.16 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1wvv h PRO 210 Cb 0.68 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.81 1wvv h PRO 210 CO 0.76 0.11 -0.01 1.88 -0.23 0.00 0.00 178.00 180.52 1wvv h TYR 211 N 0.00 0.00 -1.03 1.56 -1.99 -1.86 -1.81 116.97 111.84 1wvv h TYR 211 Ca -0.00 0.00 0.29 0.00 2.00 0.00 0.00 58.73 61.01 1wvv h TYR 211 Cb 0.48 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 39.15 1wvv h TYR 211 CO 0.00 0.01 0.72 -0.07 -0.00 0.00 0.00 178.16 178.82 1wvv h LEU 212 N 0.00 0.14 -1.26 3.88 3.38 -1.87 -1.25 115.31 118.33 1wvv h LEU 212 Ca -0.00 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1wvv h LEU 212 Cb 0.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1wvv h LEU 212 CO 0.00 0.03 -0.09 0.58 0.09 0.00 0.00 178.44 179.05 1wvv h VAL 213 N 0.13 0.23 -0.02 1.22 2.07 -1.57 0.63 116.25 118.95 1wvv h VAL 213 Ca 0.52 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1wvv h VAL 213 Cb 1.81 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 33.21 1wvv h VAL 213 CO -0.09 0.09 -0.11 -1.84 0.02 0.00 0.00 177.57 175.64 1wvv n GLU 214 N -3.22 1.43 -0.02 1.57 0.28 -0.53 -4.06 120.64 116.10 1wvv n GLU 214 Ca 0.01 -1.26 -0.01 0.00 -0.16 0.00 0.00 57.16 55.73 1wvv n GLU 214 Cb 0.37 -1.30 -0.04 0.00 1.43 0.00 0.00 31.44 31.90 1wvv n GLU 214 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1wvv n GLN 215 N 0.59 2.26 -3.99 3.44 6.02 -0.85 -4.97 117.38 119.88 1wvv n GLN 215 Ca 0.09 -0.02 -0.31 0.00 -0.01 0.00 0.00 57.00 56.75 1wvv n GLN 215 Cb 0.39 -1.12 -0.16 0.00 1.02 0.00 0.00 30.24 30.37 1wvv n GLN 215 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1wvv s ASP 216 N -3.26 3.73 0.32 1.08 -1.08 0.17 -5.02 116.67 112.61 1wvv s ASP 216 Ca -0.02 -1.07 0.06 0.00 -0.52 0.00 0.00 52.55 51.00 1wvv s ASP 216 Cb 0.02 -1.28 0.56 0.00 -1.46 0.00 0.00 42.92 40.76 1wvv s ASP 216 CO 0.20 -0.18 1.79 1.55 0.52 0.00 0.00 175.17 179.05 1wvv h PRO 217 N 7.93 0.33 -0.59 4.34 0.13 -1.84 -0.68 132.00 141.63 1wvv h PRO 217 Ca -0.23 -0.11 -0.05 0.00 -0.87 0.00 0.00 66.00 64.73 1wvv h PRO 217 Cb 1.08 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 1wvv h PRO 217 CO 0.46 0.55 0.16 0.00 -0.23 0.00 0.00 178.00 178.94 1wvv h ALA 218 N 1.46 0.77 -0.18 -0.56 0.00 -1.92 -0.75 119.26 118.07 1wvv h ALA 218 Ca 0.05 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1wvv h ALA 218 Cb 0.59 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1wvv h ALA 218 CO 0.04 0.46 0.09 0.28 0.00 0.00 0.00 179.25 180.13 1wvv h VAL 219 N 0.84 1.11 -0.23 0.00 2.07 -1.80 -0.42 116.25 117.82 1wvv h VAL 219 Ca 0.19 -0.31 0.05 0.00 0.82 0.00 0.00 66.70 67.45 1wvv h VAL 219 Cb 0.33 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 1wvv h VAL 219 CO -0.00 0.11 -0.13 0.00 0.02 0.00 0.00 177.57 177.57 1wvv h ALA 220 N 0.98 0.05 -0.75 1.67 0.00 -0.94 -1.36 119.26 118.91 1wvv h ALA 220 Ca 0.06 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1wvv h ALA 220 Cb 0.09 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1wvv h ALA 220 CO -0.01 -0.54 0.28 -1.49 0.00 0.00 0.00 179.25 177.48 1wvv h TRP 221 N -0.11 1.16 -0.90 0.00 4.06 -1.04 -2.31 115.95 116.82 1wvv h TRP 221 Ca 0.12 -0.10 0.10 0.00 2.06 0.00 0.00 58.89 61.08 1wvv h TRP 221 Cb 0.29 -0.34 -0.07 0.00 -1.00 0.00 0.00 29.16 28.04 1wvv h TRP 221 CO -0.29 0.90 0.58 0.87 -3.56 0.00 0.00 178.44 176.93 1wvv h LYS 222 N 1.09 0.85 -0.42 0.49 1.57 -0.54 -0.61 116.57 118.99 1wvv h LYS 222 Ca 0.25 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.91 1wvv h LYS 222 Cb 0.25 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1wvv h LYS 222 CO -0.02 0.56 -0.01 1.79 -0.57 0.00 0.00 179.45 181.21 1wvv h THR 223 N 0.87 1.23 -0.44 -0.16 1.35 -0.72 0.87 112.91 115.92 1wvv h THR 223 Ca 0.42 -0.94 -0.06 0.00 -0.55 0.00 0.00 66.41 65.28 1wvv h THR 223 Cb 0.44 0.91 -0.02 0.00 -1.73 0.00 0.00 68.15 67.76 1wvv h THR 223 CO -0.18 0.33 0.04 1.23 -0.25 0.00 0.00 175.52 176.68 1wvv h GLY 224 N 0.94 0.81 1.69 5.82 0.00 -0.88 -2.72 103.07 108.73 1wvv h GLY 224 Ca 0.13 -0.57 -0.10 0.00 0.00 0.00 0.00 47.33 46.79 1wvv h GLY 224 CO 0.02 0.52 -0.35 1.41 0.00 0.00 0.00 176.54 178.14 1wvv h LEU 225 N 0.60 0.37 0.04 3.11 3.38 -0.79 -2.00 115.31 120.02 1wvv h LEU 225 Ca 0.13 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1wvv h LEU 225 Cb 0.43 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1wvv h LEU 225 CO 0.01 0.69 -0.13 -0.25 0.09 0.00 0.00 178.44 178.86 1wvv h TRP 226 N 0.31 -0.34 0.15 1.13 7.01 -0.68 -1.17 115.95 122.36 1wvv h TRP 226 Ca 0.04 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.04 1wvv h TRP 226 Cb 0.76 0.15 0.00 0.00 -2.10 0.00 0.00 29.16 27.97 1wvv h TRP 226 CO 0.02 -0.20 -0.08 -0.92 -2.79 0.00 0.00 178.44 174.47 1wvv h TYR 227 N -0.24 -0.20 -0.89 2.65 5.03 -1.26 -1.38 116.97 120.67 1wvv h TYR 227 Ca 0.03 -0.00 0.08 0.00 2.58 0.00 0.00 58.73 61.42 1wvv h TYR 227 Cb 0.28 0.07 -0.06 0.00 1.55 0.00 0.00 36.73 38.56 1wvv h TYR 227 CO -0.17 -0.13 0.58 2.35 -1.32 0.00 0.00 178.16 179.47 1wvv h TRP 228 N -0.21 0.99 -0.01 -3.82 2.91 -1.24 -1.40 115.95 113.17 1wvv h TRP 228 Ca -0.02 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.03 1wvv h TRP 228 Cb 0.17 -0.32 0.00 0.00 -0.51 0.00 0.00 29.16 28.50 1wvv h TRP 228 CO -0.07 0.48 -0.71 0.09 -1.03 0.00 0.00 178.44 177.20 1wvv n ASN 229 N -4.51 1.25 0.00 2.65 3.02 -0.45 -1.55 115.26 115.66 1wvv n ASN 229 Ca 0.15 -1.12 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 1wvv n ASN 229 Cb 0.26 0.80 0.00 0.00 -0.61 0.00 0.00 39.78 40.24 1wvv n ASN 229 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1wvv n SER 230 N -0.93 3.15 -4.54 6.41 3.41 -0.53 -4.91 113.62 115.68 1wvv n SER 230 Ca 0.05 -0.01 -0.34 0.00 -0.26 0.00 0.00 58.87 58.31 1wvv n SER 230 Cb 0.34 0.66 -0.12 0.00 -0.26 0.00 0.00 64.21 64.83 1wvv n SER 230 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1wvv s GLN 231 N -1.29 3.08 0.17 4.33 -1.52 -0.54 -4.93 119.66 118.96 1wvv s GLN 231 Ca 0.00 -0.54 0.18 0.00 -1.95 0.00 0.00 55.36 53.05 1wvv s GLN 231 Cb 0.00 -2.70 -0.03 0.00 -0.22 0.00 0.00 33.01 30.06 1wvv s GLN 231 CO 0.00 0.51 1.06 -0.91 -0.25 0.00 0.00 175.29 175.70 1wvv h ASN 232 N 5.79 0.00 0.00 5.90 2.35 -1.86 -3.37 115.58 124.39 1wvv h ASN 232 Ca -0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 1wvv h ASN 232 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.55 1wvv h ASN 232 CO 0.56 0.38 0.00 0.61 -1.65 0.00 0.00 177.43 177.33 1wvv n GLY 233 N 1.29 2.27 0.00 2.83 0.00 -1.23 -0.63 105.19 109.72 1wvv n GLY 233 Ca -0.04 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.58 1wvv n GLY 233 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1wvv n PRO 234 N 10.68 0.63 -0.09 1.61 -0.02 -1.26 -4.83 135.00 141.72 1wvv n PRO 234 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1wvv n PRO 234 Cb 0.00 -1.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 1wvv n PRO 234 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1wvv n GLY 235 N 0.14 3.54 0.00 -1.23 0.00 0.20 -4.73 105.19 103.10 1wvv n GLY 235 Ca 0.01 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1wvv n GLY 235 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wvv n THR 236 N -0.05 0.52 -3.61 2.61 -2.24 -1.26 -4.91 114.28 105.33 1wvv n THR 236 Ca 0.00 -0.65 -0.10 0.00 -2.27 0.00 0.00 64.05 61.03 1wvv n THR 236 Cb 0.00 0.82 -0.03 0.00 -2.10 0.00 0.00 70.33 69.02 1wvv n THR 236 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wvv s MET 237 N -0.52 1.40 0.47 -0.78 0.23 -1.26 -5.04 119.30 113.80 1wvv s MET 237 Ca 0.00 -0.70 -0.22 0.00 -1.03 0.00 0.00 55.69 53.74 1wvv s MET 237 Cb 0.00 0.57 -0.08 0.00 -1.53 0.00 0.00 34.83 33.79 1wvv s MET 237 CO 0.00 -0.61 1.11 0.95 -2.03 0.00 0.00 175.02 174.44 1wvv s THR 238 N -3.82 3.38 0.35 3.16 -4.23 -1.26 -4.38 115.64 108.84 1wvv s THR 238 Ca 0.05 0.97 0.10 0.00 -1.18 0.00 0.00 61.69 61.63 1wvv s THR 238 Cb -0.02 -3.46 0.33 0.00 1.34 0.00 0.00 72.50 70.69 1wvv s THR 238 CO -0.06 -0.08 1.83 -0.65 -0.54 0.00 0.00 174.62 175.13 1wvv h PRO 239 N 1.90 0.65 -0.30 3.99 0.11 -1.69 0.07 132.00 136.73 1wvv h PRO 239 Ca -0.49 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.64 1wvv h PRO 239 Cb 1.24 -0.15 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 1wvv h PRO 239 CO 0.60 0.43 -0.06 1.25 -0.21 0.00 0.00 178.00 180.01 1wvv h HIS 240 N 0.67 -0.12 -0.07 0.65 -0.00 -1.63 -2.63 115.15 112.00 1wvv h HIS 240 Ca 0.50 0.03 -0.14 0.00 -0.00 0.00 0.00 60.37 60.75 1wvv h HIS 240 Cb 0.88 0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 28.37 1wvv h HIS 240 CO -0.00 -0.11 -0.59 -0.91 -0.00 0.00 0.00 177.93 176.32 1wvv h ASN 241 N 0.02 0.27 -0.84 3.26 -0.26 -1.56 -1.14 115.58 115.34 1wvv h ASN 241 Ca 0.14 -0.15 0.13 0.00 -0.56 0.00 0.00 56.30 55.87 1wvv h ASN 241 Cb 0.21 -0.08 -0.09 0.00 -1.06 0.00 0.00 38.32 37.30 1wvv h ASN 241 CO -0.29 0.79 0.44 0.00 -1.06 0.00 0.00 177.43 177.32 1wvv h ALA 242 N 1.21 1.25 0.03 -0.83 0.00 -0.68 0.34 119.26 120.57 1wvv h ALA 242 Ca -0.00 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1wvv h ALA 242 Cb 1.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1wvv h ALA 242 CO 0.09 -0.05 -0.17 0.82 0.00 0.00 0.00 179.25 179.94 1wvv h ILE 243 N 0.66 1.74 -0.27 0.00 1.08 -1.17 0.13 117.51 119.68 1wvv h ILE 243 Ca 0.45 -2.39 -0.06 0.00 -0.39 0.00 0.00 64.86 62.47 1wvv h ILE 243 Cb 0.58 3.36 -0.02 0.00 -3.07 0.00 0.00 36.82 37.68 1wvv h ILE 243 CO -0.34 0.63 -0.08 0.58 -0.69 0.00 0.00 178.15 178.26 1wvv h VAL 244 N -0.87 1.20 -0.15 1.67 2.07 -1.10 -1.83 116.25 117.24 1wvv h VAL 244 Ca -0.03 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.62 1wvv h VAL 244 Cb 1.14 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.00 1wvv h VAL 244 CO 0.03 0.28 0.00 0.59 0.02 0.00 0.00 177.57 178.50 1wvv n ASN 245 N -4.25 1.63 -2.89 0.57 3.02 0.12 -4.94 115.26 108.53 1wvv n ASN 245 Ca 0.01 -1.68 -0.22 0.00 -0.03 0.00 0.00 54.58 52.65 1wvv n ASN 245 Cb 0.28 -0.09 0.03 0.00 -0.61 0.00 0.00 39.78 39.38 1wvv n ASN 245 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1wvv n ASN 246 N 0.30 -6.07 0.20 6.41 5.15 -0.69 -4.90 115.26 115.66 1wvv n ASN 246 Ca 0.16 -0.23 0.14 0.00 -0.60 0.00 0.00 54.58 54.05 1wvv n ASN 246 Cb 0.33 -4.94 0.39 0.00 -0.53 0.00 0.00 39.78 35.03 1wvv n ASN 246 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wvv h ALA 247 N 1.01 1.00 0.00 5.20 0.00 -1.00 -3.47 119.26 122.00 1wvv h ALA 247 Ca -0.52 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1wvv h ALA 247 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1wvv h ALA 247 CO 0.57 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.23 1wvv n GLY 248 N 0.76 3.09 0.42 0.00 0.00 -1.07 -4.61 105.19 103.77 1wvv n GLY 248 Ca 0.03 -1.72 0.22 0.00 0.00 0.00 0.00 46.02 44.55 1wvv n GLY 248 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1wvv h PHE 249 N 0.00 0.39 -0.38 1.61 3.57 -1.61 -1.82 116.94 118.71 1wvv h PHE 249 Ca 0.00 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.54 1wvv h PHE 249 Cb 0.00 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 1wvv h PHE 249 CO 0.00 0.09 0.25 0.78 -2.23 0.00 0.00 178.31 177.21 1wvv h GLY 250 N 0.28 0.45 2.00 2.40 0.00 -0.77 0.39 103.07 107.83 1wvv h GLY 250 Ca 0.46 -0.16 -0.06 0.00 0.00 0.00 0.00 47.33 47.57 1wvv h GLY 250 CO -0.14 0.14 -0.30 0.83 0.00 0.00 0.00 176.54 177.08 1wvv h GLU 251 N 0.40 0.00 -0.47 4.80 4.39 -1.54 -1.87 114.58 120.29 1wvv h GLU 251 Ca 0.15 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.73 1wvv h GLU 251 Cb 0.11 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.75 1wvv h GLU 251 CO -0.04 0.30 -0.17 1.79 -1.16 0.00 0.00 179.01 179.73 1wvv h THR 252 N 0.00 1.27 -0.40 1.13 1.35 -1.00 -1.11 112.91 114.14 1wvv h THR 252 Ca -0.00 -1.31 -0.01 0.00 -0.55 0.00 0.00 66.41 64.53 1wvv h THR 252 Cb 0.81 1.09 -0.02 0.00 -1.73 0.00 0.00 68.15 68.29 1wvv h THR 252 CO 0.04 0.45 0.20 0.40 -0.25 0.00 0.00 175.52 176.36 1wvv h ILE 253 N 0.81 1.17 -0.66 6.82 2.04 -0.96 -2.43 117.51 124.30 1wvv h ILE 253 Ca 0.12 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 1wvv h ILE 253 Cb 0.72 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1wvv h ILE 253 CO 0.06 0.18 0.21 -0.09 0.00 0.00 0.00 178.15 178.51 1wvv h ARG 254 N 0.51 1.01 0.00 2.37 2.43 -1.14 0.53 114.38 120.09 1wvv h ARG 254 Ca 0.14 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1wvv h ARG 254 Cb 0.10 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1wvv h ARG 254 CO -0.02 0.88 0.00 0.43 -1.51 0.00 0.00 179.97 179.75 1wvv n SER 255 N -4.36 0.21 -0.13 -3.80 7.64 -0.44 -1.03 113.62 111.72 1wvv n SER 255 Ca 0.04 0.53 -0.24 0.00 1.01 0.00 0.00 58.87 60.21 1wvv n SER 255 Cb 0.21 -0.59 -0.10 0.00 -1.01 0.00 0.00 64.21 62.72 1wvv n SER 255 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1wvv n ILE 256 N -1.71 1.46 -2.59 0.44 5.41 -0.93 -3.54 119.36 117.89 1wvv n ILE 256 Ca 0.05 -0.44 -0.01 0.00 1.00 0.00 0.00 62.75 63.34 1wvv n ILE 256 Cb 0.27 -1.68 0.06 0.00 -0.71 0.00 0.00 39.64 37.58 1wvv n ILE 256 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 1wvv n ASN 257 N -3.83 -0.10 -0.37 4.38 5.15 0.14 -4.84 115.26 115.79 1wvv n ASN 257 Ca -0.50 -2.09 -0.01 0.00 -0.60 0.00 0.00 54.58 51.38 1wvv n ASN 257 Cb 0.91 0.12 0.12 0.00 -0.53 0.00 0.00 39.78 40.41 1wvv n ASN 257 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1wvv h GLY 258 N 1.35 1.43 1.34 8.20 0.00 -0.97 -1.60 103.07 112.82 1wvv h GLY 258 Ca -0.34 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 46.45 1wvv h GLY 258 CO -0.05 0.48 0.30 0.00 0.00 0.00 0.00 176.54 177.27 1wvv h ALA 259 N 1.38 1.37 0.00 3.60 0.00 -1.85 -1.12 119.26 122.65 1wvv h ALA 259 Ca 0.38 -0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.95 1wvv h ALA 259 Cb -0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.41 1wvv h ALA 259 CO -0.10 0.50 -1.67 1.28 0.00 0.00 0.00 179.25 179.26 1wvv n LEU 260 N -4.36 0.67 -0.07 0.00 4.77 -1.01 -4.65 117.00 112.36 1wvv n LEU 260 Ca 0.06 0.30 -0.08 0.00 -0.03 0.00 0.00 56.01 56.25 1wvv n LEU 260 Cb 0.13 0.16 -0.09 0.00 -2.33 0.00 0.00 43.42 41.29 1wvv n LEU 260 CO 0.38 0.24 -0.95 -0.62 -1.33 0.00 0.00 177.39 175.11 1wvv n GLU 261 N -2.85 1.35 -1.74 3.23 1.02 -0.63 -3.36 120.64 117.65 1wvv n GLU 261 Ca -0.14 0.03 -0.30 0.00 -0.02 0.00 0.00 57.16 56.73 1wvv n GLU 261 Cb 0.91 -1.31 0.08 0.00 -0.02 0.00 0.00 31.44 31.11 1wvv n GLU 261 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wvv n ASN 263 N -3.33 -4.40 0.00 0.00 5.03 0.63 -1.03 115.26 112.15 1wvv n ASN 263 Ca 0.07 -0.74 0.00 0.00 0.87 0.00 0.00 54.58 54.78 1wvv n ASN 263 Cb 0.58 -4.14 0.00 0.00 -1.02 0.00 0.00 39.78 35.20 1wvv n ASN 263 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1wvv n GLY 264 N -1.72 0.82 0.36 7.41 0.00 -1.26 -4.96 105.19 105.85 1wvv n GLY 264 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.95 1wvv n GLY 264 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wvv h GLY 265 N 0.00 1.33 -5.30 -0.02 0.00 -0.88 -3.38 103.07 94.82 1wvv h GLY 265 Ca 0.00 -0.60 -0.27 0.00 0.00 0.00 0.00 47.33 46.46 1wvv h GLY 265 CO 0.00 0.57 -0.62 -2.01 0.00 0.00 0.00 176.54 174.49 1wvv n ASN 266 N -4.35 -2.57 0.01 0.19 2.85 -0.77 -4.77 115.26 105.86 1wvv n ASN 266 Ca 0.10 -2.90 0.05 0.00 -0.11 0.00 0.00 54.58 51.72 1wvv n ASN 266 Cb 0.09 1.21 0.45 0.00 1.24 0.00 0.00 39.78 42.77 1wvv n ASN 266 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1wvv h PRO 267 N 4.80 0.48 -0.82 1.20 0.11 -1.78 -2.02 132.00 133.98 1wvv h PRO 267 Ca 0.05 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1wvv h PRO 267 Cb 1.04 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.00 1wvv h PRO 267 CO 0.18 0.32 0.46 0.00 -0.21 0.00 0.00 178.00 178.75 1wvv h ALA 268 N 1.76 1.04 -0.01 -0.75 0.00 -1.95 -1.82 119.26 117.53 1wvv h ALA 268 Ca 0.16 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 1wvv h ALA 268 Cb 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1wvv h ALA 268 CO -0.04 0.54 -0.80 1.96 0.00 0.00 0.00 179.25 180.91 1wvv h GLN 269 N 1.13 0.18 -0.15 0.00 1.08 -1.79 0.60 115.11 116.17 1wvv h GLN 269 Ca 0.29 -0.18 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 1wvv h GLN 269 Cb 0.01 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 1wvv h GLN 269 CO -0.05 0.89 0.09 0.28 -0.95 0.00 0.00 178.83 179.09 1wvv h VAL 270 N 0.11 1.03 -0.56 -0.54 2.07 -1.23 0.21 116.25 117.33 1wvv h VAL 270 Ca -0.03 -0.07 -0.11 0.00 0.82 0.00 0.00 66.70 67.31 1wvv h VAL 270 Cb 1.40 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 1wvv h VAL 270 CO 0.12 0.04 -0.08 -0.61 0.02 0.00 0.00 177.57 177.05 1wvv h GLN 271 N 0.19 1.05 -0.77 1.57 5.75 -1.14 -2.11 115.11 119.64 1wvv h GLN 271 Ca 0.06 -0.37 -0.04 0.00 -0.15 0.00 0.00 58.65 58.15 1wvv h GLN 271 Cb -0.02 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.42 1wvv h GLN 271 CO -0.02 1.07 0.34 1.03 -2.65 0.00 0.00 178.83 178.60 1wvv h SER 272 N 0.93 1.04 -0.48 -0.69 0.87 -0.68 0.24 113.55 114.79 1wvv h SER 272 Ca 0.15 -0.16 0.03 0.00 -1.23 0.00 0.00 61.79 60.58 1wvv h SER 272 Cb 0.65 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 62.31 1wvv h SER 272 CO 0.04 0.91 0.28 0.03 -0.53 0.00 0.00 176.83 177.56 1wvv h ARG 273 N 1.11 0.53 -0.76 2.24 3.08 -0.74 -1.38 114.38 118.46 1wvv h ARG 273 Ca 0.26 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.26 1wvv h ARG 273 Cb 0.17 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 1wvv h ARG 273 CO -0.03 0.35 0.39 0.82 -1.07 0.00 0.00 179.97 180.43 1wvv h ILE 274 N 0.55 1.24 -0.12 2.04 2.04 -0.84 -0.36 117.51 122.04 1wvv h ILE 274 Ca 0.19 -0.63 0.04 0.00 1.00 0.00 0.00 64.86 65.46 1wvv h ILE 274 Cb 0.04 0.26 -0.04 0.00 -0.74 0.00 0.00 36.82 36.33 1wvv h ILE 274 CO -0.10 0.27 -0.15 0.78 0.00 0.00 0.00 178.15 178.96 1wvv h ASN 275 N 1.06 -0.45 -0.46 1.72 2.35 -0.19 -0.27 115.58 119.33 1wvv h ASN 275 Ca 0.26 0.08 -0.14 0.00 -0.55 0.00 0.00 56.30 55.96 1wvv h ASN 275 Cb 0.08 0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 1wvv h ASN 275 CO -0.04 -0.19 -0.25 0.50 -1.65 0.00 0.00 177.43 175.80 1wvv h LYS 276 N -0.18 0.98 -0.53 0.81 1.63 -1.04 -1.22 116.57 117.01 1wvv h LYS 276 Ca 0.09 -0.44 0.06 0.00 -0.85 0.00 0.00 60.65 59.51 1wvv h LYS 276 Cb 0.31 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 31.87 1wvv h LYS 276 CO -0.23 1.11 0.25 0.35 -3.45 0.00 0.00 179.45 177.48 1wvv h PHE 277 N 0.83 0.46 -0.36 1.91 3.57 -0.94 -0.74 116.94 121.66 1wvv h PHE 277 Ca 0.10 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.51 1wvv h PHE 277 Cb 0.83 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 1wvv h PHE 277 CO 0.06 0.20 -0.19 1.15 -2.23 0.00 0.00 178.31 177.29 1wvv h THR 278 N 0.48 1.28 -0.72 4.41 2.02 -0.82 0.11 112.91 119.67 1wvv h THR 278 Ca 0.24 -1.33 0.13 0.00 0.77 0.00 0.00 66.41 66.22 1wvv h THR 278 Cb 0.19 1.36 -0.09 0.00 -1.74 0.00 0.00 68.15 67.87 1wvv h THR 278 CO -0.19 0.44 0.29 1.56 0.37 0.00 0.00 175.52 177.99 1wvv h GLN 279 N 0.57 0.44 -0.23 6.66 4.20 -0.86 -0.61 115.11 125.28 1wvv h GLN 279 Ca 0.08 -0.03 -0.18 0.00 0.06 0.00 0.00 58.65 58.59 1wvv h GLN 279 Cb 0.74 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.43 1wvv h GLN 279 CO 0.06 0.29 -0.55 0.74 -0.67 0.00 0.00 178.83 178.71 1wvv h PHE 280 N 0.46 0.99 -0.42 2.96 -1.00 -0.60 -1.58 116.94 117.75 1wvv h PHE 280 Ca 0.39 -0.38 -0.04 0.00 2.81 0.00 0.00 57.97 60.75 1wvv h PHE 280 Cb 0.55 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 39.91 1wvv h PHE 280 CO -0.16 1.19 0.08 1.79 -1.61 0.00 0.00 178.31 179.59 1wvv h THR 281 N 0.52 1.20 -0.38 -1.55 1.35 -0.59 -1.42 112.91 112.03 1wvv h THR 281 Ca -0.00 -0.73 -0.02 0.00 -0.55 0.00 0.00 66.41 65.11 1wvv h THR 281 Cb 1.16 0.80 -0.02 0.00 -1.73 0.00 0.00 68.15 68.36 1wvv h THR 281 CO 0.12 0.26 0.17 1.56 -0.25 0.00 0.00 175.52 177.38 1wvv h GLN 282 N 0.61 0.57 -0.80 4.72 1.08 -0.90 -0.30 115.11 120.09 1wvv h GLN 282 Ca 0.14 -0.09 0.06 0.00 -1.45 0.00 0.00 58.65 57.30 1wvv h GLN 282 Cb 0.27 -0.10 -0.06 0.00 -0.05 0.00 0.00 27.48 27.55 1wvv h GLN 282 CO 0.00 0.52 0.48 0.82 -0.95 0.00 0.00 178.83 179.71 1wvv h ILE 283 N 0.48 1.02 -0.00 2.54 2.04 -0.82 -2.40 117.51 120.36 1wvv h ILE 283 Ca 0.13 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1wvv h ILE 283 Cb 0.16 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1wvv h ILE 283 CO -0.01 0.16 -0.26 0.18 0.00 0.00 0.00 178.15 178.22 1wvv n LEU 284 N -4.67 0.56 -1.73 1.44 4.77 -0.58 -4.94 117.00 111.84 1wvv n LEU 284 Ca 0.11 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 56.01 1wvv n LEU 284 Cb 0.17 -0.23 0.03 0.00 -2.33 0.00 0.00 43.42 41.06 1wvv n LEU 284 CO 0.30 0.11 0.08 0.61 -1.33 0.00 0.00 177.39 177.17 1wvv n GLY 285 N 1.40 0.32 1.29 -0.72 0.00 -0.28 -5.06 105.19 102.15 1wvv n GLY 285 Ca 0.10 -0.31 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 1wvv n GLY 285 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1wvv n THR 286 N -3.11 0.00 -4.35 2.61 5.66 -0.30 -5.04 114.28 109.75 1wvv n THR 286 Ca -0.03 -0.89 -0.24 0.00 -3.05 0.00 0.00 64.05 59.84 1wvv n THR 286 Cb 0.53 0.26 -0.09 0.00 -1.55 0.00 0.00 70.33 69.49 1wvv n THR 286 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1wvv s THR 287 N -1.93 3.04 0.13 1.09 -4.23 -1.26 -4.43 115.64 108.05 1wvv s THR 287 Ca 0.05 -2.02 0.24 0.00 -1.18 0.00 0.00 61.69 58.77 1wvv s THR 287 Cb 0.00 -2.59 0.23 0.00 1.34 0.00 0.00 72.50 71.48 1wvv s THR 287 CO 0.03 -0.32 1.82 0.71 -0.54 0.00 0.00 174.62 176.32 1wvv h THR 288 N 2.24 0.57 -0.22 3.99 1.35 -1.95 -3.45 112.91 115.44 1wvv h THR 288 Ca -0.44 -1.15 0.01 0.00 -0.55 0.00 0.00 66.41 64.28 1wvv h THR 288 Cb 1.24 1.78 -0.00 0.00 -1.73 0.00 0.00 68.15 69.44 1wvv h THR 288 CO 0.58 0.23 -0.01 0.61 -0.25 0.00 0.00 175.52 176.68 1wvv n GLY 289 N 0.17 -2.04 3.95 5.82 0.00 -1.26 -4.69 105.19 107.13 1wvv n GLY 289 Ca 0.00 -1.41 -0.25 0.00 0.00 0.00 0.00 46.02 44.36 1wvv n GLY 289 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wvv s PRO 290 N -0.22 2.04 -1.01 1.61 0.04 -1.26 -4.74 135.00 131.45 1wvv s PRO 290 Ca 0.00 -0.49 -0.14 0.00 0.04 0.00 0.00 61.00 60.41 1wvv s PRO 290 Cb 0.00 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.32 1wvv s PRO 290 CO 0.00 -1.29 0.73 0.09 0.04 0.00 0.00 177.00 176.57 1wvv n ASN 291 N -2.89 -5.50 0.17 6.66 3.02 -1.26 -3.65 115.26 111.82 1wvv n ASN 291 Ca 0.10 -0.89 0.06 0.00 -0.03 0.00 0.00 54.58 53.82 1wvv n ASN 291 Cb 0.60 -3.11 0.13 0.00 -0.61 0.00 0.00 39.78 36.79 1wvv n ASN 291 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1wvv h LEU 292 N -1.23 0.00-10.13 3.41 3.38 -1.92 -0.47 115.31 108.35 1wvv h LEU 292 Ca -0.56 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 56.89 1wvv h LEU 292 Cb 1.32 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.02 1wvv h LEU 292 CO 0.43 0.33 -0.40 -0.94 0.09 0.00 0.00 178.44 177.95 1wvv s SER 293 N -6.35 4.83 0.00 -0.43 1.04 -1.26 -2.50 113.70 109.02 1wvv s SER 293 Ca 0.04 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.57 1wvv s SER 293 Cb 0.07 -0.41 0.00 0.00 0.10 0.00 0.00 66.02 65.78 1wvv s SER 293 CO 0.71 -0.69 0.00 0.00 0.98 0.00 0.00 173.24 174.24